Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5h6q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N VAL 3.A O no hydrogen 3.220 N/A ALA 7.A N VAL 3.A O no hydrogen 3.453 N/A PHE 8.A N GLU 4.A O no hydrogen 3.186 N/A GLN 9.A N GLY 5.A O no hydrogen 3.033 N/A GLN 9.A NE2 LEU 166.A O no hydrogen 3.327 N/A SER 10.A N ALA 7.A O no hydrogen 3.152 N/A SER 10.A OG ALA 6.A O no hydrogen 3.172 N/A ARG 11.A N PHE 8.A O no hydrogen 3.222 N/A ARG 11.A NH1 GLY 168.A O no hydrogen 2.852 N/A LEU 12.A N ALA 7.A O no hydrogen 2.845 N/A THR 18.A N GLU 21.A OE1 no hydrogen 3.047 N/A GLU 21.A N THR 18.A OG1 no hydrogen 3.105 N/A ALA 22.A N THR 18.A O no hydrogen 2.942 N/A ALA 23.A N SER 19.A O no hydrogen 3.217 N/A ALA 23.A N GLN 20.A O no hydrogen 3.233 N/A CYS 24.A N GLN 20.A O no hydrogen 3.412 N/A CYS 24.A SG GLN 20.A O no hydrogen 3.753 N/A PHE 25.A N GLU 21.A O no hydrogen 2.886 N/A ILE 28.A N PHE 25.A O no hydrogen 3.169 N/A ILE 29.A N PHE 25.A O no hydrogen 3.183 N/A SER 30.A N PRO 26.A O no hydrogen 3.091 N/A SER 30.A OG PRO 26.A O no hydrogen 2.601 N/A GLY 31.A N ILE 28.A O no hydrogen 3.102 N/A THR 35.A N PRO 32.A O no hydrogen 3.090 N/A GLN 36.A N PRO 32.A O no hydrogen 3.473 N/A GLN 36.A NE2 ILE 28.A O no hydrogen 3.600 N/A GLN 36.A NE2 GLY 31.A O no hydrogen 3.221 N/A LYS 37.A N GLN 33.A O no hydrogen 3.242 N/A VAL 38.A N GLN 34.A O no hydrogen 3.317 N/A PHE 39.A N THR 35.A O no hydrogen 2.957 N/A LEU 40.A N GLN 36.A O no hydrogen 2.758 N/A PHE 41.A N LYS 37.A O no hydrogen 2.897 N/A ILE 42.A N VAL 38.A O no hydrogen 2.878 N/A ARG 43.A N PHE 39.A O no hydrogen 2.773 N/A ARG 43.A NE GLU 21.A OE2 no hydrogen 2.813 N/A ARG 43.A NH1 PRO 13.A O no hydrogen 2.907 N/A ARG 43.A NH1 ASN 44.A OD1 no hydrogen 2.932 N/A ARG 43.A NH2 PRO 13.A O no hydrogen 3.462 N/A ARG 43.A NH2 ARG 16.A O no hydrogen 2.784 N/A ARG 43.A NH2 GLU 21.A OE1 no hydrogen 2.723 N/A ARG 43.A NH2 GLU 21.A OE2 no hydrogen 3.377 N/A ASN 44.A N LEU 40.A O no hydrogen 2.800 N/A ASN 44.A ND2 HIS 14.A O no hydrogen 2.948 N/A ARG 45.A N PHE 41.A O no hydrogen 2.786 N/A ARG 45.A NH1 GLN 48.A OE1 no hydrogen 2.861 N/A THR 46.A N ILE 42.A O no hydrogen 2.890 N/A THR 46.A OG1 ILE 42.A O no hydrogen 2.569 N/A LEU 47.A N ARG 43.A O no hydrogen 3.062 N/A GLN 48.A N ASN 44.A O no hydrogen 2.943 N/A LEU 49.A N ARG 45.A O no hydrogen 2.818 N/A TRP 50.A N THR 46.A O no hydrogen 2.988 N/A LEU 51.A N LEU 47.A O no hydrogen 2.757 N/A ASP 52.A N GLN 48.A O no hydrogen 2.849 N/A ASN 53.A N LEU 49.A O no hydrogen 3.484 N/A GLN 57.A N LYS 97.A O no hydrogen 2.990 N/A LEU 58.A N ASN 92.A OD1 no hydrogen 2.857 N/A GLU 61.A N GLU 61.A OE1 no hydrogen 2.963 N/A ALA 62.A N THR 59.A OG1 no hydrogen 2.837 N/A THR 63.A N THR 59.A O no hydrogen 2.968 N/A THR 63.A OG1 THR 59.A O no hydrogen 2.818 N/A LEU 64.A N PHE 60.A O no hydrogen 2.898 N/A GLN 65.A N.A GLU 61.A O no hydrogen 3.022 N/A GLN 65.A N.B GLU 61.A O no hydrogen 2.973 N/A GLN 66.A N THR 63.A O no hydrogen 3.123 N/A LEU 67.A N LEU 64.A O no hydrogen 3.354 N/A TYR 71.A N GLU 68.A O no hydrogen 3.058 N/A ASN 72.A N GLU 68.A O no hydrogen 3.038 N/A ASN 72.A ND2 LEU 67.A O no hydrogen 3.184 N/A VAL 76.A N ASP 74.A OD1 no hydrogen 3.224 N/A LEU 77.A N ASP 74.A OD1 no hydrogen 3.314 N/A HIS 79.A N THR 75.A O no hydrogen 3.221 N/A ARG 80.A N VAL 76.A O no hydrogen 2.697 N/A ARG 80.A NH1 ASP 27.A OD2 no hydrogen 2.930 N/A ARG 80.A NH2 CYS 24.A O no hydrogen 3.469 N/A ARG 80.A NH2 ASP 27.A OD1 no hydrogen 2.826 N/A ARG 80.A NH2 ASP 27.A OD2 no hydrogen 3.560 N/A VAL 81.A N LEU 77.A O no hydrogen 3.012 N/A HIS 82.A N VAL 78.A O no hydrogen 