Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3vyl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ARG 3.A N ASP 237.A OD1 no hydrogen 2.593 N/A ARG 3.A NE ASP 33.A O no hydrogen 3.296 N/A ILE 4.A N ASP 33.A OD1 no hydrogen 3.151 N/A GLY 5.A N LEU 238.A O no hydrogen 2.781 N/A HIS 7.A N PHE 240.A O no hydrogen 3.122 N/A SER 8.A N GLU 36.A O no hydrogen 2.703 N/A SER 8.A OG GLU 36.A O no hydrogen 2.715 N/A VAL 10.A N HIS 7.A O no hydrogen 2.984 N/A TRP 11.A N SER 8.A O no hydrogen 2.676 N/A SER 12.A N SER 8.A O no hydrogen 3.076 N/A SER 12.A OG GLU 19.A OE1 no hydrogen 3.109 N/A SER 14.A N SER 12.A OG no hydrogen 2.882 N/A ALA 16.A N SER 14.A OG no hydrogen 2.966 N/A LEU 20.A N ALA 16.A O no hydrogen 2.823 N/A GLU 21.A N GLN 17.A O no hydrogen 3.045 N/A ARG 22.A N SER 18.A O no hydrogen 3.108 N/A THR 23.A N GLU 19.A O no hydrogen 2.899 N/A THR 23.A OG1 GLU 19.A O no hydrogen 2.961 N/A LEU 24.A N LEU 20.A O no hydrogen 3.304 N/A ALA 25.A N GLU 21.A O no hydrogen 3.070 N/A ASN 26.A N ARG 22.A O no hydrogen 2.830 N/A THR 27.A N THR 23.A O no hydrogen 2.881 N/A THR 27.A OG1 THR 23.A O no hydrogen 2.789 N/A ARG 28.A N LEU 24.A O no hydrogen 3.099 N/A ASP 29.A N ALA 25.A O no hydrogen 3.021 N/A ALA 30.A N ASN 26.A O no hydrogen 2.990 N/A GLY 31.A N ARG 28.A O no hydrogen 3.032 N/A PHE 32.A N THR 27.A O no hydrogen 3.171 N/A ASP 33.A N ILE 4.A O no hydrogen 3.058 N/A ILE 35.A N GLY 60.A O no hydrogen 3.054 N/A GLU 36.A N ILE 6.A O no hydrogen 3.073 N/A PHE 37.A N ALA 62.A O no hydrogen 3.019 N/A ASP 44.A N ASP 41.A O no hydrogen 2.940 N/A LEU 50.A N ASP 46.A O no hydrogen 2.951 N/A ALA 51.A N ILE 47.A O no hydrogen 2.792 N/A LYS 52.A N GLY 48.A O no hydrogen 2.963 N/A ARG 53.A N ARG 49.A O no hydrogen 2.852 N/A ARG 53.A NH2 GLU 21.A OE2 no hydrogen 2.873 N/A ILE 54.A N LEU 50.A O no hydrogen 2.748 N/A ALA 55.A N ALA 51.A O no hydrogen 3.058 N/A ASP 56.A N LYS 52.A O no hydrogen 3.083 N/A LEU 57.A N ARG 53.A O no hydrogen 3.262 N/A GLY 58.A N ILE 54.A O no hydrogen 3.194 N/A GLY 58.A N ALA 55.A O no hydrogen 3.021 N/A LEU 59.A N ILE 54.A O no hydrogen 3.088 N/A GLY 60.A N ASP 33.A O no hydrogen 3.170 N/A ALA 62.A N ILE 35.A O no hydrogen 3.047 N/A ILE 63.A N LYS 102.A O no hydrogen 3.170 N/A SER 64.A N PHE 37.A O no hydrogen 3.127 N/A SER 64.A OG GLU 36.A OE2 no hydrogen 2.820 N/A ILE 65.A N ALA 104.A O no hydrogen 3.127 N/A LEU 67.A N ILE 106.A O no hydrogen 3.201 N/A GLY 71.A N PRO 68.A O no hydrogen 2.744 N/A SER 74.A N ASP 72.A OD1 no hydrogen 