Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1r4q_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 1.A NZ LEU 49.A O no hydrogen 3.385 N/A PHE 3.A N ALA 51.A O no hydrogen 2.888 N/A LEU 5.A N ASP 53.A O no hydrogen 2.920 N/A ASP 6.A N SER 16.A OG no hydrogen 3.076 N/A PHE 7.A N ARG 55.A O no hydrogen 2.688 N/A SER 8.A N ASP 6.A OD1 no hydrogen 3.170 N/A SER 8.A OG ASP 6.A OD1 no hydrogen 2.466 N/A THR 9.A N THR 12.A OG1 no hydrogen 2.734 N/A ALA 10.A N ASP 183.A OD1 no hydrogen 2.763 N/A LYS 11.A NZ ASP 15.A OD2 no hydrogen 3.125 N/A THR 12.A N THR 9.A OG1 no hydrogen 3.325 N/A THR 12.A OG1 ASP 6.A O no hydrogen 3.077 N/A THR 12.A OG1 THR 9.A O no hydrogen 2.870 N/A TYR 13.A N THR 9.A O no hydrogen 2.841 N/A TYR 13.A OH VAL 164.A O no hydrogen 2.732 N/A VAL 14.A N ALA 10.A O no hydrogen 3.041 N/A ASP 15.A N LYS 11.A O no hydrogen 2.755 N/A SER 16.A N THR 12.A O no hydrogen 3.030 N/A SER 16.A OG THR 4.A O no hydrogen 3.457 N/A SER 16.A OG THR 12.A O no hydrogen 2.862 N/A LEU 17.A N TYR 13.A O no hydrogen 3.178 N/A ASN 18.A N VAL 14.A O no hydrogen 3.114 N/A VAL 19.A N ASP 15.A O no hydrogen 3.095 N/A ILE 20.A N SER 16.A O no hydrogen 3.431 N/A ARG 21.A N LEU 17.A O no hydrogen 3.196 N/A ARG 21.A NE LEU 169.A O no hydrogen 2.949 N/A ARG 21.A NH1 ASN 18.A OD1 no hydrogen 2.982 N/A ARG 21.A NH1 GLN 175.A OE1 no hydrogen 3.110 N/A ARG 21.A NH2 ALA 168.A O no hydrogen 2.691 N/A ARG 21.A NH2 LEU 169.A O no hydrogen 3.469 N/A ARG 21.A NH2 GLN 175.A OE1 no hydrogen 2.786 N/A SER 22.A N ASN 18.A O no hydrogen 3.209 N/A SER 22.A OG ASN 18.A O no hydrogen 2.922 N/A ALA 23.A N VAL 19.A O no hydrogen 3.161 N/A ILE 24.A N ILE 20.A O no hydrogen 3.078 N/A GLY 25.A N ARG 21.A O no hydrogen 3.033 N/A THR 26.A N MET 40.A O no hydrogen 3.004 N/A LEU 28.A N LEU 38.A O no hydrogen 2.937 N/A ILE 31.A N LEU 28.A O no hydrogen 3.162 N/A SER 32.A OG THR 36.A O no hydrogen 3.089 N/A SER 32.A OG SER 37.A OG no hydrogen 2.859 N/A SER 33.A N THR 36.A O no hydrogen 3.191 N/A SER 37.A OG SER 32.A OG no hydrogen 2.859 N/A LEU 38.A N ILE 31.A O no hydrogen 3.062 N/A LEU 39.A N ALA 237.A O no hydrogen 3.231 N/A MET 40.A N THR 26.A O no hydrogen 3.001 N/A ILE 41.A N ILE 239.A O no hydrogen 2.785 N/A ASP 42.A N ILE 24.A O no hydrogen 2.932 N/A PHE 50.A N VAL 71.A O no hydrogen 2.985 N/A ALA 51.A N LYS 1.A O no hydrogen 3.023 N/A VAL 52.A N LEU 69.A O no hydrogen 2.759 N/A ASP 53.A N PHE 3.A O no hydrogen 2.704 N/A VAL 54.A N LEU 67.A O no hydrogen 3.179 N/A ARG 55.A N LEU 5.A O no hydrogen 3.040 N/A ARG 55.A NE VAL 54.A O no hydrogen 3.322 N/A GLY 62.A N ASP 58.A OD2 no hydrogen 3.302 N/A ASN 65.A N ARG 63.A O no hydrogen 2.495 N/A ASN 66.A N TYR 139.A OH no hydrogen 3.039 N/A ARG 68.A