Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7anw_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 5.A N GLY 1.A O no hydrogen 2.803 N/A VAL 6.A N ALA 2.A O no hydrogen 3.129 N/A GLN 7.A N GLY 3.A O no hydrogen 2.886 N/A ASP 8.A N THR 4.A O no hydrogen 2.727 N/A ALA 9.A N GLU 5.A O no hydrogen 3.160 N/A LEU 10.A N VAL 6.A O no hydrogen 3.065 N/A GLU 11.A N GLN 7.A O no hydrogen 2.640 N/A ARG 12.A N ALA 9.A O no hydrogen 3.146 N/A ALA 13.A N ALA 9.A O no hydrogen 3.030 N/A LEU 14.A N LEU 10.A O no hydrogen 2.708 N/A GLU 16.A N ARG 12.A O no hydrogen 3.218 N/A LEU 17.A N ALA 13.A O no hydrogen 2.884 N/A GLN 18.A N LEU 14.A O no hydrogen 3.120 N/A GLN 18.A NE2 ASP 68.A OD2 no hydrogen 2.647 N/A GLN 19.A N PRO 15.A O no hydrogen 3.214 N/A GLN 19.A N GLU 16.A O no hydrogen 3.172 N/A ALA 20.A N GLU 16.A O no hydrogen 3.240 N/A LEU 21.A N LEU 17.A O no hydrogen 2.981 N/A SER 22.A N GLN 19.A O no hydrogen 2.938 N/A SER 22.A OG GLN 19.A O no hydrogen 2.853 N/A ALA 23.A N GLN 19.A O no hydrogen 3.318 N/A LEU 24.A N LEU 21.A O no hydrogen 3.107 N/A LYS 25.A N SER 22.A O no hydrogen 2.836 N/A GLN 26.A N SER 22.A O no hydrogen 3.100 N/A GLY 28.A N GLN 26.A O no hydrogen 2.912 N/A GLY 34.A N ALA 30.A O no hydrogen 3.110 N/A ALA 35.A N ARG 31.A O no hydrogen 2.863 N/A GLY 36.A N ALA 32.A O no hydrogen 3.021 N/A LEU 37.A N VAL 33.A O no hydrogen 2.794 N/A ALA 38.A N GLY 34.A O no hydrogen 3.007 N/A GLU 39.A N ALA 35.A O no hydrogen 2.639 N/A VAL 40.A N GLY 36.A O no hydrogen 3.102 N/A PHE 41.A N LEU 37.A O no hydrogen 2.869 N/A GLN 42.A N ALA 38.A O no hydrogen 2.973 N/A LEU 43.A N GLU 39.A O no hydrogen 3.053 N/A VAL 44.A N VAL 40.A O no hydrogen 2.900 N/A GLU 45.A N PHE 41.A O no hydrogen 2.901 N/A GLU 46.A N GLN 42.A O no hydrogen 3.024 N/A TRP 48.A N VAL 44.A O no hydrogen 2.850 N/A TRP 48.A NE1 GLN 95.A O no hydrogen 2.861 N/A LEU 49.A N GLU 45.A O no hydrogen 2.831 N/A ALA 58.A N GLY 54.A O no hydrogen 2.818 N/A GLN 59.A N ARG 55.A O no hydrogen 2.787 N/A GLY 60.A N GLU 56.A O no hydrogen 3.035 N/A LEU 61.A N VAL 57.A O no hydrogen 2.892 N/A CYS 62.A N ALA 58.A O no hydrogen 3.004 N/A CYS 62.A SG ALA 58.A O no hydrogen 3.089 N/A CYS 62.A SG ILE 96.A O no hydrogen 3.985 N/A ASP 63.A N GLN 59.A O no hydrogen 2.949 N/A ALA 64.A N GLY 60.A O no hydrogen 3.058 N/A ILE 65.A N LEU 61.A O no hydrogen 3.124 N/A ARG 66.A N CYS 62.A O no hydrogen 3.246 N/A ARG 66.A NH1 ASP 63.A OD1 no hydrogen 3.040 N/A LEU 67.A N ASP 63.A O no hydrogen 3.010 N/A ASP 68.A N ILE 65.A O no hydrogen 3.374 N/A LEU 73.A N GLY 69.A O no hydrogen 3.199 N/A LEU 75.A N LEU 71.A O no hydrogen 2.678 N/A ARG 76.A N ASP 72.A O no hydrogen 3.018 N/A ARG 76.A N LEU 73.A O no hydrogen 3.288 N/A LEU 77.A N LEU 73.A O no hydrogen 3.132 N/A GLN 79.A N ARG 76.A O no hydrogen 2.893 N/A GLN 79.A NE2 LEU 75.A O no hydrogen 2.907 N/A ALA 80.A N LEU 77.A O no hydrogen 3.343 N/A GLU 84.A N GLU 84.A OE1 no hydrogen 2.941 N/A THR 85.A OG1 GLU 82.A O no hydrogen 2.833 N/A THR 85.A OG1 GLU 82.A OE1 no hydrogen 2.936 N/A ARG 86.A N GLU 82.A O no hydrogen 2.911 N/A ARG 86.A NH2 PRO 81.A O no hydrogen 2.978 N/A VAL 87.A N LEU 83.A O no hydrogen 2.756 N/A GLN 88.A N GLU 84.A O no hydrogen 2.840 N/A ALA 89.A N THR 85.A O no hydrogen 2.982 N/A ALA 90.A N ARG 86.A O no hydrogen 2.847 N/A