Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1p2q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 2.A N ALA 116.A O no hydrogen 2.945 N/A GLN 7.A NE2 PRO 4.A O no hydrogen 3.190 N/A SER 11.A N GLU 16.A OE2 no hydrogen 2.935 N/A SER 11.A OG GLU 16.A OE1 no hydrogen 2.564 N/A SER 11.A OG GLU 16.A OE2 no hydrogen 3.567 N/A ILE 12.A N GLY 138.A O no hydrogen 3.181 N/A VAL 13.A N SER 183.A O no hydrogen 2.749 N/A GLU 16.A N GLN 151.A O no hydrogen 2.766 N/A ALA 18.A N LEU 149.A O no hydrogen 2.988 N/A SER 22.A N VAL 19.A O no hydrogen 3.016 N/A SER 22.A OG VAL 19.A O no hydrogen 2.646 N/A TRP 23.A NE1 GLN 151.A OE1 no hydrogen 2.802 N/A GLN 26.A N TRP 23.A O no hydrogen 2.969 N/A GLN 26.A NE2 VAL 27.A O no hydrogen 3.047 N/A VAL 27.A N GLY 40.A O no hydrogen 3.013 N/A SER 28.A N VAL 63.A O no hydrogen 2.947 N/A SER 28.A OG GLN 30.A OE1 no hydrogen 3.049 N/A SER 28.A OG HIS 36.A ND1 no hydrogen 2.662 N/A SER 28.A OG GLN 69.A OE1 no hydrogen 3.017 N/A LEU 29.A N CYS 38.A O no hydrogen 2.751 N/A GLN 30.A N VAL 61.A O.A no hydrogen 2.991 N/A GLN 30.A N VAL 61.A O.B no hydrogen 2.998 N/A ASP 31.A N PHE 35.A O no hydrogen 3.051 N/A THR 33.A N ASP 31.A OD1 no hydrogen 2.837 N/A THR 33.A OG1 ASP 31.A OD1 no hydrogen 2.677 N/A THR 33.A OG1 ASP 31.A OD2 no hydrogen 3.569 N/A GLY 34.A N ASP 31.A O no hydrogen 2.938 N/A PHE 35.A N ASP 31.A OD1 no hydrogen 2.957 N/A HIS 36.A ND1 SER 28.A OG no hydrogen 2.662 N/A HIS 36.A NE2 GLY 187.A O no hydrogen 2.935 N/A PHE 37.A N LEU 29.A O no hydrogen 2.991 N/A CYS 38.A SG PHE 37.A O no hydrogen 2.948 N/A CYS 38.A SG SER 189.A O no hydrogen 3.604 N/A GLY 39.A N SER 189.A O no hydrogen 2.734 N/A GLY 40.A N VAL 27.A O no hydrogen 3.160 N/A SER 41.A N VAL 49.A O no hydrogen 2.948 N/A LEU 42.A N TRP 25.A O no hydrogen 2.907 N/A ILE 43.A N TRP 47.A O no hydrogen 3.024 N/A GLU 45.A N GLU 45.A OE1 no hydrogen 2.661 N/A ASN 46.A N ASN 44.A OD1 no hydrogen 2.730 N/A TRP 47.A N ASN 44.A OD1 no hydrogen 2.823 N/A VAL 48.A N LEU 102.A O no hydrogen 2.914 N/A VAL 49.A N SER 41.A O no hydrogen 2.840 N/A THR 50.A N THR 100.A O no hydrogen 2.875 N/A THR 50.A OG1 GLY 39.A O no hydrogen 2.909 N/A ALA 51.A N THR 50.A OG1 no hydrogen 2.673 N/A HIS 53.A N ASP 98.A OD1 no hydrogen 2.881 N/A HIS 53.A ND1 ASP 98.A OD2 no hydrogen 2.633 N/A HIS 53.A NE2 SER 189.A OG no hydrogen 2.693 N/A CYS 54.A N ALA 51.A O no hydrogen 3.321 N/A GLY 55.A N ALA 52.A O no hydrogen 3.169 N/A THR 57.A N ASP 60.A OD2 no hydrogen 2.881 N/A THR 57.A OG1 ASP 60.A OD2 no hydrogen 3.423 N/A SER 59.A N.A THR 57.A OG1 no hydrogen 3.143 N/A SER 59.A N.B THR 57.A OG1 no hydrogen 3.135 N/A ASP 60.A N THR 57.A O no hydrogen 3.063 N/A VAL 61.A N.A GLN 30.A O no hydrogen 2.787 N/A VAL 61.A N.B GLN 30.A O no hydrogen 2.793 N/A VAL 62.A N LEU 79.A O no hydrogen 2.837 N/A VAL 63.A N SER 28.A O no hydrogen 2.829 N/A ALA 64.A N GLN 77.A O no hydrogen 2.933 N/A PHE 67.A N GLU 74.A OE1 no hydrogen 2.999 N/A ASP 68.A N GLU 74.A OE2 no hydrogen 2.875 N/A GLN 69.A N ASP 147.A O no hydrogen 2.769 N/A GLY 70.A N ASP 68.A OD1 no hydrogen 2.725 N/A SER 