Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5zj6_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 3.A NE1 ALA 7.A O no hydrogen 2.840 N/A ALA 7.A N GLU 4.A O no hydrogen 3.257 N/A ILE 10.A N VAL 76.A O no hydrogen 2.996 N/A ARG 12.A NH2 LYS 79.A O no hydrogen 3.311 N/A ARG 12.A NH2 GLU 80.A O no hydrogen 2.818 N/A GLU 13.A N GLU 13.A OE1 no hydrogen 2.692 N/A SER 14.A N PRO 11.A O no hydrogen 2.970 N/A SER 14.A OG PRO 11.A O no hydrogen 2.639 N/A LEU 15.A N ARG 12.A O no hydrogen 3.159 N/A LYS 16.A N THR 33.A O no hydrogen 2.849 N/A GLU 18.A N MET 31.A O no hydrogen 2.766 N/A LYS 19.A N MET 31.A O no hydrogen 3.116 N/A LEU 21.A N VAL 29.A O no hydrogen 2.831 N/A GLY 24.A N GLY 27.A O no hydrogen 2.823 N/A GLN 25.A NE2 GLU 168.A O no hydrogen 3.465 N/A GLN 25.A NE2 ALA 170.A O no hydrogen 2.774 N/A GLU 28.A N THR 44.A O no hydrogen 2.845 N/A VAL 29.A N GLY 22.A O no hydrogen 3.218 N/A TRP 30.A N VAL 42.A O no hydrogen 2.693 N/A MET 31.A N LYS 19.A O no hydrogen 2.816 N/A ALA 32.A N VAL 40.A O no hydrogen 2.926 N/A THR 33.A N LYS 16.A O no hydrogen 2.932 N/A THR 33.A OG1 GLU 18.A OE2 no hydrogen 2.575 N/A TYR 34.A N THR 38.A O no hydrogen 2.739 N/A ASN 35.A N SER 14.A O no hydrogen 2.745 N/A HIS 37.A N TYR 34.A O no hydrogen 3.153 N/A HIS 37.A ND1 ASN 35.A O no hydrogen 2.790 N/A THR 38.A N TYR 34.A O no hydrogen 3.051 N/A VAL 40.A N ALA 32.A O no hydrogen 2.963 N/A ALA 41.A N THR 86.A O no hydrogen 2.951 N/A VAL 42.A N TRP 30.A O no hydrogen 2.775 N/A LYS 43.A N ILE 84.A O no hydrogen 2.760 N/A LYS 43.A NZ ASP 152.A OD1 no hydrogen 2.848 N/A THR 44.A N GLU 28.A O no hydrogen 2.701 N/A THR 44.A OG1 GLU 28.A O no hydrogen 3.459 N/A THR 44.A OG1 GLU 28.A OE1 no hydrogen 3.005 N/A MET 45.A N ILE 82.A O no hydrogen 2.895 N/A LYS 46.A N PHE 26.A O no hydrogen 2.834 N/A LYS 46.A NZ GLY 24.A O no hydrogen 3.231 N/A LYS 46.A NZ GLN 25.A O no hydrogen 2.707 N/A LYS 46.A NZ GLU 168.A OE1 no hydrogen 3.328 N/A LYS 46.A NZ GLU 168.A OE2 no hydrogen 3.144 N/A SER 49.A N LYS 46.A O no hydrogen 2.986 N/A SER 49.A OG PHE 26.A O no hydrogen 3.071 N/A SER 49.A OG LYS 46.A O no hydrogen 3.381 N/A SER 51.A OG GLU 53.A OE2 no hydrogen 3.249 N/A GLU 53.A N GLU 53.A OE2 no hydrogen 2.858 N/A ALA 54.A N SER 51.A OG no hydrogen 3.223 N/A PHE 55.A N SER 51.A O no hydrogen 2.844 N/A LEU 56.A N VAL 52.A O no hydrogen 2.944 N/A ALA 57.A N GLU 53.A O no hydrogen 3.132 N/A GLU 58.A N ALA 54.A O no hydrogen 3.208 N/A ALA 59.A N PHE 55.A O no hydrogen 2.517 N/A ASN 60.A N LEU 56.A O no