ARG 91.A N VAL 87.A O no hydrogen 3.026 N/A LEU 92.A N GLN 88.A O no hydrogen 3.175 N/A LEU 93.A N ALA 89.A O no hydrogen 2.890 N/A GLU 94.A N ALA 90.A O no hydrogen 3.052 N/A GLN 95.A N LEU 92.A O no hydrogen 3.188 N/A ILE 96.A N LEU 93.A O no hydrogen 2.884 N/A VAL 98.A N ILE 96.A O no hydrogen 2.887 N/A ARG 102.A N VAL 98.A O no hydrogen 2.847 N/A ARG 102.A N ALA 99.A O no hydrogen 3.117 N/A ASP 103.A N ALA 99.A O no hydrogen 3.035 N/A ARG 104.A N GLU 100.A O no hydrogen 3.374 N/A VAL 105.A N ASN 101.A O no hydrogen 3.380 N/A ALA 106.A N ARG 102.A O no hydrogen 3.019 N/A ARG 107.A N ASP 103.A O no hydrogen 3.260 N/A ARG 107.A NH2 ASP 103.A OD2 no hydrogen 3.189 N/A ILE 108.A N ARG 104.A O no hydrogen 2.821 N/A GLY 109.A N VAL 105.A O no hydrogen 3.018 N/A LEU 114.A N LEU 110.A O no hydrogen 3.071 N/A ASN 115.A N VAL 112.A O no hydrogen 2.889 N/A ASN 115.A ND2 GLY 111.A O no hydrogen 3.027 N/A LEU 116.A N VAL 112.A O no hydrogen 3.059 N/A ALA 117.A N ILE 113.A O no hydrogen 3.021 N/A LYS 118.A NZ ASN 115.A OD1 no hydrogen 3.124 N/A GLU 119.A N LEU 116.A O no hydrogen 3.192 N/A ARG 120.A NE ALA 117.A O no hydrogen 3.340 N/A GLU 124.A N GLU 124.A OE1 no hydrogen 2.769 N/A ALA 126.A N PRO 122.A O no hydrogen 2.766 N/A ARG 127.A N VAL 123.A O no hydrogen 2.804 N/A ARG 127.A NH2 ASP 164.A OD2 no hydrogen 3.446 N/A SER 128.A N LEU 125.A O no hydrogen 2.616 N/A VAL 129.A N LEU 125.A O no hydrogen 2.898 N/A ALA 130.A N ALA 126.A O no hydrogen 2.869 N/A GLY 131.A N ARG 127.A O no hydrogen 3.167 N/A ILE 132.A N SER 128.A O no hydrogen 2.802 N/A LEU 133.A N VAL 129.A O no hydrogen 3.036 N/A GLU 134.A N ALA 130.A O no hydrogen 3.039 N/A HIS 135.A N GLY 131.A O no hydrogen 3.415 N/A HIS 135.A N ILE 132.A O no hydrogen 2.854 N/A MET 136.A N ILE 132.A O no hydrogen 2.938 N/A MET 136.A N LEU 133.A O no hydrogen 3.152 N/A PHE 137.A N LEU 133.A O no hydrogen 3.012 N/A HIS 139.A N MET 136.A O no hydrogen 3.341 N/A HIS 139.A ND1 THR 143.A OG1 no hydrogen 2.912 N/A SER 140.A OG THR 143.A OG1 no hydrogen 3.182 N/A THR 143.A N SER 140.A OG no hydrogen 3.225 N/A THR 143.A OG1 HIS 139.A ND1 no hydrogen 2.912 N/A THR 143.A OG1 SER 140.A OG no hydrogen 3.182 N/A CYS 144.A N SER 140.A O no hydrogen 2.879 N/A CYS 144.A SG PHE 137.A O no hydrogen 3.125 N/A CYS 144.A SG SER 140.A O no hydrogen 3.736 N/A GLN 145.A N GLU 141.A O no hydrogen 2.828 N/A ARG 146.A N GLU 142.A O no hydrogen 3.015 N/A ARG 146.A N THR 143.A O no hydrogen 3.124 N/A ARG 146.A NH1 ALA 106.A O no hydrogen 3.108 N/A LEU 147.A N THR 143.A O no hydrogen 2.939 N/A ALA 149.A N GLN 145.A O no hydrogen 3.114 N/A ALA 150.A N ARG 146.A O no hydrogen 3.217 N/A GLY 152.A N ALA 150.A O no hydrogen 2.617 N/A TYR 158.A N ALA 155.A O no hydrogen 3.162 N/A TRP 159.A N ALA 155.A O no hydrogen 3.018 N/A CYS 160.A SG VAL 156.A O no hydrogen 3.094 N/A CYS 160.A SG TRP 198.A O no hydrogen 3.770 N/A ARG 161.A N TYR 158.A O no hydrogen 3.257 N/A ARG 161.A NE TYR 158.A O no hydrogen 3.069 N/A ARG 161.A NH2 LEU 157.A O no hydrogen 3.199 N/A LEU 167.A N ASP 164.A OD2 no hydrogen 3.020 N/A LEU 168.A N ASP 164.A O no hydrogen 3.048 N/A ARG 169.A N PRO 165.A O no hydrogen 3.065 N/A ARG 169.A NH1 ASP 208.A OD2 no hydrogen 3.011 N/A HIS 170.A N ALA 166.A O no hydrogen 2.961 N/A HIS 170.A ND1 GLU 134.A OE1 no hydrogen 