Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4i9q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N SER 22.A O no hydrogen 3.056 N/A LYS 2.A NZ GLU 3.A O no hydrogen 2.840 N/A LYS 2.A NZ LYS 102.A O no hydrogen 3.451 N/A PHE 4.A N ILE 20.A O no hydrogen 3.440 N/A TYR 5.A OH ILE 353.A O no hydrogen 2.659 N/A LEU 6.A N ARG 18.A O no hydrogen 2.634 N/A THR 7.A N ARG 18.A O no hydrogen 3.189 N/A THR 7.A OG1 GLY 267.A O no hydrogen 2.994 N/A GLU 9.A N PHE 16.A O no hydrogen 2.793 N/A ILE 11.A N SER 14.A O no hydrogen 3.025 N/A SER 14.A N ILE 11.A O no hydrogen 3.236 N/A SER 14.A OG GLU 30.A OE2 no hydrogen 3.062 N/A ILE 15.A N VAL 31.A O no hydrogen 2.682 N/A PHE 16.A N GLU 9.A O no hydrogen 3.005 N/A GLU 17.A N ARG 29.A O no hydrogen 3.135 N/A ARG 18.A N THR 7.A O no hydrogen 3.018 N/A ARG 18.A NE GLU 26.A OE2 no hydrogen 3.295 N/A ARG 18.A NH1 PRO 210.A O no hydrogen 2.864 N/A ARG 18.A NH1 GLY 267.A O no hydrogen 3.147 N/A ARG 18.A NH2 GLU 26.A OE2 no hydrogen 2.495 N/A ARG 18.A NH2 THR 209.A O no hydrogen 2.967 N/A TYR 19.A N ARG 27.A O no hydrogen 2.992 N/A ILE 20.A N PHE 4.A O no hydrogen 2.997 N/A ASP 21.A N ARG 25.A O no hydrogen 2.929 N/A ASN 23.A N ASP 21.A OD1 no hydrogen 3.110 N/A GLY 24.A N ASP 21.A O no hydrogen 3.327 N/A ARG 25.A N ASP 21.A OD1 no hydrogen 2.598 N/A ARG 27.A N TYR 19.A O no hydrogen 2.744 N/A ARG 27.A NE GLU 26.A O no hydrogen 3.242 N/A ARG 29.A N GLU 17.A O no hydrogen 3.119 N/A ARG 29.A NE GLU 17.A OE2 no hydrogen 2.985 N/A ARG 29.A NH2 GLU 17.A OE2 no hydrogen 3.168 N/A VAL 31.A N ILE 15.A O no hydrogen 2.816 N/A TYR 33.A N VAL 31.A O no hydrogen 2.885 N/A TYR 33.A OH ASP 95.A OD2 no hydrogen 2.617 N/A LEU 37.A N LYS 60.A O no hydrogen 3.265 N/A PHE 38.A N LEU 83.A O no hydrogen 2.842 N/A ALA 39.A N THR 58.A O no hydrogen 3.247 N/A HIS 40.A NE2 ASP 51.A OD2 no hydrogen 2.745 N/A CYS 41.A N PRO 56.A O no hydrogen 3.126 N/A CYS 41.A SG PRO 42.A O no hydrogen 3.808 N/A CYS 41.A SG GLN 45.A O no hydrogen 3.940 N/A CYS 41.A SG GLN 45.A OE1 no hydrogen 3.872 N/A GLN 45.A N PRO 42.A O no hydrogen 3.033 N/A THR 47.A OG1 CYS 57.A O no hydrogen 3.043 N/A TYR 49.A N THR 47.A OG1 no hydrogen 3.132 N/A ASP 51.A N LYS 55.A O no hydrogen 2.947 N/A TYR 53.A N ASP 51.A OD1 no hydrogen 2.864 N/A LYS 55.A N ASP 51.A OD1 no hydrogen 2.727 N/A CYS 57.A N TYR 49.A O no hydrogen 2.748 N/A CYS 57.A SG LYS 55.A O no hydrogen 3.665 N/A THR 58.A N ALA 39.A O no hydrogen 2.797 N/A THR 58.A OG1 GLN 45.A OE1 no hydrogen 2.562 N/A LYS 60.A N LEU 37.A O no hydrogen 2.856 N/A PHE 62.A N PRO 35.A O no hydrogen 3.161 N/A ASP 67.A N ASN 64.A OD1 no hydrogen 2.775 N/A ALA 68.A N ASN 64.A O no hydrogen 3.369 N/A SER 69.A N MET 65.A O no hydrogen 3.117 N/A GLN 70.A N ARG 66.A O no hydrogen 2.993 N/A TRP 71.A N ASP 67.A O no hydrogen 2.949 N/A ILE 72.A N ALA 68.A O no hydrogen 3.275 N/A LYS 73.A NZ ASP 77.A OD2 no hydrogen 3.355 N/A ARG 74.A N GLN 70.A O no hydrogen 3.120 N/A MET 75.A N TRP 71.A O no hydrogen 2.977 N/A GLU 76.A N ILE 72.A O no hydrogen 3.047 N/A ASP 77.A N LYS 73.A O no hydrogen 2.810 N/A ILE 78.A N ARG 74.A O no hydrogen 2.819 N/A GLY 79.A N MET 75.A O no hydrogen 2.690 N/A LEU 80.A N MET 75.A O no hydrogen 2.851 N/A ALA 82.A N GLN 382.A OE1 no hydrogen 2.903 N/A LEU 83.A N PHE 38.A O no hydrogen 2.895 N/A GLY 84.A N ILE 380.A O no hydrogen 3.068 N/A ASP 86.A N ASP 86.A OD1 no hydrogen 2.400 N/A LYS 89.A NZ ASP 87.A OD1 no hydrogen 3.214 N/A LEU 90.A N ASP 87.A O no hydrogen 3.058 N/A ALA 91.A N ASP 87.A O no hydrogen 3.444 N/A TYR 92.A N PHE 88.A O no hydrogen 3.050 N/A TYR 92.A OH GLU 17.A OE2 no hydrogen 2.722 N/A LEU 93.A N LYS 89.A O no hydrogen 3.209 N/A SER 94.A N LEU 90.A O no hydrogen 3.058 N/A SER 94.A OG ASN 371.A OD1 no hydrogen 2.651 N/A ASP 95.A N ALA 91.A O no hydrogen 2.985 N/A THR 96.A N TYR 92.A O no hydrogen 2.875 N/A THR 96.A OG1 TYR 92.A O no hydrogen 2.669 N/A TYR 97.A N LEU 93.A O no hydrogen 2.969 N/A TYR 97.A OH GLU 17.A OE1 no hydrogen 2.371 N/A TYR 99.A N TYR 97.A O no hydrogen 2.824 N/A TYR 99.A OH GLU 3.A O no hydrogen 3.186 N/A LYS 102.A NZ GLU 100.A OE2 no hydrogen 3.537 N/A TYR 103.A OH ASP 346.A OD1 no hydrogen 2.317 N/A THR 106.A N ASP 104.A OD1 no hydrogen 3.497 N/A THR 106.A OG1 ASP 104.A OD1 no hydrogen 3.037 N/A THR 106.A OG1 ASP 104.A OD2 no hydrogen 2.777 N/A LYS 107.A N ASP 104.A O no hydrogen 3.202 N/A ILE 108.A N HIS 105.A O no hydrogen 3.085 N/A ARG 109.A NH1 ASP 140.A OD2 no hydrogen 2.969 N/A VAL 110.A N SER 141.A OG no hydrogen 2.642 N/A ALA 111.A N ILE 212.A O no hydrogen 2.651 N/A ASN 112.A N.A TYR 139.A O no hydrogen 3.091 N/A ASN 112.A N.B TYR 139.A O no hydrogen 3.087 N/A PHE 113.A N THR 214.A O no hydrogen 3.284 N/A ASP 114.A N THR 137.A O no hydrogen 3.100 N/A GLU 116.A N ALA 135.A O no hydrogen 2.911 N/A THR 118.A N ASP 134.A OD2 no hydrogen 3.099 N/A THR 118.A OG1 ASP 134.A OD2 no hydrogen 2.849 N/A SER 119.A OG ASP 121.A OD1 no hydrogen 3.212 N/A SER 119.A OG