Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7d6n_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 9.A NE2 ASP 7.A OD1 no hydrogen 3.486 N/A ALA 14.A N GLU 10.A O no hydrogen 2.658 N/A LEU 15.A N ARG 11.A O no hydrogen 2.643 N/A ARG 16.A N SER 13.A O no hydrogen 3.344 N/A ARG 16.A NH1 SER 13.A O no hydrogen 3.411 N/A THR 22.A N TYR 19.A O no hydrogen 3.361 N/A TRP 23.A N GLY 20.A O no hydrogen 3.212 N/A HIS 24.A N SER 39.A O no hydrogen 2.939 N/A HIS 24.A ND1 THR 22.A O no hydrogen 2.843 N/A ASP 26.A N TYR 36.A OH no hydrogen 3.121 N/A GLU 28.A N ASP 26.A OD1 no hydrogen 2.773 N/A TYR 31.A N HIS 29.A ND1 no hydrogen 3.083 N/A TYR 31.A OH ASP 293.A OD2 no hydrogen 2.553 N/A ARG 32.A N ASP 91.A OD2 no hydrogen 2.829 N/A THR 33.A N ASP 91.A OD1 no hydrogen 2.758 N/A THR 33.A OG1 ASP 91.A OD1 no hydrogen 2.617 N/A THR 33.A OG1 THR 92.A O no hydrogen 3.015 N/A TRP 34.A NE1 VAL 90.A O no hydrogen 3.272 N/A GLN 35.A N THR 296.A O no hydrogen 3.018 N/A GLN 35.A NE2 GLU 5.A OE1 no hydrogen 3.153 N/A TYR 36.A OH SER 39.A OG no hydrogen 2.420 N/A TRP 37.A N VAL 294.A O no hydrogen 3.026 N/A TRP 37.A NE1 THR 296.A OG1 no hydrogen 2.988 N/A SER 39.A N HIS 24.A O no hydrogen 3.262 N/A SER 39.A OG TYR 36.A OH no hydrogen 2.420 N/A TYR 40.A N MET 292.A O no hydrogen 3.016 N/A THR 42.A N CYS 290.A O no hydrogen 2.601 N/A SER 47.A N THR 77.A OG1 no hydrogen 2.728 N/A ALA 49.A N SER 47.A OG no hydrogen 3.057 N/A ASN 53.A N ARG 440.A O no hydrogen 2.975 N/A ASN 53.A ND2 THR 451.A O no hydrogen 3.309 N/A ASN 53.A ND2 SER 455.A OG no hydrogen 2.850 N/A VAL 56.A N ASN 53.A OD1 no hydrogen 2.653 N/A LYS 57.A N ASN 53.A O no hydrogen 3.012 N/A LEU 58.A N GLY 54.A O no hydrogen 2.863 N/A LEU 59.A N VAL 55.A O no hydrogen 3.062 N/A LEU 59.A N VAL 56.A O no hydrogen 3.259 N/A SER 60.A N LYS 57.A O no hydrogen 3.312 N/A SER 60.A OG VAL 56.A O no hydrogen 2.413 N/A TRP 63.A N SER 60.A O no hydrogen 3.316 N/A ASN 64.A N TRP 61.A O no hydrogen 3.375 N/A VAL 70.A N GLU 67.A O no hydrogen 3.302 N/A MET 74.A N ARG 71.A O no hydrogen 3.205 N/A THR 77.A N SER 47.A O no hydrogen 3.158 N/A THR 77.A OG1 SER 47.A O no hydrogen 3.338 N/A THR 78.A N ASP 76.A OD2 no hydrogen 3.467 N/A GLN 82.A N THR 78.A O no hydrogen 2.722 N/A GLN 83.A N ALA 79.A O no hydrogen 2.844 N/A GLN 83.A NE2 TYR 31.A OH no hydrogen 3.244 N/A ARG 84.A N PHE 80.A O no hydrogen 3.167 N/A VAL 85.A N GLY 81.A O no hydrogen 3.062 N/A PHE 86.A N GLN 82.A O no hydrogen 2.949 N/A LYS 87.A N GLN 83.A O no hydrogen 2.872 N/A GLU 88.A N ARG 84.A O no hydrogen 3.104 N/A GLU 88.A N VAL 85.A O no hydrogen 2.963 N/A LYS 89.A N VAL 85.A O no hydrogen 2.878 N/A VAL 90.A N PHE 86.A O no hydrogen 3.012 N/A ASP 91.A N PHE 86.A O no hydrogen 3.030 N/A THR 92.A N VAL 90.A O no hydrogen 3.048 N/A LYS 93.A NZ ALA 94.A O no hydrogen 2.763 N/A LYS 93.A NZ GLU 96.A OE2 no hydrogen 3.022 N/A LYS 93.A NZ ASP 299.A OD2 no hydrogen 2.525 N/A GLN 98.A N ASP 384.A OD2 no hydrogen 3.316 N/A GLY 100.A N ALA 336.A O no hydrogen 2.643 N/A THR 101.A OG1 ASP 384.A OD2 no hydrogen 2.611 N/A LYS 102.A N GLN 98.A O no hydrogen 3.048 N/A VAL 103.A N PRO 99.A O no hydrogen 3.162 N/A VAL 103.A N GLY 100.A O no hydrogen 2.758 N/A ILE 104.A N GLY 100.A O no hydrogen 3.057 N/A MET 105.A N THR 101.A O no hydrogen 2.800 N/A ARG 106.A N LYS 102.A O no hydrogen 3.041 N/A ALA 107.A N VAL 103.A O no