hydrogen 2.947 N/A VAL 61.A N GLU 58.A O no hydrogen 2.865 N/A MET 62.A N GLU 58.A O no hydrogen 2.901 N/A LYS 63.A N ALA 59.A O no hydrogen 2.961 N/A LYS 63.A NZ ASN 60.A OD1 no hydrogen 3.075 N/A THR 64.A N VAL 61.A O no hydrogen 3.113 N/A THR 64.A OG1 VAL 61.A O no hydrogen 2.688 N/A LEU 65.A N MET 62.A O no hydrogen 2.920 N/A GLN 66.A N THR 64.A O no hydrogen 2.905 N/A GLN 66.A NE2 LYS 63.A O no hydrogen 2.978 N/A LYS 69.A N HIS 67.A ND1 no hydrogen 2.933 N/A LYS 69.A NZ GLN 117.A OE1 no hydrogen 3.274 N/A LEU 70.A N HIS 67.A O no hydrogen 3.058 N/A VAL 71.A N ILE 150.A O no hydrogen 2.959 N/A LYS 72.A N GLU 87.A OE2 no hydrogen 2.917 N/A HIS 74.A N ILE 85.A O no hydrogen 2.774 N/A ALA 75.A N ILE 85.A O no hydrogen 3.094 N/A VAL 76.A N TRP 8.A O no hydrogen 2.893 N/A VAL 77.A N TYR 83.A O no hydrogen 3.059 N/A TYR 83.A N VAL 77.A O no hydrogen 3.252 N/A ILE 84.A N LYS 43.A O no hydrogen 2.771 N/A ILE 85.A N ALA 75.A O no hydrogen 2.860 N/A THR 86.A N ALA 41.A O no hydrogen 2.940 N/A THR 86.A OG1 GLU 87.A O no hydrogen 3.022 N/A GLU 87.A N LYS 72.A O no hydrogen 3.171 N/A LYS 91.A N VAL 142.A O no hydrogen 2.920 N/A LYS 91.A NZ GLU 102.A OE1 no hydrogen 3.236 N/A GLY 92.A N MET 89.A O no hydrogen 3.234 N/A LEU 94.A N ILE 140.A O no hydrogen 2.736 N/A LEU 95.A N ALA 137.A O no hydrogen 3.299 N/A ASP 96.A N SER 93.A OG no hydrogen 3.024 N/A PHE 97.A N SER 93.A O no hydrogen 2.848 N/A LEU 98.A N LEU 94.A O no hydrogen 2.827 N/A LYS 99.A N LEU 95.A O no hydrogen 3.320 N/A LYS 99.A N ASP 96.A O no hydrogen 3.020 N/A SER 100.A N PHE 97.A O no hydrogen 3.011 N/A SER 100.A OG PHE 97.A O no hydrogen 2.688 N/A GLY 103.A N SER 100.A OG no hydrogen 3.128 N/A SER 104.A N SER 100.A O no hydrogen 2.880 N/A SER 104.A OG SER 100.A O no hydrogen 2.950 N/A SER 104.A OG ASP 101.A O no hydrogen 3.121 N/A LYS 105.A N GLU 102.A O no hydrogen 3.307 N/A LYS 105.A NZ ASP 101.A O no hydrogen 2.726 N/A GLN 106.A N GLY 103.A O no hydrogen 3.227 N/A GLN 106.A NE2 GLU 102.A O no hydrogen 3.103 N/A LYS 110.A NZ ASP 113.A OD2 no hydrogen 3.392 N/A LEU 111.A N PRO 107.A O no hydrogen 3.047 N/A ILE 112.A N LEU 108.A O no hydrogen 2.933 N/A ASP 113.A N PRO 109.A O no hydrogen 2.850 N/A PHE 114.A N LYS 110.A O no hydrogen 2.839 N/A SER 115.A N LEU 111.A O no hydrogen 3.069 N/A SER 115.A OG LEU 111.A O no hydrogen 2.904 N/A ALA 116.A N ILE 112.A O no hydrogen 2.909 N/A GLN 117.A N ASP 113.A O no hydrogen 2.975 N/A GLN 117.A NE2 ASP 113.A OD1 no hydrogen 3.226 N/A ILE 118.A N PHE 114.A O no hydrogen 3.085 N/A