Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1pto_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 6.A N VAL 90.A O no hydrogen 2.849 N/A TYR 7.A N SER 53.A O no hydrogen 2.850 N/A ARG 8.A NE SER 51.A O no hydrogen 3.239 N/A ARG 8.A NH1 TYR 9.A O no hydrogen 3.260 N/A ASP 10.A N TYR 86.A O no hydrogen 2.937 N/A SER 11.A N ALA 205.A O no hydrogen 3.151 N/A SER 11.A OG ALA 205.A O no hydrogen 2.973 N/A SER 11.A OG SER 207.A OG no hydrogen 3.292 N/A ARG 12.A N ASP 10.A OD1 no hydrogen 2.878 N/A ARG 12.A NH2 GLN 204.A O no hydrogen 3.557 N/A GLU 15.A N GLU 15.A OE1 no hydrogen 2.727 N/A ASP 16.A N PRO 13.A O no hydrogen 2.791 N/A VAL 17.A N PRO 13.A O no hydrogen 2.983 N/A PHE 18.A N PRO 14.A O no hydrogen 2.748 N/A GLN 19.A N ASP 16.A O no hydrogen 3.337 N/A ASN 20.A N VAL 17.A O no hydrogen 2.928 N/A ASN 20.A ND2 ASP 16.A O no hydrogen 2.794 N/A ASN 20.A ND2 ASP 16.A OD1 no hydrogen 3.240 N/A GLY 21.A N VAL 17.A O no hydrogen 2.751 N/A PHE 22.A N ILE 135.A O no hydrogen 2.739 N/A ALA 24.A N ARG 133.A O no hydrogen 3.047 N/A GLY 26.A N SER 47.A O no hydrogen 3.098 N/A ASN 28.A N ASN 46.A O no hydrogen 2.907 N/A ASN 28.A ND2 GLU 33.A OE1 no hydrogen 3.047 N/A ASN 30.A N ASN 28.A OD1 no hydrogen 2.851 N/A VAL 31.A N SER 179.A OG no hydrogen 2.739 N/A GLU 33.A N ASN 30.A OD1 no hydrogen 2.691 N/A HIS 34.A N ASN 30.A O no hydrogen 3.169 N/A HIS 34.A NE2 GLU 128.A OE2 no hydrogen 2.843 N/A LEU 35.A N VAL 31.A O no hydrogen 2.766 N/A THR 36.A N LEU 32.A O no hydrogen 2.851 N/A THR 36.A OG1 GLY 188.A O no hydrogen 3.162 N/A GLY 37.A N HIS 34.A O no hydrogen 2.768 N/A SER 39.A N GLU 33.A O no hydrogen 3.182 N/A CYS 40.A N GLY 37.A O no hydrogen 2.911 N/A CYS 40.A SG HIS 34.A ND1 no hydrogen 3.482 N/A GLN 41.A N ARG 38.A O no hydrogen 3.412 N/A GLN 41.A NE2 ARG 38.A O no hydrogen 3.669 N/A SER 44.A OG ARG 38.A O no hydrogen 3.003 N/A SER 45.A OG CYS 40.A O no hydrogen 3.367 N/A SER 45.A OG GLN 41.A O no hydrogen 2.805 N/A ASN 46.A N SER 39.A O no hydrogen 2.611 N/A SER 47.A N SER 39.A O no hydrogen 2.919 N/A SER 47.A OG HIS 34.A ND1 no hydrogen 2.984 N/A ALA 48.A N ASN 28.A O no hydrogen 2.782 N/A VAL 50.A N ALA 131.A O no hydrogen 2.797 N/A SER 51.A N GLN 204.A OE1 no hydrogen 2.813 N/A SER 51.A OG GLU 128.A OE2 no hydrogen 3.243 N/A THR 52.A N TYR 129.A O no hydrogen 3.107 N/A THR 52.A OG1 TYR 129.A O no hydrogen 2.909 N/A SER 53.A N TYR 7.A O no hydrogen 3.036 N/A SER 53.A OG SER 55.A O no hydrogen 3.417 N/A SER 53.A OG GLN 126.A O no hydrogen 2.934 N/A SER 54.A N SER 127.A O no hydrogen 2.995 N/A SER 55.A N SER 53.A OG no hydrogen 2.998 N/A ARG 56.A NE GLU 60.A OE2 no hydrogen 3.446 N/A ARG 57.A NH1 GLU 60.A OE1 no hydrogen 3.461 N/A TYR 58.A N SER 55.A OG no hydrogen 3.152 N/A TYR 58.A OH GLN 126.A OE1 no hydrogen 3.001 N/A TYR 58.A OH VAL 196.A O no hydrogen 3.397 N/A THR 59.A N SER 55.A O no hydrogen 3.283 N/A THR 59.A OG1 SER 55.A O no hydrogen 3.353 N/A THR 59.A OG1 ARG 56.A O no hydrogen 2.327 N/A GLU 60.A N ARG 56.A O no hydrogen 2.775 N/A VAL 