hydrogen 2.990 N/A VAL 108.A N ILE 104.A O no hydrogen 2.992 N/A ASN 109.A N MET 105.A O no hydrogen 2.797 N/A ASN 109.A ND2 ASP 250.A O no hydrogen 2.812 N/A ASP 110.A N ARG 106.A O no hydrogen 2.966 N/A TRP 111.A N ALA 107.A O no hydrogen 3.012 N/A ILE 112.A N VAL 108.A O no hydrogen 3.027 N/A ILE 112.A N ASN 109.A O no hydrogen 3.113 N/A LEU 113.A N ASN 109.A O no hydrogen 3.077 N/A GLU 114.A N ASP 110.A O no hydrogen 2.980 N/A ARG 115.A N TRP 111.A O no hydrogen 3.217 N/A ARG 115.A NH1 GLU 353.A OE1 no hydrogen 2.987 N/A ARG 115.A NH2 SER 203.A O no hydrogen 2.968 N/A LEU 116.A N ILE 112.A O no hydrogen 2.979 N/A ALA 117.A N LEU 113.A O no hydrogen 2.793 N/A ARG 118.A N GLU 114.A O no hydrogen 3.133 N/A LYS 119.A N LEU 116.A O no hydrogen 3.258 N/A LYS 119.A NZ GLY 202.A O no hydrogen 3.466 N/A LYS 121.A NZ PRO 122.A O no hydrogen 3.220 N/A ARG 123.A NE ASP 196.A OD1 no hydrogen 3.536 N/A ARG 123.A NE ASP 196.A OD2 no hydrogen 3.099 N/A ARG 123.A NH1 MET 124.A O no hydrogen 3.412 N/A ARG 123.A NH1 GLU 129.A OE2 no hydrogen 2.684 N/A ARG 123.A NH2 GLU 129.A OE1 no hydrogen 3.405 N/A ARG 123.A NH2 ASP 196.A OD1 no hydrogen 3.223 N/A CYS 125.A N GLU 188.A O no hydrogen 3.137 N/A SER 126.A OG GLU 129.A OE2 no hydrogen 3.260 N/A ARG 127.A NH2 ASP 157.A OD2 no hydrogen 3.323 N/A GLU 129.A N SER 126.A O no hydrogen 3.038 N/A PHE 130.A N SER 126.A O no hydrogen 3.140 N/A ILE 131.A N ARG 127.A O no hydrogen 2.801 N/A ALA 132.A N GLU 128.A O no hydrogen 3.106 N/A LYS 133.A N GLU 129.A O no hydrogen 2.835 N/A LYS 133.A NZ GLU 195.A OE2 no hydrogen 2.783 N/A VAL 134.A N PHE 130.A O no hydrogen 2.860 N/A LYS 135.A N ILE 131.A O no hydrogen 2.741 N/A SER 136.A N LYS 133.A O no hydrogen 3.179 N/A SER 136.A OG LYS 133.A O no hydrogen 3.261 N/A ASN 137.A N VAL 134.A O no hydrogen 2.841 N/A TRP 141.A NE1 ASP 149.A OD2 no hydrogen 2.564 N/A ALA 146.A N ALA 143.A O no hydrogen 3.072 N/A VAL 147.A N ALA 143.A O no hydrogen 3.291 N/A GLU 148.A N GLU 145.A O no hydrogen 3.415 N/A ALA 151.A N ASP 149.A OD1 no hydrogen 2.903 N/A PHE 152.A N ASP 149.A O no hydrogen 2.795 N/A TRP 153.A NE1 VAL 147.A O no hydrogen 2.782 N/A GLN 154.A N PRO 150.A O no hydrogen 2.791 N/A LEU 155.A N ALA 151.A O no hydrogen 2.958 N/A LEU 155.A N PHE 152.A O no hydrogen 2.784 N/A VAL 156.A N PHE 152.A O no hydrogen 3.093 N/A ASP 157.A N TRP 153.A O no hydrogen 2.875 N/A GLU 159.A N LEU 155.A O no hydrogen 3.248 N/A ARG 160.A N VAL 156.A O no hydrogen 2.498 N/A GLU 161.A N ASP 157.A O no hydrogen 2.979 N/A ARG 162.A N GLU 158.A O no hydrogen 3.152 N/A ARG 162.A NH1 GLU 159.A OE2 no hydrogen 2.667 N/A HIS 163.A N GLU 159.A O no hydrogen 2.871 N/A LEU 164.A N ARG 160.A O no hydrogen 2.857 N/A ALA 165.A N GLU 161.A O no hydrogen 3.258 N/A GLY 166.A N HIS 163.A O no hydrogen 2.647 N/A ARG 167.A N ARG 162.A O no hydrogen 3.057 N/A ALA 169.A N GLU 159.A OE1 no hydrogen 2.731 N/A ALA 169.A N GLU 159.A OE2 no hydrogen 3.415 N/A HIS 170.A N GLU 159.A OE1 no hydrogen 2.577 N/A CYS 171.A SG HIS 163.A NE2 no hydrogen 3.502 N/A CYS 171.A SG SER 182.A OG no hydrogen 3.296 N/A TYR 173.A N VAL 278.A O no hydrogen 2.904 N/A ASN 174.A N TYR 177.A O no hydrogen 2.605 N/A MET 175.A N LYS 280.A O no hydrogen 3.081 N/A TYR 177.A N ASN 174.A O no hydrogen 2.873 N/A SER 182.A OG HIS 170.A O no hydrogen 3.273 N/A ARG 183.A N TRP 179.A O no hydrogen 2.935 N/A PHE 