2.980 N/A HIS 82.A NE2 LEU 58.A O no hydrogen 2.781 N/A SER 83.A N HIS 79.A O no hydrogen 3.005 N/A SER 83.A OG HIS 79.A O no hydrogen 2.901 N/A TYR 84.A N ARG 80.A O no hydrogen 3.082 N/A LEU 85.A N VAL 81.A O no hydrogen 3.067 N/A GLU 86.A N HIS 82.A O no hydrogen 3.073 N/A ARG 87.A N SER 83.A O no hydrogen 2.784 N/A ARG 87.A NH1 ASP 656.A OD1 no hydrogen 2.721 N/A ARG 87.A NH1 GLY 660.A O no hydrogen 3.284 N/A HIS 88.A N TYR 84.A O no hydrogen 2.967 N/A HIS 88.A ND1 TYR 84.A O no hydrogen 2.975 N/A GLY 89.A N GLU 86.A O no hydrogen 3.234 N/A ILE 91.A N LEU 85.A O no hydrogen 3.292 N/A ASN 92.A ND2 LEU 58.A O no hydrogen 3.012 N/A ASN 92.A ND2 GLU 86.A OE2 no hydrogen 3.356 N/A ILE 95.A N GLN 177.A OE1 no hydrogen 2.847 N/A TYR 96.A OH ASN 92.A O no hydrogen 3.054 N/A LYS 97.A N LYS 55.A O no hydrogen 3.044 N/A ARG 98.A NH2 LYS 100.A O no hydrogen 3.425 N/A ILE 99.A N GLN 57.A OE1 no hydrogen 3.080 N/A THR 107.A N GLY 130.A O no hydrogen 2.975 N/A LYS 109.A N ASP 448.A OD2 no hydrogen 2.748 N/A LYS 109.A NZ ASP 132.A OD1 no hydrogen 3.191 N/A LYS 109.A NZ THR 134.A OG1 no hydrogen 2.869 N/A VAL 110.A N ASP 132.A O no hydrogen 2.875 N/A ILE 111.A N ALA 449.A O no hydrogen 3.070 N/A ILE 112.A N THR 134.A O no hydrogen 2.847 N/A ILE 113.A N LEU 451.A O no hydrogen 2.825 N/A GLY 114.A N LEU 136.A O no hydrogen 2.732 N/A SER 115.A N GLU 137.A OE1 no hydrogen 2.647 N/A SER 115.A OG GLU 137.A OE1 no hydrogen 2.923 N/A LEU 120.A N GLY 116.A O no hydrogen 2.883 N/A ALA 121.A N VAL 117.A O no hydrogen 2.974 N/A ALA 122.A N SER 118.A O no hydrogen 3.129 N/A ALA 123.A N GLY 119.A O no hydrogen 2.845 N/A ARG 124.A N LEU 120.A O no hydrogen 2.955 N/A ARG 124.A NE LEU 407.A O no hydrogen 3.215 N/A GLN 125.A N ALA 121.A O no hydrogen 3.377 N/A LEU 126.A N ALA 122.A O no hydrogen 2.908 N/A GLN 127.A N ALA 123.A O no hydrogen 2.962 N/A GLN 127.A NE2 GLY 410.A O no hydrogen 2.935 N/A SER 128.A N ARG 124.A O no hydrogen 3.024 N/A SER 128.A OG ARG 124.A O no hydrogen 3.101 N/A PHE 129.A N GLN 125.A O no hydrogen 3.072 N/A PHE 129.A N LEU 126.A O no hydrogen 3.067 N/A GLY 130.A N GLN 127.A O no hydrogen 2.894 N/A MET 131.A N LEU 126.A O no hydrogen 2.983 N/A ASP 132.A N GLY 108.A O no hydrogen 3.010 N/A THR 134.A N VAL 110.A O no hydrogen 3.133 N/A THR 134.A OG1 ASP 412.A OD2 no hydrogen 2.757 N/A LEU 135.A N ASP 412.A O no hydrogen 2.974 N/A LEU 136.A N ILE 112.A O no hydrogen 2.939 N/A GLU 137.A N LYS 414.A O no hydrogen 3.084 N/A ARG 139.A N GLU 137.A OE2 no hydrogen 2.944 N/A ARG 139.A NH1 ASP 583.A OD2 no hydrogen 2.827 N/A ARG 139.A NH2 ASP 583.A OD2 no hydrogen 2.818 N/A ARG 141.A NH1 VAL 142.A O no hydrogen 3.159 N/A ARG 141.A NH1 GLY 144.A O no hydrogen 3.111 N/A ARG 141.A NH2 GLY 144.A O no hydrogen 2.876 N/A GLY 143.A N SER 115.A O no hydrogen 2.931 N/A ARG 145.A NH1 SER 589.A O no hydrogen 2.833 N/A ARG 145.A NH1 GLU 630.A OE1 no hydrogen 3.015 N/A VAL 146.A N GLY 143.A O no hydrogen 3.049 N/A THR 148.A OG1 ASP 157.A OD1 no hydrogen 2.521 N/A PHE 149.A N ALA 156.A O no hydrogen 2.702 N/A ARG 150.A NH1 ASN 398.A O no hydrogen 3.261 N/A ARG 150.A NH2 ASN 398.A O no hydrogen 2.957 N/A ARG 150.A NH2 SER 401.A OG no hydrogen 2.911 N/A LYS 151.A N TYR 154.A O no hydrogen 3.225 N/A TYR 154.A N LYS 151.A O no hydrogen 2.937 N/A TYR 154.A OH PHE 495.A O no hydrogen 2.857 N/A ALA 156.A N PHE 149.A O no hydrogen 3.165 N/A ASP 157.A N TYR 527.A OH no hydrogen 3.244 N/A LEU 158.A N ALA 147.A O no hydrogen 2.909 N/A ALA 160.A N ARG 145.A O no hydrogen 3.148 N/A VAL 163.A N LEU 394.A O no hydrogen 2.789 N/A THR 164.A OG1 HIS 641.A NE2 no hydrogen 