Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1jti_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 6.A N SER 2.A O no hydrogen 3.006 N/A SER 7.A N ILE 3.A O no hydrogen 2.896 N/A SER 7.A OG ILE 3.A O no hydrogen 3.096 N/A SER 7.A OG GLY 4.A O no hydrogen 2.618 N/A MET 8.A N GLY 4.A O no hydrogen 3.077 N/A GLU 9.A N ALA 5.A O no hydrogen 3.104 N/A PHE 10.A N ALA 6.A O no hydrogen 3.119 N/A CYS 11.A N SER 7.A O no hydrogen 3.007 N/A CYS 11.A SG TYR 29.A OH no hydrogen 3.585 N/A PHE 12.A N MET 8.A O no hydrogen 3.055 N/A ASP 13.A N GLU 9.A O no hydrogen 2.806 N/A VAL 14.A N PHE 10.A O no hydrogen 2.918 N/A PHE 15.A N CYS 11.A O no hydrogen 2.980 N/A LYS 16.A N PHE 12.A O no hydrogen 3.019 N/A LYS 16.A NZ ILE 258.A O no hydrogen 2.762 N/A GLU 17.A N VAL 14.A O no hydrogen 2.998 N/A LEU 18.A N VAL 14.A O no hydrogen 2.924 N/A LYS 19.A N PHE 15.A O no hydrogen 2.875 N/A LYS 19.A NZ GLU 255.A O no hydrogen 2.861 N/A HIS 21.A N LEU 18.A O no hydrogen 2.890 N/A GLU 25.A N HIS 22.A O no hydrogen 3.411 N/A ASN 26.A ND2 SER 380.A O no hydrogen 2.981 N/A ILE 27.A N ARG 377.A O no hydrogen 3.098 N/A PHE 28.A N TYR 290.A OH no hydrogen 3.038 N/A TYR 29.A N PHE 375.A O no hydrogen 3.103 N/A TYR 29.A OH CYS 11.A O no hydrogen 2.809 N/A CYS 30.A N HIS 327.A NE2 no hydrogen 3.044 N/A CYS 30.A SG LEU 373.A O no hydrogen 3.448 N/A ILE 34.A N CYS 30.A O no hydrogen 3.292 N/A ILE 34.A N PRO 31.A O no hydrogen 3.069 N/A MET 35.A N PRO 31.A O no hydrogen 2.954 N/A SER 36.A N ILE 32.A O no hydrogen 3.136 N/A ALA 37.A N ALA 33.A O no hydrogen 3.289 N/A LEU 38.A N ILE 34.A O no hydrogen 3.034 N/A ALA 39.A N MET 35.A O no hydrogen 2.734 N/A MET 40.A N SER 36.A O no hydrogen 3.180 N/A VAL 41.A N ALA 37.A O no hydrogen 3.273 N/A TYR 42.A N LEU 38.A O no hydrogen 2.992 N/A TYR 42.A OH ASP 60.A OD2 no hydrogen 2.729 N/A LEU 43.A N ALA 39.A O no hydrogen 3.015 N/A GLY 44.A N VAL 41.A O no hydrogen 3.004 N/A ALA 45.A N TYR 42.A O no hydrogen 3.237 N/A LYS 46.A N ASN 310.A O no hydrogen 3.192 N/A SER 48.A N ASP 47.A OD1 no hydrogen 2.326 N/A SER 48.A OG ASP 47.A OD1 no hydrogen 2.603 N/A ARG 50.A N LYS 46.A O no hydrogen 3.247 N/A ARG 50.A NH1 ALA 45.A O no hydrogen 3.540 N/A THR 51.A N ASP 47.A O no hydrogen 2.927 N/A GLN 52.A N SER 48.A O no hydrogen 2.697 N/A ILE 53.A N THR 49.A O no hydrogen 3.286 N/A ILE 53.A N ARG 50.A O no hydrogen 3.099 N/A ASN 54.A N ARG 50.A O no hydrogen 3.317 N/A LYS 55.A N THR 51.A O no hydrogen 3.147 N/A VAL 56.A N ILE 53.A O no hydrogen 3.106 N/A VAL 