71.A N ASP 68.A O no hydrogen 3.051 N/A SER 73.A OG SER 71.A OG no hydrogen 3.405 N/A GLU 74.A N SER 71.A OG no hydrogen 3.140 N/A GLN 77.A N ALA 64.A O no hydrogen 3.000 N/A GLN 77.A NE2 SER 109.A O no hydrogen 2.787 N/A LEU 79.A N VAL 62.A O no hydrogen 2.686 N/A ALA 82.A N LYS 103.A O no hydrogen 2.719 N/A LYS 83.A N LYS 103.A O no hydrogen 3.181 N/A PHE 85.A N LEU 101.A O no hydrogen 2.738 N/A ASN 87.A N ILE 99.A O no hydrogen 3.179 N/A LYS 89.A N ASN 87.A OD1 no hydrogen 2.804 N/A TYR 90.A N ASN 87.A O no hydrogen 2.987 N/A ASN 91.A N ASN 96.A O no hydrogen 2.954 N/A LEU 93.A N ASN 91.A OD1 no hydrogen 2.854 N/A THR 94.A N ASN 91.A OD1 no hydrogen 2.931 N/A ILE 95.A N ASN 91.A O no hydrogen 2.690 N/A ASN 96.A N THR 94.A OG1 no hydrogen 3.247 N/A ASN 96.A ND2 ASP 172.A OD1 no hydrogen 2.930 N/A ASN 97.A ND2 LYS 89.A O no hydrogen 3.004 N/A ILE 99.A N ASN 97.A O no hydrogen 2.984 N/A THR 100.A N THR 50.A O no hydrogen 2.910 N/A LEU 101.A N PHE 85.A O no hydrogen 2.839 N/A LEU 102.A N VAL 48.A O no hydrogen 2.719 N/A LYS 103.A N LYS 83.A O no hydrogen 2.901 N/A LYS 103.A NZ ASN 239.A O no hydrogen 2.842 N/A LEU 104.A N ASN 46.A O no hydrogen 2.923 N/A SER 105.A N LYS 80.A O no hydrogen 2.924 N/A ALA 108.A N GLU 45.A O no hydrogen 2.806 N/A SER 109.A N GLN 77.A OE1 no hydrogen 2.789 N/A SER 111.A N VAL 114.A O no hydrogen 2.726 N/A THR 113.A N SER 111.A OG no hydrogen 3.407 N/A VAL 114.A N SER 111.A O no hydrogen 3.317 N/A SER 115.A N PRO 24.A O no hydrogen 3.190 N/A VAL 117.A N LEU 42.A O no hydrogen 3.004 N/A CYS 118.A N TRP 201.A O no hydrogen 3.202 N/A SER 121.A N ASP 124.A OD2 no hydrogen 2.499 N/A ASP 124.A N SER 121.A O no hydrogen 2.880 N/A GLY 129.A N LEU 156.A O no hydrogen 2.788 N/A THR 130.A N ALA 127.A O no hydrogen 3.157 N/A THR 130.A OG1 ALA 127.A O no hydrogen 2.541 N/A CYS 132.A N LEU 154.A O no hydrogen 2.784 N/A CYS 132.A SG THR 130.A O no hydrogen 3.795 N/A VAL 133.A N VAL 194.A O no hydrogen 2.813 N/A THR 134.A N ALA 152.A O no hydrogen 3.037 N/A THR 134.A OG1 PRO 192.A O no hydrogen 2.838 N/A THR 135.A OG1 GLN 26.A OE1 no hydrogen 2.634 N/A GLY 136.A N GLN 150.A O no hydrogen 3.106 N/A TRP 137.A NE1 PHE 67.A O no hydrogen 3.016 N/A GLY 138.A N ASP 188.A OD1 no hydrogen 2.799 N/A LEU 139.A N MET 186.A O.A no hydrogen 2.891 N/A LEU 139.A N MET 186.A O.B no hydrogen 2.906 N/A LEU 149.A N PHE 67.A O no hydrogen 2.948 N/A GLN 150.A N GLY 136.A O no hydrogen 3.048 N/A GLN 150.A NE2 ARG 148.A O no hydrogen 2.978 N/A GLN 151.A N GLU 16.A O no hydrogen 2.748 N/A GLN 151.A NE2 VAL 9.A O no hydrogen 2.812 N/A GLN 151.A NE2 GLU 16.A OE2 no hydrogen 3.089 N/A ALA 152.A N THR 134.A O no hydrogen 3.101 N/A LEU 154.A N CYS 132.A O no hydrogen 2.843 N/A LEU 156.A N THR 130.A O no hydrogen 2.979 N/A LEU 157.A N CYS 176.A O no hydrogen 2.843 N/A ASN 161.A N SER 158.A OG no hydrogen 3.059 N/A CYS 162.A N SER 158.A O no hydrogen 2.902 N/A LYS 163.A N ASN 159.A O no hydrogen 2.856 N/A LYS 164.A N ASN 161.A O no hydrogen 3.160 N/A TYR 165.A N CYS 162.A O no hydrogen 2.922 N/A TRP 166.A N CYS 162.A O no hydrogen 3.078 