Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1try_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ALA 125.A O no hydrogen 2.743 N/A ILE 1.A N ASP 179.A OD2 no hydrogen 2.774 N/A VAL 2.A N ASP 174.A O no hydrogen 2.681 N/A THR 5.A N LYS 139.A O no hydrogen 2.826 N/A ALA 7.A N LEU 137.A O no hydrogen 2.945 N/A SER 8.A N ASP 11.A OD2 no hydrogen 2.823 N/A ASP 11.A N SER 8.A O no hydrogen 2.937 N/A ILE 15.A N PHE 12.A O no hydrogen 3.060 N/A VAL 16.A N GLY 28.A O no hydrogen 2.962 N/A SER 17.A N ARG 54A.A O no hydrogen 3.001 N/A ILE 18.A N CYS 26.A O no hydrogen 2.863 N/A SER 19.A N GLN 52.A O no hydrogen 2.809 N/A SER 19.A OG GLN 52.A O no hydrogen 3.272 N/A ARG 20.A N GLY 23.A O no hydrogen 2.846 N/A ASN 21.A N GLY 50.A O no hydrogen 2.857 N/A GLY 23.A N ARG 20.A O no hydrogen 2.923 N/A TRP 25.A NE1 CYS 42.A O no hydrogen 2.761 N/A CYS 26.A N ILE 18.A O no hydrogen 2.989 N/A CYS 26.A SG TRP 25.A O no hydrogen 3.127 N/A GLY 27.A N SER 180.A O no hydrogen 2.878 N/A GLY 28.A N VAL 16.A O no hydrogen 2.985 N/A SER 29.A N LEU 37.A O no hydrogen 2.797 N/A LEU 30.A N PHE 14.A O no hydrogen 2.661 N/A LEU 31.A N THR 35.A O no hydrogen 2.947 N/A ASN 32.A ND2 ALA 224.A O no hydrogen 2.961 N/A ASN 34.A N ASN 32.A OD1 no hydrogen 3.138 N/A THR 35.A N ASN 32.A O no hydrogen 3.488 N/A THR 35.A OG1 ASN 32.A OD1 no hydrogen 2.748 N/A THR 35.A OG1 ASN 34.A OD1 no hydrogen 3.103 N/A VAL 36.A N LEU 88.A O no hydrogen 2.814 N/A LEU 37.A N SER 29.A O no hydrogen 2.760 N/A THR 38.A N ALA 86.A O no hydrogen 2.993 N/A THR 38.A OG1 GLY 27.A O no hydrogen 2.696 N/A HIS 41.A N ASP 84.A OD1 no hydrogen 2.891 N/A HIS 41.A ND1 ASP 84.A OD2 no hydrogen 2.588 N/A HIS 41.A NE2 SER 180.A OG no hydrogen 3.057 N/A CYS 42.A N ALA 39.A O no hydrogen 3.099 N/A CYS 42.A SG SER 180.A O no hydrogen 3.558 N/A VAL 43.A N ALA 40.A O no hydrogen 3.074 N/A GLY 50.A N ALA 47D.A O no hydrogen 3.252 N/A PHE 51.A N GLN 48.A O no hydrogen 3.341 N/A GLN 52.A N SER 19.A O no hydrogen 3.133 N/A ILE 53.A N SER 67.A O no hydrogen 2.880 N/A ALA 55.A N ILE 65.A O no hydrogen 2.798 N/A SER 57.A OG SER 59.A O no hydrogen 3.250 N/A SER 57.A OG SER 62.A O no hydrogen 2.727 N/A SER 59.A N SER 57.A OG no hydrogen 2.941 N/A ARG 60.A N VAL 135.A O no hydrogen 2.863 N/A ARG 60.A NE PRO 134.A O no hydrogen 2.722 N/A ARG 60.A NH2 THR 133.A O no hydrogen 2.945 N/A ARG 60.A NH2 PRO 134.A O no hydrogen 3.525 N/A