57.A N ILE 53.A O no hydrogen 3.057 N/A ARG 58.A N ASN 54.A O no hydrogen 2.759 N/A ARG 58.A NH2 ALA 6.A O no hydrogen 2.697 N/A GLN 72.A N SER 68.A O no hydrogen 2.859 N/A CYS 73.A N ILE 69.A O no hydrogen 2.993 N/A CYS 73.A SG ILE 69.A O no hydrogen 2.875 N/A GLY 74.A N ALA 71.A O no hydrogen 2.767 N/A THR 75.A OG1 ALA 71.A O no hydrogen 2.337 N/A ASN 78.A N SER 81.A OG no hydrogen 3.324 N/A VAL 79.A N ASP 60.A OD1 no hydrogen 2.852 N/A SER 81.A N ASN 78.A OD1 no hydrogen 3.180 N/A SER 81.A OG ASN 78.A O no hydrogen 2.965 N/A SER 82.A N ASN 78.A O no hydrogen 2.929 N/A LEU 83.A N VAL 79.A O no hydrogen 2.754 N/A ARG 84.A N HIS 80.A O no hydrogen 2.996 N/A ASP 85.A N SER 81.A O no hydrogen 2.990 N/A ILE 86.A N SER 82.A O no hydrogen 3.217 N/A LEU 87.A N LEU 83.A O no hydrogen 3.202 N/A ASN 88.A N ARG 84.A O no hydrogen 3.073 N/A GLN 89.A N ASP 85.A O no hydrogen 2.968 N/A ILE 90.A N ILE 86.A O no hydrogen 3.192 N/A THR 91.A OG1 LEU 87.A O no hydrogen 2.517 N/A TYR 96.A OH ILE 90.A O no hydrogen 2.663 N/A SER 97.A N LYS 180.A O no hydrogen 2.894 N/A SER 99.A N VAL 178.A O no hydrogen 2.865 N/A ALA 101.A N ALA 176.A O no hydrogen 2.984 N/A ARG 103.A N VAL 174.A O no hydrogen 2.894 N/A ARG 103.A NH1 TYR 105.A OH no hydrogen 2.788 N/A LEU 104.A N GLY 127.A O no hydrogen 2.976 N/A TYR 105.A N VAL 172.A O no hydrogen 3.069 N/A ALA 106.A N GLU 129.A O no hydrogen 3.069 N/A GLU 107.A N ALA 170.A O no hydrogen 3.253 N/A ARG 109.A NH2 TYR 110.A O no hydrogen 3.158 N/A ILE 112.A N TYR 110.A O no hydrogen 2.580 N/A LEU 113.A N ILE 314.A O no hydrogen 2.912 N/A TYR 116.A N LEU 113.A O no hydrogen 2.917 N/A TYR 116.A OH MET 40.A O no hydrogen 2.642 N/A GLN 118.A N PRO 114.A O no hydrogen 3.060 N/A CYS 119.A N GLU 115.A O no hydrogen 2.985 N/A VAL 120.A N TYR 116.A O no hydrogen 3.036 N/A LYS 121.A N LEU 117.A O no hydrogen 3.195 N/A GLU 122.A N GLN 118.A O no hydrogen 2.885 N/A LEU 123.A N CYS 119.A O no hydrogen 2.645 N/A TYR 124.A N VAL 120.A O no hydrogen 3.009 N/A TYR 124.A OH HIS 80.A ND1 no hydrogen 2.827 N/A GLY 126.A N VAL 120.A O no hydrogen 3.151 N/A GLU 129.A N LEU 104.A O no hydrogen 2.772 N/A ILE 131.A N ALA 106.A O no hydrogen 2.823 N/A ASN 132.A ND2 THR 135.A OG1 no hydrogen 3.028 N/A PHE 133.A N GLU 107.A OE2 no hydrogen 2.735 N/A GLN 134.A N GLU 107.A OE2 no hydrogen 2.766 N/A THR 135.A N ASN 132.A OD1 no hydrogen 3.311 N/A THR 135.A OG1 ASN 132.A OD1 no hydrogen 3.069 N/A ALA 140.A N ALA 136.A O no hydrogen 2.961 N/A ARG 141.A N ALA 137.A O no hydrogen 