GLY 122.A O no hydrogen 2.573 N/A SER 127.A OG.B GLN 128.A OE1 no hydrogen 2.872 N/A GLN 128.A N GLU 125.A O no hydrogen 3.055 N/A ALA 129.A N GLU 125.A O no hydrogen 2.864 N/A LYS 130.A NZ ASP 121.A OD2 no hydrogen 3.176 N/A HIS 131.A N TYR 225.A OH no hydrogen 3.188 N/A HIS 131.A NE2 ASP 121.A OD1 no hydrogen 2.606 N/A ILE 133.A N GLU 194.A OE1 no hydrogen 2.991 N/A ASP 134.A N GLU 116.A O no hydrogen 3.232 N/A ILE 136.A N PHE 149.A O no hydrogen 2.902 N/A THR 137.A N ASP 114.A O no hydrogen 3.037 N/A THR 137.A OG1 ASN 324.A OD1 no hydrogen 2.250 N/A HIS 138.A N TYR 147.A O no hydrogen 2.767 N/A HIS 138.A ND1 TYR 201.A OH no hydrogen 3.031 N/A TYR 139.A N ASN 112.A O.A no hydrogen 2.856 N/A TYR 139.A N ASN 112.A O.B no hydrogen 2.921 N/A TYR 139.A OH ASP 144.A OD1 no hydrogen 2.780 N/A ASP 140.A N ARG 145.A O no hydrogen 3.102 N/A SER 141.A N VAL 110.A O no hydrogen 3.027 N/A SER 141.A OG ILE 108.A O no hydrogen 3.252 N/A SER 141.A OG VAL 110.A O no hydrogen 3.204 N/A ASP 143.A N ASP 140.A OD1 no hydrogen 2.666 N/A ASP 144.A N ASP 140.A O no hydrogen 2.681 N/A ARG 145.A NH1 ASP 144.A O no hydrogen 2.901 N/A PHE 146.A N LYS 185.A O no hydrogen 2.666 N/A TYR 147.A N HIS 138.A O no hydrogen 2.973 N/A TYR 147.A OH ASP 143.A OD2 no hydrogen 2.851 N/A VAL 148.A N ILE 187.A O no hydrogen 2.911 N/A PHE 149.A N ILE 136.A O no hydrogen 2.601 N/A ASP 150.A N MET 189.A O no hydrogen 3.135 N/A LEU 151.A N ASP 134.A O no hydrogen 3.157 N/A LEU 152.A N PHE 191.A O no hydrogen 3.005 N/A ASN 153.A ND2 ASP 192.A O no hydrogen 2.953 N/A TYR 156.A N SER 154.A OG no hydrogen 3.114 N/A TYR 156.A OH HIS 131.A ND1 no hydrogen 2.894 N/A GLY 157.A N SER 154.A O no hydrogen 3.002 N/A VAL 159.A N LEU 152.A O no hydrogen 2.885 N/A TRP 162.A N TYR 188.A OH no hydrogen 2.871 N/A TRP 162.A NE1 SER 322.A OG no hydrogen 2.793 N/A SER 163.A N GLN 318.A OE1 no hydrogen 2.789 N/A SER 163.A OG GLU 165.A OE1 no hydrogen 3.232 N/A GLU 165.A N GLU 165.A OE1 no hydrogen 2.813 N/A ILE 166.A N SER 163.A OG no hydrogen 3.245 N/A ALA 167.A N SER 163.A O no hydrogen 3.105 N/A ALA 168.A N ILE 164.A O no hydrogen 3.184 N/A ALA 168.A N GLU 165.A O no hydrogen 3.263 N/A LYS 169.A N GLU 165.A O no hydrogen 3.242 N/A LYS 169.A N ILE 166.A O no hydrogen 3.093 N/A LEU 170.A N GLN 173.A OE1 no hydrogen 2.960 N/A GLN 171.A N GLU 177.A OE1 no hydrogen 3.243 N/A GLN 173.A N LEU 170.A O no hydrogen 2.963 N/A GLY 174.A N GLN 171.A O no hydrogen 3.106 N/A GLY 175.A N LEU 170.A O no hydrogen 2.814 N/A GLU 177.A N LYS 169.A O no hydrogen 2.770 N/A VAL 178.A N ALA 167.A O no hydrogen 2.828 N/A GLU 181.A N GLU 181.A OE1 no hydrogen 2.615 N/A ILE 182.A N PRO 179.A O no hydrogen 3.095 N/A ILE 183.A N PRO 179.A O no hydrogen 3.184 N/A LYS 185.A N ILE 182.A O no hydrogen 2.945 N/A LYS 185.A NZ ASP 144.A OD2 no hydrogen 3.027 N/A LYS 185.A NZ GLU 181.A O no hydrogen 3.560 N/A ILE 187.A N PHE 146.A O no hydrogen 2.912 N/A TYR 188.A OH ASP 150.A OD2 no hydrogen 2.403 N/A MET 189.A N VAL 148.A O no hydrogen 3.023 N/A PHE 191.A N ASP 150.A O no hydrogen 2.996 N/A ASN 193.A ND2 ASP 192.A OD2.B no hydrogen 3.467 N/A GLU 196.A N.A ASN 193.A OD1 no hydrogen 3.138 N/A GLU 196.A N.B ASN 193.A OD1 no hydrogen 3.126 N/A LEU 197.A N ASN 193.A O no hydrogen 3.213 N/A LEU 198.A N GLU 194.A O no hydrogen 2.929 N/A MET 199.A N LYS 195.A O no hydrogen 2.894 N/A GLU 200.A N GLU 196.A O.A no hydrogen 3.171 N/A GLU 200.A N GLU 196.A O.B no hydrogen 3.032 N/A TYR 201.A N LEU 197.A O no hydrogen 3.004 N/A TYR 201.A OH HIS 138.A ND1 no hydrogen 3.031 N/A LEU 202.A N LEU 198.A O no hydrogen 3.071 N/A ASN 203.A N MET 199.A O no hydrogen 3.163 N/A PHE 204.A N GLU 200.A O no hydrogen 2.792 N/A TRP 205.A N TYR 201.A O no hydrogen 2.656 N/A TRP 205.A NE1 LEU 242.A O no hydrogen 2.857 N/A GLN 206.A N LEU 202.A O no hydrogen 2.819 N/A GLN 207.A N ASN 203.A O no hydrogen 3.287 N/A LYS 208.A N PHE 204.A O no hydrogen 3.091 N/A LYS 208.A NZ ASP 143.A OD2 no hydrogen 2.747 N/A THR 209.A OG1 TRP 205.A O no hydrogen 3.116 N/A THR 209.A OG1 GLN 206.A O no hydrogen 3.328 N/A VAL 211.A N ARG 109.A O no hydrogen 2.896 N/A ILE 212.A N ARG 109.A O no hydrogen 3.195 N/A LEU 213.A N SER 269.A O no hydrogen 2.937 N/A THR 214.A N ALA 111.A O no hydrogen 2.752 N/A THR 214.A OG1 LEU 271.A O no hydrogen 2.713 N/A GLY 215.A N THR 214.A OG1 no hydrogen 2.563 N/A TRP 216.A NE1 TYR 288.A O no hydrogen 3.038 N/A ASN 217.A ND2 SER 220.A OG no hydrogen 3.339 N/A GLU 219.A N ASP 272.A OD2 no hydrogen 2.990 N/A PHE 221.A N ASN 217.A O no hydrogen 3.018 N/A ILE 223.A N VAL 218.A O no hydrogen 2.669 N/A TYR 225.A N PHE 221.A O no hydrogen 2.911 N/A TYR 225.A OH HIS 131.A O no hydrogen 2.351 N/A VAL 226.A N ALA 222.A O no hydrogen 3.172 N/A TYR 227.A N ILE 223.A O no hydrogen 3.045 N/A TYR 227.A OH THR 248.A OG1 no hydrogen 2.712 N/A ASN 228.A N PRO 224.A O no hydrogen 2.964 N/A ASN 228.A ND2 PRO 126.A O no hydrogen 2.355 N/A ARG 229.A N TYR 225.A O no hydrogen 2.805 