Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8sni_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 2.A N ASP 256.A OD1 no hydrogen 2.956 N/A ALA 4.A N HIS 31.A ND1 no hydrogen 3.073 N/A HIS 5.A NE2 THR 34.A OG1 no hydrogen 2.791 N/A PHE 6.A N LYS 32.A O no hydrogen 2.770 N/A VAL 7.A N ILE 75.A O no hydrogen 2.956 N/A LEU 8.A N THR 34.A O no hydrogen 2.844 N/A VAL 9.A N VAL 77.A O no hydrogen 2.624 N/A HIS 10.A ND1 GLY 11.A O no hydrogen 2.849 N/A CYS 13.A SG MET 148.A O no hydrogen 3.635 N/A CYS 13.A SG ARG 176.A O no hydrogen 3.412 N/A HIS 14.A N GLY 11.A O no hydrogen 3.240 N/A HIS 14.A ND1 ALA 12.A O no hydrogen 2.845 N/A HIS 14.A NE2 TYR 160.A OH no hydrogen 2.804 N/A ALA 16.A N ASP 37.A OD1 no hydrogen 2.813 N/A SER 18.A N GLY 15.A O no hydrogen 3.038 N/A SER 18.A OG GLY 15.A O no hydrogen 3.514 N/A TRP 19.A N ALA 16.A O no hydrogen 2.839 N/A HIS 20.A N TRP 17.A O no hydrogen 3.080 N/A HIS 20.A NE2 GLU 167.A OE1 no hydrogen 2.974 N/A LYS 23.A N TRP 19.A O no hydrogen 2.897 N/A LYS 23.A NZ GLU 27.A OE2 no hydrogen 2.627 N/A LEU 26.A N LEU 22.A O no hydrogen 3.021 N/A GLU 27.A N LYS 23.A O no hydrogen 3.021 N/A ALA 28.A N PRO 24.A O no hydrogen 2.972 N/A LEU 29.A N LEU 25.A O no hydrogen 3.146 N/A GLY 30.A N GLU 27.A O no hydrogen 2.844 N/A HIS 31.A N LEU 26.A O no hydrogen 3.091 N/A HIS 31.A NE2 GLN 252.A OE1 no hydrogen 2.721 N/A LYS 32.A N ALA 4.A O no hydrogen 2.965 N/A THR 34.A N PHE 6.A O no hydrogen 2.847 N/A THR 34.A OG1 HIS 5.A NE2 no hydrogen 2.791 N/A LEU 36.A N LEU 8.A O no hydrogen 3.511 N/A LEU 38.A N HIS 10.A NE2 no hydrogen 2.919 N/A ALA 39.A N TYR 57.A O no hydrogen 3.046 N/A ALA 40.A N ASP 44.A OD1 no hydrogen 2.995 N/A SER 41.A N LEU 38.A O no hydrogen 3.078 N/A SER 41.A OG LEU 38.A O no hydrogen 3.445 N/A SER 41.A OG ALA 39.A O no hydrogen 2.928 N/A VAL 43.A N ASP 37.A OD2 no hydrogen 2.934 N/A ASP 44.A N SER 41.A O no hydrogen 2.897 N/A ARG 46.A N ASP 44.A OD1 no hydrogen 3.021 N/A ARG 46.A NE ASP 44.A OD1 no hydrogen 2.968 N/A ARG 46.A NH1 GLU 59.A OE1 no hydrogen 2.734 N/A ARG 46.A NH2 ASP 44.A OD2 no hydrogen 2.885 N/A ARG 46.A NH2 GLU 59.A OE1 no hydrogen 2.792 N/A GLN 47.A N GLU 50.A OE2 no hydrogen 2.824 N/A GLU 49.A N GLU 49.A OE1 no hydrogen 2.917 N/A GLU 50.A N GLN 47.A O no hydrogen 2.972 N/A ILE 51.A N ILE 48.A O no hydrogen 2.857 N/A GLY 52.A N GLU 56.A OE2 no hydrogen 2.886 N/A GLU 56.A N SER 53.A OG no hydrogen 3.184 N/A TYR 57.A N SER 53.A O no hydrogen 2.985 N/A SER 58.A N PHE 54.A O no hydrogen 2.967 N/A SER 58.A N ASP 55.A O no hydrogen 3.197 N/A SER 58.A OG PHE 54.A O no hydrogen 2.932 N/A GLU 59.A N GLU 56.A O no hydrogen 2.939 N/A LEU 62.A N SER 58.A O no hydrogen 3.117 N/A THR 63.A N GLU 59.A O no hydrogen 2.749 N/A THR 63.A OG1 GLU 59.A O no hydrogen 3.106 N/A THR 63.A