184.A N LEU 180.A O no hydrogen 2.839 N/A LEU 185.A N GLY 181.A O no hydrogen 3.240 N/A GLU 186.A N SER 182.A O no hydrogen 3.085 N/A PHE 187.A N ARG 183.A O no hydrogen 3.095 N/A GLU 188.A N PHE 184.A O no hydrogen 2.839 N/A ALA 189.A N LEU 185.A O no hydrogen 3.174 N/A LEU 190.A N GLU 186.A O no hydrogen 2.800 N/A GLY 191.A N PHE 187.A O no hydrogen 3.016 N/A LEU 193.A N LEU 190.A O no hydrogen 3.039 N/A ASN 194.A N GLY 191.A O no hydrogen 3.051 N/A ASN 194.A ND2 VAL 306.A O no hydrogen 2.896 N/A GLU 195.A N GLY 191.A O no hydrogen 2.933 N/A ASP 196.A N PHE 192.A O no hydrogen 2.715 N/A HIS 197.A N ASN 194.A O no hydrogen 3.177 N/A HIS 197.A ND1 GLU 209.A OE1 no hydrogen 3.157 N/A TRP 198.A N LEU 193.A O no hydrogen 2.969 N/A SER 200.A N HIS 197.A O no hydrogen 3.359 N/A SER 200.A OG HIS 197.A O no hydrogen 2.716 N/A ARG 201.A NH1 MET 359.A O no hydrogen 3.323 N/A ARG 201.A NH2 GLY 207.A O no hydrogen 3.562 N/A ARG 201.A NH2 MET 359.A O no hydrogen 2.739 N/A SER 203.A N SER 200.A O no hydrogen 3.286 N/A SER 203.A OG HIS 197.A O no hydrogen 2.995 N/A SER 203.A OG SER 200.A OG no hydrogen 2.910 N/A SER 204.A N SER 200.A O no hydrogen 2.962 N/A SER 204.A OG SER 200.A O no hydrogen 2.726 N/A GLY 205.A N ARG 201.A O no hydrogen 3.161 N/A SER 206.A N SER 204.A O no hydrogen 2.805 N/A GLY 207.A N SER 204.A OG no hydrogen 3.148 N/A GLU 209.A N ALA 199.A O no hydrogen 3.296 N/A ILE 211.A N VAL 208.A O no hydrogen 3.099 N/A LEU 213.A N HIS 498.A O no hydrogen 3.366 N/A TYR 215.A N SER 212.A O no hydrogen 2.854 N/A TYR 215.A OH VAL 516.A O no hydrogen 2.608 N/A LEU 216.A N SER 212.A O no hydrogen 3.018 N/A TRP 218.A N TYR 215.A O no hydrogen 2.966 N/A TYR 219.A N LEU 216.A O no hydrogen 2.801 N/A LEU 220.A N LEU 216.A O no hydrogen 3.124 N/A LYS 221.A N GLY 217.A O no hydrogen 2.909 N/A LYS 221.A NZ GLU 416.A OE1 no hydrogen 3.402 N/A LYS 221.A NZ GLU 416.A OE2 no hydrogen 2.892 N/A GLY 222.A N TRP 218.A O no hydrogen 2.900 N/A LEU 223.A N TYR 219.A O no hydrogen 3.067 N/A SER 224.A N LYS 221.A O no hydrogen 2.863 N/A SER 224.A OG LYS 221.A O no hydrogen 2.586 N/A THR 225.A N GLY 222.A O no hydrogen 3.128 N/A THR 225.A OG1 GLY 222.A O no hydrogen 2.788 N/A LEU 226.A N LEU 223.A O no hydrogen 3.229 N/A GLY 229.A N PRO 370.A O no hydrogen 2.712 N/A LEU 230.A N ASP 373.A OD1 no hydrogen 2.428 N/A PHE 231.A N PHE 401.A O no hydrogen 2.852 N/A TYR 232.A N VAL 368.A O no hydrogen 2.806 N/A TYR 232.A OH ASP 373.A OD1 no hydrogen 2.921 N/A TYR 232.A OH SER 376.A OG no hydrogen 2.794 N/A ALA 237.A N THR 388.A O no hydrogen 3.181 N/A TRP 239.A NE1 ASN 312.A OD1 no hydrogen 2.324 N/A THR 241.A N GLY 238.A O no hydrogen 2.876 N/A THR 241.A OG1 GLY 238.A O no hydrogen 3.069 N/A LYS 242.A N TRP 239.A O no hydrogen 2.720 N/A LYS 242.A NZ ALA 237.A O no hydrogen 2.412 N/A THR 244.A N ASP 247.A OD2 no hydrogen 3.174 N/A THR 244.A OG1 ASP 247.A OD2 no hydrogen 3.140 N/A ASN 245.A N GLU 96.A OE2 no hydrogen 2.587 N/A ASN 245.A ND2 GLU 96.A OE2 no hydrogen 2.911 N/A ALA 246.A N GLU 96.A OE1 no hydrogen 3.094 N/A ASP 247.A N THR 244.A OG1 no hydrogen 3.323 N/A LEU 248.A N THR 244.A O no hydrogen 2.911 N/A GLU 249.A N ASN 245.A O no hydrogen 2.761 N/A ASP 250.A N ALA 246.A O no hydrogen 2.874 N/A GLU 251.A N ASP 247.A O no hydrogen 3.119 N/A GLU 252.A N LEU 248.A O no hydrogen 3.005 N/A GLN 253.A N ASP 250.A O no hydrogen 