N/A ARG 229.A NE GLU 194.A OE1 no hydrogen 2.804 N/A ARG 229.A NH1 ALA 129.A O no hydrogen 2.843 N/A ARG 229.A NH1 LYS 130.A O no hydrogen 3.090 N/A ARG 229.A NH2 GLU 194.A OE1 no hydrogen 3.521 N/A ARG 229.A NH2 GLU 194.A OE2 no hydrogen 2.872 N/A ILE 230.A N VAL 226.A O no hydrogen 3.095 N/A LYS 231.A N TYR 227.A O no hydrogen 3.013 N/A LYS 231.A NZ ASN 228.A OD1 no hydrogen 3.486 N/A ASN 232.A N ASN 228.A O no hydrogen 2.889 N/A ASN 232.A ND2 GLN 128.A O no hydrogen 2.957 N/A ILE 233.A N ARG 229.A O no hydrogen 3.327 N/A PHE 234.A N ILE 230.A O no hydrogen 2.791 N/A GLY 235.A N LYS 231.A O no hydrogen 2.813 N/A THR 238.A N GLY 235.A O no hydrogen 3.128 N/A ALA 239.A N GLY 235.A O no hydrogen 3.191 N/A LYS 240.A N GLU 236.A O no hydrogen 2.788 N/A LYS 240.A NZ.A THR 248.A OG1 no hydrogen 2.754 N/A LYS 240.A NZ.B GLU 236.A OE1 no hydrogen 3.384 N/A LYS 240.A NZ.B THR 248.A OG1 no hydrogen 3.325 N/A ARG 241.A N THR 238.A O no hydrogen 3.171 N/A ARG 241.A NH2 GLN 206.A OE1 no hydrogen 2.674 N/A LEU 242.A N ALA 239.A O no hydrogen 3.327 N/A SER 243.A N LYS 240.A O no hydrogen 3.072 N/A SER 243.A OG LYS 247.A O no hydrogen 3.245 N/A SER 243.A OG PHE 266.A O no hydrogen 2.497 N/A HIS 245.A N SER 243.A OG no hydrogen 3.127 N/A ARG 246.A N SER 243.A O no hydrogen 3.120 N/A ARG 246.A NH1 SER 243.A O no hydrogen 2.376 N/A LYS 247.A N SER 243.A OG no hydrogen 3.377 N/A LYS 247.A NZ THR 248.A O no hydrogen 3.141 N/A THR 248.A OG1 TYR 227.A OH no hydrogen 2.712 N/A ARG 249.A N THR 264.A O no hydrogen 3.127 N/A LYS 251.A N ILE 262.A O no hydrogen 2.909 N/A ILE 253.A N ARG 260.A O no hydrogen 3.361 N/A GLU 254.A N GLU 254.A OE2 no hydrogen 2.696 N/A ARG 260.A N ILE 253.A O no hydrogen 2.902 N/A ILE 262.A N LYS 251.A O no hydrogen 3.092 N/A THR 264.A N ARG 249.A O no hydrogen 2.816 N/A PHE 266.A N LYS 247.A O no hydrogen 3.305 N/A GLY 267.A N GLU 9.A OE2 no hydrogen 3.180 N/A ILE 268.A N LEU 265.A O no hydrogen 3.141 N/A SER 269.A N VAL 211.A O no hydrogen 3.067 N/A SER 269.A OG GLN 356.A OE1 no hydrogen 2.831 N/A LEU 271.A N LEU 213.A O no hydrogen 2.871 N/A TYR 273.A N GLY 215.A O no hydrogen 2.908 N/A TYR 273.A OH ASP 335.A OD1 no hydrogen 2.836 N/A ILE 274.A N ASP 272.A OD1 no hydrogen 3.408 N/A ASP 275.A N ASP 272.A O no hydrogen 2.835 N/A LEU 276.A N ASP 272.A O no hydrogen 3.056 N/A TYR 277.A N TYR 273.A O no hydrogen 2.747 N/A TYR 277.A OH GLU 297.A OE2 no hydrogen 2.416 N/A LYS 278.A N ILE 274.A O no hydrogen 3.239 N/A PHE 280.A N LEU 276.A O no hydrogen 3.233 N/A SER 281.A N TYR 277.A O no hydrogen 3.185 N/A SER 281.A OG TYR 277.A O no hydrogen 2.514 N/A SER 281.A OG THR 283.A OG1 no hydrogen 3.177 N/A THR 283.A OG1 SER 281.A OG no hydrogen 3.177 N/A GLN 285.A N TYR 288.A OH no hydrogen 3.093 N/A SER 287.A OG SER 289.A OG no hydrogen 3.141 N/A TYR 288.A OH THR 283.A O no hydrogen 2.947 N/A SER 289.A N SER 287.A OG no hydrogen 3.318 N/A SER 289.A OG SER 287.A OG no hydrogen 3.141 N/A ILE 293.A N SER 289.A O no hydrogen 3.155 N/A SER 294.A N LEU 290.A O no hydrogen 2.939 N/A SER 294.A OG.A LEU 290.A O no hydrogen 2.697 N/A SER 294.A OG.B VAL 300.A O no hydrogen 2.339 N/A GLU 295.A N ASP 291.A O no hydrogen 3.143 N/A PHE 296.A N TYR 292.A O no hydrogen 3.090 N/A GLU 297.A N ILE 293.A O no hydrogen 2.849 N/A LEU 298.A N SER 294.A O no hydrogen 2.819 N/A ASN 299.A N GLU 295.A O no hydrogen 3.020 N/A LYS 302.A N ASP 291.A OD1 no hydrogen 2.687 N/A LYS 311.A N PRO 308.A O no hydrogen 3.111 N/A LEU 312.A N ILE 309.A O no hydrogen 3.329 N/A ARG 313.A NH1 GLY 157.A O no hydrogen 2.825 N/A ARG 313.A NH2 LEU 151.A O no hydrogen 3.071 N/A ARG 313.A NH2 GLY 157.A O no hydrogen 3.128 N/A SER 315.A N LYS 311.A O no hydrogen 3.125 N/A SER 315.A OG LYS 311.A O no hydrogen 2.549 N/A SER 315.A OG LEU 312.A O no hydrogen 3.418 N/A ASN 316.A N LEU 312.A O no hydrogen 2.807 N/A HIS 317.A NE2 ASP 150.A OD1 no hydrogen 2.881 N/A GLN 318.A NE2 SER 163.A O no hydrogen 2.815 N/A GLN 318.A NE2 ASP 176.A OD2 no hydrogen 3.127 N/A ARG 319.A N ASN 316.A OD1 no hydrogen 3.014 N/A ARG 319.A NE ASP 176.A OD1 no hydrogen 3.457 N/A ARG 319.A NH1 LYS 304.A O no hydrogen 2.933 N/A ARG 319.A NH2 GLN 171.A OE1 no hydrogen 2.851 N/A ARG 319.A NH2 ASP 176.A OD1 no hydrogen 3.144 N/A TYR 320.A N ASN 316.A O no hydrogen 2.931 N/A TYR 320.A OH ASP 134.A OD1 no hydrogen 2.568 N/A TYR 320.A OH ASP 134.A OD2 no hydrogen 3.330 N/A ILE 321.A N HIS 317.A O no hydrogen 3.138 N/A SER 322.A N GLN 318.A O no hydrogen 3.302 N/A SER 322.A OG ASP 176.A OD2 no hydrogen 2.668 N/A SER 322.A OG GLN 318.A O no hydrogen 3.312 N/A TYR 323.A N ARG 319.A O no hydrogen 2.672 N/A ASN 324.A N TYR 320.A O no hydrogen 3.289 N/A ASN 324.A ND2 ASP 114.A O no hydrogen 3.342 N/A ASN 324.A ND2 GLU 116.A OE2 no hydrogen 2.657 N/A ILE 325.A N ILE 321.A O no hydrogen 3.089 N/A ILE 326.A N SER 322.A O no hydrogen 3.051 N/A ALA 327.A N TYR 323.A O no hydrogen 3.099 N/A TYR 329.A N ILE 325.A O no hydrogen 3.157 N/A TYR 