3.225 N/A CYS 171.A N LEU 167.A O no hydrogen 2.913 N/A CYS 171.A SG TRP 159.A O no hydrogen 3.500 N/A CYS 171.A SG LEU 167.A O no hydrogen 3.015 N/A ALA 172.A N LEU 168.A O no hydrogen 3.061 N/A LEU 173.A N ARG 169.A O no hydrogen 3.264 N/A LEU 175.A N CYS 171.A O no hydrogen 3.348 N/A GLY 176.A N ALA 172.A O no hydrogen 3.113 N/A ASN 177.A N LEU 173.A O no hydrogen 3.313 N/A ASN 177.A ND2 GLU 134.A O no hydrogen 3.045 N/A CYS 178.A N ALA 174.A O no hydrogen 2.829 N/A ALA 179.A N LEU 175.A O no hydrogen 3.094 N/A LEU 180.A N GLY 176.A O no hydrogen 3.010 N/A HIS 181.A ND1 ASN 177.A O no hydrogen 3.043 N/A GLN 187.A N GLY 183.A O no hydrogen 2.938 N/A GLN 187.A NE2 ALA 179.A O no hydrogen 2.784 N/A ARG 188.A N GLN 184.A O no hydrogen 3.054 N/A ARG 188.A NH1 GLU 227.A OE1 no hydrogen 2.663 N/A ARG 189.A N ALA 185.A O no hydrogen 3.272 N/A ARG 189.A NH1 GLU 192.A OE1 no hydrogen 3.086 N/A MET 190.A N VAL 186.A O no hydrogen 2.859 N/A MET 190.A N GLN 187.A O no hydrogen 3.173 N/A VAL 191.A N GLN 187.A O no hydrogen 3.140 N/A GLU 192.A N ARG 188.A O no hydrogen 3.030 N/A LYS 193.A N ARG 189.A O no hydrogen 2.887 N/A LYS 193.A N MET 190.A O no hydrogen 3.113 N/A LYS 193.A NZ VAL 148.A O no hydrogen 3.067 N/A LYS 193.A NZ ASP 154.A OD1 no hydrogen 3.065 N/A ARG 194.A N VAL 191.A O no hydrogen 2.936 N/A GLU 197.A N GLU 197.A OE1 no hydrogen 2.855 N/A TRP 198.A N ALA 195.A O no hydrogen 3.027 N/A LEU 199.A N ALA 196.A O no hydrogen 2.954 N/A LEU 202.A N LEU 199.A O no hydrogen 3.071 N/A ALA 203.A N LEU 199.A O no hydrogen 2.996 N/A ALA 203.A N PHE 200.A O no hydrogen 3.108 N/A PHE 204.A N PHE 200.A O no hydrogen 2.953 N/A LYS 206.A N GLU 207.A OE1 no hydrogen 3.271 N/A LYS 206.A NZ SER 205.A O no hydrogen 3.427 N/A LEU 211.A N ASP 208.A OD2 no hydrogen 3.108 N/A ARG 212.A NE ALA 203.A O no hydrogen 2.843 N/A LEU 213.A N GLU 209.A O no hydrogen 3.358 N/A HIS 214.A N LEU 210.A O no hydrogen 2.839 N/A ALA 215.A N LEU 211.A O no hydrogen 3.038 N/A CYS 216.A N LEU 213.A O no hydrogen 3.427 N/A CYS 216.A SG ARG 212.A O no hydrogen 3.170 N/A LEU 217.A N LEU 213.A O no hydrogen 3.288 N/A ALA 218.A N HIS 214.A O no hydrogen 3.450 N/A ALA 220.A N CYS 216.A O no hydrogen 2.923 N/A VAL 221.A N LEU 217.A O no hydrogen 2.861 N/A LEU 222.A N ALA 218.A O no hydrogen 3.151 N/A ALA 223.A N VAL 219.A O no hydrogen 2.973 N/A THR 224.A N VAL 221.A O no hydrogen 3.231 N/A THR 224.A OG1 ALA 220.A O no hydrogen 2.825 N/A ASN 225.A N LEU 222.A O no hydrogen 3.199 N/A ASN 225.A ND2 GLN 187.A OE1 no hydrogen 2.838 N/A GLU 227.A N ASN 225.A OD1 no hydrogen 3.252 N/A VAL 228.A N ASN 225.A O no hydrogen 2.872 N/A ARG 230.A NH1 GLU 233.A OE1 no hydrogen 3.075 N/A GLU 231.A N VAL 228.A O no hydrogen 3.077 N/A VAL 232.A N VAL 228.A O no hydrogen 3.026 N/A GLU 233.A N GLU 229.A O no hydrogen 2.974 N/A SER 235.A N VAL 232.A O no hydrogen 3.230 N/A SER 235.A OG VAL 232.A O no hydrogen 2.714 N/A SER 235.A OG THR 237.A OG1 no hydrogen 3.095 N/A GLY 236.A N GLU 233.A O no hydrogen 3.022 N/A THR 237.A N SER 235.A OG no hydrogen 3.131 N/A THR 237.A OG1 ALA 196.A O no hydrogen 3.239 N/A THR 237.A OG1 SER 235.A OG no hydrogen 3.095 N/A LEU 240.A N THR 237.A O no hydrogen 3.229 N/A VAL 241.A N LEU 238.A O no hydrogen 2.978 N/A LEU 244.A N VAL 241.A O no hydrogen 3.134 N/A VAL 245.A