Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3ndc_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 5.A N ASP 78.A OD1 no hydrogen 2.867 N/A THR 5.A OG1 HIS 3.A O no hydrogen 3.170 N/A VAL 6.A N PRO 106.A O no hydrogen 2.951 N/A HIS 7.A N VAL 79.A O no hydrogen 2.744 N/A HIS 7.A ND1 ASP 108.A OD1 no hydrogen 2.727 N/A HIS 7.A NE2 ASP 78.A OD2 no hydrogen 3.169 N/A PHE 8.A N ASP 108.A O no hydrogen 2.925 N/A ILE 9.A N ARG 81.A O no hydrogen 2.810 N/A GLY 10.A N THR 110.A O no hydrogen 2.993 N/A ALA 11.A N HIS 83.A O no hydrogen 2.759 N/A GLY 12.A N GLY 85.A O no hydrogen 2.992 N/A ALA 15.A N SER 197.A OG no hydrogen 2.974 N/A LEU 18.A N ALA 15.A O no hydrogen 2.907 N/A GLY 23.A N THR 20.A OG1 no hydrogen 2.876 N/A ARG 24.A N THR 20.A O no hydrogen 3.015 N/A ASP 25.A N ILE 21.A O no hydrogen 2.925 N/A LEU 26.A N ARG 22.A O no hydrogen 2.870 N/A ILE 27.A N GLY 23.A O no hydrogen 3.069 N/A ALA 28.A N ARG 24.A O no hydrogen 2.981 N/A SER 29.A N LEU 26.A O no hydrogen 3.119 N/A SER 29.A OG ASP 25.A O no hydrogen 3.466 N/A SER 29.A OG LEU 26.A O no hydrogen 3.084 N/A CYS 30.A N ILE 27.A O no hydrogen 3.299 N/A CYS 30.A SG LEU 26.A O no hydrogen 3.225 N/A VAL 32.A N ASP 78.A O no hydrogen 3.276 N/A CYS 33.A N LYS 53.A O no hydrogen 2.868 N/A CYS 33.A SG ALA 80.A O no hydrogen 3.730 N/A LEU 34.A N ALA 80.A O no hydrogen 2.824 N/A TYR 35.A N VAL 55.A O no hydrogen 2.923 N/A ALA 36.A N LEU 82.A O no hydrogen 3.115 N/A GLY 37.A N TYR 35.A O no hydrogen 2.948 N/A VAL 40.A N GLY 37.A O no hydrogen 2.987 N/A LEU 44.A N PRO 41.A O no hydrogen 2.956 N/A LEU 45.A N GLU 42.A O no hydrogen 2.934 N/A ALA 46.A N ALA 43.A O no hydrogen 3.204 N/A HIS 47.A N LEU 44.A O no hydrogen 2.964 N/A CYS 48.A N LEU 45.A O no hydrogen 3.155 N/A CYS 48.A SG LEU 45.A O no hydrogen 3.353 N/A ALA 52.A N PRO 49.A O no hydrogen 3.182 N/A LYS 53.A N PRO 31.A O no hydrogen 2.914 N/A VAL 55.A N CYS 33.A O no hydrogen 2.769 N/A THR 57.A N TYR 35.A O no hydrogen 2.851 N/A THR 57.A OG1 TYR 35.A O no hydrogen 3.162 N/A ALA 58.A N ASN 56.A OD1 no hydrogen 2.926 N/A MET 60.A N THR 57.A O no hydrogen 2.962 N/A ALA 64.A N SER 61.A OG no hydrogen 3.119 N/A ILE 65.A N SER 61.A O no hydrogen 2.988 N/A ILE 66.A N LEU 62.A O no hydrogen 2.878 N/A ASP 67.A N ASP 63.A O no hydrogen 2.863 N/A THR 68.A N ALA 64.A O no hydrogen 3.003 N/A THR 68.A OG1 ALA 64.A O no hydrogen 2.786 N/A ILE 69.A N ILE 65.A O no hydrogen 3.036 N/A ALA 70.A N ILE 66.A O no hydrogen 2.777 N/A GLU 71.A N ASP 67.A O no hydrogen 2.950 N/A ALA 72.A N THR 68.A O no hydrogen 3.168 N/A HIS 73.A N ILE 69.A O no hydrogen 2.900 N/A ALA 74.A N ALA 70.A O no hydrogen 2.771 N/A ALA 75.A N GLU 71.A O no hydrogen 3.014 N/A ALA 75.A N ALA 72.A O no hydrogen 3.201 N/A GLY 76.A N HIS 73.A O no hydrogen 3.133 N/A GLN 77.A N ALA 72.A O no hydrogen 2.741 N/A VAL 79.A N THR 5.A O no hydrogen 3.225 N/A ALA 80.A N VAL 32.A O no hydrogen 2.734 N/A ARG 81.A N HIS 7.A O no hydrogen 2.856 N/A ARG 81.A NE GLN 96.A OE1 no hydrogen 2.788 