3.429 N/A GLY 165.A N VAL 163.A O no hydrogen 2.876 N/A GLY 167.A N THR 390.A O no hydrogen 2.983 N/A GLY 168.A N GLN 9.A OE1 no hydrogen 3.047 N/A ASN 169.A N LEU 166.A O no hydrogen 3.132 N/A ASN 169.A ND2 GLY 165.A O no hydrogen 2.905 N/A MET 171.A N ASN 169.A OD1 no hydrogen 2.783 N/A ALA 172.A N ASN 169.A O no hydrogen 2.884 N/A VAL 174.A N PRO 170.A O no hydrogen 3.361 N/A SER 175.A N MET 171.A O no hydrogen 2.940 N/A SER 175.A OG MET 171.A O no hydrogen 3.464 N/A SER 175.A OG ALA 172.A O no hydrogen 2.521 N/A LYS 176.A N ALA 172.A O no hydrogen 3.253 N/A GLN 177.A N VAL 173.A O no hydrogen 3.241 N/A GLN 177.A N VAL 174.A O no hydrogen 3.077 N/A GLN 177.A NE2 PRO 54.A O no hydrogen 3.019 N/A GLN 177.A NE2 PHE 93.A O no hydrogen 3.066 N/A VAL 178.A N VAL 174.A O no hydrogen 2.791 N/A MET 180.A N VAL 178.A O no hydrogen 2.966 N/A ALA 183.A N THR 395.A O no hydrogen 3.124 N/A ILE 185.A N HIS 393.A O no hydrogen 3.018 N/A LYS 186.A N ASN 505.A OD1 no hydrogen 2.751 N/A TYR 192.A N GLY 508.A O no hydrogen 3.197 N/A GLU 193.A N GLN 197.A O no hydrogen 3.060 N/A GLY 196.A N GLU 193.A O no hydrogen 2.796 N/A GLN 197.A N ASN 195.A OD1 no hydrogen 2.681 N/A VAL 199.A N LEU 191.A O no hydrogen 3.088 N/A LYS 203.A N PRO 200.A O no hydrogen 3.076 N/A LYS 203.A NZ ASP 354.A OD1 no hydrogen 3.002 N/A ASP 204.A N PRO 200.A O no hydrogen 3.105 N/A GLU 205.A N LYS 201.A O no hydrogen 3.155 N/A MET 206.A N GLU 202.A O no hydrogen 3.133 N/A VAL 207.A N LYS 203.A O no hydrogen 2.828 N/A GLU 208.A N ASP 204.A O no hydrogen 3.159 N/A GLN 209.A N GLU 205.A O no hydrogen 3.170 N/A GLU 210.A N MET 206.A O no hydrogen 3.031 N/A PHE 211.A N VAL 207.A O no hydrogen 2.754 N/A ASN 212.A N GLU 208.A O no hydrogen 3.043 N/A ASN 212.A ND2 GLU 208.A O no hydrogen 3.118 N/A ARG 213.A N GLN 209.A O no hydrogen 2.985 N/A ARG 213.A NE GLU 210.A OE1 no hydrogen 3.279 N/A LEU 214.A N GLU 210.A O no hydrogen 2.731 N/A LEU 215.A N PHE 211.A O no hydrogen 2.915 N/A GLU 216.A N ASN 212.A O no hydrogen 2.833 N/A ALA 217.A N ARG 213.A O no hydrogen 2.920 N/A THR 218.A N LEU 214.A O no hydrogen 3.052 N/A THR 218.A OG1 LEU 215.A O no hydrogen 2.558 N/A SER 219.A N LEU 215.A O no hydrogen 3.081 N/A SER 219.A OG HIS 223.A ND1 no hydrogen 3.369 N/A TYR 220.A N GLU 216.A O no hydrogen 2.880 N/A LEU 221.A N ALA 217.A O no hydrogen 2.691 N/A SER 222.A N THR 218.A O no hydrogen 2.904 N/A SER 222.A OG ASN 228.A OD1 no hydrogen 2.814 N/A HIS 223.A N SER 219.A O no hydrogen 2.850 N/A GLN 224.A N TYR 220.A O no hydrogen 2.956 N/A LEU 225.A N TYR 220.A O no hydrogen 3.459 N/A PHE 227.A N LEU 221.A O no hydrogen 3.101 N/A ASN 228.A ND2 SER 222.A O no hydrogen 3.251 N/A ASN 228.A ND2 ASP 226.A OD1 no hydrogen 3.011 N/A LEU 230.A N LYS 233.A O no hydrogen 2.879 N/A VAL 235.A N ASN 228.A O no hydrogen 2.969 N/A LEU 237.A N LEU 376.A O no hydrogen 2.871 N/A GLY 238.A N LEU 373.A O no hydrogen 2.937 N/A GLN 239.A N SER 236.A OG no hydrogen 3.048 N/A GLN 239.A NE2 PRO 234.A O no hydrogen 3.681 N/A ALA 240.A N SER 236.A O no hydrogen 3.141 N/A LEU 241.A N LEU 237.A O no hydrogen 3.038 N/A GLU 242.A N GLY 238.A O no hydrogen 3.105 N/A VAL 243.A N GLN 239.A O no hydrogen 2.903 N/A VAL 244.A N ALA 240.A O no hydrogen 2.883 N/A ILE 245.A N LEU 241.A O no hydrogen 2.901 N/A GLN 246.A N GLU 242.A O no hydrogen 2.885 N/A LEU 247.A N VAL 243.A O no hydrogen 3.027 N/A GLN 248.A N VAL 244.A O no hydrogen 3.213 N/A GLN 248.A N ILE 245.A O no hydrogen 3.176 N/A GLN 248.A NE2 VAL 244.A O no hydrogen 3.208 N/A GLU 249.A N ILE 245.A O no hydrogen 3.064 N/A LYS 250.A N GLN 246.A O no hydrogen 2.807 