N VAL 241.A O no hydrogen 3.144 N/A ALA 246.A N GLU 242.A O no hydrogen 3.134 N/A SER 247.A N PRO 243.A O no hydrogen 3.182 N/A SER 247.A OG PRO 243.A O no hydrogen 2.823 N/A LEU 248.A N LEU 244.A O no hydrogen 3.164 N/A ARG 252.A N ASP 249.A O no hydrogen 3.166 N/A PHE 253.A N ASP 249.A O no hydrogen 3.444 N/A PHE 253.A N PRO 250.A O no hydrogen 3.059 N/A ALA 254.A N PRO 250.A O no hydrogen 3.079 N/A ALA 254.A N GLY 251.A O no hydrogen 3.257 N/A ARG 255.A N ARG 252.A O no hydrogen 3.238 N/A CYS 256.A SG ARG 252.A O no hydrogen 3.399 N/A VAL 258.A N ALA 254.A O no hydrogen 2.864 N/A ALA 260.A N LEU 257.A O no hydrogen 3.331 N/A SER 264.A OG ALA 260.A O no hydrogen 3.237 N/A SER 264.A OG SER 261.A O no hydrogen 2.986 N/A GLY 266.A N THR 263.A O no hydrogen 3.045 N/A ARG 267.A N GLU 297.A OE1 no hydrogen 3.086 N/A ARG 267.A NH1 ASP 271.A O no hydrogen 3.331 N/A ASP 271.A N GLY 268.A O no hydrogen 3.045 N/A LEU 272.A N GLY 268.A O no hydrogen 3.129 N/A LEU 275.A N LEU 272.A O no hydrogen 3.197 N/A LEU 278.A N LEU 275.A O no hydrogen 3.200 N/A SER 281.A N LEU 278.A O no hydrogen 3.212 N/A SER 281.A OG LEU 278.A O no hydrogen 2.845 N/A SER 281.A OG ARG 283.A O no hydrogen 3.480 N/A ARG 283.A NH2 GLU 285.A OE2 no hydrogen 3.053 N/A GLU 285.A N GLU 285.A OE1 no hydrogen 2.967 N/A GLN 287.A N ARG 283.A O no hydrogen 2.912 N/A GLN 287.A NE2 LEU 279.A O no hydrogen 3.407 N/A CYS 288.A N LEU 284.A O no hydrogen 2.859 N/A CYS 288.A SG LEU 284.A O no hydrogen 3.526 N/A ILE 289.A N GLU 285.A O no hydrogen 3.166 N/A GLY 290.A N ALA 286.A O no hydrogen 2.860 N/A ALA 291.A N GLN 287.A O no hydrogen 3.227 N/A PHE 292.A N CYS 288.A O no hydrogen 2.846 N/A TYR 293.A N ILE 289.A O no hydrogen 3.197 N/A TYR 293.A OH LEU 213.A O no hydrogen 2.972 N/A LEU 294.A N GLY 290.A O no hydrogen 3.044 N/A CYS 295.A N ALA 291.A O no hydrogen 3.092 N/A CYS 295.A N PHE 292.A O no hydrogen 3.245 N/A CYS 295.A SG LEU 334.A O no hydrogen 3.648 N/A ALA 296.A N PHE 292.A O no hydrogen 3.102 N/A GLU 297.A N TYR 293.A O no hydrogen 3.030 N/A ALA 298.A N LEU 294.A O no hydrogen 3.096 N/A ALA 299.A N CYS 295.A O no hydrogen 3.107 N/A ALA 299.A N ALA 296.A O no hydrogen 3.277 N/A ILE 300.A N ALA 296.A O no hydrogen 3.322 N/A LYS 301.A N GLU 297.A O no hydrogen 2.806 N/A LYS 301.A NZ GLN 265.A O no hydrogen 2.783 N/A LYS 301.A NZ ARG 267.A O no hydrogen 2.968 N/A SER 302.A N ALA 298.A O no hydrogen 3.217 N/A SER 302.A N ALA 299.A O no hydrogen 3.098 N/A SER 302.A OG ALA 298.A O no hydrogen 3.311 N/A SER 302.A OG ALA 299.A O no hydrogen 2.844 N/A LEU 303.A N ALA 299.A O no hydrogen 2.963 N/A GLN 304.A N ILE 300.A O no hydrogen 3.066 N/A GLY 305.A N LYS 301.A O no hydrogen 2.997 N/A SER 311.A N LYS 308.A O no hydrogen 3.010 N/A SER 311.A OG LYS 308.A O no hydrogen 3.320 N/A ASP 312.A N LYS 308.A O no hydrogen 3.419 N/A ASP 312.A N VAL 309.A O no hydrogen 2.822 N/A ILE 313.A N VAL 309.A O no hydrogen 2.987 N/A ALA 315.A N PHE 310.A O no hydrogen 3.105 N/A ILE 316.A N PHE 310.A O no hydrogen 3.509 N/A SER 318.A N ALA 315.A O no hydrogen 2.690 N/A SER 318.A OG ASP 280.A OD1 no hydrogen 2.828 N/A SER 318.A OG ASP 280.A OD2 no hydrogen 3.554 N/A SER 318.A OG GLY 314.A O no hydrogen 3.485 N/A LEU 319.A N ALA 315.A O no hydrogen 2.768 N/A LYS 320.A N ILE 316.A O no hydrogen 3.076 