3.116 N/A ARG 141.A NH1 LEU 160.A O no hydrogen 2.724 N/A LEU 143.A N GLN 139.A O no hydrogen 3.008 N/A ILE 144.A N ALA 140.A O no hydrogen 2.974 N/A ASN 145.A N ARG 141.A O no hydrogen 2.938 N/A ASN 145.A ND2 LEU 160.A O no hydrogen 3.127 N/A SER 146.A N GLU 142.A O no hydrogen 3.079 N/A TRP 147.A N LEU 143.A O no hydrogen 3.074 N/A TRP 147.A N ILE 144.A O no hydrogen 2.981 N/A VAL 148.A N ILE 144.A O no hydrogen 3.048 N/A GLU 149.A N ASN 145.A O no hydrogen 2.810 N/A SER 150.A N SER 146.A O no hydrogen 3.120 N/A GLN 151.A N TRP 147.A O no hydrogen 2.991 N/A THR 152.A N VAL 148.A O no hydrogen 3.159 N/A THR 152.A N GLU 149.A O no hydrogen 3.278 N/A THR 152.A OG1 VAL 148.A O no hydrogen 2.910 N/A THR 152.A OG1 GLU 149.A O no hydrogen 3.164 N/A ASN 153.A N SER 150.A O no hydrogen 3.416 N/A GLY 154.A N GLU 149.A O no hydrogen 2.720 N/A ILE 155.A N THR 152.A O no hydrogen 2.889 N/A ILE 156.A N THR 152.A OG1 no hydrogen 3.106 N/A LEU 160.A N ASN 145.A OD1 no hydrogen 2.711 N/A SER 164.A OG GLN 161.A O no hydrogen 3.011 N/A ASP 166.A N THR 169.A OG1 no hydrogen 2.841 N/A GLN 168.A N ASP 166.A OD1 no hydrogen 2.982 N/A GLN 168.A NE2 SER 167.A OG no hydrogen 2.465 N/A THR 169.A N ASP 166.A O no hydrogen 3.010 N/A THR 169.A OG1 ASP 166.A O no hydrogen 3.122 N/A THR 169.A OG1 ASP 349.A OD1 no hydrogen 3.549 N/A ALA 170.A N VAL 348.A O no hydrogen 2.776 N/A MET 171.A N VAL 348.A O no hydrogen 3.123 N/A VAL 172.A N TYR 105.A O no hydrogen 2.887 N/A LEU 173.A N ALA 346.A O no hydrogen 2.828 N/A VAL 174.A N ARG 103.A O no hydrogen 3.128 N/A ASN 175.A N ALA 344.A O no hydrogen 2.859 N/A ASN 175.A ND2 ALA 33.A O no hydrogen 2.917 N/A ALA 176.A N ALA 101.A O no hydrogen 2.901 N/A ILE 177.A N GLY 342.A O no hydrogen 2.889 N/A VAL 178.A N SER 99.A O no hydrogen 2.909 N/A PHE 179.A N VAL 340.A O no hydrogen 2.699 N/A LYS 180.A N SER 97.A O no hydrogen 2.905 N/A GLY 181.A N THR 338.A O no hydrogen 2.948 N/A LEU 182.A N VAL 95.A O no hydrogen 3.182 N/A TRP 183.A N ALA 336.A O no hydrogen 3.074 N/A TRP 183.A NE1 ASN 334.A O no hydrogen 2.941 N/A GLU 184.A N PRO 232.A O no hydrogen 3.140 N/A LYS 185.A NZ LEU 215.A O no hydrogen 2.508 N/A PHE 187.A N GLU 335.A O no hydrogen 3.133 N/A THR 192.A N ASP 189.A O no hydrogen 2.892 N/A THR 192.A OG1 LYS 188.A O no hydrogen 3.422 N/A THR 192.A OG1 ASP 189.A O no hydrogen 3.244 N/A THR 192.A OG1 GLU 335.A OE1 no hydrogen 2.805 N/A GLN 193.A N MET 209.A O no hydrogen 3.224 N/A PHE 197.A N LYS 205.A O no hydrogen 2.683 N/A ARG 198.A NH2 ASP 