OG1 GLU 59.A OE2 no hydrogen 2.614 N/A PHE 64.A N PRO 60.A O no hydrogen 2.869 N/A LEU 65.A N LEU 61.A O no hydrogen 2.927 N/A GLU 66.A N LEU 62.A O no hydrogen 2.847 N/A ALA 67.A N THR 63.A O no hydrogen 3.281 N/A ALA 67.A N PHE 64.A O no hydrogen 2.984 N/A LEU 68.A N LEU 65.A O no hydrogen 3.183 N/A GLU 72.A N PRO 69.A O no hydrogen 3.148 N/A LYS 73.A NZ GLU 95.A O no hydrogen 2.786 N/A VAL 74.A N LYS 96.A O no hydrogen 2.891 N/A ILE 75.A N HIS 5.A O no hydrogen 2.887 N/A LEU 76.A N ALA 99.A O no hydrogen 2.937 N/A VAL 77.A N VAL 7.A O no hydrogen 2.734 N/A GLY 78.A N VAL 101.A O no hydrogen 2.955 N/A HIS 79.A N VAL 9.A O no hydrogen 3.015 N/A HIS 79.A NE2 HIS 237.A O no hydrogen 2.647 N/A SER 80.A N LEU 103.A O no hydrogen 3.376 N/A GLY 82.A N HIS 79.A O no hydrogen 2.736 N/A GLY 83.A N SER 80.A O no hydrogen 3.039 N/A MET 84.A N LEU 81.A O no hydrogen 2.893 N/A ASN 85.A ND2 SER 58.A OG no hydrogen 2.804 N/A ILE 86.A N GLY 82.A O no hydrogen 3.121 N/A ALA 87.A N GLY 83.A O no hydrogen 3.286 N/A ILE 88.A N MET 84.A O no hydrogen 3.114 N/A ALA 89.A N ASN 85.A O no hydrogen 2.959 N/A ALA 90.A N ILE 86.A O no hydrogen 2.909 N/A ASP 91.A N ALA 87.A O no hydrogen 3.132 N/A LYS 92.A N ALA 89.A O no hydrogen 3.267 N/A TYR 93.A N ALA 89.A O no hydrogen 2.989 N/A LYS 96.A N TYR 93.A O no hydrogen 2.952 N/A LYS 96.A NZ LEU 65.A O no hydrogen 2.724 N/A LYS 96.A NZ LEU 68.A O no hydrogen 3.249 N/A ILE 97.A N CYS 94.A O no hydrogen 3.103 N/A ALA 98.A N VAL 74.A O no hydrogen 2.756 N/A ALA 100.A N LYS 200.A O no hydrogen 2.845 N/A VAL 101.A N LEU 76.A O no hydrogen 2.674 N/A PHE 102.A N ILE 202.A O no hydrogen 2.671 N/A LEU 103.A N GLY 78.A O no hydrogen 2.753 N/A ALA 104.A N VAL 204.A O no hydrogen 2.904 N/A PHE 106.A N SER 80.A O no hydrogen 2.976 N/A LEU 107.A N GLN 220.A OE1 no hydrogen 2.825 N/A HIS 112.A N ASP 109.A OD1 no hydrogen 3.019 N/A HIS 112.A ND1 ASP 109.A OD2 no hydrogen 2.530 N/A CYS 113.A SG SER 115.A OG no hydrogen 3.669 N/A SER 115.A OG ASP 119.A OD2 no hydrogen 2.948 N/A TYR 116.A N CYS 113.A O no hydrogen 2.858 N/A ASP 119.A N SER 115.A O no hydrogen 2.789 N/A LYS 120.A N TYR 116.A O no hydrogen 2.975 N/A TYR 121.A N VAL 117.A O no hydrogen 2.924 N/A TYR 121.A OH GLY 211.A O no hydrogen 2.620 N/A ASN 122.A N LEU 118.A O no hydrogen 3.068 N/A GLU 123.A N ASP 119.A O no hydrogen 3.023 N/A VAL 124.A N LYS 120.A O no hydrogen 3.204 N/A VAL 124.A N TYR 121.A O no hydrogen 3.233 N/A THR 125.A OG1 TYR 121.A O no hydrogen 2.677 N/A ASN 129.A N PRO 126.A O no hydrogen 3.095 N/A TRP 130.A N ALA 127.A O no hydrogen 3.307 N/A LEU 131.A N GLU 128.A O no hydrogen 3.069 N/A THR 133.A N TRP 130.A O no hydrogen 2.912 N/A THR 133.A OG1 TRP 130.A O no hydrogen 2.968 N/A THR 134.A N PHE 149.A O no hydrogen 2.952 N/A THR 134.A OG1 PHE 149.A