329.A OH GLU 181.A OE2 no hydrogen 2.858 N/A ARG 330.A N ILE 326.A O no hydrogen 2.804 N/A ARG 330.A NE GLY 301.A O no hydrogen 2.912 N/A ARG 330.A NH1 GLN 333.A OE1 no hydrogen 2.876 N/A ARG 330.A NH2 GLY 301.A O no hydrogen 3.335 N/A VAL 331.A N VAL 328.A O no hydrogen 3.224 N/A LEU 332.A N VAL 328.A O no hydrogen 3.352 N/A GLN 333.A N TYR 329.A O no hydrogen 2.883 N/A ILE 334.A N ARG 330.A O no hydrogen 2.982 N/A ASP 335.A N VAL 331.A O no hydrogen 2.958 N/A ALA 336.A N LEU 332.A O no hydrogen 3.032 N/A LYS 337.A N ILE 334.A O no hydrogen 3.284 N/A LYS 337.A NZ GLU 297.A O no hydrogen 2.763 N/A ARG 338.A N ILE 334.A O no hydrogen 2.855 N/A ARG 338.A NE GLU 297.A OE1 no hydrogen 3.230 N/A ARG 338.A NE GLU 297.A OE2 no hydrogen 3.316 N/A ARG 338.A NH1 SER 281.A O no hydrogen 3.567 N/A ARG 338.A NH2 GLU 297.A OE2 no hydrogen 2.802 N/A GLN 339.A N ASP 335.A O no hydrogen 2.688 N/A GLN 339.A NE2 ASP 335.A O no hydrogen 3.230 N/A PHE 340.A N TYR 273.A OH no hydrogen 3.326 N/A ILE 341.A N ASP 335.A OD1 no hydrogen 3.423 N/A ASN 342.A ND2 GLN 339.A OE1 no hydrogen 2.403 N/A LEU 343.A N GLN 339.A O no hydrogen 3.017 N/A SER 344.A N PHE 340.A O no hydrogen 3.029 N/A SER 344.A OG PHE 340.A O no hydrogen 2.857 N/A LEU 345.A N ILE 341.A O no hydrogen 2.978 N/A ASP 346.A N ASN 342.A O no hydrogen 3.010 N/A MET 347.A N LEU 343.A O no hydrogen 2.870 N/A GLY 348.A N SER 344.A O no hydrogen 2.891 N/A TYR 349.A N LEU 345.A O no hydrogen 3.174 N/A TYR 349.A OH TYR 5.A O no hydrogen 2.564 N/A TYR 350.A N ASP 346.A O no hydrogen 2.980 N/A ALA 351.A N MET 347.A O no hydrogen 2.932 N/A LYS 352.A NZ TYR 97.A O no hydrogen 2.720 N/A LYS 352.A NZ TYR 99.A O no hydrogen 2.891 N/A ILE 353.A N GLY 348.A O no hydrogen 2.910 N/A GLN 354.A NE2 VAL 8.A O no hydrogen 2.487 N/A GLN 356.A N GLN 356.A OE1 no hydrogen 2.571 N/A SER 357.A N GLN 354.A O no hydrogen 2.893 N/A VAL 358.A N ILE 355.A O no hydrogen 3.393 N/A SER 360.A N SER 357.A O no hydrogen 2.821 N/A LYS 363.A N SER 360.A OG no hydrogen 3.191 N/A LYS 363.A NZ ASP 87.A OD2 no hydrogen 2.701 N/A THR 364.A N SER 360.A O no hydrogen 3.081 N/A THR 364.A OG1 SER 357.A O no hydrogen 3.328 N/A THR 364.A OG1 SER 360.A O no hydrogen 2.743 N/A TRP 365.A N PRO 361.A O no hydrogen 2.861 N/A TRP 365.A NE1 LEU 513.A O no hydrogen 2.509 N/A ASP 366.A N ILE 362.A O no hydrogen 2.860 N/A ALA 367.A N LYS 363.A O no hydrogen 3.204 N/A ILE 368.A N THR 364.A O no hydrogen 3.122 N/A ILE 369.A N TRP 365.A O no hydrogen 3.020 N/A PHE 370.A N ASP 366.A O no hydrogen 2.997 N/A ASN 371.A N ALA 367.A O no hydrogen 3.050 N/A ASN 371.A ND2 ALA 367.A O no hydrogen 2.480 N/A SER 372.A N ILE 368.A O no hydrogen 3.057 N/A SER 372.A OG GLU 474.A OE1 no hydrogen 2.692 N/A LEU 373.A N ILE 369.A O no hydrogen 2.922 N/A LYS 374.A N PHE 370.A O no hydrogen 2.821 N/A LYS 374.A NZ ASP 95.A OD1 no hydrogen 2.544 N/A GLU 375.A N ASN 371.A O no hydrogen 3.105 N/A GLN 376.A N LEU 373.A O no hydrogen 3.089 N/A ASN 377.A N LYS 374.A O no hydrogen 2.763 N/A LYS 378.A N LEU 373.A O no hydrogen 2.781 N/A LYS 378.A NZ GLN 376.A OE1 no hydrogen 3.058 N/A VAL 379.A N PHE 50.A O no hydrogen 2.763 N/A GLN 382.A N GLU 81.A OE2 no hydrogen 2.846 N/A LYS 397.A N GLY 571.A O no hydrogen 2.915 N/A LYS 397.A NZ GLU 549.A OE2 no hydrogen 3.191 N/A ASN 402.A N TRP 653.A O no hydrogen 3.205 N/A ARG 403.A N ASN 402.A OD1 no hydrogen 2.556 N/A ARG 403.A NE ALA 838.A O no hydrogen 2.985 N/A ARG 403.A NH2 ALA 838.A O no hydrogen 3.110 N/A ARG 403.A NH2 LYS 839.A O no hydrogen 3.164 N/A TYR 404.A N GLY 651.A O no hydrogen 2.850 N/A TYR 404.A OH ILE 400.A O no hydrogen 2.609 N/A LYS 405.A NZ GLU 589.A OE1 no hydrogen 3.172 N/A LYS 405.A NZ GLU 589.A OE2 no hydrogen 3.557 N/A TYR 406.A N ASP 581.A OD1 no hydrogen 3.081 N/A TYR 406.A OH GLU 589.A OE1 no hydrogen 2.325 N/A VAL 407.A N ALA 640.A O no hydrogen 2.953 N/A MET 408.A N VAL 578.A O no hydrogen 2.987 N/A SER 409.A N ALA 638.A O no hydrogen 2.897 N/A PHE 410.A N ILE 576.A O no hydrogen 3.094 N/A ASP 411.A N ASP 635.A O no hydrogen 3.240 N/A LEU 412.A N ASP 574.A O no hydrogen 2.896 N/A THR 413.A N PHE 633.A O no hydrogen 2.936 N/A THR 413.A OG1 PHE 633.A O no hydrogen 3.161 N/A SER 414.A OG.A THR 413.A O no hydrogen 2.688 N/A SER 414.A OG.A SER 414.A O no hydrogen 2.561 N/A SER 414.A OG.A SER 418.A OG no hydrogen 3.157 N/A SER 418.A N SER 414.A O no hydrogen 2.994 N/A SER 418.A OG THR 413.A O no hydrogen 2.778 N/A SER 418.A OG SER 414.A O no hydrogen 2.833 N/A SER 418.A OG SER 414.A OG.A no hydrogen 3.157 N/A ILE 419.A N LEU 415.A O no hydrogen 2.733 N/A ILE 420.A N TYR 416.A O no hydrogen 3.015 N/A ARG 421.A N PRO 417.A O no hydrogen 3.010 N/A ARG 421.A NE THR 476.A OG1 no hydrogen 3.124 N/A GLN 422.A N SER 418.A O no hydrogen 2.717 N/A GLN 422.A NE2 ASN 627.A OD1 no hydrogen 3.004 N/A VAL 423.A N ILE 419.A O no hydrogen 2.870 N/A ASN 424.A ND2 TYR 464.A O no hydrogen 2.750 N/A ASN 424.A ND2 ARG 467.A O no hydrogen 3.036 N/A