N/A HIS 251.A N LEU 247.A O no hydrogen 3.173 N/A VAL 252.A N GLN 248.A O no hydrogen 3.083 N/A LYS 253.A N GLU 249.A O no hydrogen 3.085 N/A ASP 254.A N LYS 250.A O no hydrogen 2.768 N/A GLU 255.A N HIS 251.A O no hydrogen 2.961 N/A GLN 256.A N VAL 252.A O no hydrogen 3.287 N/A GLN 256.A NE2 ASP 347.A O no hydrogen 3.606 N/A ILE 257.A N LYS 253.A O no hydrogen 3.055 N/A GLU 258.A N ASP 254.A O no hydrogen 3.069 N/A HIS 259.A N GLU 255.A O no hydrogen 3.194 N/A HIS 259.A NE2 LEU 340.A O no hydrogen 2.934 N/A TRP 260.A N GLN 256.A O no hydrogen 2.914 N/A LYS 261.A N ILE 257.A O no hydrogen 2.804 N/A LYS 262.A N GLU 258.A O no hydrogen 3.235 N/A LYS 262.A N HIS 259.A O no hydrogen 3.246 N/A ILE 263.A N HIS 259.A O no hydrogen 3.158 N/A VAL 264.A N TRP 260.A O no hydrogen 3.056 N/A LYS 265.A N LYS 261.A O no hydrogen 3.189 N/A THR 266.A N LYS 262.A O no hydrogen 3.209 N/A THR 266.A N ILE 263.A O no hydrogen 3.276 N/A GLN 267.A N ILE 263.A O no hydrogen 2.939 N/A GLU 268.A N VAL 264.A O no hydrogen 2.955 N/A GLU 269.A N LYS 265.A O no hydrogen 3.204 N/A LEU 270.A N THR 266.A O no hydrogen 3.028 N/A LYS 271.A N GLN 267.A O no hydrogen 2.837 N/A GLU 272.A N GLU 268.A O no hydrogen 3.038 N/A LEU 273.A N GLU 269.A O no hydrogen 3.010 N/A LEU 274.A N LEU 270.A O no hydrogen 2.676 N/A ASN 275.A N LYS 271.A O no hydrogen 2.999 N/A LYS 276.A N GLU 272.A O no hydrogen 3.179 N/A MET 277.A N LEU 273.A O no hydrogen 2.938 N/A VAL 278.A N LEU 274.A O no hydrogen 2.893 N/A ASN 279.A N ASN 275.A O no hydrogen 3.121 N/A LEU 280.A N LYS 276.A O no hydrogen 3.120 N/A LYS 281.A N MET 277.A O no hydrogen 2.916 N/A GLU 282.A N VAL 278.A O no hydrogen 3.193 N/A LYS 283.A N ASN 279.A O no hydrogen 3.000 N/A ILE 284.A N LEU 280.A O no hydrogen 2.907 N/A LYS 285.A N LYS 281.A O no hydrogen 2.929 N/A GLU 286.A N GLU 282.A O no hydrogen 3.185 N/A LEU 287.A N LYS 283.A O no hydrogen 3.159 N/A HIS 288.A N ILE 284.A O no hydrogen 2.983 N/A GLN 289.A N LYS 285.A O no hydrogen 3.205 N/A GLN 289.A NE2 GLU 293.A OE2 no hydrogen 3.360 N/A GLN 290.A N GLU 286.A O no hydrogen 2.993 N/A TYR 291.A N LEU 287.A O no hydrogen 3.118 N/A LYS 292.A N HIS 288.A O no hydrogen 2.820 N/A LYS 292.A NZ GLU 296.A OE2 no hydrogen 3.515 N/A GLU 293.A N GLN 289.A O no hydrogen 2.803 N/A ALA 294.A N GLN 290.A O no hydrogen 3.149 N/A SER 295.A N TYR 291.A O no hydrogen 2.984 N/A SER 295.A N LYS 292.A O no hydrogen 3.082 N/A SER 295.A OG TYR 291.A O no hydrogen 3.364 N/A SER 295.A OG LYS 292.A O no hydrogen 3.321 N/A GLU 296.A N LYS 292.A O no hydrogen 2.931 N/A GLU 296.A N GLU 293.A O no hydrogen 3.136 N/A ARG 301.A NE GLU 306.A OE1 no hydrogen 3.087 N/A ARG 301.A NH1 VAL 297.A O no hydrogen 2.630 N/A ARG 301.A NH2 GLU 306.A OE2 no hydrogen 3.523 N/A THR 304.A OG1 ASP 302.A OD1 no hydrogen 2.694 N/A ALA 305.A N ASP 302.A OD1 no hydrogen 2.980 N/A GLU 306.A N ASP 302.A O no hydrogen 3.321 N/A PHE 307.A N ILE 303.A O no hydrogen 2.883 N/A LEU 308.A N THR 304.A O no hydrogen 2.951 N/A VAL 309.A N ALA 305.A O no hydrogen 3.456 N/A LYS 310.A N GLU 306.A O no hydrogen 2.991 N/A SER 311.A N PHE 307.A O no hydrogen 2.693 N/A SER 311.A OG PHE 307.A O no hydrogen 3.376 N/A SER 311.A OG LEU 308.A O no hydrogen 3.394 N/A LYS 312.A N LEU 308.A O no hydrogen 3.122 N/A LYS 312.A NZ GLN 290.A OE1 no hydrogen 2.757 N/A HIS 313.A N VAL 309.A O no hydrogen 3.082 N/A ARG 314.A N LYS 310.A O no hydrogen 3.012 N/A ARG 314.A NE ASP 315.A OD1 no hydrogen 2.995 N/A ASP 315.A N SER 311.A O no hydrogen 3.016 N/A LEU 316.A N LYS 312.A O no hydrogen 2.939 N/A THR 317.A N HIS 313.A O no hydrogen 2.993 N/A THR 317.A