Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 7dr1_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 1.A N ALA 12.A O no hydrogen 3.175 N/A THR 2.A N ALA 12.A O no hydrogen 3.243 N/A PHE 4.A N THR 2.A OG1 no hydrogen 3.370 N/A GLN 9.A N ASP 34.A OD1 no hydrogen 2.762 N/A ALA 12.A N SER 8.A O no hydrogen 3.128 N/A GLN 13.A N ALA 10.A O no hydrogen 3.425 N/A ASP 14.A N LEU 11.A O no hydrogen 2.973 N/A THR 16.A OG1 ASP 14.A OD1 no hydrogen 3.378 N/A THR 16.A OG1 ASP 14.A OD2 no hydrogen 2.781 N/A THR 17.A N LYS 669.A O no hydrogen 2.954 N/A THR 17.A OG1 LYS 669.A O no hydrogen 2.641 N/A ARG 18.A N THR 16.A OG1 no hydrogen 3.409 N/A ARG 19.A N THR 16.A O no hydrogen 3.468 N/A ARG 19.A NH1 PHE 4.A O no hydrogen 2.746 N/A TYR 22.A N ARG 18.A O no hydrogen 2.923 N/A GLY 23.A N ARG 19.A O no hydrogen 2.729 N/A ILE 24.A N ILE 20.A O no hydrogen 2.932 N/A ALA 25.A N TRP 21.A O no hydrogen 3.004 N/A THR 26.A N TYR 22.A O no hydrogen 2.784 N/A THR 26.A OG1 TYR 22.A O no hydrogen 2.784 N/A THR 32.A N ASP 29.A O no hydrogen 3.098 N/A THR 32.A OG1 ASP 29.A O no hydrogen 2.879 N/A THR 32.A OG1 ASP 29.A OD1 no hydrogen 2.951 N/A ASN 33.A N PHE 30.A O no hydrogen 3.188 N/A ASN 40.A N THR 37.A OG1 no hydrogen 3.310 N/A LEU 41.A N THR 37.A O no hydrogen 2.928 N/A TYR 42.A N GLU 38.A O no hydrogen 3.329 N/A GLN 43.A N GLU 39.A O no hydrogen 3.501 N/A GLN 43.A NE2 PRO 162.A O no hydrogen 2.526 N/A LYS 44.A N ASN 40.A O no hydrogen 3.306 N/A ILE 45.A N LEU 41.A O no hydrogen 3.126 N/A PHE 46.A N TYR 42.A O no hydrogen 3.103 N/A ALA 47.A N GLN 43.A O no hydrogen 3.207 N/A SER 48.A N LYS 44.A O no hydrogen 2.937 N/A SER 48.A OG LYS 44.A O no hydrogen 2.848 N/A HIS 49.A N ILE 45.A O no hydrogen 2.938 N/A PHE 50.A N PHE 46.A O no hydrogen 3.263 N/A GLY 51.A N ALA 47.A O no hydrogen 3.257 N/A HIS 52.A N SER 48.A O no hydrogen 3.047 N/A LEU 53.A N HIS 49.A O no hydrogen 2.948 N/A ALA 54.A N PHE 50.A O no hydrogen 3.029 N/A ILE 55.A N GLY 51.A O no hydrogen 3.219 N/A ILE 56.A N HIS 52.A O no hydrogen 3.110 N/A PHE 57.A N LEU 53.A O no hydrogen 2.955 N/A LEU 58.A N ALA 54.A O no hydrogen 2.762 N/A TRP 59.A N ILE 55.A O no hydrogen 2.816 N/A THR 60.A N ILE 56.A O no hydrogen 3.132 N/A SER 61.A N PHE 57.A O no hydrogen 2.977 N/A SER 61.A OG LEU 58.A O no hydrogen 2.629 N/A GLY 62.A N LEU 58.A O no hydrogen 2.805 N/A ASN 63.A N TRP 59.A O no hydrogen 3.041 N/A LEU 64.A N THR 60.A O no hydrogen 3.125 N/A PHE 65.A N SER 61.A O no hydrogen 2.836 N/A HIS 66.A N GLY 62.A O no hydrogen 3.148 N/A HIS 66.A ND1 GLN 70.A OE1 no hydrogen 2.894 N/A VAL 67.A N ASN 63.A O no hydrogen 3.195 N/A ALA 68.A N LEU 64.A O no hydrogen 2.917 N/A TRP 69.A N PHE 65.A O no hydrogen 2.903 N/A GLN 70.A N HIS 66.A O no hydrogen 2.762 N/A GLY 71.A N VAL 67.A O no hydrogen 2.792 N/A ASN 72.A N TYR 120.A OH no hydrogen 3.150 N/A ASN 72.A ND2 ARG 84.A O no hydrogen 2.713 N/A GLN 75.A N GLN 75.A OE1 no hydrogen 2.662 N/A TRP 76.A N ASN 72.A O no hydrogen 2.703 N/A VAL 77.A N PHE 73.A O no hydrogen 2.905 N/A THR 83.A N ASP 79.A O no hydrogen 3.257 N/A THR 83.A OG1 ASP 79.A O no hydrogen 2.650 N/A ARG 84.A NH1 ASP 334.A OD2 no hydrogen 2.413 N/A ARG 84.A NH2 LEU 81.A O no hydrogen 3.141 N/A ILE 86.A N ASN 72.A OD1 no hydrogen 2.990 N/A ALA 87.A N ASN 113.A O no hydrogen 2.676 N/A HIS 88.A ND1 ALA 89.A O no hydrogen 2.877 N/A ALA 89.A N GLN 70.A OE1 no hydrogen 3.074 N/A ILE 90.A N PRO 111.A O no hydrogen 2.768 N/A HIS 94.A N ASP 92.A OD1 no hydrogen 3.132 N/A HIS 94.A ND1 ASP 92.A OD1 no hydrogen 2.421 N/A PHE 95.A N ASP 92.A O no hydrogen 3.154 N/A GLN 97.A NE2 GLU 101.A OE2 no hydrogen 2.804 N/A ARG 98.A NH1 ARG 98.A O no hydrogen 2.928 N/A ILE 100.A N GLY 96.A O no hydrogen 3.206 N/A GLU 101.A N GLN 97.A O no hydrogen 3.188 N/A ALA 102.A N ARG 98.A O no hydrogen 