ILE 425.A N ILE 420.A O no hydrogen 2.960 N/A SER 426.A OG GLU 428.A OE1 no hydrogen 2.820 N/A GLU 428.A N GLU 428.A OE1 no hydrogen 2.692 N/A THR 429.A N SER 426.A O no hydrogen 3.371 N/A THR 429.A OG1 ASN 424.A O no hydrogen 2.752 N/A THR 429.A OG1 SER 426.A O no hydrogen 3.162 N/A ALA 431.A N MET 462.A O no hydrogen 2.715 N/A PHE 434.A N GLY 460.A O no hydrogen 3.145 N/A ALA 437.A N TYR 442.A OH no hydrogen 3.047 N/A ASP 441.A N PRO 438.A O no hydrogen 2.941 N/A TYR 442.A N LEU 439.A O no hydrogen 3.035 N/A ILE 443.A N LEU 439.A O no hydrogen 3.118 N/A ASN 444.A N HIS 440.A O.A no hydrogen 3.165 N/A ASN 444.A N HIS 440.A O.C no hydrogen 3.108 N/A ALA 445.A N TYR 442.A O no hydrogen 3.250 N/A VAL 446.A N ASP 441.A O no hydrogen 2.806 N/A ALA 447.A N ASP 441.A O no hydrogen 3.227 N/A ARG 449.A NE GLU 623.A O.A no hydrogen 2.651 N/A ARG 449.A NE GLU 623.A O.B no hydrogen 2.703 N/A ARG 449.A NH2 GLU 623.A O.A no hydrogen 2.726 N/A ARG 449.A NH2 GLU 623.A O.B no hydrogen 2.738 N/A VAL 453.A N SER 451.A OG no hydrogen 3.110 N/A TYR 454.A N SER 451.A OG no hydrogen 3.085 N/A SER 455.A N TYR 463.A O no hydrogen 2.741 N/A SER 455.A OG VAL 423.A O no hydrogen 2.845 N/A CYS 456.A N MET 625.A O no hydrogen 2.966 N/A CYS 456.A SG TYR 454.A O no hydrogen 3.479 N/A SER 457.A N MET 461.A O no hydrogen 3.088 N/A SER 457.A OG.A ASN 459.A OD1 no hydrogen 3.217 N/A SER 457.A OG.A ALA 536.A O no hydrogen 2.776 N/A ASN 459.A ND2 ARG 532.A O no hydrogen 3.137 N/A GLY 460.A N SER 457.A O no hydrogen 2.879 N/A MET 461.A N ASN 459.A OD1 no hydrogen 3.192 N/A MET 462.A N GLY 432.A O no hydrogen 2.833 N/A TYR 463.A N SER 455.A O no hydrogen 2.681 N/A TYR 463.A OH ASN 533.A OD1 no hydrogen 2.678 N/A TYR 464.A N THR 429.A O no hydrogen 2.847 N/A LYS 465.A NZ ASN 626.A O no hydrogen 3.494 N/A LYS 465.A NZ ASN 626.A OD1 no hydrogen 2.677 N/A VAL 470.A N GLU 428.A OE2 no hydrogen 2.758 N/A VAL 471.A N SER 426.A OG no hydrogen 3.304 N/A THR 473.A N GLY 469.A O no hydrogen 3.028 N/A THR 473.A OG1 GLY 469.A O no hydrogen 2.688 N/A GLU 474.A N VAL 470.A O no hydrogen 2.898 N/A ILE 475.A N VAL 471.A O no hydrogen 3.084 N/A THR 476.A N PRO 472.A O no hydrogen 3.118 N/A THR 476.A OG1 PRO 472.A O no hydrogen 2.545 N/A LYS 477.A NZ GLU 474.A OE1 no hydrogen 2.634 N/A PHE 479.A N ILE 475.A O no hydrogen 3.051 N/A ASN 480.A N THR 476.A O no hydrogen 2.812 N/A GLN 481.A N LYS 477.A O no hydrogen 3.007 N/A GLN 481.A NE2 LYS 477.A O no hydrogen 3.543 N/A ARG 482.A N VAL 478.A O no hydrogen 3.216 N/A ARG 482.A NE GLN 507.A O no hydrogen 3.092 N/A ARG 482.A NE GLN 507.A OE1 no hydrogen 2.821 N/A LYS 483.A N PHE 479.A O no hydrogen 3.094 N/A GLU 484.A N ASN 480.A O no hydrogen 3.102 N/A HIS 485.A N GLN 481.A O no hydrogen 3.384 N/A LYS 486.A N ARG 482.A O no hydrogen 2.701 N/A GLY 487.A N LYS 483.A O no hydrogen 3.142 N/A TYR 488.A N HIS 485.A O no hydrogen 2.879 N/A TYR 488.A OH GLU 484.A OE2 no hydrogen 2.524 N/A MET 489.A N HIS 485.A O no hydrogen 3.202 N/A LEU 490.A N LYS 486.A O no hydrogen 3.354 N/A GLN 493.A N MET 489.A O no hydrogen 3.294 N/A ARG 494.A N LEU 490.A O no hydrogen 3.053 N/A ARG 494.A NE LEU 490.A O no hydrogen 2.900 N/A ASN 495.A N ALA 491.A O no hydrogen 2.714 N/A GLU 500.A N ARG 498.A O no hydrogen 2.217 N/A GLY 503.A N THR 499.A O no hydrogen 2.640 N/A MET 504.A N GLU 500.A O no hydrogen 2.308 N/A THR 505.A N VAL 501.A O no hydrogen 2.944 N/A THR 505.A OG1 ARG 338.A O no hydrogen 3.462 N/A THR 505.A OG1 VAL 501.A O no hydrogen 3.171 N/A ALA 506.A N ALA 502.A O no hydrogen 2.824 N/A GLN 507.A N GLY 503.A O no hydrogen 3.351 N/A GLN 507.A N MET 504.A O no hydrogen 2.994 N/A ILE 508.A N MET 504.A O no hydrogen 2.562 N/A ASN 509.A N THR 505.A O no hydrogen 2.970 N/A ASN 509.A ND2 PHE 280.A O no hydrogen 3.231 N/A ARG 510.A NH1 ALA 506.A O no hydrogen 3.518 N/A LYS 511.A N GLN 507.A O no hydrogen 3.260 N/A LEU 513.A N ARG 510.A O no hydrogen 3.235 N/A ILE 514.A N ARG 510.A O no hydrogen 3.409 N/A ASN 515.A N LYS 511.A O no hydrogen 2.729 N/A SER 516.A N LEU 512.A O no hydrogen 3.231 N/A SER 516.A OG LEU 512.A O no hydrogen 2.904 N/A SER 516.A OG LEU 513.A O no hydrogen 2.775 N/A ALA 520.A N SER 516.A O no hydrogen 2.746 N/A LEU 521.A N LEU 517.A O no hydrogen 3.276 N/A GLY 522.A N GLY 519.A O no hydrogen 2.796 N/A ASN 523.A N ALA 520.A O no hydrogen 2.891 N/A TRP 525.A N ASN 523.A OD1 no hydrogen 2.987 N/A PHE 526.A N ASN 523.A O no hydrogen 2.981 N/A ARG 527.A NE ASP 366.A OD1 no hydrogen 2.713 N/A ARG 527.A NH1 PRO 381.A O no hydrogen 2.856 N/A ARG 527.A NH2 ASP 86.A OD1 no hydrogen 3.224 N/A ARG 527.A NH2 ASP 366.A OD2 no hydrogen 3.146 N/A TYR 529.A N PHE 526.A O no hydrogen 3.210 N/A ASP 530.A N LEU 521.A O no hydrogen 3.028 N/A ARG 532.A N ASP 530.A OD1 no hydrogen 2.946 N/A ARG 532.A NE ASP 530.A OD1 no hydrogen 2.953 N/A ARG 532.A NE ASP 530.A OD2 no hydrogen 3.288 N/A ARG 532.A NH2 ASP 530.A OD2 no hydrogen 2.715 N/A ALA 534.A N ASP 530.A O no hydrogen 