Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6pvd_D.pdb H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 2.D NE2 ASP 92.D OD2 no hydrogen 3.093 N/A ASN 3.D N GLN 25.D O no hydrogen 2.996 N/A ASN 3.D ND2.B ASP 5.D OD2 no hydrogen 2.379 N/A ASN 3.D ND2.B GLN 25.D OE1 no hydrogen 2.951 N/A ASP 5.D N THR 23.D O no hydrogen 2.858 N/A GLN 6.D NE2 TYR 86.D O no hydrogen 2.854 N/A GLN 6.D NE2 THR 103.D OG1 no hydrogen 3.162 N/A MET 10.D N LYS 104.D O no hydrogen 2.967 N/A ALA 12.D N ILE 106.D O no hydrogen 3.053 N/A GLU 14.D N LYS 108.D O no hydrogen 2.827 N/A GLY 15.D N LEU 78.D O no hydrogen 2.635 N/A ALA 16.D N THR 13.D O no hydrogen 3.020 N/A VAL 18.D N LEU 75.D O no hydrogen 3.079 N/A GLN 19.D NE2 ASN 21.D OD1 no hydrogen 2.875 N/A ILE 20.D N LEU 73.D O no hydrogen 2.852 N/A CYS 22.D N SER 71.D O no hydrogen 2.742 N/A THR 23.D N ASP 5.D O no hydrogen 2.915 N/A TYR 24.D N GLY 69.D O no hydrogen 3.092 N/A GLN 25.D N ASN 3.D O no hydrogen 2.912 N/A THR 26.D OG1 GLY 28.D O no hydrogen 2.826 N/A SER 27.D N GLN 2.D OE1 no hydrogen 2.702 N/A SER 27.D OG GLN 2.D OE1 no hydrogen 2.831 N/A ASN 30.D N LYS 91.D O no hydrogen 2.798 N/A ASN 30.D ND2 ASP 92.D O no hydrogen 2.959 N/A LEU 32.D N ASN 49.D O no hydrogen 2.752 N/A PHE 33.D N ALA 89.D O no hydrogen 2.728 N/A TRP 34.D N SER 47.D O no hydrogen 2.979 N/A TRP 34.D NE1 SER 71.D OG no hydrogen 3.178 N/A TYR 35.D N LEU 87.D O no hydrogen 2.825 N/A GLN 36.D N THR 44.D O no hydrogen 2.938 N/A GLN 36.D NE2 TYR 86.D OH no hydrogen 2.969 N/A GLN 37.D N SER 85.D O no hydrogen 2.740 N/A GLN 37.D NE2 GLU 41.D O no hydrogen 3.008 N/A HIS 38.D NE2 LYS 81.D O no hydrogen 2.939 N/A GLU 41.D N HIS 38.D O no hydrogen 2.931 N/A THR 44.D N GLN 36.D O no hydrogen 2.843 N/A THR 44.D OG1 GLN 36.D O no hydrogen 3.443 N/A LEU 46.D N TRP 34.D O no hydrogen 2.756 N/A SER 47.D N TRP 34.D O no hydrogen 3.251 N/A SER 47.D OG SER 62.D OG.B no hydrogen 2.612 N/A TYR 48.D OH ASN 30.D O no hydrogen 2.852 N/A ASN 49.D N LEU 32.D O no hydrogen 2.920 N/A ASN 49.D ND2 SER 62.D O no hydrogen 3.224 N/A GLY 53.D N LEU 64.D O no hydrogen 3.268 N/A GLU 55.D N SER 62.D O no hydrogen 2.819 N/A LYS 57.D N PHE 60.D O no hydrogen 2.666 N/A LYS 57.D NZ LEU 46.D O no hydrogen 2.961 N/A ARG 59.D NH1 LYS 76.D O no hydrogen 2.973 N/A ARG 59.D NH1 ASP 82.D OD1 no hydrogen 3.007 N/A ARG 59.D NH2 ASP 82.D OD1 no hydrogen 3.269 N/A ARG 59.D