61.A N ARG 57.A O no hydrogen 2.979 N/A TYR 62.A N TYR 58.A O no hydrogen 3.176 N/A LEU 63.A N THR 59.A O no hydrogen 3.004 N/A GLU 64.A N GLU 60.A O no hydrogen 2.671 N/A HIS 65.A N VAL 61.A O no hydrogen 2.958 N/A HIS 65.A N TYR 62.A O no hydrogen 2.805 N/A ARG 66.A N TYR 62.A O no hydrogen 2.686 N/A ARG 66.A NE GLU 69.A OE1 no hydrogen 3.300 N/A ARG 66.A NH1 GLU 206.A OE2 no hydrogen 3.212 N/A ARG 66.A NH2 GLU 206.A OE1 no hydrogen 3.380 N/A MET 67.A N LEU 63.A O no hydrogen 2.860 N/A GLU 69.A N HIS 65.A O no hydrogen 2.952 N/A ALA 70.A N ARG 66.A O no hydrogen 3.379 N/A VAL 71.A N MET 67.A O no hydrogen 3.304 N/A GLU 72.A N GLN 68.A O no hydrogen 2.966 N/A ALA 73.A N GLU 69.A O no hydrogen 2.895 N/A ALA 73.A N ALA 70.A O no hydrogen 2.781 N/A GLU 74.A N ALA 70.A O no hydrogen 2.892 N/A ARG 75.A N VAL 71.A O no hydrogen 2.758 N/A ALA 76.A N ALA 73.A O no hydrogen 2.711 N/A GLY 77.A N ALA 73.A O no hydrogen 2.834 N/A GLY 77.A N GLU 74.A O no hydrogen 2.608 N/A ARG 78.A N ALA 73.A O no hydrogen 2.915 N/A HIS 82.A N THR 80.A OG1 no hydrogen 3.410 N/A PHE 83.A N HIS 148.A O no hydrogen 2.892 N/A GLY 85.A N VAL 146.A O no hydrogen 2.900 N/A TYR 86.A N ASP 10.A O no hydrogen 3.118 N/A ILE 87.A N THR 144.A O no hydrogen 3.195 N/A TYR 88.A N ARG 8.A O no hydrogen 3.051 N/A TYR 88.A OH ARG 12.A O no hydrogen 2.427 N/A GLU 89.A N ARG 142.A O no hydrogen 3.407 N/A VAL 90.A N VAL 6.A O no hydrogen 2.951 N/A ARG 91.A N ASN 139.A O no hydrogen 2.890 N/A ALA 92.A N ALA 4.A O no hydrogen 2.627 N/A PHE 96.A N ASP 93.A O no hydrogen 3.257 N/A TYR 97.A N LEU 130.A O no hydrogen 2.763 N/A ALA 99.A N GLU 128.A O no hydrogen 3.087 N/A SER 102.A N GLY 98.A O no hydrogen 3.243 N/A SER 102.A OG GLY 98.A O no hydrogen 2.649 N/A TYR 103.A N ALA 99.A O no hydrogen 2.784 N/A PHE 104.A N ALA 100.A O no hydrogen 2.909 N/A GLU 105.A N SER 101.A O no hydrogen 2.769 N/A TYR 106.A N SER 102.A O no hydrogen 2.909 N/A VAL 107.A N TYR 103.A O no hydrogen 2.976 N/A ASP 108.A N PHE 104.A O no hydrogen 3.242 N/A THR 109.A OG1 GLU 105.A O no hydrogen 2.990 N/A THR 109.A OG1 GLU 105.A OE1 no hydrogen 3.510 N/A TYR 110.A N VAL 107.A O no hydrogen 2.946 N/A TYR 110.A OH SER 179.A O no hydrogen 2.975 N/A GLY 111.A N VAL 107.A O no hydrogen 2.698 N/A ALA 114.A N GLY 111.A O no hydrogen 2.599 N/A ARG 116.A NH1 VAL 187.A O no hydrogen 2.821 N/A GLY 120.A N ILE 117.A O no hydrogen 2.883 N/A ALA 121.A N ILE 117.A O no hydrogen 3.083 N/A LEU 122.A N LEU 118.A O no hydrogen 2.648 N/A ALA 123.A N ALA 119.A O no hydrogen 3.413 N/A THR 124.A N GLY 120.A O no hydrogen 3.221 N/A TYR 125.A N ALA 121.A O no hydrogen 3.249 N/A TYR 125.A OH VAL 196.A O no hydrogen 2.753 N/A GLN 126.A N LEU 122.A O no hydrogen 3.090 N/A SER 127.A N THR 124.A O no hydrogen 3.167 N/A TYR 129.A N THR 52.A O no hydrogen 2.954 N/A LEU 130.A N TYR 97.A O no hydrogen 2.480 N/A ALA 131.A N VAL 50.A O no hydrogen 3.027 N/A HIS 132.A N ASN 95.A O no hydrogen 3.063 N/A ARG 133.A N ALA 48.A O no hydrogen 2.867 N/A ARG 133.A NH2 ASN 95.A OD1 no