N/A LYS 320.A NZ GLU 344.A OE1 no hydrogen 3.169 N/A LEU 322.A N LEU 319.A O no hydrogen 3.299 N/A SER 324.A OG LYS 320.A O no hydrogen 3.338 N/A SER 324.A OG GLN 368.A OE1 no hydrogen 3.399 N/A SER 326.A OG VAL 323.A O no hydrogen 3.240 N/A SER 326.A OG SER 332.A OG no hydrogen 2.288 N/A THR 330.A OG1 GLU 242.A OE2 no hydrogen 2.749 N/A THR 330.A OG1 ASN 328.A OD1 no hydrogen 3.005 N/A LYS 331.A NZ GLN 287.A OE1 no hydrogen 3.296 N/A SER 332.A N ASN 328.A O no hydrogen 3.360 N/A SER 332.A OG LEU 322.A O no hydrogen 3.518 N/A SER 332.A OG ASN 328.A O no hydrogen 3.450 N/A ALA 333.A N GLY 329.A O no hydrogen 2.834 N/A LEU 334.A N THR 330.A O no hydrogen 3.150 N/A ALA 335.A N LYS 331.A O no hydrogen 2.952 N/A LYS 336.A N SER 332.A O no hydrogen 3.002 N/A LYS 336.A N ALA 333.A O no hydrogen 3.245 N/A ARG 337.A N ALA 333.A O no hydrogen 2.991 N/A ARG 337.A NH1 ASP 249.A OD1 no hydrogen 2.839 N/A ARG 337.A NH2 ASP 249.A OD1 no hydrogen 3.255 N/A ALA 338.A N LEU 334.A O no hydrogen 3.048 N/A LEU 339.A N ALA 335.A O no hydrogen 3.314 N/A ARG 340.A N LYS 336.A O no hydrogen 3.073 N/A ARG 340.A N ARG 337.A O no hydrogen 3.085 N/A LEU 341.A N ARG 337.A O no hydrogen 2.907 N/A LEU 342.A N ALA 338.A O no hydrogen 2.953 N/A GLY 343.A N ARG 340.A O no hydrogen 2.836 N/A GLU 344.A N LEU 339.A O no hydrogen 2.750 N/A ILE 350.A N SER 324.A O no hydrogen 3.443 N/A SER 356.A N SER 353.A O no hydrogen 3.154 N/A TRP 357.A N VAL 354.A O no hydrogen 2.795 N/A TRP 357.A NE1 LEU 351.A O no hydrogen 2.950 N/A LYS 358.A N GLU 361.A OE1 no hydrogen 3.325 N/A GLN 363.A N GLU 359.A O no hydrogen 3.191 N/A GLN 363.A NE2 CYS 375.A O no hydrogen 3.145 N/A THR 364.A N ALA 360.A O no hydrogen 3.130 N/A TRP 365.A N GLU 361.A O no hydrogen 3.218 N/A TRP 365.A NE1 TYR 325.A OH no hydrogen 3.017 N/A LEU 366.A N VAL 362.A O no hydrogen 3.007 N/A GLN 367.A N GLN 363.A O no hydrogen 3.184 N/A GLN 367.A N THR 364.A O no hydrogen 2.874 N/A GLN 368.A N TRP 365.A O no hydrogen 2.928 N/A GLN 368.A NE2 ARG 348.A O no hydrogen 3.022 N/A ILE 369.A N TRP 365.A O no hydrogen 3.225 N/A PHE 371.A N LEU 366.A O no hydrogen 2.873 N/A LYS 373.A NZ TYR 374.A OH no hydrogen 3.509 N/A TYR 374.A N PHE 371.A O no hydrogen 2.843 N/A CYS 375.A SG GLN 363.A O no hydrogen 3.818 N/A CYS 375.A SG GLN 367.A OE1 no hydrogen 3.309 N/A SER 377.A OG TYR 374.A O no hydrogen 3.469 N/A SER 377.A OG LEU 400.A O no hydrogen 2.910 N/A PHE 378.A N CYS 375.A O no hydrogen 2.824 N/A ARG 379.A N CYS 375.A O no hydrogen 3.067 N/A ARG 379.A N GLU 376.A O no hydrogen 3.168 N/A ARG 379.A NE GLU 376.A OE2 no hydrogen 3.400 N/A ARG 379.A NH2 GLU 376.A OE1 no hydrogen 3.222 N/A GLU 380.A N GLU 376.A O no hydrogen 2.954 N/A GLN 382.A N ARG 379.A O no hydrogen 3.059 N/A VAL 383.A N PHE 378.A O no hydrogen 3.008 N/A GLY 385.A N TRP 357.A O no hydrogen 2.983 N/A ASP 386.A N ASP 384.A OD2 no hydrogen 3.087 N/A LEU 387.A N ASP 384.A O no hydrogen 3.209 N/A LEU 388.A N ASP 384.A O no hydrogen 3.065 N/A ARG 390.A NE ASP 386.A O no hydrogen 3.104 N/A ARG 390.A NE ASP 386.A OD1 no hydrogen 2.499 N/A LEU 391.A N LEU 388.A O no hydrogen 3.210 N/A THR 392.A OG1 GLU 394.A OE1 no hydrogen 3.234 N/A GLU 395.A N THR 392.A OG1 no hydrogen 3.392 N/A LEU 396.A N THR 392.A O no hydrogen 2.991 N/A GLN 397.A N GLU 393.A O no hydrogen 2.769 