3.134 N/A PHE 103.A N ALA 99.A O no hydrogen 3.261 N/A SER 104.A N ILE 100.A O no hydrogen 3.069 N/A SER 104.A OG GLU 101.A O no hydrogen 3.543 N/A SER 104.A OG SER 104.A O no hydrogen 2.336 N/A GLN 105.A NE2 VAL 112.A O no hydrogen 3.187 N/A ALA 108.A N GLN 105.A O no hydrogen 2.933 N/A SER 110.A OG PRO 111.A O no hydrogen 3.534 N/A VAL 112.A N PHE 103.A O no hydrogen 3.012 N/A ASN 113.A N HIS 88.A O no hydrogen 3.043 N/A SER 115.A N PRO 85.A O no hydrogen 2.413 N/A TYR 120.A OH ASN 72.A OD1 no hydrogen 3.255 N/A TYR 120.A OH ILE 86.A O no hydrogen 2.407 N/A TRP 122.A N GLY 118.A O no hydrogen 3.171 N/A TRP 123.A N VAL 119.A O no hydrogen 2.986 N/A TYR 124.A N TYR 120.A O no hydrogen 3.075 N/A THR 125.A OG1 GLN 121.A O no hydrogen 3.368 N/A THR 125.A OG1 TRP 122.A O no hydrogen 2.580 N/A GLN 126.A N TRP 122.A O no hydrogen 3.473 N/A GLY 127.A N TYR 124.A O no hydrogen 2.965 N/A MET 128.A N TRP 123.A O no hydrogen 3.230 N/A ARG 129.A N GLU 133.A OE1 no hydrogen 2.855 N/A ARG 129.A NH1 TYR 124.A O no hydrogen 2.636 N/A ARG 129.A NH1 MET 128.A O no hydrogen 2.706 N/A ARG 129.A NH2 GLU 200.A O no hydrogen 3.248 N/A THR 130.A N GLU 133.A OE1 no hydrogen 3.483 N/A ASN 131.A ND2 ALA 68.A O no hydrogen 2.590 N/A GLU 133.A N THR 130.A O no hydrogen 3.278 N/A TYR 135.A N ASN 131.A O no hydrogen 3.017 N/A ASN 136.A N GLU 132.A O no hydrogen 3.246 N/A GLY 137.A N GLU 133.A O no hydrogen 3.385 N/A GLY 137.A N LEU 134.A O no hydrogen 3.011 N/A ALA 138.A N LEU 134.A O no hydrogen 3.230 N/A ILE 139.A N TYR 135.A O no hydrogen 3.167 N/A PHE 140.A N ASN 136.A O no hydrogen 3.391 N/A LEU 141.A N GLY 137.A O no hydrogen 3.065 N/A LEU 142.A N ALA 138.A O no hydrogen 3.108 N/A ILE 143.A N ILE 139.A O no hydrogen 3.237 N/A LEU 144.A N PHE 140.A O no hydrogen 3.058 N/A SER 145.A N LEU 141.A O no hydrogen 2.898 N/A SER 145.A OG LEU 141.A O no hydrogen 3.321 N/A SER 145.A OG LEU 142.A O no hydrogen 2.525 N/A ALA 146.A N LEU 142.A O no hydrogen 2.998 N/A LEU 147.A N ILE 143.A O no hydrogen 2.470 N/A SER 148.A N LEU 144.A O no hydrogen 2.725 N/A SER 148.A OG LEU 144.A O no hydrogen 2.697 N/A LEU 149.A N SER 145.A O no hydrogen 2.662 N/A PHE 150.A N ALA 146.A O no hydrogen 3.040 N/A ALA 151.A N LEU 147.A O no hydrogen 3.275 N/A GLY 152.A N SER 148.A O no hydrogen 3.099 N/A TRP 153.A N LEU 149.A O no hydrogen 3.256 N/A LEU 154.A N PHE 150.A O no hydrogen 2.692 N/A HIS 155.A N ALA 151.A O no hydrogen 2.837 N/A LEU 156.A N TRP 153.A O no hydrogen 3.230 N/A GLN 157.A N LEU 154.A O no hydrogen 3.063 N/A GLN 157.A NE2 TRP 153.A O no hydrogen 2.794 N/A PHE 160.A N GLN 157.A O no hydrogen 2.815 N/A ARG 161.A N PRO 158.A O no hydrogen 3.498 N/A ARG 161.A NE LEU 156.A O no hydrogen 3.317 N/A LEU 164.A N ASN 163.A OD1 no hydrogen 2.676 N/A PHE 167.A N LEU 164.A O no hydrogen 3.129 N/A LYS 168.A N LEU 164.A O no hydrogen 3.318 N/A LYS 168.A NZ ASN 298.A OD1 no hydrogen 3.025 N/A ASN 169.A N TRP 166.A O no hydrogen 3.417 N/A GLU 171.A N GLU 171.A OE2 no hydrogen 2.709 N/A SER 172.A OG ASN 169.A OD1 no hydrogen 2.764 N/A ARG 173.A NH1 PHE 167.A O no hydrogen 2.469 N/A LEU 174.A N ALA 170.A O no hydrogen 3.162 N/A ASN 175.A N GLU 171.A O no hydrogen 3.369 N/A ASN 175.A ND2 TYR 290.A O no hydrogen 3.160 N/A HIS 176.A N SER 172.A O no hydrogen 3.111 N/A HIS 176.A ND1 SER 172.A O no hydrogen 2.817 N/A HIS 177.A N ARG 173.A O no hydrogen 2.822 N/A LEU 178.A N LEU 174.A O no hydrogen 2.934 N/A GLY 179.A N ASN 175.A O no hydrogen 2.906 N/A GLY 180.A N HIS 176.A O no hydrogen 2.752 N/A LEU 181.A N HIS 176.A O no hydrogen 3.395 N/A PHE 182.A N HIS 177.A O no hydrogen 2.599 N/A GLY 183.A N LEU 178.A O no hydrogen 2.762 N/A THR 184.A N GLY 179.A O no hydrogen 2.842 N/A THR 184.A OG1 GLY 180.A O no hydrogen 2.564 N/A SER 185.A N GLY 180.A O no hydrogen 3.230 N/A SER 