N VAL 82.A O no hydrogen 3.205 N/A ARG 68.A NE ASP 53.A OD1 no hydrogen 2.712 N/A ARG 68.A NH2 ASP 53.A OD1 no hydrogen 3.425 N/A ARG 68.A NH2 ASP 53.A OD2 no hydrogen 3.326 N/A LEU 69.A N VAL 52.A O no hydrogen 2.729 N/A ILE 70.A N GLY 80.A O no hydrogen 2.941 N/A VAL 71.A N PHE 50.A O no hydrogen 2.878 N/A GLU 72.A N TYR 77.A O no hydrogen 2.832 N/A ARG 73.A N ASN 48.A O no hydrogen 3.083 N/A ARG 73.A NE ASN 74.A OD1 no hydrogen 3.505 N/A ARG 73.A NH2 ASN 74.A OD1 no hydrogen 3.456 N/A ASN 74.A N ASP 47.A OD1 no hydrogen 2.849 N/A ASN 75.A N GLU 72.A OE1 no hydrogen 2.929 N/A ASN 75.A ND2 GLU 72.A OE1 no hydrogen 3.538 N/A ASN 75.A ND2 GLU 72.A OE2 no hydrogen 3.163 N/A TYR 77.A OH PRO 245.A O no hydrogen 2.750 N/A THR 79.A N ILE 70.A O no hydrogen 2.928 N/A THR 79.A OG1 ILE 70.A O no hydrogen 3.065 N/A PHE 81.A N TYR 90.A O no hydrogen 3.130 N/A VAL 82.A N ARG 68.A O no hydrogen 2.790 N/A ASN 83.A N VAL 88.A O no hydrogen 3.278 N/A ASN 83.A ND2 MET 143.A O no hydrogen 3.103 N/A ARG 84.A N ASN 66.A O no hydrogen 2.907 N/A THR 85.A N ASN 83.A OD1 no hydrogen 2.942 N/A ASN 87.A ND2 GLY 102.A O no hydrogen 2.732 N/A PHE 89.A N THR 104.A O no hydrogen 3.214 N/A TYR 90.A N PHE 81.A O no hydrogen 2.752 N/A ARG 91.A N VAL 106.A O no hydrogen 3.101 N/A ARG 91.A NE THR 107.A OG1 no hydrogen 3.047 N/A ARG 91.A NH1 VAL 98.A O no hydrogen 2.482 N/A ARG 91.A NH2 THR 107.A OG1 no hydrogen 3.380 N/A PHE 92.A N THR 79.A O no hydrogen 3.067 N/A ALA 93.A N GLY 110.A O no hydrogen 2.934 N/A PHE 95.A N PHE 92.A O no hydrogen 2.823 N/A SER 96.A OG ALA 93.A O no hydrogen 2.970 N/A VAL 98.A N PHE 95.A O no hydrogen 3.201 N/A THR 103.A N PHE 100.A O no hydrogen 2.971 N/A THR 103.A OG1 PHE 100.A O no hydrogen 2.453 N/A THR 103.A OG1 THR 104.A O no hydrogen 3.433 N/A THR 104.A N ASN 87.A O no hydrogen 3.386 N/A VAL 106.A N PHE 89.A O no hydrogen 3.154 N/A LEU 108.A N ARG 91.A O no hydrogen 2.941 N/A SER 109.A N THR 148.A O no hydrogen 2.850 N/A SER 112.A N ASP 94.A OD1 no hydrogen 2.734 N/A SER 112.A OG ASP 94.A OD1 no hydrogen 3.284 N/A SER 112.A OG ASP 94.A OD2 no hydrogen 2.594 N/A SER 113.A OG ASP 111.A OD2 no hydrogen 2.823 N/A TYR 114.A OH GLU 167.A OE2 no hydrogen 2.511 N/A THR 116.A N SER 113.A OG no hydrogen 3.287 N/A THR 116.A OG1 ASP 111.A OD1 no hydrogen 2.476 N/A THR 116.A OG1 ASP 111.A OD2 no hydrogen 3.430 N/A THR 116.A OG1 SER 113.A OG no hydrogen 3.248 N/A LEU 117.A N SER 113.A O no hydrogen 3.150 N/A GLN 118.A N TYR 114.A O no hydrogen 2.878 N/A GLN 118.A NE2 ILE 123.A O no hydrogen 3.656 N/A ARG 119.A N THR 115.A O no hydrogen 3.203 N/A VAL 120.A N THR 116.A O no hydrogen 3.037 N/A ALA 121.A N LEU 117.A O no hydrogen 2.747 N/A GLY 122.A N GLN 118.A O no hydrogen 3.098 