Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jr8_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 4.A N GLU 4.A OE1 no hydrogen 2.503 N/A TRP 7.A N GLU 4.A O no hydrogen 3.199 N/A LEU 8.A N GLU 4.A O no hydrogen 3.432 N/A TRP 9.A N ALA 5.A O no hydrogen 2.920 N/A LEU 10.A N ILE 6.A O no hydrogen 2.903 N/A GLY 11.A N TRP 7.A O no hydrogen 2.914 N/A THR 12.A N LEU 8.A O no hydrogen 3.015 N/A THR 12.A OG1 LEU 8.A O no hydrogen 2.716 N/A ALA 13.A N TRP 9.A O no hydrogen 2.973 N/A GLY 14.A N LEU 10.A O no hydrogen 2.816 N/A MET 15.A N GLY 11.A O no hydrogen 2.937 N/A PHE 16.A N THR 12.A O no hydrogen 3.035 N/A LEU 17.A N ALA 13.A O no hydrogen 2.821 N/A GLY 18.A N GLY 14.A O no hydrogen 2.905 N/A MET 19.A N MET 15.A O no hydrogen 2.853 N/A LEU 20.A N PHE 16.A O no hydrogen 3.069 N/A TYR 21.A N LEU 17.A O no hydrogen 2.943 N/A PHE 22.A N GLY 18.A O no hydrogen 2.810 N/A ILE 23.A N MET 19.A O no hydrogen 2.929 N/A ALA 24.A N LEU 20.A O no hydrogen 3.001 N/A ARG 25.A N TYR 21.A O no hydrogen 2.807 N/A ARG 25.A NH1 LEU 225.A O no hydrogen 2.728 N/A GLY 26.A N PHE 22.A O no hydrogen 3.119 N/A TRP 27.A N ALA 24.A O no hydrogen 3.257 N/A GLU 29.A N GLY 26.A O no hydrogen 2.943 N/A ASP 31.A N GLU 29.A OE1 no hydrogen 2.686 N/A ARG 33.A NE LEU 231.A O no hydrogen 2.933 N/A ARG 33.A NH2 LEU 94.A O no hydrogen 2.694 N/A ARG 34.A N ASP 31.A OD1 no hydrogen 2.736 N/A ARG 34.A NH1 HIS 228.A ND1 no hydrogen 3.053 N/A GLN 35.A N ASP 31.A O no hydrogen 2.965 N/A LYS 36.A N ARG 33.A O no hydrogen 3.084 N/A TYR 38.A N ARG 34.A O no hydrogen 3.300 N/A TYR 38.A OH HIS 228.A NE2 no hydrogen 3.216 N/A ILE 39.A N GLN 35.A O no hydrogen 2.794 N/A ALA 40.A N LYS 36.A O no hydrogen 3.027 N/A THR 41.A N PHE 37.A O no hydrogen 3.038 N/A THR 41.A OG1 PHE 37.A O no hydrogen 2.717 N/A THR 41.A OG1 ASP 91.A OD2 no hydrogen 2.720 N/A ILE 42.A N TYR 38.A O no hydrogen 2.755 N/A LEU 43.A N ILE 39.A O no hydrogen 2.890 N/A ILE 44.A N ALA 40.A O no hydrogen 2.945 N/A THR 45.A N THR 41.A O no hydrogen 3.255 N/A THR 45.A OG1 THR 41.A O no hydrogen 3.362 N/A THR 45.A OG1 ILE 42.A O no hydrogen 2.710 N/A ALA 46.A N ILE 42.A O no hydrogen 2.915 N/A ILE 47.A N LEU 43.A O no hydrogen 2.895 N/A ALA 48.A N ILE 44.A O no hydrogen 3.097 N/A PHE 49.A N THR 45.A O no hydrogen 2.793 N/A VAL 50.A N ALA 46.A O no hydrogen 2.987 N/A ASN 51.A N ILE 47.A O no hydrogen 2.994 N/A TYR 52.A N ALA 48.A O no hydrogen 2.735 N/A TYR 52.A OH ASP 213.A OD2 no hydrogen 2.585 N/A LEU 53.A N PHE 49.A O no hydrogen 2.849 N/A ALA 54.A N VAL 50.A O no hydrogen 2.955 N/A MET 55.A N ASN 51.A O no hydrogen 2.961 N/A ALA 56.A N TYR 52.A O no hydrogen 2.766 N/A LEU 57.A N LEU 53.A O no hydrogen 