3.043 N/A THR 535.A N LEU 531.A O no hydrogen 2.874 N/A THR 535.A OG1.A LEU 531.A O no hydrogen 2.684 N/A THR 535.A OG1.B LEU 531.A O no hydrogen 2.644 N/A ALA 536.A N ARG 532.A O no hydrogen 3.003 N/A ILE 537.A N ASN 533.A O no hydrogen 3.249 N/A THR 538.A N ALA 534.A O no hydrogen 3.437 N/A THR 538.A OG1 PRO 392.A O no hydrogen 2.813 N/A THR 538.A OG1 ALA 534.A O no hydrogen 3.516 N/A THR 538.A OG1 THR 535.A O no hydrogen 3.172 N/A THR 539.A N THR 535.A O no hydrogen 2.774 N/A THR 539.A OG1 THR 535.A O no hydrogen 2.694 N/A PHE 540.A N ALA 536.A O no hydrogen 3.202 N/A GLY 541.A N ILE 537.A O no hydrogen 3.005 N/A GLN 542.A N THR 538.A O no hydrogen 2.989 N/A GLN 542.A NE2 GLY 393.A O no hydrogen 2.783 N/A MET 543.A N THR 539.A O no hydrogen 2.993 N/A ALA 544.A N PHE 540.A O no hydrogen 2.908 N/A LEU 545.A N GLY 541.A O no hydrogen 3.259 N/A GLN 546.A N GLN 542.A O no hydrogen 3.396 N/A GLN 546.A NE2 GLN 542.A O no hydrogen 2.961 N/A TRP 547.A N MET 543.A O no hydrogen 2.655 N/A TRP 547.A NE1 GLY 617.A O no hydrogen 2.509 N/A ILE 548.A N ALA 544.A O no hydrogen 2.997 N/A GLU 549.A N LEU 545.A O no hydrogen 3.050 N/A ARG 550.A N GLN 546.A O no hydrogen 3.143 N/A ARG 550.A NE ILE 443.A O no hydrogen 2.836 N/A ARG 550.A NH1 GLU 554.A OE2 no hydrogen 3.159 N/A ARG 550.A NH2 ILE 443.A O no hydrogen 2.849 N/A LYS 551.A N TRP 547.A O no hydrogen 3.093 N/A LYS 551.A NZ GLU 620.A OE1 no hydrogen 3.078 N/A VAL 552.A N ILE 548.A O no hydrogen 3.002 N/A ASN 553.A N GLU 549.A O no hydrogen 3.166 N/A GLU 554.A N ARG 550.A O no hydrogen 2.991 N/A TYR 555.A N LYS 551.A O no hydrogen 2.997 N/A LEU 556.A N VAL 552.A O no hydrogen 2.940 N/A ASN 557.A N ASN 553.A O no hydrogen 2.931 N/A ASN 557.A ND2 ASN 553.A O no hydrogen 2.333 N/A ASN 557.A ND2 GLU 565.A O no hydrogen 3.086 N/A GLU 558.A N GLU 554.A O no hydrogen 3.159 N/A VAL 559.A N TYR 555.A O no hydrogen 3.091 N/A CYS 560.A N LEU 556.A O no hydrogen 2.937 N/A CYS 560.A SG LEU 556.A O no hydrogen 3.198 N/A THR 562.A N ASN 557.A O no hydrogen 2.970 N/A THR 562.A OG1 ASN 557.A OD1 no hydrogen 3.048 N/A GLU 565.A N ASN 557.A OD1 no hydrogen 2.768 N/A PHE 567.A N ASN 553.A OD1 no hydrogen 2.923 N/A VAL 568.A N ASN 553.A OD1 no hydrogen 2.913 N/A LEU 569.A N TYR 577.A O no hydrogen 2.738 N/A ASP 572.A N SER 575.A O no hydrogen 3.194 N/A THR 573.A N PHE 395.A O no hydrogen 2.902 N/A THR 573.A OG1 ASP 572.A OD1 no hydrogen 2.727 N/A ASP 574.A N ASP 572.A O no hydrogen 2.678 N/A SER 575.A N ASP 572.A O no hydrogen 3.237 N/A SER 575.A OG PHE 410.A O no hydrogen 2.990 N/A ILE 576.A N PHE 410.A O no hydrogen 2.867 N/A TYR 577.A N TYR 570.A O no hydrogen 2.679 N/A VAL 578.A N MET 408.A O no hydrogen 2.900 N/A SER 579.A N PHE 567.A O no hydrogen 2.842 N/A ALA 580.A N TYR 406.A O no hydrogen 2.732 N/A LYS 582.A NZ GLU 565.A OE1 no hydrogen 3.112 N/A ILE 584.A N ALA 580.A O no hydrogen 3.080 N/A ASP 585.A N ASP 581.A O no hydrogen 2.988 N/A LYS 586.A N LYS 582.A O no hydrogen 3.241 N/A LYS 586.A NZ CYS 560.A O no hydrogen 2.959 N/A GLY 588.A N ILE 584.A O no hydrogen 2.926 N/A LYS 591.A N GLY 588.A O no hydrogen 3.090 N/A ARG 593.A N HIS 597.A ND1 no hydrogen 2.988 N/A HIS 597.A N ASP 594.A O no hydrogen 3.248 N/A VAL 599.A N THR 595.A O no hydrogen 3.195 N/A ASP 600.A N ASN 596.A O no hydrogen 2.826 N/A PHE 601.A N HIS 597.A O no hydrogen 3.145 N/A LEU 602.A N TRP 598.A O no hydrogen 3.059 N/A ASP 603.A N VAL 599.A O no hydrogen 3.027 N/A LYS 604.A N ASP 600.A O no hydrogen 3.033 N/A LYS 604.A NZ GLU 608.A OE1 no hydrogen 2.549 N/A LYS 604.A NZ GLU 608.A OE2 no hydrogen 3.315 N/A PHE 605.A N PHE 601.A O no hydrogen 2.973 N/A ALA 606.A N LEU 602.A O no hydrogen 2.951 N/A ARG 607.A N ASP 603.A O no hydrogen 3.274 N/A GLU 608.A N LYS 604.A O no hydrogen 2.998 N/A ARG 609.A N PHE 605.A O no hydrogen 3.009 N/A MET 610.A N PHE 605.A O no hydrogen 3.191 N/A GLU 611.A N ALA 606.A O no hydrogen 2.817 N/A ALA 613.A N ARG 609.A O no hydrogen 3.271 N/A ILE 614.A N MET 610.A O no hydrogen 2.684 N/A ASP 615.A N GLU 611.A O no hydrogen 2.954 N/A ARG 616.A N PRO 612.A O no hydrogen 3.173 N/A GLY 617.A N ALA 613.A O no hydrogen 3.042 N/A PHE 618.A N ASP 615.A O no hydrogen 3.132 N/A ARG 619.A N ASP 615.A O no hydrogen 2.962 N/A ARG 619.A NE ASP 615.A OD2 no hydrogen 2.913 N/A GLU 620.A N ARG 616.A O no hydrogen 3.455 N/A CYS 622.A N PHE 618.A O no hydrogen 2.958 N/A GLU 623.A N.A ARG 619.A O no hydrogen 3.021 N/A GLU 623.A N.B ARG 619.A O no hydrogen 3.006 N/A TYR 624.A N GLU 620.A O no hydrogen 2.684 N/A TYR 624.A OH ALA 447.A O no hydrogen 2.419 N/A MET 625.A N MET 621.A O no hydrogen 2.849 N/A ASN 626.A N GLU 623.A O.A no hydrogen 3.083 N/A ASN 626.A N GLU 623.A O.B no hydrogen 3.017 N/A ASN 626.A ND2 SER 451.A O no hydrogen 3.536 N/A ASN 626.A ND2 TYR 454.A O no hydrogen 3.133 N/A ASN 627.A N CYS 622.A O no hydrogen 2.844 N/A ASN 627.A ND2 SER 455.A OG no hydrogen 2.936 N/A ASN 627.A ND2 CYS 456.A O no hydrogen 3.262 N/A LYS 