357.A OD1 no hydrogen 3.184 N/A GLN 202.A N THR 200.A OG1 no hydrogen 3.000 N/A LYS 205.A NZ PRO 381.A OXT no hydrogen 2.989 N/A VAL 207.A N MET 195.A O no hydrogen 3.007 N/A MET 209.A N GLN 193.A O no hydrogen 2.667 N/A MET 210.A N LEU 281.A O no hydrogen 2.777 N/A GLN 212.A N VAL 279.A O no hydrogen 3.072 N/A GLN 212.A NE2 LYS 185.A O no hydrogen 2.974 N/A GLY 214.A N ILE 277.A O no hydrogen 3.281 N/A PHE 216.A N ARG 275.A O no hydrogen 2.943 N/A ARG 217.A NE GLU 230.A OE1 no hydrogen 3.250 N/A ARG 217.A NH2 GLU 230.A OE1 no hydrogen 3.301 N/A VAL 218.A N GLU 273.A O no hydrogen 3.073 N/A ALA 219.A N ILE 228.A O no hydrogen 3.197 N/A MET 221.A N MET 226.A O no hydrogen 2.726 N/A SER 223.A OG MET 221.A O no hydrogen 3.521 N/A SER 223.A OG GLU 224.A OE1 no hydrogen 2.792 N/A GLU 224.A N MET 221.A O no hydrogen 2.625 N/A LYS 227.A N LEU 244.A O no hydrogen 2.971 N/A LYS 227.A NZ GLU 353.A O no hydrogen 3.369 N/A ILE 228.A N ALA 219.A O no hydrogen 3.069 N/A LEU 229.A N VAL 242.A O no hydrogen 2.957 N/A GLU 230.A N ARG 217.A O no hydrogen 3.241 N/A LEU 231.A N MET 240.A O no hydrogen 2.958 N/A PHE 233.A N MET 238.A O no hydrogen 2.902 N/A ALA 234.A N LEU 182.A O no hydrogen 2.579 N/A SER 235.A OG THR 237.A OG1 no hydrogen 2.859 N/A GLY 236.A N PHE 233.A O no hydrogen 3.261 N/A THR 237.A N SER 235.A OG no hydrogen 3.209 N/A THR 237.A OG1 SER 235.A OG no hydrogen 2.859 N/A SER 239.A N LYS 365.A O no hydrogen 3.213 N/A SER 239.A OG GLU 230.A OE2 no hydrogen 2.758 N/A MET 240.A N LEU 231.A O no hydrogen 3.037 N/A LEU 241.A N CYS 363.A O no hydrogen 2.860 N/A VAL 242.A N LEU 229.A O no hydrogen 2.882 N/A LEU 243.A N LEU 361.A O no hydrogen 2.943 N/A LEU 244.A N LYS 227.A O no hydrogen 2.973 N/A ASP 246.A N LYS 225.A O no hydrogen 2.560 N/A GLY 250.A N GLU 247.A O no hydrogen 2.803 N/A GLN 253.A N GLY 250.A O no hydrogen 3.256 N/A LEU 254.A N GLY 250.A O no hydrogen 3.188 N/A GLU 255.A N LEU 251.A O no hydrogen 2.991 N/A SER 256.A N GLN 253.A O no hydrogen 3.209 N/A SER 256.A OG GLU 252.A O no hydrogen 3.236 N/A SER 256.A OG GLN 253.A O no hydrogen 3.485 N/A ILE 258.A N LEU 254.A O no hydrogen 3.258 N/A LYS 262.A N ASN 259.A OD1 no hydrogen 2.829 N/A LEU 263.A N ASN 259.A O no hydrogen 2.937 N/A THR 264.A N PHE 260.A O no hydrogen 2.879 N/A THR 264.A OG1 PHE 260.A O no hydrogen 2.632 N/A GLU 265.A N GLU 261.A O no hydrogen 2.720 N/A TRP 266.A N LYS 262.A O no hydrogen 2.599 N/A THR 267.A N LEU 263.A O no hydrogen 2.955 N/A THR 267.A OG1 LEU 263.A O no hydrogen 2.976 