Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3gpt_E.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASN 4.A N PHE 1.A O no hydrogen 2.633 N/A TYR 5.A N ARG 2.A O no hydrogen 2.791 N/A THR 11.A OG1 ASP 8.A OD1 no hydrogen 2.647 N/A SER 13.A N ARG 17.A O no hydrogen 2.925 N/A SER 13.A OG THR 15.A OG1 no hydrogen 3.171 N/A THR 15.A N SER 13.A OG no hydrogen 3.264 N/A THR 15.A OG1 SER 13.A OG no hydrogen 3.171 N/A GLY 16.A N SER 13.A O no hydrogen 2.934 N/A ARG 17.A N SER 13.A OG no hydrogen 3.122 N/A ARG 17.A NE GLU 22.A OE2 no hydrogen 3.072 N/A ARG 17.A NH2 GLU 22.A OE1 no hydrogen 2.647 N/A GLN 20.A NE2 ASP 6.A O no hydrogen 2.816 N/A GLU 22.A N LEU 18.A O no hydrogen 3.001 N/A TYR 23.A N PHE 19.A O no hydrogen 2.605 N/A TYR 23.A OH ASP 6.A OD1 no hydrogen 2.394 N/A ALA 24.A N GLN 20.A O no hydrogen 3.000 N/A LEU 25.A N VAL 21.A O no hydrogen 2.974 N/A GLU 26.A N GLU 22.A O no hydrogen 3.085 N/A ALA 27.A N ALA 24.A O no hydrogen 2.776 N/A ILE 28.A N LEU 25.A O no hydrogen 3.012 N/A LYS 29.A N LEU 25.A O no hydrogen 3.408 N/A LYS 29.A NZ GLU 26.A OE2 no hydrogen 3.450 N/A GLN 30.A N GLU 26.A O no hydrogen 3.301 N/A GLY 31.A N ILE 28.A O no hydrogen 2.710 N/A SER 32.A OG LEU 48.A O no hydrogen 2.444 N/A THR 34.A N ILE 160.A O no hydrogen 3.112 N/A THR 34.A OG1 VAL 46.A O no hydrogen 3.178 N/A THR 34.A OG1 SER 72.A OG no hydrogen 3.098 N/A VAL 35.A N VAL 46.A O no hydrogen 2.492 N/A GLY 36.A N THR 158.A O no hydrogen 2.842 N/A LEU 37.A N VAL 44.A O no hydrogen 3.112 N/A ARG 38.A N TYR 156.A O no hydrogen 2.849 N/A ARG 38.A NH1 SER 39.A O no hydrogen 2.530 N/A SER 39.A N HIS 42.A O no hydrogen 2.840 N/A SER 39.A OG THR 41.A OG1 no hydrogen 3.323 N/A SER 39.A OG ASP 182.A OD1 no hydrogen 3.253 N/A SER 39.A OG ILE 181F.A O no hydrogen 3.137 N/A ASN 40.A N ASP 182.A OD1 no hydrogen 2.611 N/A THR 41.A N SER 39.A OG no hydrogen 2.976 N/A THR 41.A OG1 SER 39.A OG no hydrogen 3.323 N/A THR 41.A OG1 HIS 42.A ND1 no hydrogen 2.661 N/A HIS 42.A N SER 39.A OG no hydrogen 3.067 N/A HIS 42.A ND1 THR 41.A OG1 no hydrogen 2.661 N/A ALA 43.A N VAL 215.A O no hydrogen 2.921 N/A VAL 44.A N LEU 37.A O no hydrogen 2.733 N/A LEU 45.A N ALA 213.A O no hydrogen 2.740 N/A VAL 46.A N VAL 35.A O no hydrogen 2.768 N/A ALA 47.A N SER 211.A O no hydrogen 2.897 N/A LEU 48.A N VAL 33.A O no hydrogen 2.936 N/A LYS 49.A N ASN 209E.A O no hydrogen 3.152 N/A LYS 49.A NZ ASP 225.A OD1 no hydrogen 3.208 N/A ARG 50.A NH1 GLN 30.A O no hydrogen 3.065 N/A ARG 50.A NH2 GLN 30.A O no hydrogen 