2.650 N/A SER 74.A OG ASP 72.A OD1 no hydrogen 2.299 N/A SER 75.A N ASP 72.A O no hydrogen 2.918 N/A ASP 77.A N SER 75.A OG no hydrogen 2.971 N/A VAL 80.A N ASP 77.A OD1 no hydrogen 2.742 N/A ALA 81.A N ASP 77.A O no hydrogen 3.201 N/A ALA 82.A N LYS 78.A O no hydrogen 2.896 N/A ARG 83.A N ALA 79.A O no hydrogen 3.127 N/A GLY 84.A N VAL 80.A O no hydrogen 3.113 N/A VAL 85.A N ALA 81.A O no hydrogen 3.052 N/A GLU 86.A N ALA 82.A O no hydrogen 2.992 N/A ILE 87.A N ARG 83.A O no hydrogen 2.968 N/A LEU 88.A N GLY 84.A O no hydrogen 2.836 N/A ASN 89.A N VAL 85.A O no hydrogen 2.841 N/A GLN 90.A N GLU 86.A O no hydrogen 3.182 N/A THR 91.A N ILE 87.A O no hydrogen 2.999 N/A THR 91.A OG1 ILE 87.A O no hydrogen 2.654 N/A ILE 92.A N LEU 88.A O no hydrogen 3.012 N/A ALA 93.A N ASN 89.A O no hydrogen 3.264 N/A LEU 94.A N GLN 90.A O no hydrogen 2.899 N/A THR 95.A N THR 91.A O no hydrogen 2.973 N/A THR 95.A OG1 THR 91.A O no hydrogen 2.945 N/A ARG 96.A N ILE 92.A O no hydrogen 2.838 N/A ARG 96.A NE ASP 97.A OD2 no hydrogen 2.786 N/A ARG 96.A NH2 ASP 97.A OD1 no hydrogen 2.997 N/A ARG 96.A NH2 ASP 97.A OD2 no hydrogen 2.805 N/A ASP 97.A N ALA 93.A O no hydrogen 2.969 N/A LEU 98.A N LEU 94.A O no hydrogen 3.003 N/A LEU 98.A N THR 95.A O no hydrogen 3.025 N/A GLY 99.A N ARG 96.A O no hydrogen 3.091 N/A GLY 100.A N THR 95.A O no hydrogen 3.036 N/A ARG 101.A NH2 ASP 236.A OD1 no hydrogen 3.489 N/A LYS 102.A NZ GLY 203.A O no hydrogen 2.600 N/A LYS 102.A NZ ASP 236.A OD1 no hydrogen 3.143 N/A LYS 102.A NZ ASP 236.A OD2 no hydrogen 3.195 N/A VAL 103.A N THR 143.A O no hydrogen 3.072 N/A ALA 104.A N ILE 63.A O no hydrogen 2.663 N/A GLY 105.A N HIS 178.A ND1 no hydrogen 3.322 N/A ILE 106.A N ILE 65.A O no hydrogen 2.799 N/A GLY 110.A N ASP 72.A OD2 no hydrogen 3.066 N/A HIS 111.A N LEU 67.A O no hydrogen 2.932 N/A HIS 111.A NE2 GLU 153.A OE1 no hydrogen 2.561 N/A GLY 112.A N GLU 153.A O no hydrogen 2.589 N/A THR 119.A N GLN 122.A OE1 no hydrogen 3.295 N/A GLN 122.A N THR 119.A OG1 no hydrogen 3.164 N/A GLN 122.A NE2 ASN 155.A OD1 no hydrogen 3.127 N/A TRP 123.A N THR 119.A O no hydrogen 3.176 N/A TRP 123.A NE1 ASP 169.A OD2 no hydrogen 2.865 N/A ASN 124.A N ARG 120.A O no hydrogen 2.779 N/A ARG 125.A N ASP 121.A O no hydrogen 2.912 N/A ARG 125.A NE SER 74.A O no hydrogen 2.810 N/A ARG 125.A NH2 SER 74.A O no hydrogen 3.335 N/A SER 126.A N GLN 122.A O no hydrogen 3.140 N/A SER 126.A OG SER 108.A O no hydrogen 2.468 N/A ALA 127.A N TRP 123.A O no hydrogen 3.024 N/A ALA 