185.A OG LEU 181.A O no hydrogen 3.153 N/A SER 186.A N PHE 182.A O no hydrogen 3.001 N/A SER 186.A OG HIS 276.A O no hydrogen 2.997 N/A LEU 187.A N GLY 183.A O no hydrogen 2.808 N/A ALA 188.A N THR 184.A O no hydrogen 2.768 N/A TRP 189.A N SER 185.A O no hydrogen 2.842 N/A THR 190.A N SER 186.A O no hydrogen 3.003 N/A THR 190.A OG1 SER 186.A O no hydrogen 2.896 N/A GLY 191.A N LEU 187.A O no hydrogen 3.153 N/A HIS 192.A N ALA 188.A O no hydrogen 3.055 N/A HIS 192.A NE2 GLN 126.A O no hydrogen 2.766 N/A ILE 193.A N TRP 189.A O no hydrogen 3.200 N/A ILE 193.A N THR 190.A O no hydrogen 3.251 N/A VAL 194.A N THR 190.A O no hydrogen 3.126 N/A HIS 195.A N GLY 191.A O no hydrogen 3.184 N/A VAL 196.A N HIS 192.A O no hydrogen 2.885 N/A ALA 197.A N HIS 192.A O no hydrogen 3.220 N/A ILE 198.A N ILE 193.A O no hydrogen 2.775 N/A GLU 200.A N VAL 196.A O no hydrogen 2.883 N/A SER 201.A N ALA 197.A O no hydrogen 3.091 N/A SER 201.A N ILE 198.A O no hydrogen 3.228 N/A SER 201.A OG ALA 197.A O no hydrogen 3.503 N/A SER 201.A OG ILE 198.A O no hydrogen 2.641 N/A ARG 202.A N PRO 199.A O no hydrogen 3.060 N/A ARG 202.A NE ASP 237.A OD1 no hydrogen 3.334 N/A ARG 202.A NH1 ALA 252.A O no hydrogen 2.724 N/A ARG 202.A NH2 ASP 237.A OD1 no hydrogen 3.069 N/A ARG 202.A NH2 ALA 252.A O no hydrogen 3.101 N/A GLY 203.A N GLU 200.A O no hydrogen 3.452 N/A GLN 204.A N PRO 199.A O no hydrogen 3.028 N/A VAL 206.A N GLU 200.A OE2 no hydrogen 3.313 N/A GLY 207.A N ASN 210.A OD1 no hydrogen 2.777 N/A ASN 210.A N GLY 207.A O no hydrogen 3.259 N/A ASN 210.A ND2 HIS 205.A O no hydrogen 3.267 N/A PHE 211.A N GLY 207.A O no hydrogen 2.930 N/A GLN 213.A N ASN 210.A O no hydrogen 2.826 N/A VAL 214.A N ASN 210.A O no hydrogen 3.411 N/A GLY 220.A N HIS 217.A O no hydrogen 3.352 N/A LEU 221.A N TYR 232.A OH no hydrogen 3.226 N/A GLN 222.A N GLN 222.A OE1 no hydrogen 2.686 N/A THR 226.A N GLN 222.A O no hydrogen 3.369 N/A THR 226.A OG1 GLN 222.A O no hydrogen 2.793 N/A TRP 229.A NE1 PHE 224.A O no hydrogen 2.745 N/A VAL 231.A N ASN 228.A O no hydrogen 3.490 N/A TYR 232.A N TRP 229.A O no hydrogen 3.340 N/A THR 233.A N GLY 230.A O no hydrogen 3.149 N/A THR 233.A OG1 GLY 230.A O no hydrogen 2.485 N/A GLU 234.A N VAL 231.A O no hydrogen 3.227 N/A THR 238.A N GLY 248.A O no hydrogen 3.468 N/A HIS 241.A N THR 238.A O no hydrogen 3.093 N/A HIS 241.A NE2 SER 245.A O no hydrogen 3.273 N/A GLY 244.A N SER 201.A O no hydrogen 2.969 N/A SER 245.A OG VAL 242.A O no hydrogen 3.146 N/A SER 246.A OG ARG 202.A O no hydrogen 2.627 N/A ALA 249.A N SER 246.A O no hydrogen 3.416 N/A GLY 250.A N ASP 237.A OD1 no hydrogen 2.879 N/A THR 251.A N ASN 235.A O no hydrogen 3.400 N/A THR 251.A OG1 ASN 235.A OD1 no hydrogen 3.364 N/A ILE 253.A N TYR 232.A O no hydrogen 3.390 N/A PHE 256.A N THR 255.A OG1 no hydrogen 2.560 N/A GLY 258.A N ASP 271.A OD1 no hydrogen 2.811 N/A HIS 261.A N SER 266.A O no hydrogen 2.558 N/A GLN 265.A N HIS 261.A O no hydrogen 3.011 N/A GLN 265.A NE2 ASN 478.A O no hydrogen 3.427 N/A SER 266.A OG PRO 326.A O no hydrogen 2.483 N/A LEU 267.A N PRO 326.A O no hydrogen 3.074 N/A ILE 272.A N TRP 268.A O no hydrogen 3.082 N/A ALA 273.A N LEU 269.A O no hydrogen 3.077 N/A HIS 274.A N THR 270.A O no hydrogen 3.453 N/A HIS 274.A ND1 THR 255.A O no hydrogen 3.149 N/A HIS 275.A N ASP 271.A O no hydrogen 3.427 N/A HIS 276.A N ILE 272.A O no hydrogen 3.348 N/A HIS 276.A ND1 ILE 272.A O no hydrogen 3.015 N/A LEU 277.A N ALA 273.A O no hydrogen 3.185 N/A ALA 278.A N HIS 274.A O no hydrogen 2.995 N/A ILE 279.A N HIS 275.A O no hydrogen 2.925 N/A ALA 280.A N HIS 276.A O no hydrogen 2.888 N/A VAL 281.A N LEU 277.A O no hydrogen 3.240 N/A LEU 282.A N ALA 278.A O no hydrogen 3.164 N/A PHE 283.A N ILE 279.A O no hydrogen 3.117 N/A ILE 284.A N ALA 280.A O no hydrogen 2.949 N/A