628.A N GLN 422.A O no hydrogen 2.987 N/A HIS 630.A NE2 ASP 615.A OD1 no hydrogen 2.979 N/A LEU 631.A N GLN 422.A OE1 no hydrogen 2.930 N/A ASP 635.A N ASP 411.A O no hydrogen 3.384 N/A ARG 636.A N GLU 611.A OE2 no hydrogen 2.740 N/A ARG 636.A NH1 GLU 637.A O no hydrogen 3.198 N/A ARG 636.A NH2 ASP 603.A OD1 no hydrogen 2.662 N/A GLU 637.A N SER 409.A O no hydrogen 2.618 N/A ALA 638.A N SER 409.A OG no hydrogen 2.685 N/A ILE 639.A N ALA 665.A O no hydrogen 3.087 N/A ALA 640.A N VAL 407.A O no hydrogen 2.673 N/A GLY 641.A N ASN 662.A O no hydrogen 3.208 N/A LEU 644.A N THR 595.A OG1 no hydrogen 2.864 N/A SER 646.A N PRO 643.A O no hydrogen 3.116 N/A SER 646.A OG PRO 643.A O no hydrogen 2.735 N/A SER 646.A OG GLN 705.A O no hydrogen 3.245 N/A GLY 648.A N SER 646.A OG no hydrogen 3.374 N/A ILE 649.A N MET 703.A O no hydrogen 2.965 N/A GLY 650.A N LEU 704.A O no hydrogen 3.220 N/A GLY 651.A N ILE 649.A O no hydrogen 2.846 N/A PHE 652.A N ALA 660.A O no hydrogen 3.049 N/A TRP 653.A N ASN 402.A O no hydrogen 3.031 N/A THR 654.A N ARG 658.A O no hydrogen 3.188 N/A LYS 656.A NZ VAL 396.A O no hydrogen 3.339 N/A LYS 657.A N TYR 570.A OH no hydrogen 2.889 N/A LYS 657.A NZ ASP 572.A OD1 no hydrogen 3.312 N/A LYS 657.A NZ ASP 572.A OD2 no hydrogen 2.657 N/A ARG 658.A N GLY 655.A O no hydrogen 3.282 N/A ARG 658.A NE THR 654.A OG1 no hydrogen 2.811 N/A ARG 658.A NH1 GLU 682.A OE1 no hydrogen 3.515 N/A ARG 658.A NH1 GLU 682.A OE2 no hydrogen 3.411 N/A ARG 658.A NH2 THR 654.A OG1 no hydrogen 3.281 N/A TYR 659.A N MET 679.A O no hydrogen 3.067 N/A TYR 659.A OH TYR 577.A OH no hydrogen 2.761 N/A ALA 660.A N PHE 652.A O no hydrogen 3.034 N/A LEU 661.A N LYS 677.A O no hydrogen 2.645 N/A ASN 662.A N GLY 650.A O no hydrogen 2.967 N/A ASN 662.A ND2 GLY 641.A O no hydrogen 2.988 N/A VAL 663.A N LYS 675.A O no hydrogen 2.800 N/A TRP 664.A N ILE 639.A O no hydrogen 2.910 N/A TRP 664.A NE1 GLY 641.A O no hydrogen 2.583 N/A MET 666.A N THR 669.A O no hydrogen 2.714 N/A GLU 667.A N GLU 637.A O no hydrogen 2.821 N/A THR 669.A N MET 666.A O no hydrogen 2.879 N/A ARG 670.A NH1 ASP 600.A OD1 no hydrogen 2.533 N/A ARG 670.A NH2 ASP 600.A OD1 no hydrogen 2.942 N/A ARG 670.A NH2 ASP 603.A OD2 no hydrogen 3.351 N/A TYR 671.A N TRP 664.A O no hydrogen 2.982 N/A LYS 675.A N VAL 663.A O no hydrogen 2.929 N/A LYS 677.A N LEU 661.A O no hydrogen 2.713 N/A MET 679.A N TYR 659.A O no hydrogen 2.884 N/A GLU 682.A N GLU 682.A OE1 no hydrogen 2.602 N/A THR 683.A OG1 GLN 684.A OE1 no hydrogen 2.516 N/A GLN 684.A N LEU 681.A O no hydrogen 2.762 N/A LYS 685.A N GLU 682.A O no hydrogen 3.230 N/A THR 688.A N LYS 685.A O no hydrogen 3.037 N/A THR 688.A OG1 GLU 682.A O no hydrogen 3.132 N/A ALA 691.A N SER 729.A O no hydrogen 2.769 N/A VAL 692.A N PRO 689.A O no hydrogen 3.080 N/A GLN 693.A N PRO 689.A O no hydrogen 2.903 N/A GLN 693.A NE2 LYS 685.A O no hydrogen 2.802 N/A LYS 694.A N LYS 690.A O no hydrogen 3.286 N/A ALA 695.A N ALA 691.A O no hydrogen 3.222 N/A LEU 696.A N VAL 692.A O no hydrogen 2.761 N/A LYS 697.A N GLN 693.A O no hydrogen 2.818 N/A GLU 698.A N LYS 694.A O no hydrogen 2.869 N/A CYS 699.A N ALA 695.A O no hydrogen 2.934 N/A CYS 699.A SG ALA 695.A O no hydrogen 3.318 N/A ILE 700.A N LEU 696.A O no hydrogen 2.823 N/A ARG 701.A N LYS 697.A O no hydrogen 2.837 N/A ARG 701.A NE GLU 698.A OE1 no hydrogen 3.396 N/A ARG 701.A NE GLU 698.A OE2 no hydrogen 2.936 N/A ARG 701.A NH1 GLN 705.A OE1 no hydrogen 2.990 N/A ARG 701.A NH1 GLU 706.A OE1 no hydrogen 3.172 N/A ARG 701.A NH2 GLU 698.A OE1 no hydrogen 2.933 N/A ARG 701.A NH2 GLU 706.A OE1 no hydrogen 3.182 N/A ARG 702.A N GLU 698.A O no hydrogen 3.077 N/A ARG 702.A NE GLU 698.A OE1 no hydrogen 2.834 N/A ARG 702.A NH1 SER 710.A O no hydrogen 2.922 N/A MET 703.A N CYS 699.A O no hydrogen 3.101 N/A LEU 704.A N ILE 700.A O no hydrogen 2.965 N/A GLN 705.A N ARG 701.A O no hydrogen 2.966 N/A GLN 705.A NE2 ASN 662.A OD1 no hydrogen 2.641 N/A GLU 706.A N ARG 702.A O no hydrogen 2.953 N/A GLY 707.A N ARG 702.A O no hydrogen 2.630 N/A SER 710.A OG GLU 706.A OE2 no hydrogen 2.675 N/A LEU 711.A N GLY 707.A O no hydrogen 3.378 N/A GLN 712.A N GLU 708.A O no hydrogen 2.938 N/A GLN 712.A NE2 ASP 841.A O no hydrogen 2.917 N/A GLU 713.A N GLU 709.A O no hydrogen 3.049 N/A TYR 714.A N SER 710.A O no hydrogen 3.043 N/A PHE 715.A N LEU 711.A O no hydrogen 2.925 N/A LYS 716.A N GLN 712.A O no hydrogen 3.093 N/A GLU 717.A N GLU 713.A O no hydrogen 3.282 N/A PHE 718.A N TYR 714.A O no hydrogen 2.888 N/A GLU 719.A N PHE 715.A O no hydrogen 2.948 N/A LYS 720.A N LYS 716.A O no hydrogen 3.374 N/A GLU 721.A N PHE 718.A O no hydrogen 3.402 N/A PHE 722.A N PHE 718.A O no hydrogen 3.028 N/A ARG 723.A NH1 LYS 720.A O no hydrogen 3.103 N/A GLN 724.A N GLU 721.A O no hydrogen 2.863 N/A LEU 725.A N PHE 722.A O no hydrogen 3.224 N/A TYR 727.A OH GLU 804.A OE1 no hydrogen 2.901 N/A ILE 728.A N ASN 726.A OD1 no hydrogen 3.302 N/A SER 729.A OG ASN 726.A O no hydrogen 