128.A N ASN 124.A O no hydrogen 2.732 N/A ALA 129.A N ARG 125.A O no hydrogen 2.817 N/A LEU 130.A N SER 126.A O no hydrogen 2.837 N/A ALA 131.A N ALA 127.A O no hydrogen 2.837 N/A LYS 132.A N ALA 129.A O no hydrogen 3.065 N/A VAL 133.A N ALA 129.A O no hydrogen 3.117 N/A ALA 134.A N LEU 130.A O no hydrogen 2.887 N/A THR 136.A N LYS 132.A O no hydrogen 3.406 N/A ALA 137.A N VAL 133.A O no hydrogen 2.935 N/A LYS 138.A N ALA 134.A O no hydrogen 2.769 N/A LYS 138.A NZ ASP 173.A OD2 no hydrogen 3.079 N/A ALA 139.A N GLU 135.A O no hydrogen 3.066 N/A ALA 140.A N THR 136.A O no hydrogen 3.140 N/A GLY 141.A N LYS 138.A O no hydrogen 2.671 N/A VAL 142.A N ALA 137.A O no hydrogen 2.940 N/A THR 143.A N ARG 101.A O no hydrogen 2.745 N/A THR 143.A OG1 ARG 101.A O no hydrogen 3.076 N/A THR 143.A OG1 ASN 145.A OD1 no hydrogen 3.374 N/A LEU 144.A N ASN 174.A O no hydrogen 2.950 N/A ASN 145.A N VAL 103.A O no hydrogen 2.973 N/A LEU 146.A N PHE 176.A O no hydrogen 2.861 N/A GLU 147.A N GLY 105.A O no hydrogen 2.746 N/A ILE 148.A N HIS 178.A O no hydrogen 2.954 N/A VAL 149.A N LEU 157.A O no hydrogen 3.152 N/A ASN 150.A N HIS 183.A ND1 no hydrogen 3.096 N/A ASN 150.A ND2 GLU 153.A OE2 no hydrogen 3.476 N/A ASN 150.A ND2 HIS 183.A ND1 no hydrogen 2.964 N/A ARG 151.A N GLU 187.A OE2 no hydrogen 2.726 N/A ARG 151.A NE GLU 187.A OE1 no hydrogen 3.443 N/A ARG 151.A NE GLU 187.A OE2 no hydrogen 2.811 N/A ARG 151.A NH2 GLU 187.A OE1 no hydrogen 2.922 N/A PHE 152.A N ASN 150.A OD1 no hydrogen 2.845 N/A GLU 153.A N ASN 150.A O no hydrogen 2.863 N/A SER 154.A N ASN 150.A O no hydrogen 3.395 N/A ASN 155.A ND2 GLU 116.A O no hydrogen 2.834 N/A LEU 156.A N SER 154.A OG no hydrogen 3.331 N/A ASN 158.A N GLN 162.A OE1 no hydrogen 2.719 N/A ALA 160.A N GLU 188.A OE2 no hydrogen 2.741 N/A GLY 163.A N THR 159.A O no hydrogen 3.045 N/A LEU 164.A N ALA 160.A O no hydrogen 2.996 N/A ALA 165.A N ALA 161.A O no hydrogen 3.092 N/A PHE 166.A N GLN 162.A O no hydrogen 2.793 N/A ILE 167.A N GLY 163.A O no hydrogen 2.631 N/A GLU 168.A N LEU 164.A O no hydrogen 2.884 N/A ASP 169.A N ALA 165.A O no hydrogen 2.948 N/A THR 170.A N PHE 166.A O no hydrogen 3.142 N/A THR 170.A N ILE 167.A O no hydrogen 2.885 N/A THR 170.A OG1 ILE 167.A O no hydrogen 2.616 N/A GLY 171.A N GLU 168.A O no hydrogen 3.281 N/A SER 172.A N THR 170.A OG1 no hydrogen 3.353 N/A ASN 174.A N SER 172.A OG no hydrogen 2.787 N/A ASN 174.A ND2 ALA 134.A O no hydrogen 3.233 N/A ASN 174.A ND2 VAL 142.A O no hydrogen 2.727 N/A PHE 176.A