3.114 N/A GLN 253.A NE2 ASP 110.A OD1 no hydrogen 3.208 N/A GLN 253.A NE2 ASP 110.A OD2 no hydrogen 3.274 N/A LEU 254.A N GLU 251.A O no hydrogen 3.034 N/A LEU 255.A N GLU 252.A O no hydrogen 2.846 N/A ARG 256.A N GLN 253.A O no hydrogen 3.414 N/A ARG 256.A NE GLN 253.A O no hydrogen 3.351 N/A TYR 257.A N LEU 254.A O no hydrogen 3.239 N/A TYR 257.A OH GLU 114.A OE1 no hydrogen 2.832 N/A MET 258.A N LEU 255.A O no hydrogen 2.854 N/A LYS 263.A N GLU 259.A O no hydrogen 3.231 N/A LEU 265.A N GLU 261.A O no hydrogen 2.862 N/A ALA 266.A N HIS 262.A O no hydrogen 3.021 N/A ALA 267.A N LYS 263.A O no hydrogen 3.018 N/A THR 268.A N GLN 264.A O no hydrogen 3.014 N/A THR 268.A OG1 HIS 163.A O no hydrogen 3.054 N/A ILE 269.A N LEU 265.A O no hydrogen 3.484 N/A MET 270.A N ALA 266.A O no hydrogen 2.763 N/A GLN 271.A N ALA 267.A O no hydrogen 2.744 N/A LYS 272.A N THR 268.A O no hydrogen 2.677 N/A LYS 272.A NZ GLN 9.A OE1 no hydrogen 2.999 N/A ALA 273.A N THR 268.A O no hydrogen 3.320 N/A TYR 274.A N ILE 269.A O no hydrogen 3.007 N/A TYR 274.A OH GLU 186.A OE2 no hydrogen 2.255 N/A HIS 275.A ND1 GLU 252.A OE2 no hydrogen 2.770 N/A HIS 275.A NE2 ASN 245.A OD1 no hydrogen 2.545 N/A ALA 276.A N LYS 272.A O no hydrogen 2.838 N/A LYS 277.A N ARG 297.A O no hydrogen 3.059 N/A LYS 277.A NZ TYR 274.A O no hydrogen 2.445 N/A LYS 277.A NZ ARG 298.A O no hydrogen 3.479 N/A LYS 277.A NZ GLN 300.A O no hydrogen 2.577 N/A VAL 279.A N ILE 295.A O no hydrogen 2.865 N/A LYS 280.A N TYR 173.A O no hydrogen 2.671 N/A LYS 280.A NZ TYR 19.A OH no hydrogen 2.996 N/A VAL 281.A N ASP 293.A O no hydrogen 3.064 N/A ARG 283.A N VAL 291.A O no hydrogen 3.071 N/A ARG 283.A NE ASP 293.A OD1 no hydrogen 3.493 N/A ARG 283.A NE ASP 293.A OD2 no hydrogen 2.636 N/A ARG 283.A NH2 ASP 293.A OD1 no hydrogen 3.174 N/A SER 285.A N GLY 289.A O no hydrogen 3.010 N/A SER 285.A OG ASP 287.A OD2 no hydrogen 2.503 N/A SER 285.A OG GLY 289.A O no hydrogen 2.684 N/A ARG 286.A NH1 ASP 26.A OD2 no hydrogen 3.162 N/A ARG 286.A NH2 ASP 26.A OD1 no hydrogen 3.260 N/A ARG 286.A NH2 ASP 26.A OD2 no hydrogen 3.550 N/A GLY 289.A N SER 285.A OG no hydrogen 3.282 N/A CYS 290.A SG ARG 283.A O no hydrogen 3.364 N/A CYS 290.A SG VAL 291.A O no hydrogen 3.997 N/A VAL 291.A N ARG 283.A O no hydrogen 3.018 N/A MET 292.A N TYR 40.A O no hydrogen 2.633 N/A ASP 293.A N VAL 281.A O no hydrogen 2.792 N/A VAL 294.A N GLY 38.A O no hydrogen 2.887 N/A ILE 295.A N VAL 279.A O no hydrogen 2.913 N/A THR 296.A N GLN 35.A O no hydrogen 3.102 N/A ARG 297.A N LYS 277.A O no hydrogen 3.401 N/A ARG 297.A NE ASP 299.A OD1 no hydrogen 2.820 N/A ARG 297.A NH1 THR 33.A OG1 no hydrogen 3.286 N/A ARG 297.A NH1 THR 92.A O no hydrogen 3.175 N/A ARG 297.A NH2 THR 92.A O no hydrogen 2.764 N/A ARG 297.A NH2 ASP 299.A OD1 no hydrogen 2.943 N/A GLN 300.A N VAL 243.A O no hydrogen 2.821 N/A GLN 300.A NE2 VAL 90.A O no hydrogen 3.121 N/A ARG 301.A N ASP 240.A O no hydrogen 2.921 N/A ARG 301.A NE ASN 312.A OD1 no hydrogen 2.978 N/A ARG 301.A NH1 GLU 251.A OE2 no hydrogen 2.662 N/A ARG 301.A NH2 GLU 251.A OE1 no hydrogen 3.039 N/A ARG 301.A NH2 GLU 251.A OE2 no hydrogen 2.829 N/A GLN 305.A NE2 TYR 173.A OH no hydrogen 2.503 N/A VAL 306.A N GLU 186.A OE2 no hydrogen 2.996 N/A THR 308.A N GLN 305.A O no hydrogen 3.298 N/A THR 308.A OG1 GLY 302.A O no hydrogen 3.156 N/A THR 308.A OG1 SER 303.A O no hydrogen 