OG1 HIS 313.A O no hydrogen 3.350 N/A THR 317.A OG1 ARG 314.A O no hydrogen 3.160 N/A ALA 318.A N ARG 314.A O no hydrogen 2.953 N/A LEU 319.A N ASP 315.A O no hydrogen 3.198 N/A CYS 320.A N LEU 316.A O no hydrogen 3.138 N/A CYS 320.A SG LEU 316.A O no hydrogen 3.095 N/A LYS 321.A N THR 317.A O no hydrogen 2.849 N/A GLU 322.A N ALA 318.A O no hydrogen 3.166 N/A TYR 323.A N LEU 319.A O no hydrogen 3.184 N/A ASP 324.A N CYS 320.A O no hydrogen 3.136 N/A GLU 325.A N LYS 321.A O no hydrogen 2.914 N/A LEU 326.A N GLU 322.A O no hydrogen 2.799 N/A ALA 327.A N TYR 323.A O no hydrogen 3.143 N/A GLU 328.A N ASP 324.A O no hydrogen 3.158 N/A THR 329.A N GLU 325.A O no hydrogen 3.374 N/A THR 329.A OG1 GLU 325.A O no hydrogen 3.515 N/A GLN 330.A N LEU 326.A O no hydrogen 2.796 N/A GLY 331.A N ALA 327.A O no hydrogen 3.136 N/A LYS 332.A N GLU 328.A O no hydrogen 3.221 N/A LEU 333.A N THR 329.A O no hydrogen 3.368 N/A GLU 334.A N GLN 330.A O no hydrogen 3.150 N/A GLU 335.A N LYS 332.A O no hydrogen 3.230 N/A LYS 336.A N LYS 332.A O no hydrogen 3.056 N/A LEU 337.A N LEU 333.A O no hydrogen 3.192 N/A GLN 338.A N GLU 334.A O no hydrogen 3.303 N/A GLU 339.A N GLU 335.A O no hydrogen 2.996 N/A LEU 340.A N LYS 336.A O no hydrogen 3.314 N/A GLU 341.A N LEU 337.A O no hydrogen 3.114 N/A ALA 342.A N GLU 339.A O no hydrogen 3.102 N/A ASN 343.A N LEU 340.A O no hydrogen 3.282 N/A TYR 349.A OH GLU 210.A OE2 no hydrogen 2.667 N/A SER 351.A N ASP 354.A OD2 no hydrogen 3.468 N/A ASP 354.A N SER 351.A OG no hydrogen 3.121 N/A ARG 355.A N SER 351.A O no hydrogen 3.132 N/A ARG 355.A NH1 ASP 359.A OD2 no hydrogen 3.473 N/A GLN 356.A N SER 352.A O no hydrogen 3.119 N/A GLN 356.A NE2 SER 512.A O no hydrogen 3.128 N/A ILE 357.A N ARG 353.A O no hydrogen 3.034 N/A LEU 358.A N ASP 354.A O no hydrogen 2.828 N/A ASP 359.A N ARG 355.A O no hydrogen 2.937 N/A TRP 360.A N GLN 356.A O no hydrogen 3.224 N/A TRP 360.A N ILE 357.A O no hydrogen 3.074 N/A TRP 360.A NE1 PHE 521.A O no hydrogen 2.728 N/A PHE 362.A N LEU 358.A O no hydrogen 3.145 N/A ALA 363.A N ASP 359.A O no hydrogen 2.808 N/A ASN 364.A N TRP 360.A O no hydrogen 2.937 N/A LEU 365.A N HIS 361.A O no hydrogen 3.125 N/A GLU 366.A N PHE 362.A O no hydrogen 2.962 N/A PHE 367.A N ALA 363.A O no hydrogen 2.777 N/A ALA 368.A N ASN 364.A O no hydrogen 3.222 N/A ASN 369.A N LEU 365.A O no hydrogen 3.108 N/A ASN 369.A ND2 LEU 365.A O no hydrogen 3.100 N/A ALA 370.A N PHE 367.A O no hydrogen 3.041 N/A THR 371.A N GLU 366.A O no hydrogen 3.061 N/A THR 371.A OG1 THR 375.A OG1 no hydrogen 2.338 N/A LEU 373.A N GLU 366.A OE2 no hydrogen 2.963 N/A THR 375.A N PRO 372.A O no hydrogen 2.872 N/A THR 375.A OG1 THR 371.A OG1 no hydrogen 2.338 N/A THR 375.A OG1 PRO 372.A O no hydrogen 2.691 N/A THR 375.A OG1 TYR 592.A OH no hydrogen 3.425 N/A LEU 376.A N LEU 373.A O no hydrogen 3.345 N/A SER 377.A N VAL 593.A O no hydrogen 2.977 N/A LEU 378.A N VAL 235.A O no hydrogen 3.296 N/A HIS 380.A N SER 377.A OG no hydrogen 2.987 N/A TRP 381.A N SER 377.A O no hydrogen 3.220 N/A GLN 383.A N HIS 380.A O no hydrogen 3.127 N/A GLN 383.A NE2 ARG 634.A O no hydrogen 2.855 N/A ASP 385.A N ASP 382.A O no hydrogen 2.926 N/A PHE 387.A N ASP 384.A O no hydrogen 3.095 N/A GLU 388.A N ASP 385.A O no hydrogen 3.108 N/A THR 390.A N GLY 167.A O no hydrogen 3.291 N/A LEU 394.A N VAL 163.A O no hydrogen 2.948 N/A THR 395.A N ALA 183.A O no hydrogen 2.915 N/A ARG 397.A N GLU 181.A O no hydrogen 2.884 N/A ARG 397.A NE LEU 526.A O no hydrogen 2.941 N/A ARG 397.A NH2 LEU 526.A O no hydrogen 3.184 N/A ASN 398.A ND2 ASN 179.A O no hydrogen 2.659 N/A GLY 399.A