VAL 285.A N VAL 281.A O no hydrogen 2.971 N/A ALA 286.A N LEU 282.A O no hydrogen 3.120 N/A GLY 287.A N PHE 283.A O no hydrogen 2.880 N/A HIS 288.A N VAL 285.A O no hydrogen 3.229 N/A HIS 288.A ND1 ILE 284.A O no hydrogen 2.652 N/A TYR 290.A N ASN 175.A OD1 no hydrogen 3.126 N/A THR 295.A N LEU 292.A O no hydrogen 2.965 N/A THR 295.A OG1 LEU 292.A O no hydrogen 2.530 N/A VAL 296.A N LEU 292.A O no hydrogen 3.147 N/A ASN 297.A N ASP 294.A O no hydrogen 2.974 N/A ASN 297.A ND2 LYS 168.A O no hydrogen 3.215 N/A ASN 298.A N ASP 294.A O no hydrogen 3.061 N/A SER 299.A OG ASP 367.A OD2 no hydrogen 2.728 N/A HIS 301.A ND1 HIS 359.A ND1 no hydrogen 3.156 N/A PHE 302.A N SER 299.A OG no hydrogen 3.155 N/A GLN 303.A N SER 299.A O no hydrogen 3.435 N/A GLN 303.A NE2 VAL 296.A O no hydrogen 3.318 N/A GLN 303.A NE2 SER 299.A O no hydrogen 3.291 N/A LEU 304.A N LEU 300.A O no hydrogen 3.034 N/A GLY 305.A N HIS 301.A O no hydrogen 2.941 N/A LEU 306.A N PHE 302.A O no hydrogen 3.062 N/A ALA 307.A N GLN 303.A O no hydrogen 2.763 N/A LEU 308.A N LEU 304.A O no hydrogen 2.649 N/A ALA 309.A N GLY 305.A O no hydrogen 2.985 N/A ALA 310.A N LEU 306.A O no hydrogen 2.818 N/A LEU 311.A N ALA 307.A O no hydrogen 2.962 N/A GLY 312.A N LEU 308.A O no hydrogen 2.637 N/A VAL 313.A N ALA 309.A O no hydrogen 2.972 N/A ILE 314.A N ALA 310.A O no hydrogen 3.326 N/A THR 315.A OG1 LEU 311.A O no hydrogen 2.468 N/A SER 316.A N GLY 312.A O no hydrogen 3.401 N/A SER 316.A OG GLY 312.A O no hydrogen 2.937 N/A LEU 317.A N VAL 313.A O no hydrogen 3.112 N/A VAL 318.A N ILE 314.A O no hydrogen 3.110 N/A ALA 319.A N THR 315.A O no hydrogen 3.422 N/A GLN 320.A N SER 316.A O no hydrogen 2.979 N/A HIS 321.A N LEU 317.A O no hydrogen 2.989 N/A HIS 321.A ND1 LEU 317.A O no hydrogen 2.785 N/A MET 322.A N VAL 318.A O no hydrogen 2.999 N/A SER 324.A OG GLN 320.A O no hydrogen 3.031 N/A ILE 325.A N HIS 321.A O no hydrogen 2.939 N/A TYR 330.A N THR 264.A O no hydrogen 3.376 N/A LEU 331.A N TYR 328.A O no hydrogen 3.248 N/A ARG 333.A NE GLN 265.A OE1 no hydrogen 2.559 N/A THR 337.A OG1 TYR 116.A O no hydrogen 2.819 N/A ALA 339.A N PHE 335.A O no hydrogen 3.031 N/A ALA 340.A N THR 336.A O no hydrogen 2.829 N/A LEU 341.A N THR 337.A O no hydrogen 2.768 N/A TYR 342.A N GLN 338.A O no hydrogen 3.317 N/A THR 343.A N ALA 339.A O no hydrogen 3.293 N/A THR 343.A OG1 ALA 339.A O no hydrogen 2.869 N/A HIS 344.A N ALA 340.A O no hydrogen 2.931 N/A HIS 345.A N LEU 341.A O no hydrogen 3.383 N/A HIS 345.A ND1 LEU 341.A O no hydrogen 3.187 N/A GLN 346.A N TYR 342.A O no hydrogen 3.020 N/A TYR 347.A N THR 343.A O no hydrogen 3.020 N/A ILE 348.A N HIS 344.A O no hydrogen 3.145 N/A ALA 349.A N HIS 345.A O no hydrogen 3.048 N/A GLY 350.A N GLN 346.A O no hydrogen 3.034 N/A PHE 351.A N TYR 347.A O no hydrogen 3.039 N/A LEU 352.A N ILE 348.A O no hydrogen 2.870 N/A MET 353.A N ALA 349.A O no hydrogen 2.960 N/A VAL 354.A N GLY 350.A O no hydrogen 3.055 N/A GLY 355.A N PHE 351.A O no hydrogen 2.755 N/A ALA 356.A N LEU 352.A O no hydrogen 2.714 N/A PHE 357.A N MET 353.A O no hydrogen 3.426 N/A ALA 358.A N VAL 354.A O no hydrogen 3.042 N/A HIS 359.A N GLY 355.A O no hydrogen 2.995 N/A HIS 359.A ND1 HIS 301.A ND1 no hydrogen 3.156 N/A GLY 360.A N ALA 356.A O no hydrogen 3.185 N/A ALA 361.A N PHE 357.A O no hydrogen 3.135 N/A ILE 362.A N ALA 358.A O no hydrogen 3.107 N/A PHE 363.A N HIS 359.A O no hydrogen 3.093 N/A LEU 364.A N GLY 360.A O no hydrogen 3.191 N/A VAL 365.A N ALA 361.A O no hydrogen 3.361 N/A ARG 366.A N ILE 362.A O no hydrogen 2.997 N/A ASP 367.A N PHE 363.A O no hydrogen 2.797 N/A TYR 368.A N PHE 363.A O no hydrogen 2.634 N/A ARG 380.A N ASN 376.A O no hydrogen 3.005 N/A ILE 381.A N VAL 377.A O no hydrogen 3.184 N/A ILE 381.A N LEU 378.A O no hydrogen 3.208 N/A ILE 382.A N LEU 