O no hydrogen 3.148 N/A PHE 136.A N GLY 147.A O no hydrogen 3.159 N/A TYR 138.A N ILE 145.A O no hydrogen 2.993 N/A TYR 138.A OH ILE 51.A O no hydrogen 2.853 N/A LYS 140.A N LYS 143.A O no hydrogen 2.719 N/A LYS 143.A N LYS 140.A O no hydrogen 2.753 N/A ILE 145.A N TYR 138.A O no hydrogen 2.756 N/A GLY 147.A N PHE 136.A O no hydrogen 2.713 N/A MET 148.A N SER 178.A O no hydrogen 2.972 N/A PHE 149.A N THR 134.A O no hydrogen 2.818 N/A LYS 153.A N ASP 132.A OD2 no hydrogen 2.842 N/A PHE 154.A N ASP 132.A OD1 no hydrogen 2.931 N/A LEU 155.A N GLY 151.A O no hydrogen 2.943 N/A ALA 156.A N PRO 152.A O no hydrogen 2.864 N/A HIS 157.A N LYS 153.A O no hydrogen 2.749 N/A LYS 158.A N PHE 154.A O no hydrogen 2.757 N/A LEU 159.A N LEU 155.A O no hydrogen 3.125 N/A TYR 160.A N LEU 155.A O no hydrogen 2.798 N/A TYR 160.A OH HIS 14.A NE2 no hydrogen 2.804 N/A GLN 161.A N GLN 161.A OE1 no hydrogen 2.847 N/A GLN 161.A NE2 GLN 208.A O no hydrogen 3.002 N/A LEU 162.A N ASP 236.A OD2 no hydrogen 3.005 N/A CYS 163.A N TYR 160.A O no hydrogen 2.872 N/A CYS 163.A SG ASP 236.A OD2 no hydrogen 3.368 N/A TYR 168.A N GLY 164.A O no hydrogen 3.222 N/A TYR 168.A OH PRO 152.A O no hydrogen 2.808 N/A GLU 169.A N PRO 165.A O no hydrogen 2.927 N/A ALA 171.A N GLU 167.A O no hydrogen 3.237 N/A LYS 172.A N TYR 168.A O no hydrogen 3.073 N/A MET 173.A N GLU 169.A O no hydrogen 3.097 N/A LEU 174.A N ALA 171.A O no hydrogen 3.280 N/A VAL 175.A N ALA 171.A O no hydrogen 3.005 N/A ARG 176.A N CYS 13.A O no hydrogen 3.182 N/A ARG 176.A NH1 GLY 42.A O no hydrogen 2.924 N/A ARG 176.A NH1 ASP 44.A O no hydrogen 2.782 N/A ARG 176.A NH2 ASP 44.A O no hydrogen 3.516 N/A ARG 176.A NH2 ARG 46.A O no hydrogen 2.723 N/A ARG 176.A NH2 GLN 47.A OE1 no hydrogen 3.293 N/A SER 178.A N MET 148.A O no hydrogen 2.976 N/A SER 179.A N SER 178.A OG no hydrogen 2.745 N/A SER 179.A OG THR 146.A O no hydrogen 2.828 N/A PHE 181.A N SER 179.A OG no hydrogen 2.898 N/A ASN 183.A ND2 GLU 144.A O no hydrogen 2.707 N/A ILE 184.A N ASN 183.A OD1 no hydrogen 2.809 N/A LEU 185.A N PHE 181.A O no hydrogen 2.683 N/A ALA 186.A N ASN 183.A O no hydrogen 2.997 N/A LYS 187.A N ASN 183.A O no hydrogen 3.372 N/A ARG 188.A N LEU 185.A O no hydrogen 3.432 N/A ARG 188.A NE ASP 55.A OD1 no hydrogen 2.809 N/A ARG 188.A NH1 PRO 189.A O no hydrogen 3.004 N/A ARG 188.A NH2 ASP 55.A OD1 no hydrogen 3.544 N/A ARG 188.A NH2 ASP 55.A OD2 no hydrogen 3.008 N/A THR 192.A N ASP 91.A OD2 no hydrogen 3.011 N/A THR 192.A OG1 ASP 91.A OD1 no hydrogen 2.597 N/A GLY 195.A N THR 192.A OG1 no hydrogen 2.908 N/A TYR 196.A N ASP 91.A OD1 no hydrogen 2.918 N/A TYR 196.A OH PRO 108.A O no hydrogen 2.478 N/A GLY 197.A N THR 192.A O no hydrogen 3.082 N/A SER 198.A N GLY 195.A O no hydrogen 3.078 N/A SER 198.A OG GLU 194.A O no hydrogen 