THR 61.A N SER 59.A OG no hydrogen 2.978 N/A THR 61.A OG1 SER 59.A OG no hydrogen 3.136 N/A SER 62.A N SER 59.A OG no hydrogen 3.238 N/A ILE 65.A N ALA 55.A O no hydrogen 2.951 N/A SER 67.A N ILE 53.A O no hydrogen 3.020 N/A SER 67.A OG SER 68.A O no hydrogen 2.660 N/A SER 67.A OG THR 92.A O no hydrogen 3.497 N/A SER 68.A OG.A SER 91.A OG.A no hydrogen 2.654 N/A SER 70.A N LYS 89.A O no hydrogen 2.888 N/A SER 71.A N LYS 89.A O no hydrogen 3.429 N/A ARG 73.A N ILE 87.A O no hydrogen 2.814 N/A HIS 75.A N LEU 85.A O no hydrogen 2.855 N/A SER 77.A N HIS 75.A ND1 no hydrogen 3.083 N/A TYR 78.A N HIS 75.A O no hydrogen 3.054 N/A SER 79.A N ASN 82.A O no hydrogen 3.076 N/A ASN 82.A N SER 79.A O no hydrogen 2.717 N/A ASN 82.A ND2 GLN 162.A OE1 no hydrogen 3.117 N/A ASN 83.A ND2 SER 77.A O no hydrogen 3.122 N/A LEU 85.A N ASN 83.A O no hydrogen 2.897 N/A ALA 86.A N THR 38.A O no hydrogen 2.936 N/A ILE 87.A N ARG 73.A O no hydrogen 2.691 N/A LEU 88.A N VAL 36.A O no hydrogen 2.630 N/A LYS 89.A N SER 71.A O no hydrogen 2.859 N/A LYS 89.A NZ THR 35.A OG1 no hydrogen 2.681 N/A LYS 89.A NZ TYR 223.A O no hydrogen 3.054 N/A LYS 89.A NZ ALA 224.A O no hydrogen 3.147 N/A LEU 90.A N ASN 34.A O no hydrogen 2.856 N/A SER 91.A N SER 68.A O no hydrogen 2.978 N/A SER 91.A OG.A SER 68.A O no hydrogen 3.171 N/A SER 91.A OG.A SER 68.A OG.A no hydrogen 2.654 N/A THR 92.A N SER 67.A OG no hydrogen 3.040 N/A ILE 94.A N ALA 33.A O no hydrogen 2.814 N/A GLY 97.A N ILE 100.A O no hydrogen 2.882 N/A ILE 100.A N GLY 97.A O no hydrogen 3.033 N/A GLY 101.A N PRO 13.A O no hydrogen 3.052 N/A TYR 102.A OH ILE 94.A O no hydrogen 2.628 N/A ALA 103.A N LEU 30.A O no hydrogen 2.892 N/A ALA 106.A N LEU 191.A O no hydrogen 3.017 N/A GLY 109.A N GLY 214.A O no hydrogen 3.079 N/A SER 110.A N ALA 107.A O no hydrogen 3.049 N/A SER 110.A OG ALA 107.A O no hydrogen 2.540 N/A GLY 115.A N ILE 144.A O no hydrogen 2.740 N/A SER 116.A N VAL 113.A O no hydrogen 2.915 N/A SER 116.A OG VAL 113.A O no hydrogen 2.580 N/A ALA 118.A N VAL 142.A O no hydrogen 2.846 N/A THR 119.A N VAL 185.A O no hydrogen 2.889 N/A THR 119.A OG1 THR 141.A OG1 no hydrogen 2.933 N/A VAL 120.A N VAL 140.A O no hydrogen 2.840 N/A ALA 121.A N PRO 183.A O no hydrogen 3.320 N/A GLY 122.A N LEU 138.A O no hydrogen 3.015 N/A TRP 123.A NE1 LEU 58.A O no hydrogen 2.975 N/A GLY 124.A N ASP 179.A OD1 no hydrogen 2.736 N/A ALA 125.A N GLN 177.A