378.A O no hydrogen 3.379 N/A ASP 383.A N ARG 380.A O no hydrogen 3.183 N/A HIS 384.A N ARG 380.A O no hydrogen 3.343 N/A HIS 384.A ND1 ARG 380.A O no hydrogen 2.606 N/A LYS 385.A N ILE 382.A O no hydrogen 3.428 N/A LYS 385.A NZ LEU 512.A O no hydrogen 2.970 N/A LYS 385.A NZ GLY 516.A O no hydrogen 2.946 N/A GLU 386.A N GLU 386.A OE1 no hydrogen 3.279 N/A ALA 387.A N HIS 384.A O no hydrogen 3.056 N/A ILE 388.A N HIS 384.A O no hydrogen 3.319 N/A ILE 389.A N LYS 385.A O no hydrogen 3.104 N/A SER 390.A N GLU 386.A O no hydrogen 3.004 N/A HIS 391.A N ALA 387.A O no hydrogen 2.987 N/A HIS 391.A ND1 ALA 387.A O no hydrogen 2.741 N/A LEU 392.A N ILE 388.A O no hydrogen 2.962 N/A SER 393.A N ILE 389.A O no hydrogen 2.784 N/A TRP 394.A N SER 390.A O no hydrogen 2.953 N/A VAL 395.A N HIS 391.A O no hydrogen 3.052 N/A SER 396.A N LEU 392.A O no hydrogen 3.320 N/A SER 396.A OG LEU 392.A O no hydrogen 2.973 N/A SER 396.A OG THR 502.A OG1 no hydrogen 3.319 N/A LEU 397.A N SER 393.A O no hydrogen 3.153 N/A PHE 398.A N TRP 394.A O no hydrogen 2.671 N/A LEU 399.A N VAL 395.A O no hydrogen 2.873 N/A GLY 400.A N SER 396.A O no hydrogen 2.793 N/A PHE 401.A N LEU 397.A O no hydrogen 2.972 N/A HIS 402.A ND1 PHE 398.A O no hydrogen 2.806 N/A THR 403.A N LEU 399.A O no hydrogen 2.930 N/A THR 403.A OG1 LEU 491.A O no hydrogen 3.503 N/A LEU 404.A N GLY 400.A O no hydrogen 3.189 N/A GLY 405.A N PHE 401.A O no hydrogen 3.074 N/A LEU 406.A N HIS 402.A O no hydrogen 2.921 N/A TYR 407.A N THR 403.A O no hydrogen 3.145 N/A VAL 408.A N LEU 404.A O no hydrogen 2.793 N/A HIS 409.A N GLY 405.A O no hydrogen 2.824 N/A HIS 409.A NE2 LYS 421.A O no hydrogen 3.274 N/A ASN 410.A N LEU 406.A O no hydrogen 2.856 N/A ASN 410.A ND2 ILE 423.A O no hydrogen 3.579 N/A ASN 410.A ND2 THR 587.A O no hydrogen 2.773 N/A ASP 411.A N TYR 407.A O no hydrogen 2.876 N/A VAL 412.A N VAL 408.A O no hydrogen 3.110 N/A VAL 413.A N HIS 409.A O no hydrogen 3.100 N/A GLN 414.A N ASN 410.A O no hydrogen 2.770 N/A ALA 415.A N ASP 411.A O no hydrogen 2.845 N/A PHE 416.A N VAL 412.A O no hydrogen 2.949 N/A GLY 417.A N GLN 414.A O no hydrogen 3.317 N/A THR 418.A N VAL 413.A O no hydrogen 3.209 N/A THR 418.A OG1 VAL 413.A O no hydrogen 2.862 N/A LYS 421.A N THR 418.A O no hydrogen 3.240 N/A GLN 422.A N PRO 419.A O no hydrogen 3.258 N/A GLN 422.A NE2 PRO 419.A O no hydrogen 3.169 N/A ILE 423.A N ASN 410.A OD1 no hydrogen 3.161 N/A VAL 428.A N GLU 426.A O no hydrogen 2.737 N/A GLN 431.A N PRO 427.A O no hydrogen 2.809 N/A GLN 431.A NE2 GLU 426.A OE1 no hydrogen 2.984 N/A GLN 431.A NE2 ILE 485.A O no hydrogen 3.469 N/A TRP 432.A N VAL 428.A O no hydrogen 2.927 N/A ILE 433.A N PHE 429.A O no hydrogen 3.330 N/A GLN 434.A N ALA 430.A O no hydrogen 3.066 N/A GLN 434.A NE2 LEU 483.A O no hydrogen 3.193 N/A SER 435.A N GLN 431.A O no hydrogen 3.227 N/A SER 435.A OG GLN 431.A O no hydrogen 3.410 N/A SER 435.A OG TRP 432.A O no hydrogen 2.372 N/A VAL 436.A N TRP 432.A O no hydrogen 2.725 N/A HIS 437.A N ILE 433.A O no hydrogen 2.737 N/A GLY 438.A N SER 435.A O no hydrogen 3.293 N/A LYS 439.A N GLN 434.A O no hydrogen 2.655 N/A LYS 439.A NZ PHE 482.A O no hydrogen 2.477 N/A LYS 439.A NZ THR 484.A OG1 no hydrogen 3.133 N/A SER 440.A N ASN 475.A OD1 no hydrogen 3.122 N/A SER 440.A OG ASN 475.A OD1 no hydrogen 3.231 N/A ASN 450.A ND2 ASP 452.A OD2 no hydrogen 3.173 N/A SER 453.A N ASN 450.A O no hydrogen 3.336 N/A SER 453.A OG ASN 450.A O no hydrogen 3.271 N/A SER 453.A OG THR 455.A OG1 no hydrogen 3.008 N/A THR 455.A OG1 SER 453.A OG no hydrogen 3.008 N/A ARG 456.A N SER 453.A O no hydrogen 3.108 N/A ARG 456.A NH2 LEU 448.A O no hydrogen 2.457 N/A VAL 457.A N SER 453.A O no hydrogen 3.066 N/A ALA 458.A N ILE 454.A O no hydrogen 2.844 N/A ALA 462.A N ALA 458.A O no hydrogen 3.268 N/A ILE 465.A