3.568 N/A THR 308.A OG1 GLN 305.A O no hydrogen 2.939 N/A TYR 309.A OH SER 362.A OG no hydrogen 2.779 N/A LEU 311.A N VAL 307.A O no hydrogen 2.964 N/A ASN 312.A N THR 308.A O no hydrogen 2.804 N/A ASN 312.A ND2 ASP 240.A OD1 no hydrogen 3.384 N/A ASN 312.A ND2 THR 308.A O no hydrogen 2.972 N/A THR 313.A N TYR 309.A O no hydrogen 2.909 N/A THR 313.A OG1 TYR 309.A O no hydrogen 2.678 N/A LEU 314.A N ALA 310.A O no hydrogen 2.900 N/A THR 315.A N LEU 311.A O no hydrogen 2.744 N/A THR 315.A OG1 GLU 251.A OE1 no hydrogen 2.930 N/A THR 315.A OG1 LEU 311.A O no hydrogen 3.367 N/A ASN 316.A N ASN 312.A O no hydrogen 2.826 N/A ASN 316.A ND2 GLY 363.A O no hydrogen 3.124 N/A ILE 317.A N THR 313.A O no hydrogen 2.774 N/A LYS 318.A N LEU 314.A O no hydrogen 3.068 N/A LYS 318.A NZ ASP 247.A OD1 no hydrogen 2.987 N/A LYS 318.A NZ ASP 250.A OD2 no hydrogen 2.946 N/A VAL 319.A N THR 315.A O no hydrogen 3.104 N/A GLN 320.A N ASN 316.A O no hydrogen 2.888 N/A GLN 320.A NE2 ASN 316.A OD1 no hydrogen 3.031 N/A LEU 321.A N ILE 317.A O no hydrogen 2.789 N/A ILE 322.A N LYS 318.A O no hydrogen 2.922 N/A ARG 323.A N VAL 319.A O no hydrogen 2.984 N/A ARG 323.A NE PHE 375.A O no hydrogen 3.292 N/A ARG 323.A NH1 ASP 234.A OD2 no hydrogen 3.006 N/A ARG 323.A NH2 ASP 234.A OD2 no hydrogen 3.532 N/A ARG 323.A NH2 PHE 375.A O no hydrogen 2.939 N/A ARG 323.A NH2 SER 398.A OG no hydrogen 3.067 N/A MET 324.A N GLN 320.A O no hydrogen 2.843 N/A MET 325.A N LEU 321.A O no hydrogen 3.156 N/A GLU 326.A N ILE 322.A O no hydrogen 2.951 N/A GLY 327.A N ARG 323.A O no hydrogen 3.090 N/A GLU 328.A N MET 324.A O no hydrogen 2.939 N/A GLY 329.A N MET 325.A O no hydrogen 3.047 N/A GLY 329.A N GLU 326.A O no hydrogen 3.229 N/A VAL 330.A N MET 325.A O no hydrogen 2.958 N/A GLU 332.A N ASP 335.A OD1 no hydrogen 2.670 N/A ASP 335.A N GLU 332.A O no hydrogen 2.628 N/A ALA 336.A N ALA 333.A O no hydrogen 3.151 N/A HIS 337.A N SER 334.A O no hydrogen 2.803 N/A ARG 340.A N ASP 335.A OD2 no hydrogen 2.934 N/A ARG 340.A NH1 GLU 332.A OE2 no hydrogen 3.016 N/A ARG 340.A NH2 GLU 332.A OE2 no hydrogen 3.097 N/A ARG 340.A NH2 ASP 335.A OD2 no hydrogen 3.340 N/A ARG 343.A N ARG 340.A O no hydrogen 2.770 N/A ARG 343.A NE VAL 330.A O no hydrogen 3.088 N/A ARG 343.A NH2 GLY 329.A O no hydrogen 3.415 N/A GLU 345.A N LEU 341.A O no hydrogen 3.019 N/A ARG 346.A N LEU 342.A O no hydrogen 3.086 N/A TRP 347.A N ARG 343.A O no hydrogen 3.385 N/A TRP 347.A NE1 GLU 328.A OE1 no hydrogen 2.994 N/A LEU 348.A N VAL 344.A O no hydrogen 3.008 N/A ARG 349.A N GLU 345.A O no hydrogen 3.095 N/A ASP 350.A N ARG 346.A O no hydrogen 2.746 N/A HIS 351.A N TRP 347.A O no hydrogen 2.666 N/A GLY 352.A N LEU 348.A O no hydrogen 3.055 N/A ARG 355.A N HIS 351.A O no hydrogen 2.831 N/A ARG 355.A NE GLU 354.A OE2 no hydrogen 3.020 N/A ARG 355.A NH1 GLU 328.A OE2 no hydrogen 2.274 N/A LEU 356.A N GLY 352.A O no hydrogen 2.843 N/A GLY 357.A N GLU 354.A O no hydrogen 3.120 N/A ARG 358.A N ARG 355.A O no hydrogen 3.026 N/A ARG 358.A NE GLU 354.A OE1 no hydrogen 3.026 N/A ARG 358.A NE GLU 354.A OE2 no hydrogen 3.033 N/A ARG 358.A NH1 GLU 227.A O no hydrogen 3.261 N/A ARG 358.A NH1 GLU 354.A OE1 no hydrogen 2.743 N/A ARG 358.A NH2 GLU 227.A O no hydrogen 2.635 N/A ARG 358.A NH2 ARG 369.A O no hydrogen 3.336 N/A LEU 360.A N VAL 367.A O no hydrogen 2.830 N/A VAL 361.A N SER 206.A O no