N/A THR 398.A N GLU 394.A O no hydrogen 2.833 N/A THR 398.A OG1 GLU 394.A O no hydrogen 2.709 N/A ASP 399.A N GLU 395.A O no hydrogen 3.045 N/A LEU 400.A N GLU 395.A O no hydrogen 3.029 N/A MET 402.A N LEU 396.A O no hydrogen 3.065 N/A ILE 406.A N SER 404.A OG no hydrogen 2.978 N/A THR 407.A N SER 404.A OG no hydrogen 2.892 N/A ARG 408.A N SER 404.A O no hydrogen 3.080 N/A ARG 408.A NH1 GLU 393.A OE2 no hydrogen 3.161 N/A ARG 408.A NH2 MET 402.A O no hydrogen 2.701 N/A ARG 408.A NH2 LYS 403.A O no hydrogen 2.454 N/A LYS 409.A N ILE 406.A O no hydrogen 2.883 N/A ARG 410.A N ILE 406.A O no hydrogen 3.027 N/A ARG 410.A N THR 407.A O no hydrogen 3.139 N/A PHE 411.A N THR 407.A O no hydrogen 2.967 N/A PHE 412.A N ARG 408.A O no hydrogen 3.243 N/A ARG 413.A N ARG 410.A O no hydrogen 3.419 N/A GLU 414.A N ARG 410.A O no hydrogen 3.363 N/A LEU 415.A N PHE 411.A O no hydrogen 2.891 N/A THR 416.A N PHE 412.A O no hydrogen 3.307 N/A THR 416.A OG1 PHE 412.A O no hydrogen 2.968 N/A THR 416.A OG1 GLN 445.A OE1 no hydrogen 3.136 N/A GLU 417.A N ARG 413.A O no hydrogen 3.221 N/A GLU 417.A N GLU 414.A O no hydrogen 3.121 N/A LEU 418.A N GLU 414.A O no hydrogen 3.234 N/A LYS 419.A N LEU 415.A O no hydrogen 2.882 N/A THR 420.A N GLU 417.A O no hydrogen 2.961 N/A THR 420.A OG1 THR 416.A O no hydrogen 2.847 N/A PHE 421.A N LEU 418.A O no hydrogen 2.968 N/A ALA 422.A N LEU 418.A O no hydrogen 2.947 N/A ASN 423.A N PRO 352.A O no hydrogen 2.993 N/A TYR 424.A OH LYS 419.A O no hydrogen 2.878 N/A CYS 427.A N TYR 424.A O no hydrogen 2.955 N/A CYS 427.A SG TYR 424.A O no hydrogen 3.368 N/A ASP 428.A N TYR 424.A O no hydrogen 2.857 N/A SER 430.A N ASP 428.A OD1 no hydrogen 3.400 N/A ASN 431.A ND2 ASP 434.A OD2 no hydrogen 3.219 N/A LEU 432.A N ASP 428.A OD1 no hydrogen 2.949 N/A ALA 433.A N ASP 428.A OD2 no hydrogen 2.835 N/A ASP 434.A N ASN 431.A O no hydrogen 3.025 N/A TRP 435.A N LEU 432.A O no hydrogen 3.246 N/A LEU 436.A N LEU 432.A O no hydrogen 2.992 N/A GLY 437.A N ALA 433.A O no hydrogen 3.155 N/A SER 438.A N TRP 435.A O no hydrogen 3.280 N/A SER 438.A OG ASP 434.A O no hydrogen 3.146 N/A LEU 439.A N TRP 435.A O no hydrogen 3.291 N/A ASP 440.A N LEU 436.A O no hydrogen 3.312 N/A ARG 442.A NE ASP 440.A OD2 no hydrogen 3.474 N/A PHE 443.A N ASP 440.A O no hydrogen 2.626 N/A ARG 444.A N PRO 441.A O no hydrogen 3.457 N/A ARG 444.A NH1 ALA 422.A O no hydrogen 3.187 N/A ARG 444.A NH2 ALA 422.A O no hydrogen 3.214 N/A GLN 445.A NE2 ARG 442.A O no hydrogen 3.048 N/A TYR 446.A N PHE 443.A O no hydrogen 2.858 N/A TYR 446.A OH HIS 479.A ND1 no hydrogen 2.652 N/A THR 447.A N ARG 444.A O no hydrogen 3.497 N/A THR 447.A OG1 ARG 444.A O no hydrogen 2.964 N/A LEU 450.A N TYR 446.A O no hydrogen 3.056 N/A VAL 451.A N THR 447.A O no hydrogen 2.872 N/A SER 452.A N TYR 448.A O no hydrogen 2.806 N/A SER 452.A OG TYR 448.A O no hydrogen 2.978 N/A CYS 453.A N LEU 450.A O no hydrogen 3.469 N/A CYS 453.A SG GLY 449.A O no hydrogen 3.377 N/A LEU 455.A N LEU 450.A O no hydrogen 3.282 N/A ARG 457.A N SER 430.A OG no hydrogen 3.289 N/A ARG 457.A NE SER 430.A O no hydrogen 2.806 N/A ARG 457.A NE ASN 431.A O no hydrogen 3.455 N/A ARG 457.A NH1 ASN 431.A O no hydrogen 3.029 N/A SER 458.A OG ASP 456.A OD1 no hydrogen 3.094 N/A SER 458.A OG ASP 456.A OD2 no hydrogen 3.002 N/A LEU 