ALA 119.A N SER 115.A O no hydrogen 2.882 N/A GLU 120.A N ALA 116.A O no hydrogen 2.859 N/A GLY 121.A N GLN 117.A O no hydrogen 3.094 N/A MET 122.A N ILE 118.A O no hydrogen 2.874 N/A ALA 123.A N ALA 119.A O no hydrogen 2.767 N/A PHE 124.A N GLU 120.A O no hydrogen 3.070 N/A ILE 125.A N GLY 121.A O no hydrogen 3.053 N/A GLU 126.A N MET 122.A O no hydrogen 2.769 N/A GLN 127.A N ALA 123.A O no hydrogen 2.839 N/A ARG 128.A N PHE 124.A O no hydrogen 2.907 N/A ARG 128.A NH1 THR 64.A O no hydrogen 3.117 N/A ARG 128.A NH2 THR 64.A OG1 no hydrogen 2.841 N/A ASN 129.A N GLU 126.A O no hydrogen 3.072 N/A TYR 130.A N ILE 125.A O no hydrogen 2.971 N/A TYR 130.A OH GLU 58.A OE2 no hydrogen 2.658 N/A HIS 132.A N ASP 192.A OD2 no hydrogen 2.637 N/A HIS 132.A NE2 ALA 151.A O no hydrogen 2.705 N/A ARG 133.A N ASP 192.A OD1 no hydrogen 3.040 N/A ASP 134.A N HIS 132.A ND1 no hydrogen 3.020 N/A ARG 136.A NE ASP 134.A OD1 no hydrogen 2.733 N/A ARG 136.A NH2 ASP 134.A OD1 no hydrogen 3.326 N/A ARG 136.A NH2 ASP 134.A OD2 no hydrogen 2.679 N/A ALA 137.A N GLU 202.A OE1 no hydrogen 2.912 N/A ASN 139.A N ARG 136.A O no hydrogen 2.831 N/A ASN 139.A ND2 ASP 134.A O no hydrogen 2.761 N/A ASN 139.A ND2 ASP 134.A OD2 no hydrogen 2.978 N/A ILE 140.A N ALA 137.A O no hydrogen 3.169 N/A LEU 141.A N LYS 149.A O no hydrogen 2.812 N/A VAL 142.A N GLY 92.A O no hydrogen 2.845 N/A SER 143.A N VAL 147.A O no hydrogen 2.891 N/A SER 143.A OG SER 145.A OG no hydrogen 3.384 N/A SER 145.A OG SER 143.A OG no hydrogen 3.384 N/A LEU 146.A N SER 143.A O no hydrogen 3.054 N/A VAL 147.A N SER 143.A OG no hydrogen 3.028 N/A CYS 148.A N GLN 117.A OE1 no hydrogen 2.871 N/A LYS 149.A N LEU 141.A O no hydrogen 2.802 N/A LYS 149.A NZ GLU 87.A OE1 no hydrogen 3.356 N/A LYS 149.A NZ GLU 87.A OE2 no hydrogen 3.247 N/A ILE 150.A N LYS 69.A O no hydrogen 2.809 N/A ALA 151.A N ASN 139.A O no hydrogen 2.888 N/A GLY 154.A N HIS 132.A O no hydrogen 2.932 N/A LEU 155.A N ASP 152.A O no hydrogen 3.068 N/A ARG 157.A N GLY 154.A O no hydrogen 3.216 N/A VAL 158.A N LEU 155.A O no hydrogen 3.068 N/A ILE 159.A N ALA 156.A O no hydrogen 3.422 N/A GLU 160.A N SER 49.A O no hydrogen 2.902 N/A ASN 162.A N THR 165.A OG1 no hydrogen 3.142 N/A ASN 162.A ND2 GLY 48.A O no hydrogen 2.967 N/A TYR 164.A N ASN 162.A OD1 no hydrogen 2.816 N/A THR 165.A N ASN 162.A OD1 no hydrogen 2.999 N/A THR 165.A OG1 GLU 160.A O no hydrogen 2.613 N/A THR 165.A OG1 ASN 162.A O no hydrogen 3.551 N/A THR 165.A OG1 ASN 162.A OD1 no hydrogen 3.474 N/A ALA 166.A N ASN 162.A