N GLN 463.A O no hydrogen 2.669 N/A LEU 467.A N PRO 464.A O no hydrogen 3.063 N/A TRP 470.A N TRP 466.A O no hydrogen 3.384 N/A TRP 470.A NE1 HIS 437.A O no hydrogen 2.794 N/A LEU 471.A N LEU 467.A O no hydrogen 3.072 N/A ASP 472.A N PRO 468.A O no hydrogen 3.290 N/A ILE 474.A N TRP 470.A O no hydrogen 3.112 N/A ASN 475.A N LEU 471.A O no hydrogen 3.252 N/A ASN 475.A ND2 GLY 438.A O no hydrogen 3.436 N/A ASN 475.A ND2 LEU 471.A O no hydrogen 2.714 N/A SER 476.A N ASP 472.A O no hydrogen 3.115 N/A SER 476.A OG ASN 478.A OD1 no hydrogen 2.360 N/A ASN 479.A ND2 ALA 473.A O no hydrogen 3.118 N/A SER 480.A OG HIS 571.A NE2 no hydrogen 3.210 N/A LEU 481.A N ASN 479.A OD1 no hydrogen 3.211 N/A ILE 485.A N TYR 442.A OH no hydrogen 3.142 N/A GLY 486.A N ASP 489.A OD2 no hydrogen 2.918 N/A PHE 490.A N GLY 486.A O no hydrogen 3.364 N/A PHE 490.A N PRO 487.A O no hydrogen 3.253 N/A LEU 491.A N PRO 487.A O no hydrogen 3.500 N/A VAL 492.A N GLY 488.A O no hydrogen 3.378 N/A HIS 493.A N ASP 489.A O no hydrogen 3.203 N/A HIS 493.A ND1 ASP 489.A O no hydrogen 2.972 N/A HIS 494.A N PHE 490.A O no hydrogen 3.323 N/A HIS 494.A N LEU 491.A O no hydrogen 3.162 N/A HIS 494.A ND1 PHE 490.A O no hydrogen 2.965 N/A ALA 495.A N LEU 491.A O no hydrogen 3.022 N/A ILE 496.A N VAL 492.A O no hydrogen 2.725 N/A ALA 497.A N HIS 493.A O no hydrogen 3.010 N/A LEU 498.A N HIS 494.A O no hydrogen 2.821 N/A GLY 499.A N ALA 495.A O no hydrogen 2.921 N/A LEU 500.A N ILE 496.A O no hydrogen 2.844 N/A HIS 501.A N ALA 497.A O no hydrogen 2.965 N/A HIS 501.A ND1 ALA 497.A O no hydrogen 2.790 N/A THR 502.A N LEU 498.A O no hydrogen 2.987 N/A THR 502.A OG1 SER 396.A OG no hydrogen 3.319 N/A THR 502.A OG1 LEU 498.A O no hydrogen 2.659 N/A THR 503.A N GLY 499.A O no hydrogen 2.958 N/A THR 503.A OG1 GLY 499.A O no hydrogen 2.733 N/A THR 503.A OG1 THR 559.A OG1 no hydrogen 3.376 N/A THR 504.A N LEU 500.A O no hydrogen 3.255 N/A THR 504.A OG1 LEU 500.A O no hydrogen 2.869 N/A LEU 505.A N HIS 501.A O no hydrogen 2.926 N/A ILE 506.A N THR 502.A O no hydrogen 3.138 N/A LEU 507.A N THR 503.A O no hydrogen 3.272 N/A VAL 508.A N THR 504.A O no hydrogen 2.633 N/A LYS 509.A N LEU 505.A O no hydrogen 2.831 N/A LYS 509.A NZ LYS 509.A O no hydrogen 3.563 N/A LYS 509.A NZ ASP 513.A OD2 no hydrogen 2.978 N/A GLY 510.A N ILE 506.A O no hydrogen 3.050 N/A ALA 511.A N LEU 507.A O no hydrogen 3.089 N/A LEU 512.A N VAL 508.A O no hydrogen 2.852 N/A ASP 513.A N LYS 509.A O no hydrogen 2.976 N/A ALA 514.A N ALA 511.A O no hydrogen 3.258 N/A ARG 515.A NE LEU 364.A O no hydrogen 3.035 N/A ARG 515.A NH2 TYR 368.A O no hydrogen 3.555 N/A SER 517.A N MET 520.A O no hydrogen 3.050 N/A LYS 523.A NZ ASP 513.A O no hydrogen 3.042 N/A LYS 523.A NZ ILE 543.A O no hydrogen 3.115 N/A LYS 524.A N ARG 515.A O no hydrogen 3.081 N/A ASP 525.A N ASP 522.A O no hydrogen 2.977 N/A PHE 526.A N LYS 523.A O no hydrogen 3.110 N/A GLY 527.A N LYS 524.A O no hydrogen 3.429 N/A PHE 530.A N SER 544.A OG no hydrogen 3.362 N/A ASP 533.A N THR 540.A OG1 no hydrogen 2.806 N/A ARG 537.A NE LEU 519.A O no hydrogen 2.836 N/A ARG 537.A NH1 ASP 533.A OD2 no hydrogen 2.758 N/A ARG 537.A NH2 LEU 519.A O no hydrogen 2.618 N/A ARG 537.A NH2 ASP 533.A OD2 no hydrogen 2.765 N/A GLY 539.A N GLY 536.A O no hydrogen 3.107 N/A THR 540.A OG1 GLY 534.A O no hydrogen 2.759 N/A SER 544.A OG PHE 530.A O no hydrogen 2.587 N/A TRP 546.A N TYR 528.A O no hydrogen 3.043 N/A ALA 548.A N SER 544.A O no hydrogen 3.382 N/A ALA 548.A N ALA 545.A O no hydrogen 3.275 N/A PHE 549.A N ALA 545.A O no hydrogen 3.379 N/A TYR 550.A N TRP 546.A O no hydrogen 3.027 N/A LEU 551.A N ASP 547.A O no hydrogen 2.968 N/A ALA 552.A N ALA 548.A O no hydrogen 3.090 N/A VAL 553.A N PHE 549.A O no hydrogen 2.918 N/A PHE 554.A N LEU 551.A O no hydrogen 3.120 N/A