NH2 ASP 82.D OD2 no hydrogen 2.867 N/A PHE 60.D N LYS 57.D O no hydrogen 3.148 N/A SER 61.D N LEU 74.D O no hydrogen 2.848 N/A SER 62.D N GLU 55.D O no hydrogen 2.804 N/A SER 62.D OG.A ASN 49.D OD1 no hydrogen 2.822 N/A SER 62.D OG.A GLU 55.D O no hydrogen 3.557 N/A SER 62.D OG.B SER 47.D OG no hydrogen 2.612 N/A PHE 63.D N TYR 72.D O no hydrogen 3.003 N/A LEU 64.D N GLY 53.D O no hydrogen 3.049 N/A SER 65.D N TYR 70.D O no hydrogen 3.023 N/A ARG 66.D N ASP 52.D OD2 no hydrogen 2.693 N/A ARG 66.D NE.A ASP 52.D OD1 no hydrogen 3.461 N/A ARG 66.D NE.A ASP 52.D OD2 no hydrogen 3.432 N/A ARG 66.D NH2.A ASP 52.D OD1 no hydrogen 2.981 N/A LYS 68.D N SER 65.D OG no hydrogen 3.256 N/A GLY 69.D N ARG 66.D O no hydrogen 3.304 N/A TYR 70.D N SER 65.D O no hydrogen 3.231 N/A SER 71.D N CYS 22.D O no hydrogen 2.718 N/A SER 71.D OG PHE 63.D O no hydrogen 2.563 N/A TYR 72.D N PHE 63.D O no hydrogen 3.271 N/A LEU 73.D N ILE 20.D O no hydrogen 2.831 N/A LEU 74.D N SER 61.D O no hydrogen 2.686 N/A LEU 75.D N VAL 18.D O no hydrogen 2.970 N/A LYS 76.D N ARG 59.D O no hydrogen 3.047 N/A LEU 78.D N ALA 16.D O no hydrogen 3.039 N/A GLN 79.D N ASP 82.D OD1 no hydrogen 2.733 N/A ASP 82.D N GLN 79.D O no hydrogen 2.980 N/A SER 83.D N MET 80.D O no hydrogen 3.041 N/A SER 83.D OG MET 80.D O no hydrogen 2.908 N/A SER 85.D N GLN 37.D O no hydrogen 2.915 N/A TYR 86.D N THR 103.D O no hydrogen 2.813 N/A TYR 86.D OH ASP 82.D O no hydrogen 2.734 N/A LEU 87.D N TYR 35.D O no hydrogen 2.830 N/A CYS 88.D N GLN 6.D OE1 no hydrogen 3.222 N/A ALA 89.D N PHE 33.D O no hydrogen 2.957 N/A VAL 90.D N ILE 98.D O no hydrogen 3.014 N/A LYS 91.D N GLY 31.D O no hydrogen 3.067 N/A ASP 92.D N GLN 96.D O no hydrogen 3.066 N/A SER 93.D N SER 27.D O no hydrogen 3.014 N/A SER 93.D OG.B SER 27.D O no hydrogen 3.152 N/A ASN 94.D N ASP 92.D OD1 no hydrogen 2.917 N/A TYR 95.D N ASP 92.D O no hydrogen 2.921 N/A GLN 96.D N ASP 92.D OD1 no hydrogen 2.861 N/A ILE 98.D N VAL 90.D O no hydrogen 2.817 N/A GLY 100.D N CYS 88.D O no hydrogen 2.778 N/A GLY 102.D N GLN 6.D OE1 no hydrogen 2.917 N/A THR 103.D N TYR 86.D O no hydrogen 2.955 N/A THR 103.D OG1 PRO 7.D O no hydrogen 2.537 N/A LYS 104.D N THR 8.D O no hydrogen 3.047 N/A LEU 105.D N ALA 84.D O no hydrogen 2.859 N/A ILE 106.D N MET 10.D O no hydrogen 2.835 N/A LYS 108.D N ALA 12.D O no hydrogen 2.816 N/A ASP 110.D N GLU 14.D OE2 no hydrogen 2.935 N/A