3.102 N/A SER 198.A OG GLY 195.A O no hydrogen 2.539 N/A ILE 199.A N TYR 196.A O no hydrogen 3.376 N/A LYS 201.A N ASP 227.A OD2 no hydrogen 3.101 N/A LYS 201.A NZ TYR 196.A O no hydrogen 2.848 N/A LYS 201.A NZ ILE 199.A O no hydrogen 3.040 N/A LYS 201.A NZ TYR 224.A OH no hydrogen 3.443 N/A ILE 202.A N ALA 100.A O no hydrogen 2.860 N/A TYR 203.A N LYS 228.A O no hydrogen 3.049 N/A TYR 203.A OH ALA 105.A O no hydrogen 2.690 N/A VAL 204.A N PHE 102.A O no hydrogen 2.923 N/A TRP 205.A N TYR 230.A O no hydrogen 2.982 N/A THR 206.A N GLN 217.A OE1 no hydrogen 2.980 N/A GLN 208.A N GLY 235.A O no hydrogen 3.231 N/A LYS 210.A NZ HIS 157.A O no hydrogen 3.306 N/A GLY 211.A N ASP 209.A OD1 no hydrogen 2.885 N/A ILE 212.A N ASP 209.A OD1 no hydrogen 3.060 N/A PHE 216.A N PRO 213.A O no hydrogen 2.966 N/A GLN 217.A N PRO 213.A O no hydrogen 3.193 N/A GLN 217.A NE2 THR 206.A OG1 no hydrogen 3.234 N/A GLN 217.A NE2 ILE 212.A O no hydrogen 2.689 N/A LEU 218.A N PRO 214.A O no hydrogen 2.838 N/A TRP 219.A N GLU 215.A O no hydrogen 2.937 N/A GLN 220.A N PHE 216.A O no hydrogen 2.923 N/A GLN 220.A NE2 ALA 105.A O no hydrogen 2.829 N/A ILE 221.A N GLN 217.A O no hydrogen 3.083 N/A GLU 222.A N LEU 218.A O no hydrogen 2.986 N/A ASN 223.A N TRP 219.A O no hydrogen 2.844 N/A ASN 223.A ND2 ASP 109.A OD2 no hydrogen 3.282 N/A TYR 224.A N GLN 220.A O no hydrogen 3.048 N/A TYR 224.A N ILE 221.A O no hydrogen 3.072 N/A TYR 230.A N TYR 203.A O no hydrogen 2.863 N/A TYR 230.A OH GLU 253.A OE2 no hydrogen 2.839 N/A VAL 232.A N TRP 205.A O no hydrogen 2.983 N/A GLY 234.A N ASP 207.A OD1 no hydrogen 2.691 N/A GLY 234.A N ASP 207.A OD2 no hydrogen 3.083 N/A HIS 237.A ND1 ASP 209.A OD1 no hydrogen 2.912 N/A HIS 237.A ND1 ASP 209.A OD2 no hydrogen 3.175 N/A LEU 241.A N MET 238.A O no hydrogen 2.856 N/A THR 242.A N MET 238.A O no hydrogen 3.086 N/A THR 242.A OG1 ASP 236.A OD1 no hydrogen 2.908 N/A THR 242.A OG1 MET 238.A O no hydrogen 3.378 N/A LYS 243.A N ALA 239.A O no hydrogen 2.788 N/A THR 244.A OG1 MET 240.A O no hydrogen 2.655 N/A ILE 247.A N LYS 243.A O no hydrogen 3.060 N/A ALA 248.A N THR 244.A O no hydrogen 2.961 N/A GLU 249.A N LYS 245.A O no hydrogen 2.962 N/A ILE 250.A N GLU 246.A O no hydrogen 3.034 N/A LEU 251.A N ILE 247.A O no hydrogen 2.809 N/A GLN 252.A N ALA 248.A O no hydrogen 2.896 N/A GLN 252.A NE2 ASP 256.A OD1 no hydrogen 3.036 N/A GLN 252.A NE2 ASP 256.A OD2 no hydrogen 3.337 N/A GLU 253.A N GLU 249.A O no hydrogen 3.217 N/A VAL 254.A N ILE 250.A O no hydrogen 2.912 N/A ALA 255.A N LEU 251.A O no hydrogen 2.930 N/A ASP 256.A N GLN 252.A O no hydrogen 2.910 N/A THR 257.A N GLU 253.A O no hydrogen 2.964 N/A THR 257.A N VAL 254.A O no hydrogen 2.994 N/A TYR 258.A N VAL 254.A O no hydrogen 2.884 N/A ASN 259.A N ALA 255.A O no hydrogen 3.264 N/A