MET 556.A N ALA 552.A O no hydrogen 2.931 N/A LEU 557.A N VAL 553.A O no hydrogen 3.331 N/A ASN 558.A N PHE 554.A O no hydrogen 3.224 N/A THR 559.A N TRP 555.A O no hydrogen 2.850 N/A THR 559.A OG1 THR 503.A OG1 no hydrogen 3.376 N/A THR 559.A OG1 TRP 555.A O no hydrogen 2.609 N/A ILE 560.A N MET 556.A O no hydrogen 2.600 N/A GLY 561.A N LEU 557.A O no hydrogen 2.705 N/A TRP 562.A N ASN 558.A O no hydrogen 2.971 N/A THR 563.A N THR 559.A O no hydrogen 2.983 N/A THR 563.A OG1 THR 559.A O no hydrogen 3.132 N/A THR 564.A N ILE 560.A O no hydrogen 2.851 N/A THR 564.A OG1 ILE 560.A O no hydrogen 2.730 N/A THR 564.A OG1 GLY 561.A O no hydrogen 2.890 N/A PHE 565.A N GLY 561.A O no hydrogen 2.598 N/A TYR 566.A N TRP 562.A O no hydrogen 3.185 N/A TYR 566.A OH ASP 489.A OD1 no hydrogen 2.484 N/A TRP 567.A N THR 563.A O no hydrogen 2.975 N/A HIS 568.A N THR 564.A O no hydrogen 3.082 N/A HIS 568.A NE2 THR 702.A OG1 no hydrogen 2.610 N/A TRP 569.A N PHE 565.A O no hydrogen 3.156 N/A LYS 570.A N TYR 566.A O no hydrogen 3.083 N/A LYS 570.A NZ THR 484.A O no hydrogen 2.980 N/A LYS 570.A NZ ASP 489.A OD1 no hydrogen 2.771 N/A LYS 570.A NZ ASP 489.A OD2 no hydrogen 3.060 N/A HIS 571.A N TRP 567.A O no hydrogen 3.174 N/A HIS 571.A ND1 TRP 567.A O no hydrogen 2.889 N/A LEU 572.A N HIS 568.A O no hydrogen 2.875 N/A GLY 573.A N TRP 569.A O no hydrogen 3.483 N/A VAL 574.A N LYS 570.A O no hydrogen 3.227 N/A TRP 575.A N HIS 571.A O no hydrogen 2.681 N/A GLN 576.A N LEU 572.A O no hydrogen 3.209 N/A GLY 577.A N VAL 574.A O no hydrogen 3.314 N/A ASN 578.A N GLY 573.A O no hydrogen 2.962 N/A ASN 583.A N VAL 579.A O no hydrogen 3.319 N/A GLU 584.A N ALA 580.A O no hydrogen 3.181 N/A SER 585.A N GLN 581.A O no hydrogen 3.086 N/A SER 585.A OG GLN 581.A O no hydrogen 2.986 N/A SER 585.A OG ASP 595.A OD2 no hydrogen 2.841 N/A SER 586.A N PHE 582.A O no hydrogen 2.927 N/A SER 586.A OG PHE 582.A O no hydrogen 2.751 N/A THR 587.A OG1 GLN 422.A OE1 no hydrogen 2.830 N/A THR 587.A OG1 GLU 584.A O no hydrogen 3.454 N/A TYR 588.A N SER 585.A O no hydrogen 3.480 N/A LEU 589.A N ASP 411.A OD2 no hydrogen 3.373 N/A MET 590.A N ASP 411.A OD1 no hydrogen 3.216 N/A GLY 591.A N TYR 588.A O no hydrogen 3.236 N/A TRP 592.A NE1 SER 586.A O no hydrogen 3.044 N/A PHE 593.A N LEU 589.A O no hydrogen 3.200 N/A PHE 593.A N MET 590.A O no hydrogen 3.181 N/A ARG 594.A N MET 590.A O no hydrogen 2.753 N/A ARG 594.A NE ASP 595.A OD1 no hydrogen 2.832 N/A ARG 594.A NH2 ASP 595.A OD1 no hydrogen 3.457 N/A ARG 594.A NH2 ASP 595.A OD2 no hydrogen 2.836 N/A ASP 595.A N GLY 591.A O no hydrogen 2.878 N/A TYR 596.A OH HIS 568.A ND1 no hydrogen 3.359 N/A LEU 597.A N TRP 592.A O no hydrogen 3.409 N/A TRP 598.A N PHE 593.A O no hydrogen 3.330 N/A LEU 599.A N ARG 594.A O no hydrogen 3.030 N/A ASN 600.A N TYR 596.A O no hydrogen 3.435 N/A ASN 600.A ND2 TYR 596.A O no hydrogen 2.990 N/A SER 601.A N TRP 598.A O no hydrogen 3.453 N/A SER 601.A OG SER 601.A O no hydrogen 2.449 N/A SER 602.A N LEU 599.A O no hydrogen 3.489 N/A SER 602.A OG LEU 599.A O no hydrogen 3.102 N/A ILE 605.A N SER 601.A O no hydrogen 3.092 N/A ASN 606.A N GLN 603.A O no hydrogen 2.868 N/A GLY 607.A N LEU 604.A O no hydrogen 3.108 N/A ASN 609.A N GLY 612.A O no hydrogen 3.008 N/A PHE 611.A N ASN 609.A OD1 no hydrogen 3.135 N/A GLY 612.A N ASN 609.A O no hydrogen 3.388 N/A ASN 614.A N GLY 607.A O no hydrogen 2.967 N/A ASN 615.A ND2 GLN 105.A OE1 no hydrogen 3.204 N/A SER 617.A N ASN 614.A O no hydrogen 3.166 N/A SER 617.A OG GLY 607.A O no hydrogen 2.756 N/A SER 617.A OG ASN 614.A O no hydrogen 2.651 N/A ALA 620.A N LEU 616.A O no hydrogen 2.934 N/A TRP 621.A N SER 617.A O no hydrogen 2.966 N/A MET 622.A N VAL 618.A O no hydrogen 2.792 N/A PHE 623.A N TRP 619.A O no hydrogen 2.888 N/A LEU 624.A N ALA 620.A O no