ASP 115.D N ASP 136.D O no hydrogen 2.795 N/A ALA 117.D N THR 135.D O no hydrogen 3.199 N/A VAL 118.D N PHE 196.D O no hydrogen 3.068 N/A TYR 119.D N LEU 133.D O no hydrogen 2.841 N/A LEU 121.D N VAL 131.D O no hydrogen 2.773 N/A LYS 125.D N ASP 123.D OD2 no hydrogen 2.963 N/A VAL 131.D N LEU 121.D O no hydrogen 3.353 N/A CYS 132.D N ALA 173.D O no hydrogen 2.824 N/A LEU 133.D N TYR 119.D O no hydrogen 2.732 N/A PHE 134.D N ALA 171.D O no hydrogen 2.869 N/A THR 135.D N ALA 117.D O no hydrogen 2.986 N/A THR 135.D OG1 ASP 136.D OD1 no hydrogen 2.940 N/A THR 135.D OG1 ASN 169.D O no hydrogen 3.121 N/A ASP 136.D N ASN 169.D O no hydrogen 2.997 N/A SER 139.D OG PRO 109.D O no hydrogen 2.480 N/A GLN 140.D N ASP 138.D OD2 no hydrogen 3.425 N/A THR 141.D N ASP 138.D O no hydrogen 2.996 N/A THR 141.D OG1 ASP 138.D O no hydrogen 3.396 N/A SER 144.D N SER 189.D OG no hydrogen 2.899 N/A SER 146.D OG ASP 148.D O no hydrogen 3.111 N/A SER 146.D OG VAL 151.D O no hydrogen 2.532 N/A ASP 150.D N ASP 148.D OD1 no hydrogen 3.096 N/A VAL 151.D N ASP 148.D O no hydrogen 3.276 N/A TYR 152.D N TRP 174.D O no hydrogen 2.995 N/A THR 154.D N VAL 172.D O no hydrogen 2.931 N/A THR 154.D OG1 ASP 155.D O no hydrogen 3.364 N/A THR 154.D OG1 VAL 172.D O no hydrogen 3.529 N/A LYS 156.D NZ THR 141.D O no hydrogen 3.018 N/A CYS 157.D N SER 170.D O no hydrogen 2.766 N/A LEU 159.D N SER 168.D O no hydrogen 2.826 N/A MET 161.D N PHE 166.D O no hydrogen 2.951 N/A ASP 165.D N ARG 162.D O no hydrogen 3.135 N/A PHE 166.D N MET 161.D O no hydrogen 3.297 N/A LYS 167.D NZ GLU 14.D OE1 no hydrogen 3.344 N/A SER 168.D N LEU 159.D O no hydrogen 3.104 N/A ASN 169.D ND2 PHE 137.D O no hydrogen 3.052 N/A ASN 169.D ND2 SER 139.D OG no hydrogen 3.314 N/A SER 170.D N CYS 157.D O no hydrogen 2.975 N/A ALA 171.D N PHE 134.D O no hydrogen 2.643 N/A VAL 172.D N THR 154.D OG1 no hydrogen 3.181 N/A ALA 173.D N CYS 132.D O no hydrogen 2.981 N/A TRP 174.D N TYR 152.D O no hydrogen 3.030 N/A SER 175.D OG ASP 150.D O no hydrogen 2.618 N/A PHE 180.D N LYS 177.D O no hydrogen 2.904 N/A ASN 184.D N ALA 181.D O no hydrogen 3.214 N/A ALA 185.D N CYS 182.D O no hydrogen 3.475 N/A ASN 187.D N ASN 184.D O no hydrogen 3.469 N/A SER 189.D N PHE 186.D O no hydrogen 3.278 N/A THR 195.D N PRO 192.D O no hydrogen 3.217 N/A THR 195.D OG1 PRO 192.D O no hydrogen 2.428 N/A PHE 196.D N PRO 116.D O no hydrogen 2.954 N/A