2.694 N/A ALA 731.A N ILE 728.A O no hydrogen 3.121 N/A SER 732.A N VAL 783.A O no hydrogen 2.877 N/A VAL 733.A N SER 687.A O no hydrogen 3.213 N/A SER 734.A N VAL 781.A O no hydrogen 3.149 N/A SER 734.A OG SER 735.A O no hydrogen 3.194 N/A ALA 736.A N GLU 779.A O no hydrogen 2.623 N/A ASN 738.A N GLU 777.A OE1 no hydrogen 2.852 N/A ILE 739.A N GLU 777.A OE2 no hydrogen 3.130 N/A TYR 742.A N ILE 739.A O no hydrogen 3.189 N/A ASP 743.A N ALA 740.A O no hydrogen 2.959 N/A VAL 744.A N PHE 747.A O no hydrogen 3.061 N/A GLY 746.A N ASP 743.A OD1 no hydrogen 2.965 N/A PHE 747.A N VAL 744.A O no hydrogen 3.172 N/A GLY 749.A N TYR 742.A O no hydrogen 3.048 N/A CYS 752.A N GLY 749.A O no hydrogen 3.355 N/A CYS 752.A SG PRO 753.A O no hydrogen 3.442 N/A ARG 757.A N PRO 753.A O no hydrogen 2.933 N/A ARG 757.A NH1 ASP 794.A OD1 no hydrogen 3.153 N/A ARG 757.A NH1 ASP 794.A OD2 no hydrogen 2.890 N/A GLY 758.A N PHE 754.A O no hydrogen 3.280 N/A ILE 759.A N HIS 755.A O no hydrogen 3.293 N/A ILE 759.A N ILE 756.A O no hydrogen 3.024 N/A LEU 760.A N ILE 756.A O no hydrogen 3.103 N/A THR 761.A N ARG 757.A O no hydrogen 3.099 N/A THR 761.A OG1 ARG 757.A O no hydrogen 2.782 N/A THR 761.A OG1 CYS 796.A O no hydrogen 2.976 N/A TYR 762.A N GLY 758.A O no hydrogen 3.139 N/A TYR 762.A OH PRO 773.A O no hydrogen 2.863 N/A ASN 763.A N ILE 759.A O no hydrogen 2.840 N/A ARG 764.A N LEU 760.A O no hydrogen 3.161 N/A ARG 764.A NH1 GLY 746.A O no hydrogen 2.856 N/A ARG 764.A NH2 PHE 792.A O no hydrogen 3.294 N/A ALA 765.A N THR 761.A O no hydrogen 3.299 N/A ILE 766.A N TYR 762.A O no hydrogen 3.119 N/A LYS 767.A N ARG 764.A O no hydrogen 3.441 N/A LYS 767.A NZ ASN 763.A O no hydrogen 3.087 N/A ASN 769.A N ILE 766.A O no hydrogen 2.962 N/A ALA 772.A N ASN 769.A O no hydrogen 3.299 N/A GLY 778.A N ALA 736.A O no hydrogen 2.697 N/A GLU 779.A N VAL 776.A O no hydrogen 3.193 N/A LYS 780.A NZ ASN 284.A OD1 no hydrogen 2.615 N/A LYS 780.A NZ GLN 285.A O no hydrogen 3.055 N/A VAL 781.A N SER 734.A O no hydrogen 2.904 N/A TYR 782.A N TRP 799.A O no hydrogen 2.662 N/A VAL 783.A N SER 732.A O no hydrogen 2.692 N/A LEU 784.A N ILE 797.A O no hydrogen 3.117 N/A LEU 786.A N LYS 795.A O no hydrogen 2.624 N/A ARG 787.A N TRP 816.A O no hydrogen 2.871 N/A ARG 787.A NH1 HIS 815.A O no hydrogen 2.960 N/A ARG 787.A NH1 MET 817.A O no hydrogen 3.426 N/A ARG 787.A NH2 HIS 815.A O no hydrogen 2.899 N/A ASN 790.A N ARG 787.A O no hydrogen 3.301 N/A ASN 790.A ND2 ARG 787.A O no hydrogen 2.826 N/A ASN 790.A ND2 ASP 794.A O no hydrogen 2.786 N/A PHE 792.A N ASN 790.A OD1 no hydrogen 2.975 N/A GLY 793.A N ASN 790.A O no hydrogen 3.383 N/A GLY 793.A N ASN 790.A OD1 no hydrogen 3.124 N/A LYS 795.A N ASP 794.A OD1 no hydrogen 2.664 N/A CYS 796.A SG PHE 754.A O no hydrogen 3.202 N/A ILE 797.A N LEU 784.A O no hydrogen 3.047 N/A ALA 798.A N GLY 758.A O no hydrogen 2.696 N/A TRP 799.A N TYR 782.A O no hydrogen 3.127 N/A TRP 799.A NE1 THR 803.A O no hydrogen 3.107 N/A SER 801.A N LYS 780.A O no hydrogen 3.140 N/A SER 801.A OG PRO 286.A O no hydrogen 2.779 N/A SER 801.A OG LYS 780.A O no hydrogen 3.248 N/A THR 803.A OG1 PRO 800.A O no hydrogen 2.725 N/A ILE 805.A N TYR 727.A OH no hydrogen 2.848 N/A LEU 808.A N THR 806.A OG1 no hydrogen 3.316 N/A ILE 809.A N THR 806.A O no hydrogen 3.255 N/A LYS 810.A NZ GLU 804.A OE1 no hydrogen 2.821 N/A VAL 813.A N ILE 809.A O no hydrogen 3.048 N/A LEU 814.A N LYS 810.A O no hydrogen 3.051 N/A HIS 815.A N ASP 811.A O no hydrogen 3.191 N/A HIS 815.A ND1 ASP 811.A O no hydrogen 2.510 N/A TRP 816.A N ASP 812.A O no hydrogen 3.007 N/A TRP 816.A N VAL 813.A O no hydrogen 3.303 N/A MET 817.A N VAL 813.A O no hydrogen 2.875 N/A ASP 818.A N PRO 785.A O no hydrogen 2.944 N/A VAL 821.A N ASP 818.A OD1 no hydrogen 3.344 N/A LEU 822.A N ASP 818.A O no hydrogen 3.022 N/A LEU 823.A N TYR 819.A O no hydrogen 2.943 N/A GLU 824.A N THR 820.A O no hydrogen 2.963 N/A LYS 825.A N VAL 821.A O no hydrogen 3.047 N/A THR 826.A N LEU 822.A O no hydrogen 3.296 N/A THR 826.A OG1 LEU 822.A O no hydrogen 2.833 N/A PHE 827.A N LEU 823.A O no hydrogen 3.200 N/A ILE 828.A N LEU 823.A O no hydrogen 2.917 N/A LYS 829.A N GLU 824.A O no hydrogen 2.998 N/A LEU 831.A N PHE 827.A O no hydrogen 3.078 N/A GLU 832.A N ILE 828.A O no hydrogen 2.722 N/A GLY 833.A N LYS 829.A O no hydrogen 3.315 N/A PHE 834.A N PRO 830.A O no hydrogen 3.062 N/A THR 835.A N LEU 831.A O no hydrogen 3.086 N/A THR 835.A OG1 LEU 831.A O no hydrogen 2.851 N/A SER 836.A N GLU 832.A O no hydrogen 3.173 N/A SER 836.A OG.A GLU 832.A O no hydrogen 2.636 N/A SER 836.A OG.A GLY 833.A O no hydrogen 3.517 N/A SER 836.A OG.C GLU 832.A O no hydrogen 2.709 N/A SER 836.A OG.C GLY 833.A O no hydrogen 3.542 N/A ALA 838.A N PHE 834.A O no hydrogen 2.986 N/A LYS 839.A N SER 836.A O no hydrogen 3.408 N/A LEU 840.A N THR 835.A O no hydrogen 2.685 N/A ASP 841.A N GLU 708.A OE2 no hydrogen 3.216 N/A TYR 842.A OH GLU 832.A OE1.A no hydrogen 3.117 N/A