hydrogen 3.332 N/A PHE 625.A N TRP 621.A O no hydrogen 2.774 N/A GLY 626.A N MET 622.A O no hydrogen 2.697 N/A HIS 627.A N PHE 623.A O no hydrogen 3.287 N/A HIS 627.A ND1 PHE 623.A O no hydrogen 2.901 N/A LEU 628.A N LEU 624.A O no hydrogen 3.155 N/A ILE 629.A N PHE 625.A O no hydrogen 3.252 N/A TRP 630.A N GLY 626.A O no hydrogen 2.941 N/A ALA 631.A N HIS 627.A O no hydrogen 3.036 N/A THR 632.A N LEU 628.A O no hydrogen 2.912 N/A THR 632.A OG1 LEU 628.A O no hydrogen 2.555 N/A GLY 633.A N ILE 629.A O no hydrogen 3.244 N/A GLY 633.A N TRP 630.A O no hydrogen 3.169 N/A PHE 634.A N ALA 631.A O no hydrogen 3.225 N/A MET 635.A N THR 632.A O no hydrogen 3.200 N/A LEU 637.A N GLY 633.A O no hydrogen 3.210 N/A ILE 638.A N PHE 634.A O no hydrogen 2.876 N/A SER 639.A N MET 635.A O no hydrogen 3.002 N/A SER 639.A OG MET 635.A O no hydrogen 2.541 N/A TRP 640.A NE1 LEU 637.A O no hydrogen 3.021 N/A ARG 641.A NE LEU 673.A O no hydrogen 3.186 N/A ARG 641.A NH2 ALA 672.A O no hydrogen 3.433 N/A TRP 644.A NE1 SER 639.A OG no hydrogen 2.799 N/A GLN 645.A N ARG 641.A O no hydrogen 2.858 N/A GLU 646.A N GLY 642.A O no hydrogen 3.290 N/A LEU 647.A N TYR 643.A O no hydrogen 3.198 N/A ILE 648.A N TRP 644.A O no hydrogen 2.825 N/A GLU 649.A N GLN 645.A O no hydrogen 3.211 N/A THR 650.A N LEU 647.A O no hydrogen 3.192 N/A THR 650.A OG1 LEU 647.A O no hydrogen 2.547 N/A VAL 652.A N ILE 648.A O no hydrogen 2.885 N/A TRP 653.A N GLU 649.A O no hydrogen 3.071 N/A ALA 654.A N THR 650.A O no hydrogen 2.945 N/A HIS 655.A N LEU 651.A O no hydrogen 3.013 N/A GLU 656.A N VAL 652.A O no hydrogen 3.205 N/A ARG 657.A N TRP 653.A O no hydrogen 3.151 N/A THR 658.A N HIS 655.A O no hydrogen 3.410 N/A THR 658.A OG1 PRO 659.A O no hydrogen 3.554 N/A ALA 661.A N THR 658.A O no hydrogen 3.393 N/A ASN 662.A N THR 658.A O no hydrogen 2.911 N/A ASN 662.A ND2 GLU 656.A O no hydrogen 2.569 N/A VAL 664.A N ALA 661.A O no hydrogen 3.138 N/A ASP 668.A N ASP 668.A OD2 no hydrogen 2.428 N/A LYS 669.A N PRO 15.A O no hydrogen 3.091 N/A SER 674.A N GLN 677.A OE1 no hydrogen 3.171 N/A SER 674.A OG TYR 22.A OH no hydrogen 3.289 N/A ALA 678.A N SER 674.A O no hydrogen 2.946 N/A ARG 679.A NH1 PRO 531.A O no hydrogen 3.162 N/A LEU 680.A N VAL 676.A O no hydrogen 3.117 N/A VAL 681.A N GLN 677.A O no hydrogen 2.693 N/A GLY 682.A N ALA 678.A O no hydrogen 2.766 N/A LEU 683.A N ARG 679.A O no hydrogen 2.873 N/A ALA 684.A N LEU 680.A O no hydrogen 2.844 N/A HIS 685.A N VAL 681.A O no hydrogen 3.056 N/A HIS 685.A ND1 VAL 681.A O no hydrogen 2.650 N/A PHE 686.A N GLY 682.A O no hydrogen 2.900 N/A ALA 687.A N LEU 683.A O no hydrogen 2.808 N/A VAL 688.A N ALA 684.A O no hydrogen 2.928 N/A GLY 689.A N HIS 685.A O no hydrogen 2.852 N/A TYR 690.A N PHE 686.A O no hydrogen 2.717 N/A TYR 690.A OH LEU 557.A O no hydrogen 2.655 N/A ILE 691.A N ALA 687.A O no hydrogen 3.157 N/A VAL 692.A N VAL 688.A O no hydrogen 2.880 N/A THR 693.A N GLY 689.A O no hydrogen 3.022 N/A THR 693.A OG1 GLY 689.A O no hydrogen 2.815 N/A TYR 694.A N TYR 690.A O no hydrogen 3.358 N/A ALA 695.A N ILE 691.A O no hydrogen 2.792 N/A ALA 696.A N VAL 692.A O no hydrogen 3.153 N/A PHE 697.A N THR 693.A O no hydrogen 3.174 N/A LEU 698.A N TYR 694.A O no hydrogen 2.861 N/A ILE 699.A N ALA 695.A O no hydrogen 3.180 N/A ALA 700.A N ALA 696.A O no hydrogen 3.196 N/A SER 701.A N PHE 697.A O no hydrogen 2.785 N/A SER 701.A OG PHE 697.A O no hydrogen 3.011 N/A SER 701.A OG LEU 698.A O no hydrogen 3.389 N/A THR 702.A N LEU 698.A O no hydrogen 3.401 N/A THR 702.A OG1 LEU 698.A O no hydrogen 3.038 N/A ALA 703.A N ILE 699.A O no hydrogen 2.993 N/A SER 704.A OG ALA 700.A O no hydrogen 2.257 N/A LYS 705.A NZ ASN 600.A OD1 no hydrogen 3.387 N/A LYS 705.A NZ SER 701.A O no hydrogen 3.311 N/A PHE 706.A N THR 702.A O no hydrogen 2.867 N/A