N/A TRP 166.A NE1 PRO 219.A O no hydrogen 3.001 N/A GLY 167.A N LYS 163.A O no hydrogen 2.800 N/A LYS 169.A N TRP 166.A O no hydrogen 3.106 N/A ILE 170.A N GLY 167.A O no hydrogen 3.403 N/A LYS 171.A NZ THR 168.A O no hydrogen 2.789 N/A ALA 173.A N ASN 96.A OD1 no hydrogen 3.077 N/A MET 174.A N LYS 171.A O no hydrogen 3.149 N/A ILE 175.A N TYR 222.A O no hydrogen 2.784 N/A ALA 177.A N GLY 220.A O no hydrogen 2.989 N/A GLY 178.A N PRO 155.A O no hydrogen 3.021 N/A GLY 181.A N THR 216.A O no hydrogen 2.936 N/A SER 183.A N VAL 13.A O no hydrogen 3.232 N/A SER 183.A OG SER 184.A O no hydrogen 2.693 N/A SER 184.A OG TYR 222.A OH no hydrogen 2.725 N/A CYS 185.A N ASP 188.A OD2 no hydrogen 2.816 N/A ASP 188.A N CYS 185.A O no hydrogen 2.808 N/A SER 189.A OG HIS 53.A NE2 no hydrogen 2.693 N/A SER 189.A OG SER 208.A O no hydrogen 3.455 N/A GLY 190.A N VAL 207.A O no hydrogen 2.941 N/A GLY 191.A N ASP 188.A O no hydrogen 2.977 N/A LEU 193.A N GLY 205.A O no hydrogen 2.976 N/A VAL 194.A N VAL 133.A O no hydrogen 2.735 N/A CYS 195.A N THR 202.A O no hydrogen 3.017 N/A LYS 197.A N ALA 200.A O no hydrogen 2.770 N/A LYS 197.A NZ ASP 124.A OD1 no hydrogen 3.184 N/A LYS 197.A NZ ASP 124.A OD2 no hydrogen 2.709 N/A ALA 200.A N LYS 197.A O no hydrogen 3.090 N/A TRP 201.A N GLY 2.A O no hydrogen 2.919 N/A THR 202.A N CYS 195.A O no hydrogen 2.785 N/A THR 202.A OG1 ALA 200.A O no hydrogen 3.077 N/A LEU 203.A N CYS 118.A O no hydrogen 2.819 N/A VAL 204.A N LEU 193.A O no hydrogen 2.927 N/A GLY 205.A N LEU 193.A O no hydrogen 3.073 N/A ILE 206.A N ALA 223.A O no hydrogen 3.140 N/A VAL 207.A N GLY 191.A O no hydrogen 2.943 N/A SER 208.A OG ASP 98.A OD2 no hydrogen 2.589 N/A TRP 209.A N VAL 221.A O no hydrogen 3.004 N/A THR 213.A N SER 211.A OG no hydrogen 3.248 N/A THR 213.A OG1 SER 211.A OG no hydrogen 3.322 N/A CYS 214.A N SER 211.A O no hydrogen 3.168 N/A CYS 214.A SG SER 184.A O no hydrogen 3.855 N/A SER 215.A N SER 211.A OG no hydrogen 3.001 N/A SER 217.A N SER 215.A OG no hydrogen 3.321 N/A SER 217.A OG SER 215.A OG no hydrogen 3.124 N/A THR 218.A N SER 215.A O no hydrogen 3.346 N/A GLY 220.A N ALA 177.A O no hydrogen 2.802 N/A VAL 221.A N TRP 209.A O no hydrogen 2.777 N/A TYR 222.A N ILE 175.A O no hydrogen 2.752 N/A TYR 222.A OH SER 184.A OG no hydrogen 2.725 N/A ALA 223.A N ILE 206.A O no hydrogen 2.901 N/A ARG 224.A N ALA 173.A O no hydrogen 2.741 N/A ARG 224.A NE MET 174.A O no hydrogen 3.047 N/A ARG 224.A NH2 MET 174.A O no hydrogen 3.081 N/A VAL 225.A N VAL 204.A O no hydrogen 3.063 N/A ALA 227.A N ARG 224.A O no hydrogen 3.095 N/A LEU 228.A N VAL 225.A O no hydrogen 2.959 N/A VAL 232.A N LEU 228.A O no hydrogen 3.106 N/A GLN 233.A N VAL 229.A O no hydrogen 2.823 N/A GLN 234.A N ASN 230.A O no hydrogen 2.987 N/A THR 235.A N TRP 231.A O no hydrogen 2.999 N/A THR 235.A OG1 TRP 231.A O no hydrogen 2.747 N/A LEU 236.A N VAL 232.A O no hydrogen 3.008 N/A ALA 237.A N GLN 233.A O no hydrogen 2.959 N/A ALA 238.A N GLN 234.A O no hydrogen 3.059 N/A ASN 239.A N LEU 236.A O no hydrogen 3.044 N/A ASN 239.A ND2 THR 235.A O no hydrogen 2.865 N/A