N VAL 396.A O no hydrogen 3.057 N/A TYR 400.A N ASP 157.A OD1 no hydrogen 3.229 N/A TYR 400.A N ASP 157.A OD2 no hydrogen 3.150 N/A SER 401.A N THR 148.A OG1 no hydrogen 2.834 N/A CYS 402.A N GLY 399.A O no hydrogen 3.146 N/A CYS 402.A SG ASN 179.A O no hydrogen 3.828 N/A CYS 402.A SG GLY 399.A O no hydrogen 3.225 N/A CYS 402.A SG TYR 400.A O no hydrogen 4.005 N/A VAL 403.A N TYR 400.A O no hydrogen 2.933 N/A VAL 405.A N SER 401.A O no hydrogen 3.091 N/A ALA 406.A N CYS 402.A O no hydrogen 3.220 N/A LEU 407.A N VAL 403.A O no hydrogen 3.000 N/A ALA 408.A N PRO 404.A O no hydrogen 2.891 N/A ALA 408.A N VAL 405.A O no hydrogen 3.258 N/A GLU 409.A N ALA 406.A O no hydrogen 3.216 N/A LEU 411.A N ALA 408.A O no hydrogen 3.167 N/A LYS 414.A N LEU 135.A O no hydrogen 2.873 N/A LYS 414.A NZ ASP 412.A OD1 no hydrogen 3.187 N/A ASN 416.A N ARG 139.A O no hydrogen 2.970 N/A THR 417.A N GLU 137.A O no hydrogen 2.932 N/A THR 417.A OG1 LYS 414.A O no hydrogen 3.262 N/A THR 417.A OG1 LEU 415.A O no hydrogen 2.809 N/A ALA 418.A N VAL 434.A O no hydrogen 2.976 N/A ARG 420.A N ILE 432.A O no hydrogen 2.812 N/A GLN 421.A N ILE 432.A O no hydrogen 3.040 N/A GLN 421.A NE2 GLN 467.A OE1 no hydrogen 3.376 N/A VAL 422.A N GLN 467.A O no hydrogen 2.796 N/A ARG 423.A N GLU 430.A O no hydrogen 2.855 N/A ARG 423.A NE GLN 421.A OE1 no hydrogen 2.784 N/A ARG 423.A NH2 GLN 421.A OE1 no hydrogen 3.483 N/A TYR 424.A N VAL 469.A O no hydrogen 3.011 N/A TYR 424.A OH PRO 470.A O no hydrogen 2.636 N/A THR 425.A N GLY 428.A O no hydrogen 2.945 N/A THR 425.A OG1 GLY 428.A O no hydrogen 3.063 N/A GLY 428.A N THR 425.A O no hydrogen 3.254 N/A CYS 429.A N CYS 447.A O no hydrogen 2.773 N/A CYS 429.A SG ASP 448.A O no hydrogen 4.021 N/A CYS 429.A SG ARG 624.A O no hydrogen 3.980 N/A GLU 430.A N ARG 423.A O no hydrogen 2.966 N/A VAL 431.A N TYR 445.A O no hydrogen 2.767 N/A ILE 432.A N GLN 421.A O no hydrogen 2.908 N/A ALA 433.A N PHE 443.A O no hydrogen 2.924 N/A VAL 434.A N ALA 418.A O no hydrogen 2.972 N/A ASN 435.A N GLN 441.A O no hydrogen 3.114 N/A THR 436.A N ASN 416.A O no hydrogen 2.984 N/A ARG 437.A NE ASN 435.A OD1 no hydrogen 3.164 N/A ARG 437.A NH2 ASN 435.A OD1 no hydrogen 3.121 N/A GLN 441.A N SER 438.A O no hydrogen 3.146 N/A THR 442.A OG1 SER 440.A O no hydrogen 3.038 N/A PHE 443.A N ALA 433.A O no hydrogen 2.817 N/A TYR 445.A N VAL 431.A O no hydrogen 2.808 N/A LYS 446.A NZ GLU 430.A OE1 no hydrogen 3.049 N/A CYS 447.A N CYS 429.A O no hydrogen 2.901 N/A CYS 447.A SG CYS 429.A O no hydrogen 3.903 N/A CYS 447.A SG ALA 449.A O no hydrogen 3.377 N/A ASP 448.A N LYS 109.A O no hydrogen 2.869 N/A VAL 450.A N ARG 624.A O no hydrogen 3.020 N/A LEU 451.A N ILE 111.A O no hydrogen 2.866 N/A CYS 452.A N PHE 626.A O no hydrogen 2.795 N/A THR 453.A N ILE 113.A O no hydrogen 3.070 N/A THR 453.A OG1 ILE 113.A O no hydrogen 2.651 N/A THR 453.A OG1 GLY 114.A O no hydrogen 3.493 N/A LEU 459.A N PRO 455.A O no hydrogen 2.940 N/A LYS 460.A N LEU 456.A O no hydrogen 2.948 N/A LYS 460.A NZ VAL 480.A O no hydrogen 2.827 N/A LYS 460.A NZ MET 483.A O no hydrogen 2.754 N/A GLN 461.A N VAL 458.A O no hydrogen 2.966 N/A GLN 467.A N ARG 420.A O no hydrogen 3.075 N/A VAL 469.A N VAL 422.A O no hydrogen 2.758 N/A LYS 476.A N PRO 473.A O no hydrogen 3.063 N/A LYS 476.A NZ LEU 604.A O no hydrogen 2.891 N/A LYS 476.A NZ MET 605.A O no hydrogen 2.789 N/A LYS 476.A NZ GLN 607.A O no hydrogen 2.764 N/A THR 477.A N PRO 473.A O no hydrogen 3.175 N/A THR 477.A OG1 GLU 474.A O no hydrogen 3.392 N/A SER 478.A N GLU 474.A O no hydrogen 2.928 N/A SER 478.A OG GLU 474.A O no hydrogen 2.733 N/A