hydrogen 2.814 N/A SER 362.A N ASP 365.A O no hydrogen 2.848 N/A SER 362.A OG TYR 309.A OH no hydrogen 2.779 N/A SER 362.A OG HIS 498.A NE2 no hydrogen 3.006 N/A GLY 363.A N THR 313.A OG1 no hydrogen 2.965 N/A ASP 364.A N ASP 364.A OD1 no hydrogen 2.437 N/A ASP 365.A N SER 362.A O no hydrogen 2.928 N/A CYS 366.A SG ASP 234.A O no hydrogen 3.888 N/A VAL 367.A N LEU 360.A O no hydrogen 2.790 N/A VAL 368.A N TYR 232.A O no hydrogen 2.909 N/A ARG 369.A N ARG 358.A O no hydrogen 2.920 N/A ARG 369.A NE GLY 229.A O no hydrogen 2.607 N/A ARG 369.A NH1 LEU 226.A O no hydrogen 3.268 N/A ARG 369.A NH1 GLY 229.A O no hydrogen 3.077 N/A ARG 369.A NH2 LEU 223.A O no hydrogen 2.951 N/A ARG 369.A NH2 LEU 226.A O no hydrogen 2.667 N/A ARG 374.A N ASP 372.A OD1 no hydrogen 3.158 N/A ARG 374.A NE ASP 372.A OD1 no hydrogen 3.032 N/A ARG 374.A NE ASP 372.A OD2 no hydrogen 3.296 N/A ARG 374.A NH1 GLU 328.A O no hydrogen 2.803 N/A ARG 374.A NH2 ASP 372.A OD2 no hydrogen 3.127 N/A PHE 375.A N ASP 372.A O no hydrogen 3.427 N/A SER 376.A N ASP 373.A O no hydrogen 2.883 N/A SER 376.A OG ASP 373.A O no hydrogen 2.979 N/A SER 376.A OG SER 398.A O no hydrogen 3.310 N/A ARG 377.A N ARG 374.A O no hydrogen 2.946 N/A ALA 378.A N PHE 375.A O no hydrogen 3.222 N/A TYR 380.A N GLU 326.A OE2 no hydrogen 3.055 N/A PHE 381.A N GLU 326.A OE1 no hydrogen 2.874 N/A ASN 383.A N LEU 379.A O no hydrogen 2.915 N/A ASN 383.A ND2 LEU 379.A O no hydrogen 2.838 N/A ASN 383.A ND2 GLU 394.A O no hydrogen 3.129 N/A ASP 384.A N TYR 380.A O no hydrogen 2.826 N/A MET 385.A N PHE 381.A O no hydrogen 3.000 N/A ALA 386.A N ASN 383.A O no hydrogen 3.111 N/A LYS 387.A N LEU 382.A O no hydrogen 3.208 N/A LYS 387.A NZ LYS 242.A O no hydrogen 2.526 N/A LYS 387.A NZ ASP 247.A OD2 no hydrogen 2.493 N/A LYS 387.A NZ MET 385.A O no hydrogen 3.305 N/A THR 388.A N ALA 386.A O no hydrogen 2.637 N/A ARG 389.A NH1 GLU 396.A O no hydrogen 2.864 N/A ARG 389.A NH1 SER 398.A OG no hydrogen 2.469 N/A ARG 389.A NH2 GLU 394.A O no hydrogen 3.266 N/A ARG 389.A NH2 GLU 396.A O no hydrogen 2.589 N/A LYS 390.A N ASP 235.A O no hydrogen 2.742 N/A GLY 393.A N GLU 396.A OE1 no hydrogen 3.498 N/A GLU 396.A N GLY 393.A O no hydrogen 3.006 N/A SER 398.A N SER 376.A O no hydrogen 3.267 N/A SER 398.A OG ASP 234.A OD2 no hydrogen 2.430 N/A PHE 401.A N PHE 231.A O no hydrogen 2.875 N/A GLU 405.A N ASN 403.A OD1 no hydrogen 3.243 N/A GLU 406.A N ASN 403.A O no hydrogen 2.875 N/A VAL 407.A N TRP 404.A O no hydrogen 3.212 N/A PHE 409.A N HIS 412.A O no hydrogen 2.931 N/A CYS 410.A N ASP 365.A OD2 no hydrogen 2.940 N/A HIS 412.A N PHE 409.A O no hydrogen 2.908 N/A HIS 412.A ND1 CYS 410.A O no hydrogen 2.729 N/A HIS 412.A NE2 TYR 466.A OH no hydrogen 2.674 N/A HIS 413.A N CYS 429.A O no hydrogen 3.154 N/A HIS 415.A N VAL 427.A O no hydrogen 3.132 N/A LEU 417.A N LEU 425.A O no hydrogen 2.776 N/A MET 419.A N ARG 423.A O no hydrogen 2.756 N/A LYS 420.A NZ ARG 534.A O no hydrogen 3.415 N/A GLY 422.A N MET 419.A O no hydrogen 3.204 N/A ARG 423.A NE ASP 421.A OD1 no hydrogen 2.525 N/A ARG 423.A NH1 SER 526.A O no hydrogen 2.926 N/A ARG 423.A NH1 GLU 528.A O no hydrogen 2.958 N/A ARG 423.A NH2 GLU 528.A O no hydrogen 2.626 N/A LEU 425.A N LEU 417.A O no hydrogen 2.599 N/A VAL 427.A N HIS 415.A O no hydrogen 2.789 N/A CYS 429.A N HIS 413.A O no hydrogen 2.858 N/A CYS 429.A SG ARG 430.A O no hydrogen 