2.855 N/A GLY 58.A N MET 55.A O no hydrogen 2.949 N/A GLY 60.A N ALA 54.A O no hydrogen 3.043 N/A LEU 61.A N GLY 58.A O no hydrogen 3.194 N/A THR 62.A N ILE 73.A O no hydrogen 2.842 N/A VAL 64.A N ARG 71.A O no hydrogen 2.684 N/A ILE 66.A N GLU 69.A O no hydrogen 2.740 N/A ARG 71.A N VAL 64.A O no hydrogen 2.679 N/A ILE 73.A N THR 62.A O no hydrogen 2.636 N/A TYR 74.A OH GLU 4.A OE2 no hydrogen 2.649 N/A ALA 76.A N GLY 60.A O no hydrogen 3.528 N/A ARG 77.A N TYR 74.A O no hydrogen 3.495 N/A TYR 78.A N TRP 75.A O no hydrogen 2.826 N/A SER 79.A OG ALA 76.A O no hydrogen 2.848 N/A ASP 80.A N ARG 77.A O no hydrogen 3.280 N/A TRP 81.A N ARG 77.A O no hydrogen 2.777 N/A LEU 82.A N TYR 78.A O no hydrogen 2.977 N/A PHE 83.A N ASP 80.A O no hydrogen 3.024 N/A THR 84.A N ASP 80.A O no hydrogen 2.909 N/A THR 84.A OG1 ASP 80.A O no hydrogen 3.013 N/A THR 84.A OG1 ASP 80.A OD1 no hydrogen 2.676 N/A THR 85.A N TRP 81.A O no hydrogen 3.119 N/A THR 85.A OG1 TRP 81.A O no hydrogen 2.599 N/A THR 85.A OG1 ASP 110.A OD1 no hydrogen 3.171 N/A THR 85.A OG1 ASP 110.A OD2 no hydrogen 2.368 N/A LEU 87.A N PHE 83.A O no hydrogen 3.378 N/A LEU 88.A N THR 84.A O no hydrogen 2.895 N/A LEU 89.A N THR 85.A O no hydrogen 2.911 N/A TYR 90.A N PRO 86.A O no hydrogen 2.783 N/A ASP 91.A N LEU 87.A O no hydrogen 2.881 N/A LEU 92.A N LEU 88.A O no hydrogen 3.003 N/A GLY 93.A N LEU 89.A O no hydrogen 2.799 N/A LEU 94.A N TYR 90.A O no hydrogen 2.786 N/A LEU 95.A N ASP 91.A O no hydrogen 3.018 N/A ALA 96.A N LEU 92.A O no hydrogen 3.315 N/A ALA 96.A N GLY 93.A O no hydrogen 3.153 N/A GLY 97.A N LEU 94.A O no hydrogen 3.030 N/A ALA 98.A N GLY 93.A O no hydrogen 2.892 N/A THR 102.A N ASP 99.A OD1 no hydrogen 2.536 N/A THR 102.A OG1 ASP 99.A OD1 no hydrogen 2.609 N/A THR 102.A OG1 ASP 99.A OD2 no hydrogen 3.310 N/A ILE 103.A N ASP 99.A O no hydrogen 3.197 N/A SER 104.A N ARG 100.A O no hydrogen 2.777 N/A SER 104.A OG ARG 100.A O no hydrogen 3.046 N/A SER 105.A N ASN 101.A O no hydrogen 3.006 N/A SER 105.A OG ASN 101.A O no hydrogen 2.885 N/A LEU 106.A N THR 102.A O no hydrogen 3.079 N/A VAL 107.A N ILE 103.A O no hydrogen 2.999 N/A SER 108.A N SER 104.A O no hydrogen 2.926 N/A SER 108.A OG SER 104.A O no hydrogen 2.705 N/A LEU 109.A N SER 105.A O no hydrogen 2.960 N/A ASP 110.A N LEU 106.A O no hydrogen 2.883 N/A VAL 111.A N VAL 107.A O no hydrogen 2.692 N/A LEU 112.A N SER 108.A O no hydrogen 2.924 N/A MET 113.A N LEU 109.A O no hydrogen 2.768 N/A ILE 114.A N ASP 110.A O no hydrogen 2.869 N/A GLY 115.A N VAL 111.A O no hydrogen 2.850 N/A THR 116.A N LEU 112.A O no hydrogen 3.071 N/A THR 116.A OG1 LEU 112.A O no hydrogen 2.789 N/A THR 116.A OG1 MET 113.A O no hydrogen 3.193 