O no hydrogen 2.743 N/A SER 127.A OG.B THR 126.A O no hydrogen 3.380 N/A GLY 130.A N SER 127.A O no hydrogen 2.995 N/A LEU 137.A N LEU 58.A O no hydrogen 2.843 N/A LEU 138.A N GLY 122.A O no hydrogen 3.057 N/A LYS 139.A N THR 5.A O no hydrogen 2.685 N/A LYS 139.A NZ ASP 11.A OD2 no hydrogen 2.634 N/A VAL 140.A N VAL 120.A O no hydrogen 2.824 N/A THR 141.A OG1 THR 119.A OG1 no hydrogen 2.933 N/A VAL 142.A N ALA 118.A O no hydrogen 2.749 N/A ILE 144.A N SER 116.A O no hydrogen 2.856 N/A VAL 145.A N CYS 165.A O no hydrogen 2.808 N/A SER 146.A OG THR 149.A OG1 no hydrogen 2.868 N/A ARG 147.A NE THR 160.A O no hydrogen 3.127 N/A ARG 147.A NE MET 163.A O no hydrogen 3.212 N/A ARG 147.A NH1 ASP 111.A OD2 no hydrogen 2.848 N/A ARG 147.A NH2 ASP 111.A OD1 no hydrogen 2.833 N/A ARG 147.A NH2 ASP 111.A OD2 no hydrogen 3.476 N/A ARG 147.A NH2 MET 163.A O no hydrogen 2.662 N/A THR 149.A N SER 146.A OG no hydrogen 3.172 N/A THR 149.A OG1 SER 146.A OG no hydrogen 2.868 N/A CYS 150.A N SER 146.A O no hydrogen 2.932 N/A ARG 151.A N ARG 147.A O no hydrogen 2.805 N/A ARG 151.A NE ILE 159.A O no hydrogen 2.835 N/A ARG 151.A NE THR 156A.A O no hydrogen 3.182 N/A ARG 151.A NH2 ILE 159.A O no hydrogen 2.854 N/A ALA 152.A N ALA 148.A O no hydrogen 2.969 N/A GLN 153.A N THR 149.A O no hydrogen 3.023 N/A TYR 154.A N CYS 150.A O no hydrogen 2.965 N/A TYR 154.A OH SER 207.A O no hydrogen 2.569 N/A GLY 155.A N ARG 151.A O no hydrogen 2.604 N/A ALA 158.A N GLY 155.A O no hydrogen 3.161 N/A THR 160.A OG1 ASN 82.A OD1 no hydrogen 2.642 N/A THR 160.A OG1 GLN 162.A OE1 no hydrogen 3.257 N/A GLN 162.A N THR 160.A OG1 no hydrogen 3.200 N/A MET 163.A N THR 160.A O no hydrogen 3.333 N/A PHE 164.A N TYR 210.A O no hydrogen 3.014 N/A ALA 166.A N GLY 208.A O no hydrogen 3.027 N/A GLY 167.A N PRO 143.A O no hydrogen 3.062 N/A GLY 171.A N VAL 168A.A O no hydrogen 2.843 N/A GLY 172.A N ALA 202.A O no hydrogen 2.729 N/A ASP 174.A N VAL 2.A O no hydrogen 3.167 N/A SER 175.A OG.A ASP 174.A OD1 no hydrogen 3.542 N/A SER 175.A OG.A TYR 210.A OH no hydrogen 3.167 N/A SER 175.A OG.B TYR 210.A OH no hydrogen 3.055 N/A CYS 176.A N ASP 179.A OD2 no hydrogen 2.826 N/A CYS 176.A SG SER 127.A O no hydrogen 3.765 N/A ASP 179.A N CYS 176.A O no hydrogen 2.830 N/A SER 180.A OG HIS 41.A NE2 no hydrogen 3.057 N/A GLY 181.A N VAL 195.A O no hydrogen 2.859 N/A GLY 182.A N ASP 179.A O no hydrogen 3.156 N/A ILE 