SER 478.A OG GLU 474.A OE2 no hydrogen 2.587 N/A ALA 479.A N TRP 475.A O no hydrogen 3.502 N/A VAL 480.A N LYS 476.A O no hydrogen 2.985 N/A GLN 481.A N THR 477.A O no hydrogen 2.884 N/A ARG 482.A N SER 478.A O no hydrogen 2.804 N/A ARG 482.A NE ASP 601.A OD1 no hydrogen 3.206 N/A ARG 482.A NE ASP 601.A OD2 no hydrogen 3.054 N/A ARG 482.A NH2 ASP 601.A OD1 no hydrogen 2.722 N/A MET 483.A N ALA 479.A O no hydrogen 3.066 N/A GLY 484.A N TYR 592.A O no hydrogen 3.223 N/A GLY 486.A N TYR 590.A O no hydrogen 2.823 N/A ASN 487.A N ALA 370.A O no hydrogen 2.624 N/A ASN 487.A ND2 GLU 545.A OE2 no hydrogen 3.071 N/A LEU 488.A N ASN 487.A OD1 no hydrogen 2.783 N/A ASN 489.A N VAL 536.A O no hydrogen 3.022 N/A ASN 489.A ND2 GLU 545.A OE2 no hydrogen 2.867 N/A LYS 490.A N SER 578.A OG no hydrogen 2.898 N/A LYS 490.A NZ GLY 159.A O no hydrogen 2.988 N/A VAL 491.A N ALA 534.A O no hydrogen 2.872 N/A VAL 492.A N VAL 576.A O no hydrogen 2.794 N/A LEU 493.A N LEU 532.A O no hydrogen 2.785 N/A CYS 494.A N GLU 574.A O no hydrogen 2.955 N/A PHE 495.A N PRO 530.A O no hydrogen 2.878 N/A SER 503.A N ASP 501.A OD1 no hydrogen 3.249 N/A SER 503.A OG ASP 501.A OD1 no hydrogen 3.029 N/A VAL 504.A N ASP 501.A O no hydrogen 3.156 N/A ASN 505.A ND2 ASN 525.A O no hydrogen 2.914 N/A PHE 507.A N PHE 523.A O no hydrogen 3.142 N/A GLY 508.A N PRO 190.A O no hydrogen 2.982 N/A HIS 509.A N PHE 521.A O no hydrogen 2.991 N/A VAL 510.A N TYR 192.A O no hydrogen 2.932 N/A THR 513.A OG1 SER 516.A OG no hydrogen 2.909 N/A THR 514.A OG1 ASP 359.A OD2 no hydrogen 2.656 N/A SER 516.A N THR 513.A O no hydrogen 3.260 N/A SER 516.A OG THR 513.A O no hydrogen 3.312 N/A SER 516.A OG THR 513.A OG1 no hydrogen 2.909 N/A ARG 517.A N THR 514.A O no hydrogen 3.064 N/A ARG 517.A NE GLU 366.A OE1 no hydrogen 3.053 N/A ARG 517.A NH1 ASP 359.A OD1 no hydrogen 3.002 N/A ARG 517.A NH2 GLU 366.A OE2 no hydrogen 2.835 N/A GLU 519.A N SER 516.A O no hydrogen 3.044 N/A PHE 523.A N PHE 507.A O no hydrogen 2.864 N/A TRP 524.A N LEU 533.A O no hydrogen 2.800 N/A ASN 525.A N ASN 505.A O no hydrogen 2.697 N/A ASN 525.A ND2 PRO 502.A O no hydrogen 3.527 N/A ASN 525.A ND2 VAL 504.A O no hydrogen 2.921 N/A LEU 532.A N LEU 493.A O no hydrogen 2.882 N/A LEU 533.A N TRP 524.A O no hydrogen 3.038 N/A ALA 534.A N VAL 491.A O no hydrogen 2.897 N/A LEU 535.A N LEU 522.A O no hydrogen 2.996 N/A VAL 536.A N ASN 489.A O no hydrogen 2.900 N/A ALA 537.A N GLY 518.A O no hydrogen 2.934 N/A ALA 541.A N GLY 538.A O no hydrogen 3.167 N/A MET 544.A N ALA 540.A O no hydrogen 2.740 N/A ASN 546.A N ILE 543.A O no hydrogen 3.292 N/A ILE 547.A N MET 544.A O no hydrogen 3.230 N/A VAL 551.A N SER 548.A OG no hydrogen 3.418 N/A ILE 552.A N SER 548.A O no hydrogen 3.100 N/A VAL 553.A N ASP 549.A O no hydrogen 2.634 N/A GLY 554.A N ASP 550.A O no hydrogen 2.890 N/A ARG 555.A N VAL 551.A O no hydrogen 2.874 N/A ARG 555.A NH1 GLU 519.A OE2 no hydrogen 3.254 N/A CYS 556.A N ILE 552.A O no hydrogen 3.080 N/A CYS 556.A SG ILE 552.A O no hydrogen 3.600 N/A LEU 557.A N VAL 553.A O no hydrogen 2.968 N/A ALA 558.A N GLY 554.A O no hydrogen 2.845 N/A ILE 559.A N ARG 555.A O no hydrogen 3.209 N/A LEU 560.A N CYS 556.A O no hydrogen 2.997 N/A LYS 561.A N LEU 557.A O no hydrogen 2.741 N/A LYS 561.A NZ VAL 569.A O no hydrogen 3.202 N/A GLY 562.A N ALA 558.A O no hydrogen 3.080 N/A ILE 563.A N ILE 559.A O no hydrogen 3.159 N/A ILE 563.A N LEU 560.A O no hydrogen 3.237 N/A PHE 564.A N LEU 560.A O no hydrogen 2.949 N/A GLY 565.A N LYS 561.A O no hydrogen 2.690 N/A ALA 568.A N GLY 565.A O no hydrogen 2.810 N/A LYS 573.A N CYS 494.A O no