N/A GLY 117.A N MET 113.A O no hydrogen 2.969 N/A LEU 118.A N ILE 114.A O no hydrogen 2.793 N/A VAL 119.A N GLY 115.A O no hydrogen 3.036 N/A ALA 120.A N THR 116.A O no hydrogen 2.828 N/A THR 121.A N GLY 117.A O no hydrogen 2.907 N/A THR 121.A OG1 TYR 78.A OH no hydrogen 2.616 N/A THR 121.A OG1 GLY 117.A O no hydrogen 3.005 N/A LEU 122.A N LEU 118.A O no hydrogen 2.964 N/A LEU 122.A N VAL 119.A O no hydrogen 3.040 N/A SER 123.A N VAL 119.A O no hydrogen 2.633 N/A SER 123.A OG VAL 119.A O no hydrogen 3.315 N/A SER 123.A OG ALA 120.A O no hydrogen 3.428 N/A ALA 133.A N SER 130.A OG no hydrogen 3.398 N/A GLU 134.A N SER 130.A O no hydrogen 3.017 N/A ARG 135.A N ALA 131.A O no hydrogen 2.832 N/A ARG 135.A NE GLU 195.A O no hydrogen 3.011 N/A ARG 135.A NH1 THR 121.A O no hydrogen 3.077 N/A ARG 135.A NH1 SER 123.A O no hydrogen 2.831 N/A ARG 135.A NH2 THR 121.A O no hydrogen 3.154 N/A ARG 135.A NH2 GLU 195.A O no hydrogen 2.792 N/A LEU 136.A N GLY 132.A O no hydrogen 3.009 N/A VAL 137.A N ALA 133.A O no hydrogen 2.988 N/A TRP 138.A N GLU 134.A O no hydrogen 3.157 N/A TRP 139.A N ARG 135.A O no hydrogen 2.889 N/A TRP 139.A NE1 PRO 187.A O no hydrogen 2.926 N/A GLY 140.A N LEU 136.A O no hydrogen 2.842 N/A ILE 141.A N VAL 137.A O no hydrogen 2.996 N/A SER 142.A N TRP 138.A O no hydrogen 2.824 N/A SER 142.A OG MET 113.A O no hydrogen 2.773 N/A THR 143.A N TRP 139.A O no hydrogen 2.807 N/A THR 143.A OG1 TRP 139.A O no hydrogen 2.810 N/A ALA 144.A N GLY 140.A O no hydrogen 2.940 N/A PHE 145.A N ILE 141.A O no hydrogen 3.129 N/A LEU 146.A N SER 142.A O no hydrogen 3.228 N/A LEU 147.A N THR 143.A O no hydrogen 2.871 N/A VAL 148.A N ALA 144.A O no hydrogen 2.951 N/A LEU 149.A N PHE 145.A O no hydrogen 3.016 N/A LEU 150.A N LEU 146.A O no hydrogen 2.704 N/A TYR 151.A N LEU 147.A O no hydrogen 2.801 N/A PHE 152.A N VAL 148.A O no hydrogen 2.968 N/A LEU 153.A N LEU 149.A O no hydrogen 3.279 N/A PHE 154.A N TYR 151.A O no hydrogen 3.059 N/A SER 155.A N TYR 151.A O no hydrogen 2.913 N/A SER 156.A OG PHE 152.A O no hydrogen 2.680 N/A SER 158.A N SER 155.A O no hydrogen 3.158 N/A SER 158.A OG PHE 154.A O no hydrogen 2.666 N/A SER 158.A OG SER 155.A O no hydrogen 3.002 N/A VAL 161.A N LEU 157.A O no hydrogen 2.832 N/A ALA 162.A N SER 158.A O no hydrogen 3.193 N/A LEU 164.A N VAL 161.A O no hydrogen 3.239 N/A THR 168.A OG1 LEU 95.A O no hydrogen 3.317 N/A THR 168.A OG1 VAL 230.A O no hydrogen 3.008 N/A ARG 169.A N PRO 165.A O no hydrogen 2.893 N/A ARG 169.A NE LEU 164.A O no hydrogen 3.303 N/A SER 170.A N SER 166.A O no hydrogen 2.965 N/A THR 171.A N ASP 167.A O no hydrogen 3.386 N/A THR 171.A OG1 ASP 167.A O no hydrogen 3.498 N/A PHE 172.A N THR 168.A