459.A N ASP 456.A O no hydrogen 3.096 N/A VAL 463.A N LEU 460.A O no hydrogen 2.935 N/A GLN 466.A N SER 464.A OG no hydrogen 3.073 N/A GLN 466.A NE2 GLU 470.A OE1 no hydrogen 2.964 N/A GLN 467.A N SER 464.A OG no hydrogen 3.235 N/A LEU 468.A N SER 464.A O no hydrogen 2.993 N/A LEU 469.A N GLU 465.A O no hydrogen 3.019 N/A LEU 469.A N GLN 466.A O no hydrogen 3.171 N/A GLU 470.A N GLN 466.A O no hydrogen 2.750 N/A ASP 471.A N GLN 467.A O no hydrogen 2.887 N/A CYS 472.A N GLN 467.A O no hydrogen 3.249 N/A CYS 472.A SG GLN 467.A O no hydrogen 3.593 N/A ILE 474.A N LEU 468.A O no hydrogen 2.952 N/A HIS 479.A N LEU 476.A O no hydrogen 2.776 N/A HIS 479.A ND1 TYR 446.A OH no hydrogen 2.652 N/A ARG 480.A N LEU 476.A O no hydrogen 2.919 N/A ARG 480.A NE ILE 474.A O no hydrogen 2.900 N/A ARG 480.A NH2 HIS 475.A O no hydrogen 2.729 N/A ALA 481.A N GLY 477.A O no hydrogen 3.007 N/A ARG 482.A N HIS 479.A O no hydrogen 2.865 N/A ILE 483.A N HIS 479.A O no hydrogen 3.006 N/A ILE 483.A N ARG 480.A O no hydrogen 3.272 N/A LEU 484.A N ARG 480.A O no hydrogen 3.086 N/A THR 485.A N ALA 481.A O no hydrogen 3.158 N/A THR 485.A OG1 ALA 481.A O no hydrogen 2.757 N/A ALA 486.A N ARG 482.A O no hydrogen 3.088 N/A ALA 487.A N ILE 483.A O no hydrogen 2.978 N/A ARG 488.A N LEU 484.A O no hydrogen 3.165 N/A ARG 488.A NH1 HIS 461.A O no hydrogen 2.997 N/A GLU 489.A N ALA 486.A O no hydrogen 3.085 N/A MET 490.A N ALA 486.A O no hydrogen 3.350 N/A MET 490.A N ALA 487.A O no hydrogen 3.121 N/A SER 493.A N GLU 489.A O no hydrogen 2.880 N/A CYS 497.A SG THR 498.A O no hydrogen 3.823 N/A SER 503.A OG LYS 501.A O no hydrogen 3.096 N/A ASP 508.A N SER 535.A O no hydrogen 2.827 N/A VAL 509.A N SER 535.A O no hydrogen 2.908 N/A PHE 510.A N ASN 561.A O no hydrogen 2.978 N/A ILE 511.A N PHE 537.A O no hydrogen 2.937 N/A SER 512.A N VAL 563.A O no hydrogen 2.735 N/A TYR 513.A OH ASP 539.A O no hydrogen 2.829 N/A ARG 514.A NH2 ALA 570.A O no hydrogen 2.865 N/A ARG 514.A NH2 ASP 582.A OD2 no hydrogen 3.359 N/A GLY 518.A N ARG 514.A O no hydrogen 2.878 N/A SER 519.A OG ASN 516.A O no hydrogen 3.009 N/A ALA 522.A N GLY 518.A O no hydrogen 2.813 N/A SER 523.A N SER 519.A O no hydrogen 2.968 N/A SER 523.A OG GLN 520.A O no hydrogen 2.691 N/A LEU 524.A N GLN 520.A O no hydrogen 3.053 N/A LEU 525.A N LEU 521.A O no hydrogen 2.840 N/A LYS 526.A N ALA 522.A O no hydrogen 2.824 N/A LYS 526.A NZ GLN 530.A OE1 no hydrogen 3.361 N/A VAL 527.A N SER 523.A O no hydrogen 3.100 N/A HIS 528.A N LEU 524.A O no hydrogen 3.016 N/A HIS 528.A NE2 GLN 633.A OE1 no hydrogen 3.153 N/A LEU 529.A N LEU 525.A O no hydrogen 2.992 N/A GLN 530.A N LYS 526.A O no hydrogen 2.927 N/A LEU 531.A N VAL 527.A O no hydrogen 2.827 N/A HIS 532.A N HIS 528.A O no hydrogen 3.138 N/A HIS 532.A N LEU 529.A O no hydrogen 2.965 N/A HIS 532.A NE2 GLU 634.A OE2 no hydrogen 2.948 N/A GLY 533.A N GLN 530.A O no hydrogen 3.136 N/A SER 535.A N ASP 508.A OD2 no hydrogen 3.240 N/A SER 535.A OG ASP 508.A OD2 no hydrogen 3.245 N/A PHE 537.A N VAL 509.A O no hydrogen 2.851 N/A SER 555.A N LYS 551.A O no hydrogen 2.908 N/A SER 555.A OG LYS 551.A O no hydrogen 2.879 N/A VAL 556.A N LEU 552.A O no hydrogen 3.201 N/A MET 557.A N ILE 553.A O no hydrogen 3.237 N/A GLY 558.A N SER 555.A O no hydrogen 3.106 N/A ALA 559.A N SER 555.A O no