3.078 N/A ASN 51.A ND2 GLU 54.A OE1 no hydrogen 3.548 N/A ALA 52.A N SER 56.A OG no hydrogen 2.806 N/A ASP 53.A N SER 56.A OG no hydrogen 3.171 N/A SER 56.A N ASP 53.A O no hydrogen 3.453 N/A SER 56.A OG ASP 53.A O no hydrogen 3.240 N/A SER 56.A OG SER 57.A O no hydrogen 2.984 N/A LYS 61.A NZ SER 32.A O no hydrogen 2.558 N/A LYS 61.A NZ LEU 73.A O no hydrogen 3.150 N/A ILE 63.A N LEU 71.A O no hydrogen 2.987 N/A LYS 64.A NZ GLU 67.A OE2 no hydrogen 2.832 N/A CYS 65.A N MET 69.A O no hydrogen 2.864 N/A CYS 65.A SG ILE 63.A O no hydrogen 4.038 N/A ASP 66.A N MET 69.A O no hydrogen 3.100 N/A GLU 67.A N ASP 66.A OD2 no hydrogen 2.750 N/A MET 69.A N ASP 66.A O no hydrogen 3.249 N/A GLY 70.A N ILE 134.A O no hydrogen 3.146 N/A LEU 71.A N ILE 63.A O no hydrogen 2.927 N/A SER 72.A N LEU 132.A O no hydrogen 2.840 N/A SER 72.A OG THR 34.A OG1 no hydrogen 3.098 N/A LEU 73.A N LYS 61.A O no hydrogen 2.886 N/A ALA 74.A N GLY 130.A O no hydrogen 3.045 N/A LEU 76.A N GLY 128.A O no hydrogen 2.773 N/A ALA 80.A N LEU 76.A O no hydrogen 3.330 N/A ARG 81.A N ALA 77.A O no hydrogen 3.037 N/A VAL 82.A N PRO 78.A O no hydrogen 2.991 N/A LEU 83.A N ASP 79.A O no hydrogen 2.972 N/A SER 84.A N ALA 80.A O no hydrogen 2.822 N/A SER 84.A OG ALA 80.A O no hydrogen 2.853 N/A SER 84.A OG ARG 81.A O no hydrogen 3.080 N/A ASN 85.A N ARG 81.A O no hydrogen 2.942 N/A TYR 86.A N VAL 82.A O no hydrogen 3.132 N/A LEU 87.A N LEU 83.A O no hydrogen 3.003 N/A ARG 88.A N SER 84.A O no hydrogen 2.685 N/A ARG 88.A NE LYS 64.A O no hydrogen 2.980 N/A ARG 88.A NH2 LYS 64.A O no hydrogen 3.299 N/A GLN 89.A N ASN 85.A O no hydrogen 2.988 N/A GLN 90.A N TYR 86.A O no hydrogen 3.004 N/A CYS 91.A N LEU 87.A O no hydrogen 2.910 N/A CYS 91.A SG LEU 87.A O no hydrogen 3.417 N/A ASN 92.A N ARG 88.A O no hydrogen 2.936 N/A TYR 93.A N GLN 89.A O no hydrogen 2.727 N/A SER 94.A N GLN 90.A O no hydrogen 3.163 N/A SER 94.A OG ARG 100.A O no hydrogen 2.719 N/A SER 95.A N CYS 91.A O no hydrogen 3.166 N/A SER 95.A OG CYS 91.A O no hydrogen 3.324 N/A LEU 96.A N ASN 92.A O no hydrogen 2.889 N/A VAL 97.A N TYR 93.A O no hydrogen 2.919 N/A PHE 98.A N SER 94.A O no hydrogen 2.989 N/A ASN 99.A N SER 95.A O no hydrogen 2.713 N/A ARG 100.A N SER 94.A O no hydrogen 3.230 N/A VAL 104.A N ASP 137.A OD1 no hydrogen 2.926 N/A ARG 106.A N ALA 103.A O no hydrogen 2.834 N/A ALA 107.A N ALA 103.A O no hydrogen 2.979 N/A GLY 108.A N VAL 104.A O no hydrogen 3.081 N/A HIS 109.A N GLU 105.A O no hydrogen 3.194 N/A LEU 110.A N ARG 106.A O no hydrogen 