3.785 N/A GLN 432.A N CYS 547.A O no hydrogen 3.373 N/A GLN 432.A NE2 ASP 471.A OD2 no hydrogen 2.921 N/A LEU 435.A N ASP 431.A O no hydrogen 3.159 N/A LEU 435.A N GLN 432.A O no hydrogen 3.214 N/A VAL 436.A N GLN 432.A O no hydrogen 3.061 N/A GLY 437.A N ASP 433.A O no hydrogen 3.078 N/A ARG 438.A N GLU 434.A O no hydrogen 3.412 N/A ARG 438.A NE THR 493.A O no hydrogen 3.432 N/A ALA 439.A N LEU 435.A O no hydrogen 3.439 N/A ARG 440.A N VAL 436.A O no hydrogen 2.951 N/A ARG 440.A NH2 SER 60.A O no hydrogen 3.560 N/A ARG 440.A NH2 ASN 64.A OD1 no hydrogen 2.447 N/A VAL 441.A N ARG 438.A O no hydrogen 3.226 N/A SER 442.A N LEU 51.A O no hydrogen 2.948 N/A GLU 450.A N SER 447.A OG no hydrogen 3.269 N/A THR 451.A N SER 447.A O no hydrogen 2.874 N/A ALA 452.A N VAL 448.A O no hydrogen 3.075 N/A CYS 453.A N ARG 449.A O no hydrogen 2.946 N/A CYS 453.A SG ARG 449.A O no hydrogen 3.590 N/A CYS 453.A SG VAL 488.A O no hydrogen 3.371 N/A LEU 454.A N GLU 450.A O no hydrogen 3.080 N/A SER 455.A N THR 451.A O no hydrogen 3.190 N/A SER 455.A OG THR 451.A O no hydrogen 2.815 N/A LYS 456.A N ALA 452.A O no hydrogen 3.064 N/A LYS 456.A NZ PRO 484.A O no hydrogen 3.247 N/A LYS 456.A NZ ILE 485.A O no hydrogen 3.142 N/A ALA 457.A N CYS 453.A O no hydrogen 3.164 N/A TYR 458.A N LEU 454.A O no hydrogen 3.272 N/A GLY 459.A N SER 455.A O no hydrogen 2.815 N/A GLN 460.A N LYS 456.A O no hydrogen 2.686 N/A GLN 460.A NE2 TRP 503.A O no hydrogen 2.526 N/A GLN 460.A NE2 THR 505.A O no hydrogen 2.633 N/A MET 461.A N ALA 457.A O no hydrogen 2.991 N/A TRP 462.A N TYR 458.A O no hydrogen 2.891 N/A LEU 463.A N GLY 459.A O no hydrogen 3.092 N/A LEU 464.A N GLN 460.A O no hydrogen 3.224 N/A LEU 464.A N MET 461.A O no hydrogen 2.933 N/A SER 465.A N MET 461.A O no hydrogen 3.128 N/A SER 465.A OG ASN 214.A OD1 no hydrogen 2.933 N/A TYR 466.A N TRP 462.A O no hydrogen 2.829 N/A TYR 466.A OH HIS 412.A NE2 no hydrogen 2.674 N/A HIS 468.A NE2 SER 465.A O no hydrogen 2.761 N/A ARG 469.A N TYR 466.A O no hydrogen 3.104 N/A ARG 469.A NE ASP 544.A OD1 no hydrogen 3.105 N/A ARG 469.A NH1 ARG 430.A O no hydrogen 2.972 N/A ARG 469.A NH2 ASP 544.A O no hydrogen 3.140 N/A ARG 469.A NH2 CYS 547.A O no hydrogen 2.985 N/A ARG 470.A N ASP 544.A OD2 no hydrogen 3.163 N/A ARG 470.A NH1 LEU 539.A O no hydrogen 3.384 N/A ARG 470.A NH2 LEU 539.A O no hydrogen 3.082 N/A ARG 470.A NH2 ASP 544.A OD2 no hydrogen 2.602 N/A ARG 473.A N ARG 469.A O no hydrogen 2.906 N/A ARG 473.A NH1 PHE 467.A O no hydrogen 2.535 N/A ARG 473.A NH1 VAL 536.A O no hydrogen 3.382 N/A ARG 473.A NH1 PRO 537.A O no hydrogen 3.166 N/A ARG 473.A NH2 TRP 533.A O no hydrogen 2.660 N/A ARG 473.A NH2 VAL 536.A O no hydrogen 2.629 N/A THR 474.A N ARG 470.A O no hydrogen 3.101 N/A THR 474.A OG1 ARG 470.A O no hydrogen 3.220 N/A LEU 475.A N ASP 471.A O no hydrogen 2.876 N/A GLY 476.A N LEU 472.A O no hydrogen 2.744 N/A LEU 477.A N ARG 473.A O no hydrogen 2.791 N/A ALA 478.A N THR 474.A O no hydrogen 2.868 N/A ILE 479.A N LEU 475.A O no hydrogen 3.085 N/A CYS 480.A N GLY 476.A O no hydrogen 2.999 N/A CYS 480.A SG GLY 476.A O no hydrogen 3.452 N/A SER 481.A N LEU 477.A O no hydrogen 2.968 N/A SER 481.A N ALA 478.A O no hydrogen 3.085 N/A SER 481.A OG LEU 477.A O no hydrogen 2.610 N/A ALA 482.A N ILE 479.A O no hydrogen 3.119 N/A ILE 485.A N LYS 578.A O no hydrogen 2.849 N/A ASP 486.A N ASP 