O no hydrogen 3.011 N/A GLU 168.A N THR 165.A O no hydrogen 3.036 N/A GLY 169.A N ALA 166.A O no hydrogen 3.452 N/A LYS 171.A NZ ALA 156.A O no hydrogen 3.387 N/A LYS 171.A NZ ILE 159.A O no hydrogen 2.503 N/A LYS 171.A NZ ASP 161.A OD1 no hydrogen 3.428 N/A LYS 171.A NZ ASP 161.A OD2 no hydrogen 3.558 N/A LYS 175.A NZ PRO 210.A O no hydrogen 3.046 N/A LYS 175.A NZ TYR 211.A O no hydrogen 3.150 N/A LYS 175.A NZ MET 214.A O no hydrogen 2.783 N/A TRP 176.A N PRO 173.A O no hydrogen 3.155 N/A TRP 176.A NE1 GLU 202.A OE1 no hydrogen 2.821 N/A THR 177.A N ILE 174.A O no hydrogen 3.145 N/A THR 177.A OG1 PRO 173.A O no hydrogen 2.742 N/A GLU 180.A N GLU 180.A OE1 no hydrogen 2.799 N/A ALA 181.A N ALA 178.A O no hydrogen 2.986 N/A ILE 182.A N ALA 178.A O no hydrogen 3.115 N/A ASN 183.A N PRO 179.A O no hydrogen 2.838 N/A PHE 184.A N GLU 180.A O no hydrogen 2.970 N/A GLY 185.A N ALA 181.A O no hydrogen 3.001 N/A SER 186.A N GLU 180.A O no hydrogen 3.280 N/A THR 188.A N SER 191.A OG no hydrogen 2.862 N/A LYS 190.A N THR 188.A OG1 no hydrogen 3.065 N/A LYS 190.A NZ ARG 254.A O no hydrogen 2.735 N/A LYS 190.A NZ PRO 255.A O no hydrogen 3.188 N/A SER 191.A N THR 188.A OG1 no hydrogen 3.335 N/A SER 191.A OG THR 188.A O no hydrogen 2.796 N/A ASP 192.A N THR 188.A O no hydrogen 3.102 N/A VAL 193.A N ILE 189.A O no hydrogen 2.990 N/A TRP 194.A N LYS 190.A O no hydrogen 3.199 N/A SER 195.A N SER 191.A O no hydrogen 3.091 N/A SER 195.A OG TRP 176.A O no hydrogen 2.780 N/A SER 195.A OG SER 191.A O no hydrogen 3.169 N/A PHE 196.A N ASP 192.A O no hydrogen 2.780 N/A GLY 197.A N VAL 193.A O no hydrogen 3.101 N/A ILE 198.A N TRP 194.A O no hydrogen 3.250 N/A LEU 199.A N SER 195.A O no hydrogen 2.857 N/A LEU 200.A N PHE 196.A O no hydrogen 2.753 N/A MET 201.A N GLY 197.A O no hydrogen 3.123 N/A GLU 202.A N ILE 198.A O no hydrogen 2.910 N/A ILE 203.A N LEU 199.A O no hydrogen 2.878 N/A VAL 204.A N LEU 200.A O no hydrogen 3.110 N/A THR 205.A N MET 201.A O no hydrogen 3.095 N/A THR 205.A OG1 MET 201.A O no hydrogen 2.804 N/A THR 205.A OG1 GLU 202.A O no hydrogen 3.226 N/A TYR 206.A N ILE 203.A O no hydrogen 3.084 N/A TYR 206.A OH GLN 106.A O no hydrogen 2.647 N/A GLY 207.A N GLU 202.A O no hydrogen 2.823 N/A ARG 208.A N THR 205.A OG1 no hydrogen 3.304 N/A MET 214.A N TYR 211.A O no hydrogen 3.115 N/A SER 215.A N GLU 218.A OE1 no hydrogen 2.910 N/A GLU 218.A N SER 215.A OG no hydrogen 3.259 N/A VAL 219.A N SER 215.A O no hydrogen 2.993 N/A ILE 220.A N ASN 216.A O no hydrogen 3.109 N/A ARG 221.A