2.962 N/A LEU 111.A N ALA 107.A O no hydrogen 2.949 N/A CYS 112.A N GLY 108.A O no hydrogen 2.985 N/A CYS 112.A SG ASP 113.A OD1 no hydrogen 3.911 N/A CYS 112.A SG GLY 150.A O no hydrogen 3.038 N/A ASP 113.A N HIS 109.A O no hydrogen 3.036 N/A LYS 114.A N LEU 110.A O no hydrogen 2.931 N/A LYS 114.A NZ TYR 127.A OH no hydrogen 3.548 N/A ALA 115.A N LEU 111.A O no hydrogen 2.966 N/A GLN 116.A N CYS 112.A O no hydrogen 2.901 N/A ASN 118.A N ALA 115.A O no hydrogen 3.022 N/A ASN 118.A ND2 LYS 114.A O no hydrogen 3.287 N/A THR 119.A N GLN 116.A O no hydrogen 3.024 N/A THR 119.A OG1 GLN 116.A O no hydrogen 2.842 N/A SER 121.A OG LYS 117.A O no hydrogen 3.542 N/A ARG 125.A NH1 ASP 79.A OD1 no hydrogen 2.932 N/A ARG 125.A NH1 PRO 126.A O no hydrogen 3.023 N/A ARG 125.A NH2 ASP 79.A OD1 no hydrogen 3.535 N/A ARG 125.A NH2 ASP 79.A OD2 no hydrogen 2.866 N/A GLY 128.A N ASP 79.A OD1 no hydrogen 2.694 N/A GLY 130.A N ALA 74.A O no hydrogen 2.905 N/A LEU 131.A N PHE 146.A O no hydrogen 3.008 N/A LEU 132.A N SER 72.A O no hydrogen 2.886 N/A ILE 133.A N LEU 144.A O no hydrogen 2.731 N/A ILE 134.A N GLY 70.A O no hydrogen 2.969 N/A GLY 135.A N HIS 142.A O no hydrogen 3.030 N/A TYR 136.A N HIS 68.A O no hydrogen 3.161 N/A ASP 137.A N GLY 140.A O no hydrogen 3.001 N/A SER 139.A N ASP 137.A OD2 no hydrogen 2.750 N/A SER 139.A OG ASP 137.A OD2 no hydrogen 2.825 N/A SER 139.A OG HIS 142.A NE2 no hydrogen 2.611 N/A GLY 140.A N ASP 137.A O no hydrogen 3.164 N/A HIS 142.A N GLY 135.A O no hydrogen 2.811 N/A HIS 142.A ND1 GLU 154.A OE1 no hydrogen 2.624 N/A HIS 142.A NE2 ASP 137.A OD2 no hydrogen 2.833 N/A HIS 142.A NE2 SER 139.A OG no hydrogen 2.611 N/A LEU 144.A N ILE 133.A O no hydrogen 2.579 N/A GLU 145.A N THR 153.A O no hydrogen 2.784 N/A PHE 146.A N LEU 131.A O no hydrogen 2.622 N/A GLN 147.A N ASN 151.A O no hydrogen 2.934 N/A GLN 147.A NE2 GLU 145.A OE2 no hydrogen 2.828 N/A GLY 150.A N GLN 147.A O no hydrogen 2.646 N/A ASN 151.A N SER 149.A OG no hydrogen 3.319 N/A ASN 151.A ND2 SER 149.A OG no hydrogen 2.782 N/A THR 153.A N GLU 145.A O no hydrogen 2.908 N/A LEU 155.A N LEU 143.A O no hydrogen 2.950 N/A THR 158.A N GLY 36.A O no hydrogen 2.688 N/A THR 158.A OG1 GLU 145.A OE1 no hydrogen 3.108 N/A ILE 160.A N THR 34.A O no hydrogen 3.166 N/A ALA 162.A N GLY 31.A O no hydrogen 2.735 N/A SER 164.A N GLY 161.A O no hydrogen 3.325 N/A SER 164.A OG GLY 161.A O no hydrogen 3.040 N/A GLY 166.A N ARG 163.A O no hydrogen 3.103 N/A ALA 167.A N SER 199.A OG no hydrogen 2.981 N/A LYS 168.A