O no hydrogen 2.805 N/A LYS 173.A N ARG 169.A O no hydrogen 2.945 N/A THR 174.A N SER 170.A O no hydrogen 2.887 N/A THR 174.A OG1 SER 170.A O no hydrogen 3.073 N/A LEU 175.A N THR 171.A O no hydrogen 2.907 N/A ARG 176.A N PHE 172.A O no hydrogen 2.748 N/A ARG 176.A NH1 ASN 177.A OD1 no hydrogen 2.589 N/A ASN 177.A N LYS 173.A O no hydrogen 3.029 N/A LEU 178.A N THR 174.A O no hydrogen 2.925 N/A VAL 179.A N LEU 175.A O no hydrogen 2.861 N/A THR 180.A N ARG 176.A O no hydrogen 2.958 N/A THR 180.A OG1 ARG 176.A O no hydrogen 2.825 N/A VAL 181.A N ASN 177.A O no hydrogen 2.845 N/A VAL 182.A N LEU 178.A O no hydrogen 2.775 N/A TRP 183.A N VAL 179.A O no hydrogen 2.763 N/A LEU 184.A N THR 180.A O no hydrogen 3.235 N/A VAL 185.A N VAL 182.A O no hydrogen 3.080 N/A TYR 186.A N TRP 183.A O no hydrogen 3.227 N/A TYR 186.A OH ASP 213.A OD1 no hydrogen 2.632 N/A TRP 189.A N VAL 185.A O no hydrogen 2.689 N/A TRP 189.A NE1 GLU 205.A O no hydrogen 2.932 N/A TRP 190.A N TYR 186.A O no hydrogen 2.775 N/A TRP 190.A NE1 THR 121.A OG1 no hydrogen 2.936 N/A LEU 191.A N PRO 187.A O no hydrogen 2.981 N/A VAL 192.A N VAL 188.A O no hydrogen 3.059 N/A GLY 193.A N TRP 189.A O no hydrogen 2.929 N/A GLY 193.A N TRP 190.A O no hydrogen 3.213 N/A THR 194.A N GLU 205.A OE1 no hydrogen 2.806 N/A THR 194.A OG1 GLU 195.A OE1 no hydrogen 2.692 N/A THR 194.A OG1 GLU 205.A OE1 no hydrogen 2.741 N/A GLU 195.A N GLU 195.A OE1 no hydrogen 2.678 N/A GLY 196.A N GLY 193.A O no hydrogen 3.154 N/A ILE 197.A N LEU 191.A O no hydrogen 2.682 N/A GLY 198.A N GLY 193.A O no hydrogen 2.798 N/A LEU 199.A N VAL 192.A O no hydrogen 2.754 N/A VAL 200.A N VAL 192.A O no hydrogen 2.864 N/A GLU 205.A N GLY 201.A O no hydrogen 2.878 N/A THR 206.A N ILE 202.A O no hydrogen 2.824 N/A THR 206.A OG1 ILE 202.A O no hydrogen 2.680 N/A ALA 207.A N GLY 203.A O no hydrogen 3.078 N/A GLY 208.A N ILE 204.A O no hydrogen 2.862 N/A PHE 209.A N GLU 205.A O no hydrogen 2.990 N/A MET 210.A N THR 206.A O no hydrogen 2.976 N/A VAL 211.A N ALA 207.A O no hydrogen 3.112 N/A ILE 212.A N GLY 208.A O no hydrogen 3.079 N/A ASP 213.A N PHE 209.A O no hydrogen 2.823 N/A LEU 214.A N MET 210.A O no hydrogen 3.190 N/A VAL 215.A N VAL 211.A O no hydrogen 2.979 N/A ALA 216.A N ILE 212.A O no hydrogen 2.724 N/A GLY 219.A N LEU 214.A O no hydrogen 2.890 N/A PHE 220.A N VAL 215.A O no hydrogen 2.883 N/A GLY 221.A N LYS 217.A O no hydrogen 2.648 N/A ILE 222.A N VAL 218.A O no hydrogen 2.647 N/A ILE 223.A N GLY 219.A O no hydrogen 3.121 N/A LEU 224.A N PHE 220.A O no hydrogen 2.918 N/A LEU 225.A N GLY 221.A O no hydrogen 3.068 N/A ASP 232.A N GLY 229.A O no hydrogen 3.303 N/A GLY 233.A N GLY 229.A O no hydrogen 3.166 N/A