N PRO 217.A O no hydrogen 3.047 N/A ALA 222.A N GLU 218.A O no hydrogen 2.993 N/A LEU 223.A N VAL 219.A O no hydrogen 2.924 N/A GLU 224.A N ILE 220.A O no hydrogen 3.163 N/A ARG 225.A N ALA 222.A O no hydrogen 2.946 N/A ARG 225.A NE ARG 221.A O no hydrogen 3.063 N/A GLY 226.A N LEU 223.A O no hydrogen 2.982 N/A TYR 227.A N ALA 222.A O no hydrogen 2.962 N/A ARG 228.A NE TRP 247.A O no hydrogen 2.872 N/A ARG 228.A NH1 LEU 223.A O no hydrogen 3.131 N/A ARG 228.A NH1 TYR 227.A O no hydrogen 2.778 N/A ARG 228.A NH2 TRP 247.A O no hydrogen 2.850 N/A ARG 231.A NH1 CYS 235.A O no hydrogen 2.942 N/A CYS 235.A SG PRO 236.A O no hydrogen 3.564 N/A GLU 238.A N GLU 238.A OE1 no hydrogen 2.688 N/A TYR 240.A N PRO 236.A O no hydrogen 3.092 N/A TYR 240.A OH MET 229.A O no hydrogen 2.594 N/A ASN 241.A N GLU 237.A O no hydrogen 2.819 N/A ILE 242.A N GLU 238.A O no hydrogen 3.335 N/A MET 243.A N LEU 239.A O no hydrogen 3.165 N/A MET 244.A N TYR 240.A O no hydrogen 2.982 N/A ARG 245.A N ASN 241.A O no hydrogen 3.108 N/A CYS 246.A N ILE 242.A O no hydrogen 3.080 N/A CYS 246.A SG ILE 242.A O no hydrogen 3.297 N/A TRP 247.A N MET 243.A O no hydrogen 3.081 N/A TRP 247.A N MET 244.A O no hydrogen 3.120 N/A LYS 248.A N ARG 245.A O no hydrogen 3.468 N/A GLU 252.A N GLU 252.A OE1 no hydrogen 2.608 N/A GLU 253.A N ARG 250.A O no hydrogen 3.062 N/A ARG 254.A N PRO 251.A O no hydrogen 3.019 N/A ARG 254.A NE LYS 248.A O no hydrogen 2.828 N/A ARG 254.A NH1 GLU 180.A OE2 no hydrogen 2.903 N/A ARG 254.A NH1 LYS 190.A O no hydrogen 2.945 N/A ARG 254.A NH2 GLU 180.A OE1 no hydrogen 2.932 N/A ARG 254.A NH2 LYS 248.A O no hydrogen 3.194 N/A PHE 257.A N GLU 126.A OE2 no hydrogen 2.790 N/A GLU 258.A N GLU 126.A OE1 no hydrogen 3.172 N/A TYR 259.A N THR 256.A OG1 no hydrogen 3.071 N/A ILE 260.A N THR 256.A O no hydrogen 2.977 N/A GLN 261.A N PHE 257.A O no hydrogen 2.802 N/A SER 262.A N GLU 258.A O no hydrogen 3.216 N/A VAL 263.A N TYR 259.A O no hydrogen 3.004 N/A LEU 264.A N ILE 260.A O no hydrogen 2.904 N/A ASP 265.A N GLN 261.A O no hydrogen 2.981 N/A ASP 266.A N SER 262.A O no hydrogen 3.094 N/A PHE 267.A N VAL 263.A O no hydrogen 2.948 N/A TYR 268.A N LEU 264.A O no hydrogen 2.876 N/A THR 269.A N ASP 265.A O no hydrogen 3.349 N/A THR 269.A OG1 ASP 266.A O no hydrogen 3.019 N/A ALA 270.A N ASP 266.A O no hydrogen 3.197 N/A THR 271.A N PHE 267.A O no hydrogen 3.065 N/A THR 271.A N TYR 268.A O no hydrogen 2.975 N/A THR 271.A OG1 PHE 267.A O no hydrogen 3.168 N/A THR 271.A OG1 TYR 268.A O no hydrogen 2.832 N/A