486.A OD2 no hydrogen 2.526 N/A TRP 487.A N PRO 484.A O no hydrogen 3.242 N/A SER 496.A N THR 494.A OG1 no hydrogen 2.973 N/A HIS 498.A ND1 ILE 211.A O no hydrogen 2.651 N/A HIS 498.A NE2 SER 362.A OG no hydrogen 3.006 N/A ALA 499.A N SER 496.A O no hydrogen 3.445 N/A TRP 503.A NE1 THR 493.A OG1 no hydrogen 3.145 N/A MET 504.A N GLY 501.A O no hydrogen 3.020 N/A GLU 507.A N THR 505.A OG1 no hydrogen 2.564 N/A VAL 512.A N ASP 508.A O no hydrogen 3.031 N/A TRP 513.A N MET 509.A O no hydrogen 2.913 N/A ASN 514.A N LEU 510.A O no hydrogen 3.009 N/A ASN 514.A ND2 LEU 510.A O no hydrogen 2.786 N/A ASN 514.A ND2 ILE 530.A O no hydrogen 3.374 N/A ARG 515.A N ASP 511.A O no hydrogen 3.114 N/A VAL 516.A N VAL 512.A O no hydrogen 2.865 N/A TRP 517.A N TRP 513.A O no hydrogen 2.782 N/A TRP 517.A NE1 LEU 464.A O no hydrogen 2.861 N/A ILE 518.A N ASN 514.A O no hydrogen 3.048 N/A LEU 519.A N ASN 514.A O no hydrogen 2.763 N/A ASP 520.A N ARG 515.A O no hydrogen 2.687 N/A ASN 521.A ND2 TRP 517.A O no hydrogen 3.005 N/A PHE 523.A N ASN 521.A OD1 no hydrogen 2.860 N/A MET 524.A N ASN 521.A O no hydrogen 3.108 N/A LYS 527.A NZ ILE 518.A O no hydrogen 2.871 N/A LYS 527.A NZ LEU 519.A O no hydrogen 3.439 N/A LYS 527.A NZ MET 524.A O no hydrogen 2.666 N/A ILE 530.A N ASN 514.A OD1 no hydrogen 2.712 N/A ASP 535.A N GLU 532.A O no hydrogen 2.844 N/A VAL 536.A N TRP 533.A O no hydrogen 3.246 N/A LEU 539.A N HIS 468.A O no hydrogen 2.752 N/A ASP 544.A N PRO 540.A O no hydrogen 3.092 N/A MET 545.A N LYS 541.A O no hydrogen 3.108 N/A LEU 546.A N SER 542.A O no hydrogen 2.988 N/A CYS 547.A N HIS 543.A O no hydrogen 2.900 N/A CYS 547.A SG HIS 543.A O no hydrogen 3.768 N/A SER 548.A N MET 545.A O no hydrogen 3.032 N/A SER 549.A N MET 545.A O no hydrogen 3.215 N/A SER 549.A OG ASP 471.A OD1 no hydrogen 3.500 N/A SER 549.A OG ASP 471.A OD2 no hydrogen 3.199 N/A SER 549.A OG ASP 544.A OD1 no hydrogen 3.345 N/A LEU 550.A N ASP 471.A OD2 no hydrogen 2.801 N/A VAL 551.A N SER 549.A OG no hydrogen 2.846 N/A ARG 553.A N LEU 550.A O no hydrogen 3.105 N/A ALA 557.A N ARG 553.A O no hydrogen 2.981 N/A GLU 558.A N LYS 554.A O no hydrogen 2.686 N/A TRP 559.A N GLU 555.A O no hydrogen 2.736 N/A TRP 559.A NE1 LEU 59.A O no hydrogen 2.561 N/A ALA 560.A N ARG 556.A O no hydrogen 2.870 N/A LYS 561.A N ALA 557.A O no hydrogen 3.105 N/A ASN 562.A N GLU 558.A O no hydrogen 3.175 N/A VAL 567.A N ILE 563.A O no hydrogen 3.071 N/A GLU 568.A N TRP 564.A O no hydrogen 2.820 N/A LYS 569.A N GLY 565.A O no hydrogen 3.147 N/A VAL 570.A N ALA 566.A O no hydrogen 3.148 N/A ARG 571.A N VAL 567.A O no hydrogen 3.030 N/A ARG 571.A NE SER 481.A O no hydrogen 2.799 N/A ARG 571.A NH2 SER 481.A O no hydrogen 2.623 N/A LYS 572.A N GLU 568.A O no hydrogen 2.861 N/A MET 573.A N LYS 569.A O no hydrogen 2.713 N/A ILE 574.A N VAL 570.A O no hydrogen 2.932 N/A ILE 574.A N ARG 571.A O no hydrogen 2.812 N/A GLY 575.A N ARG 571.A O no hydrogen 2.744 N/A GLU 577.A N GLY 575.A O no hydrogen 3.049 N/A TYR 582.A N SER 481.A OG no hydrogen 3.304 N/A LEU 583.A N SER 481.A OG no hydrogen 3.241 N/A SER 584.A N ASP 581.A OD1 no hydrogen 2.993 N/A SER 584.A OG ASP 581.A OD1 no hydrogen 3.055 N/A SER 584.A OG ASP 581.A OD2 no hydrogen 2.870 N/A CYS 585.A SG TYR 582.A O no hydrogen 2.883 N/A MET 586.A N LEU 583.A O no hydrogen 3.238 N/A ARG 588.A N SER 584.A O no hydrogen 3.050 N/A