hydrogen 2.730 N/A VAL 576.A N VAL 492.A O no hydrogen 3.106 N/A SER 578.A N LYS 490.A O no hydrogen 3.000 N/A SER 578.A OG ASN 489.A OD1 no hydrogen 2.444 N/A ARG 579.A NE GLU 545.A O no hydrogen 2.725 N/A ARG 579.A NH2 GLU 545.A O no hydrogen 3.184 N/A TRP 580.A N ASN 489.A OD1 no hydrogen 3.029 N/A TRP 580.A NE1 LEU 158.A O no hydrogen 2.960 N/A ARG 581.A N GLU 545.A OE2 no hydrogen 2.908 N/A ARG 581.A NH1 PHE 485.A O no hydrogen 2.663 N/A ARG 581.A NH1 ARG 587.A O no hydrogen 2.931 N/A ARG 581.A NH2 PHE 485.A O no hydrogen 2.767 N/A ALA 582.A N GLU 545.A OE1 no hydrogen 2.919 N/A ASP 583.A N ARG 579.A O no hydrogen 3.208 N/A TRP 585.A N ASP 583.A OD1 no hydrogen 3.048 N/A ALA 586.A N ASP 583.A O no hydrogen 3.124 N/A ARG 587.A N ASP 583.A O no hydrogen 2.777 N/A GLY 588.A N TRP 580.A O no hydrogen 2.978 N/A SER 589.A N GLY 486.A O no hydrogen 2.770 N/A TYR 590.A OH PHE 367.A O no hydrogen 2.872 N/A SER 591.A N GLU 630.A OE2 no hydrogen 3.215 N/A SER 591.A OG TYR 602.A OH no hydrogen 2.659 N/A SER 591.A OG GLU 630.A OE2 no hydrogen 2.533 N/A TYR 592.A N GLY 484.A O no hydrogen 3.173 N/A ALA 595.A N THR 375.A O no hydrogen 2.759 N/A SER 597.A N ALA 594.A O no hydrogen 2.826 N/A SER 597.A OG ASP 601.A OD2 no hydrogen 2.607 N/A SER 598.A N SER 597.A OG no hydrogen 2.750 N/A ASP 601.A N SER 598.A O no hydrogen 3.151 N/A TYR 602.A N GLY 599.A O no hydrogen 3.116 N/A TYR 602.A OH SER 591.A OG no hydrogen 2.659 N/A LEU 604.A N ASN 600.A O no hydrogen 3.077 N/A MET 605.A N ASP 601.A O no hydrogen 2.816 N/A ALA 606.A N TYR 602.A O no hydrogen 3.102 N/A GLN 607.A N LEU 604.A O no hydrogen 3.151 N/A GLN 607.A NE2 ASP 603.A O no hydrogen 3.226 N/A ILE 609.A N LEU 625.A O no hydrogen 2.729 N/A ALA 618.A N ILE 615.A O no hydrogen 3.298 N/A GLN 620.A NE2 PRO 621.A O no hydrogen 3.628 N/A ARG 624.A N ILE 609.A O no hydrogen 2.943 N/A ARG 624.A NH1 ASP 448.A O no hydrogen 2.982 N/A ARG 624.A NH2 ALA 426.A O no hydrogen 2.766 N/A LEU 625.A N ILE 609.A O no hydrogen 3.339 N/A PHE 626.A N VAL 450.A O no hydrogen 2.868 N/A ALA 628.A N CYS 452.A O no hydrogen 2.953 N/A GLY 629.A N SER 646.A OG no hydrogen 2.775 N/A THR 632.A N GLY 629.A O no hydrogen 2.755 N/A THR 632.A OG1 GLY 629.A O no hydrogen 2.392 N/A ARG 634.A NH1 ASP 603.A OD2 no hydrogen 3.183 N/A TYR 636.A N ILE 633.A O no hydrogen 3.256 N/A ALA 638.A N GLU 630.A OE2 no hydrogen 3.168 N/A THR 639.A OG1 TYR 636.A O no hydrogen 2.754 N/A GLY 642.A N THR 639.A OG1 no hydrogen 2.878 N/A ALA 643.A N THR 639.A O no hydrogen 3.249 N/A LEU 644.A N VAL 640.A O no hydrogen 2.930 N/A LEU 645.A N HIS 641.A O no hydrogen 2.906 N/A SER 646.A N GLY 642.A O no hydrogen 2.844 N/A SER 646.A OG ALA 643.A O no hydrogen 2.721 N/A GLY 647.A N ALA 643.A O no hydrogen 3.048 N/A LEU 648.A N LEU 644.A O no hydrogen 3.188 N/A ARG 649.A N LEU 645.A O no hydrogen 3.040 N/A ARG 649.A NE GLU 650.A OE2 no hydrogen 2.659 N/A ARG 649.A NH1 THR 632.A O no hydrogen 3.081 N/A ARG 649.A NH2 THR 632.A OG1 no hydrogen 3.314 N/A ARG 649.A NH2 GLU 650.A OE2 no hydrogen 2.889 N/A GLU 650.A N SER 646.A O no hydrogen 3.246 N/A ALA 651.A N GLY 647.A O no hydrogen 2.985 N/A GLY 652.A N LEU 648.A O no hydrogen 3.240 N/A ARG 653.A N ARG 649.A O no hydrogen 3.100 N/A ARG 653.A NH1 GLU 650.A OE1 no hydrogen 3.016 N/A ILE 654.A N GLU 650.A O no hydrogen 2.857 N/A ALA 655.A N ALA 651.A O no hydrogen 2.833 N/A ASP 656.A N GLY 652.A O no hydrogen 3.006 N/A GLN 657.A N ARG 653.A O no hydrogen 3.190 N/A GLN 657.A N ILE 654.A O no hydrogen 3.107 N/A PHE 658.A N ILE 654.A O no hydrogen 3.010 N/A LEU 659.A N ALA 655.A O no hydrogen 2.815 N/A