hydrogen 3.027 N/A ALA 559.A N VAL 556.A O no hydrogen 3.038 N/A ARG 560.A NH1 ASP 508.A OD1 no hydrogen 3.043 N/A ARG 560.A NH2 GLN 645.A O no hydrogen 2.859 N/A ASN 561.A N ASP 508.A O no hydrogen 2.869 N/A ASN 561.A ND2 ASP 508.A O no hydrogen 2.536 N/A ASN 561.A ND2 GLN 645.A O no hydrogen 3.386 N/A PHE 562.A N ASN 597.A O no hydrogen 2.641 N/A VAL 563.A N PHE 510.A O no hydrogen 2.781 N/A LEU 564.A N VAL 599.A O no hydrogen 3.019 N/A VAL 565.A N SER 512.A O no hydrogen 2.882 N/A LEU 566.A N ILE 601.A O no hydrogen 3.154 N/A SER 567.A OG VAL 565.A O no hydrogen 3.404 N/A CYS 574.A SG ASP 582.A OD2 no hydrogen 3.193 N/A GLN 576.A N VAL 612.A O no hydrogen 2.813 N/A ASP 577.A N CYS 574.A O no hydrogen 3.251 N/A CYS 580.A N ASP 577.A O no hydrogen 2.725 N/A LYS 581.A N ASP 577.A OD2 no hydrogen 2.695 N/A ASP 582.A N ASP 577.A OD2 no hydrogen 3.136 N/A HIS 585.A NE2 ASP 616.A OD1 no hydrogen 3.019 N/A LYS 586.A N ASP 582.A O no hydrogen 3.025 N/A GLN 587.A N TRP 583.A O no hydrogen 2.769 N/A ILE 588.A N VAL 584.A O no hydrogen 2.888 N/A VAL 589.A N HIS 585.A O no hydrogen 2.910 N/A THR 590.A N LYS 586.A O no hydrogen 2.805 N/A THR 590.A OG1 LYS 586.A O no hydrogen 2.900 N/A ALA 591.A N GLN 587.A O no hydrogen 2.944 N/A LEU 592.A N ILE 588.A O no hydrogen 2.827 N/A SER 593.A N VAL 589.A O no hydrogen 2.885 N/A SER 593.A OG VAL 589.A O no hydrogen 2.635 N/A CYS 594.A N THR 590.A O no hydrogen 3.101 N/A CYS 594.A SG THR 590.A O no hydrogen 3.064 N/A GLY 595.A N LEU 592.A O no hydrogen 2.954 N/A LYS 596.A N ALA 591.A O no hydrogen 2.955 N/A LYS 596.A NZ MET 557.A O no hydrogen 2.976 N/A LYS 596.A NZ ALA 559.A O no hydrogen 3.269 N/A ASN 597.A N ARG 560.A O no hydrogen 3.367 N/A ASN 597.A ND2 ASN 561.A OD1 no hydrogen 3.227 N/A ASN 597.A ND2 PHE 643.A O no hydrogen 3.132 N/A VAL 599.A N PHE 562.A O no hydrogen 2.895 N/A ILE 601.A N LEU 564.A O no hydrogen 2.706 N/A ASP 603.A N LEU 566.A O no hydrogen 2.876 N/A GLN 611.A N GLN 611.A OE1 no hydrogen 3.073 N/A GLN 611.A NE2 GLU 609.A OE1 no hydrogen 3.297 N/A VAL 612.A N GLU 609.A O no hydrogen 3.064 N/A LEU 613.A N PRO 610.A O no hydrogen 2.887 N/A MET 617.A N PRO 614.A O no hydrogen 2.940 N/A GLN 618.A N GLU 615.A O no hydrogen 3.290 N/A GLN 618.A NE2 LEU 613.A O no hydrogen 2.738 N/A VAL 620.A N MET 617.A O no hydrogen 3.193 N/A LEU 621.A N GLN 618.A O no hydrogen 3.239 N/A THR 622.A N ALA 619.A O no hydrogen 3.061 N/A THR 622.A OG1 ALA 619.A O no hydrogen 2.735 N/A PHE 623.A N VAL 620.A O no hydrogen 3.469 N/A ILE 626.A N PRO 600.A O no hydrogen 2.980 N/A TRP 628.A N ILE 602.A O no hydrogen 3.150 N/A SER 629.A N THR 636.A OG1 no hydrogen 3.357 N/A TYR 632.A N SER 629.A OG no hydrogen 3.090 N/A GLN 633.A NE2 HIS 630.A O no hydrogen 2.953 N/A THR 636.A N TYR 632.A O no hydrogen 2.926 N/A THR 636.A OG1 TYR 632.A O no hydrogen 3.114 N/A ILE 637.A N GLN 633.A O no hydrogen 2.922 N/A GLU 638.A N GLU 634.A O no hydrogen 3.019 N/A GLU 638.A N ALA 635.A O no hydrogen 3.035 N/A LYS 639.A N ALA 635.A O no hydrogen 3.230 N/A ILE 640.A N THR 636.A O no hydrogen 3.064 N/A ILE 641.A N ILE 637.A O no hydrogen 2.953 N/A ARG 642.A N GLU 638.A O no hydrogen 3.090 N/A PHE 643.A N ILE 640.A O no hydrogen 3.096 N/A LEU 644.A N ILE 641.A O no hydrogen 3.150 N/A GLN 645.A N ASN 561.A OD1 no hydrogen 2.651 N/A