N/A ARG 81.A NH1 LEU 34.A O no hydrogen 3.481 N/A ARG 81.A NH1 THR 57.A OG1 no hydrogen 3.244 N/A ARG 81.A NH2 GLN 96.A OE1 no hydrogen 3.295 N/A LEU 82.A N LEU 34.A O no hydrogen 2.823 N/A HIS 83.A N ILE 9.A O no hydrogen 3.115 N/A GLY 85.A N GLY 12.A O no hydrogen 2.745 N/A SER 88.A N ASP 86.A OD2 no hydrogen 3.001 N/A SER 88.A OG ASP 86.A OD2 no hydrogen 2.587 N/A SER 91.A OG LEU 87.A O no hydrogen 2.589 N/A MET 93.A N SER 91.A OG no hydrogen 3.063 N/A GLN 96.A NE2 HIS 83.A NE2 no hydrogen 2.951 N/A GLN 96.A NE2 ALA 92.A O no hydrogen 3.113 N/A LEU 97.A N MET 93.A O no hydrogen 2.919 N/A ARG 98.A N GLY 94.A O no hydrogen 3.106 N/A ARG 99.A N GLU 95.A O no hydrogen 3.451 N/A ARG 99.A NH1 ASP 63.A OD1 no hydrogen 2.816 N/A ARG 99.A NH2 ASP 63.A OD1 no hydrogen 3.024 N/A LEU 100.A N GLN 96.A O no hydrogen 2.911 N/A ARG 101.A N LEU 97.A O no hydrogen 2.884 N/A ARG 101.A NH1 TYR 107.A OH no hydrogen 2.886 N/A ALA 102.A N ARG 98.A O no hydrogen 3.242 N/A LEU 103.A N ARG 99.A O no hydrogen 3.258 N/A LEU 103.A N LEU 100.A O no hydrogen 3.115 N/A ASN 104.A N ARG 101.A O no hydrogen 3.025 N/A ILE 105.A N LEU 100.A O no hydrogen 2.912 N/A ASP 108.A N VAL 6.A O no hydrogen 2.945 N/A THR 110.A N PHE 8.A O no hydrogen 2.763 N/A GLY 112.A N ASP 86.A OD1 no hydrogen 2.837 N/A ALA 118.A N PRO 114.A O no hydrogen 3.202 N/A ALA 119.A N SER 115.A O no hydrogen 2.791 N/A ALA 120.A N PHE 116.A O no hydrogen 2.965 N/A ALA 121.A N ALA 117.A O no hydrogen 3.010 N/A THR 122.A N ALA 118.A O no hydrogen 2.927 N/A THR 122.A OG1 ALA 118.A O no hydrogen 2.998 N/A THR 122.A OG1 GLN 201.A OE1 no hydrogen 3.017 N/A LEU 123.A N ALA 119.A O no hydrogen 2.991 N/A GLY 124.A N ALA 121.A O no hydrogen 2.937 N/A ALA 125.A N ALA 120.A O no hydrogen 2.982 N/A THR 128.A OG1 GLU 126.A OE2 no hydrogen 3.090 N/A LEU 129.A N ALA 133.A O no hydrogen 2.689 N/A VAL 132.A N LEU 129.A O no hydrogen 2.831 N/A ALA 133.A N LEU 129.A O no hydrogen 2.930 N/A ILE 137.A N VAL 163.A O no hydrogen 2.793 N/A THR 139.A N ALA 165.A O no hydrogen 2.959 N/A THR 139.A OG1 ARG 140.A O no hydrogen 3.385 N/A ARG 140.A N THR 139.A OG1 no hydrogen 2.714 N/A ARG 140.A NE THR 141.A O no hydrogen 3.479 N/A THR 141.A N SER 169.A OG no hydrogen 2.978 N/A THR 141.A OG1 SER 169.A OG no hydrogen 2.764 N/A ALA 145.A N SER 142.A O no hydrogen 2.921 N/A SER 146.A OG SER 142.A O no hydrogen 3.433 N/A GLU 152.A N PRO 149.A O no hydrogen 3.075 N/A GLU 155.A N GLU 155.A OE2 no hydrogen 2.896 N/A ASN 156.A N THR 153.A OG1 no hydrogen 3.025 N/A ASN 156.A ND2 GLY 151.A O no hydrogen 2.842 N/A PHE 157.A N THR 153.A O no hydrogen 3.170 N/A ALA 158.A N LEU 154.A O no hydrogen 2.732 N/A ARG 159.A N GLU 155.A O no hydrogen 3.096 N/A ARG 159.A NE GLU 155.A O no hydrogen 3.394 N/A THR 160.A N PHE 157.A O no hydrogen 2.946 N/A THR 160.A OG1 PHE 157.A O no hydrogen 2.680 N/A GLY 161.A N ALA 158.A O no hydrogen 3.147 N/A ALA 162.A N THR 160.A OG1 no hydrogen 3.168 N/A VAL 163.A N SER 135.A O no hydrogen 3.274 N/A LEU 164.A N