N LEU 144.A O no hydrogen 2.706 N/A LEU 177.A N LYS 201.A O no hydrogen 2.709 N/A HIS 178.A N LEU 146.A O no hydrogen 2.842 N/A LEU 179.A N TYR 204.A O no hydrogen 3.074 N/A THR 181.A N HIS 206.A O no hydrogen 3.070 N/A THR 181.A OG1 HIS 206.A O no hydrogen 3.450 N/A THR 181.A OG1 GLY 208.A O no hydrogen 2.651 N/A MET 184.A N ASP 180.A O no hydrogen 2.782 N/A ASN 185.A N THR 181.A O no hydrogen 2.920 N/A ILE 186.A N HIS 183.A O no hydrogen 3.235 N/A GLU 187.A N HIS 183.A O no hydrogen 3.127 N/A GLU 188.A N MET 184.A O no hydrogen 2.715 N/A LEU 193.A N ASP 190.A OD2 no hydrogen 2.940 N/A ALA 194.A N ASP 190.A O no hydrogen 2.841 N/A ILE 195.A N VAL 191.A O no hydrogen 2.977 N/A ARG 196.A N GLY 192.A O no hydrogen 2.885 N/A HIS 197.A N LEU 193.A O no hydrogen 2.863 N/A ALA 198.A N ILE 195.A O no hydrogen 2.983 N/A ALA 199.A N ARG 196.A O no hydrogen 3.463 N/A LYS 201.A N ALA 198.A O no hydrogen 2.927 N/A GLY 203.A N LEU 177.A O no hydrogen 2.694 N/A TYR 204.A N LEU 177.A O no hydrogen 3.191 N/A TYR 204.A OH GLU 36.A OE1 no hydrogen 2.767 N/A TYR 204.A OH SER 239.A OG no hydrogen 2.911 N/A HIS 206.A N LEU 179.A O no hydrogen 2.804 N/A HIS 206.A NE2 GLU 36.A OE1 no hydrogen 2.857 N/A HIS 206.A NE2 GLU 36.A OE2 no hydrogen 2.864 N/A ILE 207.A N SER 239.A O no hydrogen 2.692 N/A GLY 208.A N THR 181.A OG1 no hydrogen 2.883 N/A SER 210.A N GLU 209.A OE1 no hydrogen 2.689 N/A SER 210.A OG GLU 209.A OE1 no hydrogen 3.341 N/A HIS 211.A NE2 THR 217.A O no hydrogen 2.747 N/A ARG 212.A N GLU 209.A O no hydrogen 2.787 N/A ARG 212.A NH2 GLU 241.A OE1 no hydrogen 3.351 N/A GLY 213.A N HIS 211.A ND1 no hydrogen 3.093 N/A GLY 216.A N GLU 209.A OE2 no hydrogen 2.893 N/A THR 217.A N PHE 214.A O no hydrogen 3.309 N/A GLY 218.A N GLU 209.A OE2 no hydrogen 2.927 N/A ASN 219.A N SER 210.A OG no hydrogen 2.723 N/A ILE 220.A N GLU 209.A OE1 no hydrogen 3.094 N/A ALA 224.A N ASP 221.A OD1 no hydrogen 3.257 N/A PHE 226.A N PHE 222.A O no hydrogen 2.811 N/A ASP 227.A N ALA 223.A O no hydrogen 2.861 N/A ALA 228.A N ALA 224.A O no hydrogen 3.062 N/A LEU 229.A N ILE 225.A O no hydrogen 3.059 N/A THR 230.A N PHE 226.A O no hydrogen 2.966 N/A THR 230.A OG1 PHE 226.A O no hydrogen 2.662 N/A ALA 231.A N ASP 227.A O no hydrogen 2.784 N/A ILE 232.A N ALA 228.A O no hydrogen 3.008 N/A GLY 233.A N THR 230.A O no hydrogen 3.094 N/A TYR 234.A N LEU 229.A O no hydrogen 2.938 N/A TYR 234.A OH ASP 237.A O no hydrogen 2.655 N/A ASP 237.A N ASP 236.A OD1 no hydrogen 2.865 N/A LEU 238.A N ARG 