184.A N GLY 193.A O no hydrogen 3.242 N/A VAL 185.A N THR 119.A O no hydrogen 2.841 N/A ASP 186.A N THR 190.A O no hydrogen 2.924 N/A SER 188.A N ASP 186.A OD1 no hydrogen 3.229 N/A SER 188.A OG ASP 186.A OD1 no hydrogen 2.895 N/A ASN 189.A N ASP 186.A O no hydrogen 3.006 N/A THR 190.A N ASP 186.A OD1 no hydrogen 3.067 N/A THR 190.A OG1 SER 188.A OG no hydrogen 2.882 N/A LEU 191.A N ARG 104.A O no hydrogen 2.816 N/A ILE 192.A N ILE 184.A O no hydrogen 2.969 N/A GLY 193.A N ILE 184.A O no hydrogen 3.251 N/A ALA 194.A N ALA 211.A O no hydrogen 3.084 N/A VAL 195.A N GLY 182.A O no hydrogen 2.949 N/A SER 196.A N VAL 209.A O no hydrogen 3.096 N/A SER 196.A OG ASP 84.A OD2 no hydrogen 2.675 N/A TRP 197.A N VAL 209.A O no hydrogen 2.984 N/A ASN 199.A N TYR 154.A OH no hydrogen 3.195 N/A CYS 201.A N GLU 128.A OE1 no hydrogen 3.105 N/A ALA 202.A N ASP 174.A OD2 no hydrogen 2.828 N/A ASN 205.A N SER 169.A O no hydrogen 2.774 N/A TYR 206.A N ARG 203A.A O no hydrogen 3.267 N/A SER 207.A N GLN 153.A OE1 no hydrogen 2.935 N/A SER 207.A OG GLN 153.A OE1 no hydrogen 2.855 N/A GLY 208.A N ALA 166.A O no hydrogen 2.864 N/A VAL 209.A N TRP 197.A O no hydrogen 2.880 N/A TYR 210.A N PHE 164.A O no hydrogen 2.822 N/A TYR 210.A OH SER 175.A OG.B no hydrogen 3.055 N/A ALA 211.A N ALA 194.A O no hydrogen 2.928 N/A SER 212.A N GLN 162.A O no hydrogen 2.957 N/A VAL 213.A N ILE 192.A O no hydrogen 3.077 N/A LEU 216.A N SER 212.A O no hydrogen 3.052 N/A LEU 216.A N VAL 213.A O no hydrogen 3.070 N/A ARG 217.A NE ASP 221.A OD1 no hydrogen 3.121 N/A ARG 217.A NE ASP 221.A OD2 no hydrogen 3.411 N/A ARG 217.A NH1 ALA 106.A O no hydrogen 2.708 N/A ARG 217.A NH2 ASP 221.A OD1 no hydrogen 3.106 N/A ARG 217.A NH2 ASP 221.A OD2 no hydrogen 3.133 N/A PHE 219.A N LEU 216.A O no hydrogen 3.080 N/A ILE 220.A N LEU 216.A O no hydrogen 3.280 N/A ASP 221.A N ARG 217.A O no hydrogen 2.810 N/A THR 222.A N SER 218.A O no hydrogen 3.266 N/A THR 222.A OG1 SER 218.A O no hydrogen 2.520 N/A TYR 223.A N ILE 220.A O no hydrogen 2.980 N/A ALA 224.A N ILE 220.A O no hydrogen 2.799 N/A SER 44A.A N ALA 40.A O no hydrogen 2.738 N/A ARG 54A.A N SER 17.A O no hydrogen 2.926 N/A ARG 54A.A NE ARG 60.A O no hydrogen 3.270 N/A ARG 54A.A NH1 GLY 63.A O no hydrogen 2.885 N/A ARG 203A.A NE GLU 128.A OE1 no hydrogen 2.832 N/A ARG 203A.A NH2 GLU 128.A OE2 no hydrogen 2.957 N/A TYR 46C.A N VAL 43.A O no hydrogen 3.308 N/A