N/A SER 268.A OG ASN 270.A OD1 no hydrogen 2.808 N/A MET 272.A N SER 268.A O no hydrogen 3.208 N/A GLU 273.A N VAL 218.A O no hydrogen 2.905 N/A ARG 275.A N PHE 216.A O no hydrogen 3.086 N/A ILE 277.A N GLY 214.A O no hydrogen 2.968 N/A LYS 278.A N GLU 352.A O no hydrogen 2.924 N/A VAL 279.A N GLN 212.A O no hydrogen 2.776 N/A TYR 280.A N PHE 354.A O no hydrogen 2.919 N/A LEU 281.A N MET 210.A O no hydrogen 3.041 N/A ARG 283.A N GLN 208.A O no hydrogen 3.127 N/A ARG 283.A NE GLU 335.A OE1 no hydrogen 2.847 N/A ARG 283.A NE GLU 335.A OE2 no hydrogen 3.421 N/A ARG 283.A NH2 GLU 335.A OE1 no hydrogen 2.917 N/A MET 284.A N ILE 333.A O no hydrogen 2.920 N/A MET 286.A N ALA 331.A O no hydrogen 2.773 N/A GLU 288.A N ALA 329.A O no hydrogen 2.989 N/A LYS 289.A NZ VAL 159.A O no hydrogen 3.237 N/A TYR 290.A N HIS 327.A O no hydrogen 2.854 N/A LEU 292.A N ALA 325.A O no hydrogen 2.790 N/A THR 293.A OG1 ASN 291.A OD1 no hydrogen 2.901 N/A SER 294.A OG ASN 291.A O no hydrogen 3.480 N/A LEU 296.A N LEU 292.A O no hydrogen 2.734 N/A MET 297.A N THR 293.A O no hydrogen 3.008 N/A ALA 298.A N SER 294.A O no hydrogen 2.867 N/A MET 299.A N VAL 295.A O no hydrogen 3.012 N/A GLY 300.A N MET 297.A O no hydrogen 3.151 N/A ILE 301.A N LEU 296.A O no hydrogen 3.049 N/A THR 302.A N GLN 52.A OE1 no hydrogen 3.004 N/A ASP 303.A N GLN 52.A OE1 no hydrogen 2.776 N/A PHE 305.A N THR 302.A O no hydrogen 2.948 N/A SER 306.A N ASP 303.A O no hydrogen 2.918 N/A SER 306.A OG ASP 303.A O no hydrogen 2.880 N/A SER 306.A OG SER 308.A OG no hydrogen 2.941 N/A SER 308.A N SER 306.A OG no hydrogen 3.074 N/A SER 308.A OG SER 306.A OG no hydrogen 2.941 N/A ASN 310.A N THR 49.A OG1 no hydrogen 2.912 N/A ASN 310.A ND2 SER 312.A OG no hydrogen 2.745 N/A GLY 313.A N GLY 44.A O no hydrogen 3.146 N/A ILE 314.A N LEU 311.A O no hydrogen 2.902 N/A SER 315.A N LEU 311.A O no hydrogen 3.434 N/A SER 315.A OG PRO 111.A O no hydrogen 2.595 N/A LYS 321.A N ASP 349.A O no hydrogen 2.992 N/A ILE 322.A N VAL 304.A O no hydrogen 2.902 N/A SER 323.A N GLY 347.A O no hydrogen 2.701 N/A SER 323.A OG ASP 349.A OD2 no hydrogen 3.306 N/A ALA 325.A N THR 293.A OG1 no hydrogen 3.373 N/A VAL 326.A N GLU 345.A O no hydrogen 2.889 N/A HIS 327.A N TYR 290.A O no hydrogen 3.050 N/A HIS 327.A ND1 SER 343.A O no hydrogen 2.857 N/A ALA 328.A N SER 343.A O no hydrogen 2.957 N/A ALA 329.A N GLU 288.A O no hydrogen 2.940 N/A HIS 330.A N VAL 341.A O no hydrogen 2.948 N/A HIS 330.A ND1 GLU 287.A OE1 no hydrogen 2.358 N/A HIS 330.A NE2 GLU 