hydrogen 3.567 N/A ARG 134.A N HIS 132.A O no hydrogen 2.980 N/A ARG 134.A NH2 ASN 20.A O no hydrogen 3.500 N/A ILE 135.A N PHE 22.A O no hydrogen 2.750 N/A ASN 139.A N PRO 136.A O no hydrogen 2.965 N/A ILE 140.A N PRO 137.A O no hydrogen 2.912 N/A ARG 141.A N GLU 89.A O no hydrogen 3.068 N/A ARG 142.A NH1 GLU 89.A OE1 no hydrogen 3.139 N/A THR 144.A N ILE 87.A O no hydrogen 3.144 N/A THR 144.A OG1 GLU 159.A OE2 no hydrogen 3.185 N/A ARG 145.A N THR 158.A O no hydrogen 2.958 N/A VAL 146.A N GLY 85.A O no hydrogen 2.796 N/A TYR 147.A N THR 156.A O no hydrogen 3.050 N/A HIS 148.A N PHE 83.A O no hydrogen 2.645 N/A HIS 148.A ND1 THR 155.A OG1 no hydrogen 2.988 N/A ASN 149.A N GLU 154.A O no hydrogen 2.613 N/A GLY 150.A N GLY 81.A O no hydrogen 2.829 N/A ILE 151.A N ASN 149.A OD1 no hydrogen 3.201 N/A THR 152.A OG1 GLU 154.A OE1 no hydrogen 3.080 N/A GLU 154.A N ASN 149.A O no hydrogen 2.776 N/A THR 155.A OG1 HIS 148.A ND1 no hydrogen 2.988 N/A THR 156.A N TYR 147.A O no hydrogen 2.689 N/A THR 158.A N ARG 145.A O no hydrogen 3.308 N/A ASN 162.A ND2 PHE 18.A O no hydrogen 2.870 N/A ASN 162.A ND2 ILE 140.A O no hydrogen 3.470 N/A ARG 164.A N ASN 162.A OD1 no hydrogen 3.080 N/A ARG 164.A NH1 GLN 19.A OE1 no hydrogen 3.165 N/A TYR 165.A OH SER 167.A OG no hydrogen 3.340 N/A VAL 166.A N GLU 138.A O no hydrogen 2.660 N/A SER 167.A OG TYR 165.A OH no hydrogen 3.340 N/A ARG 171.A NH1 PRO 2.A O no hydrogen 2.533 N/A ALA 172.A N PRO 3.A O no hydrogen 2.608 N/A ASN 173.A N PHE 96.A O no hydrogen 2.894 N/A ASN 175.A N ASN 173.A OD1 no hydrogen 3.104 N/A TYR 177.A N SER 102.A OG no hydrogen 3.053 N/A TYR 177.A OH ASP 29.A OD2 no hydrogen 2.799 N/A SER 179.A OG ASP 29.A O no hydrogen 2.863 N/A SER 182.A N TYR 106.A OH no hydrogen 3.053 N/A SER 182.A OG ALA 184.A O no hydrogen 3.507 N/A THR 189.A N GLU 218.A OE1 no hydrogen 2.940 N/A THR 189.A N GLU 218.A OE2 no hydrogen 3.238 N/A THR 189.A OG1 GLU 218.A OE2 no hydrogen 2.649 N/A LEU 190.A N THR 36.A O no hydrogen 3.195 N/A VAL 191.A N VAL 215.A O no hydrogen 2.782 N/A ARG 192.A N VAL 197.A O no hydrogen 2.703 N/A ARG 192.A NH2 GLU 69.A OE2 no hydrogen 2.821 N/A VAL 197.A N ARG 192.A O no hydrogen 2.935 N/A GLY 198.A N GLN 126.A OE1 no hydrogen 2.491 N/A CYS 200.A SG HIS 34.A ND1 no hydrogen 3.004 N/A CYS 200.A SG HIS 34.A O no hydrogen 3.515 N/A ALA 202.A N GLY 198.A O no hydrogen 2.715 N/A ARG 203.A N ALA 199.A O no hydrogen 3.135 N/A ARG 203.A N CYS 200.A O no hydrogen 2.634 N/A ARG 203.A NE CYS 40.A O no hydrogen 2.737 N/A GLN 204.A N CYS 200.A O no hydrogen 2.704 N/A GLN 204.A NE2 PHE 49.A O no hydrogen 2.835 N/A SER 207.A OG SER 11.A OG no hydrogen 3.292 N/A SER 207.A OG GLU 209.A OE2 no hydrogen 3.032 N/A VAL 215.A N VAL 191.A O no hydrogen 2.936 N/A TYR 217.A N THR 189.A O no hydrogen 2.538 N/A SER 219.A N TYR 216.A O no hydrogen 2.851 N/A SER 219.A OG TYR 216.A O no hydrogen 2.452 N/A ILE 220.A N TYR 217.A O no hydrogen 3.195 N/A ALA 221.A N TYR 217.A O no hydrogen 2.922 N/A ALA 221.A N GLU 218.A O no hydrogen 3.324 N/A