VAL 227.A O no hydrogen 3.005 N/A ALA 165.A N ILE 137.A O no hydrogen 2.844 N/A ILE 166.A N ILE 225.A O no hydrogen 2.756 N/A HIS 167.A N THR 139.A O no hydrogen 2.757 N/A HIS 167.A ND1 THR 139.A O no hydrogen 3.126 N/A SER 169.A OG THR 141.A OG1 no hydrogen 2.764 N/A SER 169.A OG HIS 167.A O no hydrogen 2.663 N/A HIS 171.A NE2 GLY 143.A O no hydrogen 2.687 N/A VAL 172.A N SER 169.A O no hydrogen 2.920 N/A VAL 176.A N VAL 172.A O no hydrogen 3.154 N/A VAL 177.A N LEU 173.A O no hydrogen 3.160 N/A GLN 178.A N ASP 174.A O no hydrogen 3.251 N/A LYS 179.A N GLU 175.A O no hydrogen 3.010 N/A LEU 180.A N VAL 176.A O no hydrogen 3.073 N/A LEU 180.A N VAL 177.A O no hydrogen 3.115 N/A VAL 181.A N VAL 177.A O no hydrogen 2.839 N/A HIS 183.A N LEU 180.A O no hydrogen 3.059 N/A TYR 184.A N LEU 180.A O no hydrogen 2.967 N/A TYR 184.A OH ALA 162.A O no hydrogen 2.533 N/A GLY 185.A N VAL 181.A O no hydrogen 3.013 N/A CYS 188.A N GLY 185.A O no hydrogen 3.295 N/A CYS 188.A SG PRO 189.A O no hydrogen 3.489 N/A VAL 190.A N ALA 206.A O no hydrogen 2.994 N/A ALA 191.A N LEU 226.A O no hydrogen 2.854 N/A ILE 192.A N VAL 204.A O no hydrogen 2.798 N/A VAL 193.A N LEU 224.A O no hydrogen 3.059 N/A TRP 194.A N ARG 202.A O no hydrogen 2.781 N/A ARG 195.A N THR 222.A O no hydrogen 2.837 N/A ARG 195.A NE ASP 200.A OD2 no hydrogen 3.181 N/A SER 197.A N GLN 201.A OE1 no hydrogen 2.703 N/A SER 197.A OG ALA 196.A O no hydrogen 2.683 N/A TRP 198.A N ARG 195.A O no hydrogen 2.962 N/A GLN 201.A N TRP 198.A O no hydrogen 2.963 N/A ARG 202.A N TRP 194.A O no hydrogen 2.998 N/A VAL 204.A N ILE 192.A O no hydrogen 2.919 N/A ARG 205.A NH2 LEU 123.A O no hydrogen 3.061 N/A ALA 206.A N VAL 190.A O no hydrogen 2.961 N/A THR 207.A N THR 210.A OG1 no hydrogen 2.972 N/A THR 207.A OG1 GLU 186.A O no hydrogen 3.445 N/A THR 207.A OG1 THR 210.A OG1 no hydrogen 2.651 N/A LEU 208.A N CYS 188.A O no hydrogen 2.994 N/A ALA 209.A N GLU 186.A O no hydrogen 2.989 N/A THR 210.A N THR 207.A O no hydrogen 2.952 N/A THR 210.A OG1 THR 207.A O no hydrogen 3.338 N/A THR 210.A OG1 THR 207.A OG1 no hydrogen 2.651 N/A GLN 212.A NE2 SER 214.A OG no hydrogen 3.324 N/A LEU 215.A N GLN 212.A O no hydrogen 3.271 N/A GLY 216.A N THR 213.A O no hydrogen 3.077 N/A THR 222.A N GLU 220.A OE1 no hydrogen 3.037 N/A THR 222.A OG1 GLU 220.A OE1 no hydrogen 3.118 N/A ALA 223.A N ARG 221.A O no hydrogen 2.893 N/A LEU 224.A N VAL 193.A O no hydrogen 2.890 N/A ILE 225.A N ILE 166.A O no hydrogen 3.030 N/A LEU 226.A N ALA 191.A O no hydrogen 2.775 N/A VAL 227.A N LEU 164.A O no hydrogen 2.970 N/A GLY 228.A N PRO 189.A O no hydrogen 3.201 N/A ARG 229.A NH1 ASP 187.A OD2 no hydrogen 3.197 N/A ARG 229.A NH2 TYR 184.A O no hydrogen 2.936 N/A ARG 229.A NH2 ASP 187.A OD1 no hydrogen 2.956 N/A SER 230.A OG LEU 127.A O no hydrogen 2.734 N/A LEU 231.A N GLY 228.A O no hydrogen 3.045 N/A ALA 232.A N ARG 229.A O no hydrogen 3.220 N/A ASP 235.A N THR 233.A OG1 no hydrogen 2.916 N/A PHE 236.A N GLU 234.A O no hydrogen 2.988 N/A