N SER 164.A O no hydrogen 3.039 N/A THR 169.A N GLN 165.A O no hydrogen 3.125 N/A THR 169.A OG1 GLN 165.A OE1 no hydrogen 3.451 N/A TYR 170.A N GLY 166.A O no hydrogen 3.207 N/A TYR 170.A OH GLU 194.A OE1 no hydrogen 2.676 N/A LEU 171.A N ALA 167.A O no hydrogen 2.921 N/A GLU 172.A N LYS 168.A O no hydrogen 2.917 N/A ARG 173.A N TYR 170.A O no hydrogen 3.012 N/A THR 174.A N TYR 170.A O no hydrogen 2.717 N/A THR 174.A OG1 TYR 170.A O no hydrogen 3.144 N/A ASP 182.A N LYS 180E.A O no hydrogen 2.745 N/A GLY 183.A N THR 41.A OG1 no hydrogen 2.939 N/A LEU 188.A N ASN 184.A O no hydrogen 3.312 N/A ILE 189.A N PRO 185.A O no hydrogen 2.871 N/A LYS 190.A N ASP 186.A O no hydrogen 2.979 N/A ALA 191.A N GLU 187.A O no hydrogen 2.889 N/A GLY 192.A N LEU 188.A O no hydrogen 2.932 N/A VAL 193.A N ILE 189.A O no hydrogen 2.767 N/A GLU 194.A N LYS 190.A O no hydrogen 2.942 N/A ALA 195.A N ALA 191.A O no hydrogen 3.132 N/A ILE 196.A N GLY 192.A O no hydrogen 3.096 N/A SER 197.A N VAL 193.A O no hydrogen 3.050 N/A SER 197.A OG VAL 193.A O no hydrogen 2.780 N/A SER 197.A OG GLU 194.A O no hydrogen 2.940 N/A GLN 198.A N ALA 195.A O no hydrogen 3.223 N/A GLN 198.A NE2 GLU 194.A O no hydrogen 3.099 N/A SER 199.A N ILE 196.A O no hydrogen 2.848 N/A SER 199.A OG ARG 163.A O no hydrogen 2.704 N/A LEU 200.A N SER 197.A O no hydrogen 3.240 N/A SER 211.A N ALA 47.A O no hydrogen 3.254 N/A SER 211.A OG ASP 225.A OD1 no hydrogen 2.738 N/A ILE 212.A N TYR 224.A O no hydrogen 2.965 N/A ALA 213.A N LEU 45.A O no hydrogen 2.745 N/A ILE 214.A N THR 222.A O no hydrogen 3.106 N/A VAL 215.A N ALA 43.A O no hydrogen 3.148 N/A GLY 216.A N THR 219.A O no hydrogen 2.944 N/A LYS 217.A N THR 41.A O no hydrogen 3.133 N/A THR 219.A N GLY 216.A O no hydrogen 2.579 N/A PHE 221.A N GLU 67.A O no hydrogen 2.863 N/A THR 222.A N ILE 214.A O no hydrogen 3.003 N/A THR 222.A OG1 PRO 220.A O no hydrogen 3.490 N/A TYR 224.A N ILE 212.A O no hydrogen 2.659 N/A VAL 229.A N GLY 226.A O no hydrogen 2.660 N/A ALA 230.A N GLU 227.A O no hydrogen 2.911 N/A LYS 231.A NZ ALA 228.A O no hydrogen 3.050 N/A TYR 232.A N VAL 229.A O no hydrogen 2.929 N/A TYR 232.A OH ASP 186.A OD1 no hydrogen 2.601 N/A ILE 233.A N ALA 230.A O no hydrogen 3.087 N/A THR 177B.A N THR 174.A O no hydrogen 2.702 N/A THR 206B.A OG1 ASP 208D.A OD1 no hydrogen 3.046 N/A PHE 178C.A N THR 174.A O no hydrogen 3.256 N/A ILE 179D.A N LEU 175.A O no hydrogen 3.156 N/A LYS 180E.A N THR 177B.A O no hydrogen 3.169 N/A ILE 181F.A N PHE 178C.A O no hydrogen 2.767 N/A