3.A O no hydrogen 3.344 N/A SER 239.A N VAL 205.A O no hydrogen 2.763 N/A SER 239.A OG TYR 204.A OH no hydrogen 2.911 N/A PHE 240.A N GLY 5.A O no hydrogen 2.936 N/A GLU 241.A N ILE 207.A O no hydrogen 2.890 N/A SER 242.A OG ARG 212.A O no hydrogen 2.525 N/A SER 245.A N ASN 261.A OD1 no hydrogen 2.549 N/A GLU 246.A N SER 244.A OG no hydrogen 3.058 N/A ILE 247.A N SER 244.A O no hydrogen 2.829 N/A VAL 248.A N SER 244.A O no hydrogen 2.964 N/A ASN 251.A N ASP 249.A OD2 no hydrogen 2.574 N/A LEU 252.A N ASP 249.A O no hydrogen 2.897 N/A SER 253.A N ASP 249.A O no hydrogen 3.378 N/A LYS 254.A N GLU 250.A O no hydrogen 3.208 N/A LYS 254.A NZ GLU 250.A OE2 no hydrogen 3.462 N/A LYS 255.A N ASN 251.A O no hydrogen 3.068 N/A LYS 255.A NZ HIS 111.A O no hydrogen 2.962 N/A THR 256.A N LEU 252.A O no hydrogen 2.870 N/A THR 256.A OG1 LEU 252.A O no hydrogen 2.695 N/A ALA 257.A N LYS 254.A O no hydrogen 3.360 N/A ILE 258.A N SER 253.A O no hydrogen 2.788 N/A TRP 263.A NE1 SER 242.A OG no hydrogen 2.985 N/A MET 267.A N ASP 265.A OD2 no hydrogen 3.276 N/A ALA 268.A N ASP 265.A OD2 no hydrogen 3.405 N/A LEU 269.A N ASP 265.A O no hydrogen 3.120 N/A ALA 270.A N ASN 266.A O no hydrogen 3.064 N/A LYS 271.A N MET 267.A O no hydrogen 2.905 N/A LYS 271.A NZ ASP 29.A O no hydrogen 2.864 N/A HIS 272.A N ALA 268.A O no hydrogen 2.912 N/A ALA 273.A N LEU 269.A O no hydrogen 2.940 N/A ARG 274.A N ALA 270.A O no hydrogen 2.783 N/A ARG 274.A NE GLY 31.A O no hydrogen 2.948 N/A ARG 274.A NH1 ARG 274.A O no hydrogen 2.793 N/A ALA 275.A N LYS 271.A O no hydrogen 3.028 N/A PHE 276.A N HIS 272.A O no hydrogen 2.927 N/A ILE 277.A N ALA 273.A O no hydrogen 2.991 N/A GLY 278.A N ARG 274.A O no hydrogen 2.917 N/A LEU 279.A N ALA 275.A O no hydrogen 2.698 N/A GLY 280.A N PHE 276.A O no hydrogen 2.860 N/A LEU 281.A N ILE 277.A O no hydrogen 3.071 N/A GLU 282.A N GLY 278.A O no hydrogen 3.137 N/A THR 283.A N LEU 279.A O no hydrogen 2.838 N/A THR 283.A OG1 LEU 279.A O no hydrogen 2.866 N/A ALA 284.A N GLY 280.A O no hydrogen 3.079 N/A ARG 285.A N LEU 281.A O no hydrogen 2.942 N/A ARG 285.A N GLU 282.A O no hydrogen 3.000 N/A ARG 286.A N GLU 282.A O no hydrogen 2.834 N/A LYS 287.A N THR 283.A O no hydrogen 2.953 N/A LYS 287.A NZ ASP 227.A OD1 no hydrogen 2.980 N/A ALA 288.A N ALA 284.A O no hydrogen 3.241 N/A GLU 289.A N ARG 285.A O no hydrogen 3.400 N/A LEU 290.A N ARG 286.A O no hydrogen 3.169 N/A VAL 291.A N LYS 287.A O no hydrogen 2.980 N/A ALA 293.A N LEU 290.A O no hydrogen 2.803 N/A