332.A OE2 no hydrogen 2.907 N/A ALA 331.A N MET 286.A O no hydrogen 2.840 N/A GLU 332.A N GLU 339.A O no hydrogen 2.819 N/A ILE 333.A N MET 284.A O no hydrogen 2.877 N/A ASN 334.A N GLY 337.A O no hydrogen 2.938 N/A GLU 335.A N GLU 335.A OE2 no hydrogen 2.855 N/A ALA 336.A N ASN 334.A OD1 no hydrogen 2.867 N/A GLY 337.A N ASN 334.A OD1 no hydrogen 3.209 N/A THR 338.A N GLY 181.A O no hydrogen 3.035 N/A GLU 339.A N GLU 332.A O no hydrogen 2.819 N/A VAL 340.A N PHE 179.A O no hydrogen 2.789 N/A VAL 341.A N HIS 330.A O no hydrogen 3.027 N/A GLY 342.A N ILE 177.A O no hydrogen 2.822 N/A SER 343.A N ALA 328.A O no hydrogen 2.924 N/A SER 343.A OG ASN 175.A O no hydrogen 2.768 N/A ALA 344.A N ASN 175.A O no hydrogen 3.325 N/A ALA 344.A N ASN 175.A OD1 no hydrogen 2.845 N/A GLU 345.A N VAL 326.A O no hydrogen 2.827 N/A ALA 346.A N LEU 173.A O no hydrogen 2.822 N/A GLY 347.A N GLN 324.A O no hydrogen 2.800 N/A VAL 348.A N MET 171.A O no hydrogen 2.624 N/A ASP 349.A N LYS 321.A O no hydrogen 2.831 N/A ALA 350.A N GLN 168.A O no hydrogen 2.951 N/A ALA 351.A N SER 319.A O no hydrogen 2.721 N/A PHE 354.A N LYS 278.A O no hydrogen 2.768 N/A ALA 356.A N TYR 280.A O no hydrogen 2.930 N/A HIS 358.A ND1 ASP 357.A OD1 no hydrogen 2.514 N/A HIS 358.A NE2 PRO 245.A O no hydrogen 2.670 N/A PHE 360.A N CYS 378.A O no hydrogen 3.252 N/A LEU 361.A N LEU 243.A O no hydrogen 3.196 N/A PHE 362.A N GLY 376.A O no hydrogen 2.878 N/A CYS 363.A N LEU 241.A O no hydrogen 3.078 N/A ILE 364.A N PHE 374.A O no hydrogen 2.926 N/A LYS 365.A N SER 239.A O no hydrogen 3.079 N/A HIS 366.A N ALA 371.A O no hydrogen 2.826 N/A HIS 366.A ND1 THR 369.A OG1 no hydrogen 2.681 N/A ILE 367.A N THR 237.A O no hydrogen 2.956 N/A THR 369.A OG1 HIS 366.A ND1 no hydrogen 2.681 N/A ASN 370.A N HIS 366.A O no hydrogen 2.722 N/A ALA 371.A N THR 369.A OG1 no hydrogen 3.326 N/A VAL 372.A N SER 7.A OG no hydrogen 3.264 N/A LEU 373.A N ILE 364.A O no hydrogen 2.973 N/A PHE 374.A N ILE 364.A O no hydrogen 3.307 N/A PHE 375.A N TYR 29.A O no hydrogen 3.173 N/A GLY 376.A N PHE 362.A O no hydrogen 2.847 N/A ARG 377.A N ILE 27.A O no hydrogen 2.664 N/A ARG 377.A NE GLU 255.A OE2 no hydrogen 2.548 N/A ARG 377.A NH1 HIS 22.A O no hydrogen 2.891 N/A ARG 377.A NH1 GLU 25.A O no hydrogen 3.092 N/A ARG 377.A NH2 GLU 255.A OE1 no hydrogen 2.685 N/A ARG 377.A NH2 GLU 255.A OE2 no hydrogen 2.912 N/A CYS 378.A N PHE 360.A O no hydrogen 2.832 N/A VAL 379.A N ASN 26.A OD1 no hydrogen 2.638 N/A SER 380.A N ASN 26.A OD1 no hydrogen 2.777 N/A