N/A GLY 122.A N ARG 119.A O no hydrogen 2.953 N/A SER 124.A OG THR 126.A O no hydrogen 3.242 N/A ARG 125.A NH1 THR 200.A OG1 no hydrogen 2.998 N/A ARG 125.A NH2 THR 200.A OG1 no hydrogen 2.723 N/A GLY 127.A N MET 192.A O no hydrogen 2.830 N/A MET 128.A N ARG 125.A O no hydrogen 2.880 N/A ILE 130.A N TYR 190.A O no hydrogen 2.885 N/A ASN 131.A N SER 134.A OG no hydrogen 2.799 N/A ASN 131.A ND2 ARG 188.A O no hydrogen 3.383 N/A ARG 132.A NH1 PHE 7.A O no hydrogen 2.647 N/A ARG 132.A NH1 ILE 57.A O no hydrogen 3.333 N/A ARG 132.A NH2 PHE 7.A O no hydrogen 3.216 N/A ARG 132.A NH2 SER 8.A O no hydrogen 3.044 N/A ARG 132.A NH2 LEU 182.A O no hydrogen 2.860 N/A SER 134.A N ASN 131.A OD1 no hydrogen 2.763 N/A SER 134.A OG ASN 131.A O no hydrogen 3.171 N/A SER 134.A OG ASN 131.A OD1 no hydrogen 3.196 N/A LEU 135.A N ASN 131.A O no hydrogen 2.928 N/A THR 136.A N ARG 132.A O no hydrogen 2.818 N/A THR 136.A OG1 ARG 132.A O no hydrogen 3.206 N/A THR 137.A N HIS 133.A O no hydrogen 2.998 N/A SER 138.A N SER 134.A O no hydrogen 2.898 N/A SER 138.A OG SER 134.A O no hydrogen 3.127 N/A TYR 139.A N LEU 135.A O no hydrogen 3.043 N/A TYR 139.A N THR 136.A O no hydrogen 3.121 N/A LEU 140.A N THR 136.A O no hydrogen 3.208 N/A ASP 141.A N THR 137.A O no hydrogen 3.058 N/A LEU 142.A N SER 138.A O no hydrogen 3.344 N/A MET 143.A N TYR 139.A O no hydrogen 2.986 N/A SER 144.A N LEU 140.A O no hydrogen 2.904 N/A SER 144.A OG LEU 140.A O no hydrogen 3.447 N/A HIS 145.A N LEU 142.A O no hydrogen 3.198 N/A HIS 145.A NE2 SER 149.A O no hydrogen 3.180 N/A THR 148.A OG1 THR 107.A O no hydrogen 3.492 N/A LEU 150.A N SER 109.A OG no hydrogen 2.975 N/A VAL 154.A N THR 151.A O no hydrogen 2.708 N/A ALA 155.A N THR 151.A O no hydrogen 2.987 N/A ARG 156.A N GLN 152.A O no hydrogen 2.995 N/A ARG 156.A NE ALA 121.A O no hydrogen 2.528 N/A ARG 156.A NH2 ALA 121.A O no hydrogen 2.800 N/A ALA 157.A N SER 153.A O no hydrogen 3.055 N/A MET 158.A N VAL 154.A O no hydrogen 2.773 N/A LEU 159.A N ALA 155.A O no hydrogen 2.806 N/A ARG 160.A N ARG 156.A O no hydrogen 3.342 N/A ARG 160.A NE GLN 129.A O no hydrogen 3.107 N/A ARG 160.A NH2 GLN 129.A O no hydrogen 3.339 N/A PHE 161.A N ALA 157.A O no hydrogen 3.116 N/A VAL 162.A N MET 158.A O no hydrogen 2.818 N/A THR 163.A N LEU 159.A O no hydrogen 3.159 N/A THR 163.A OG1 LEU 159.A O no hydrogen 2.589 N/A VAL 164.A N ARG 160.A O no hydrogen 3.171 N/A THR 165.A OG1 PHE 161.A O no hydrogen 2.570 N/A GLU 167.A N VAL 162.A O no hydrogen 3.090 N/A ALA 168.A N THR 163.A O no hydrogen 3.079 N/A LEU 169.A N THR 165.A O no hydrogen 2.783 N/A ARG 170.A N ALA 166.A O no hydrogen 3.015 N/A ARG 170.A NH2 ASN 75.A O no hydrogen 3.468 N/A PHE 171.A N GLU 167.A O no hydrogen 2.811 N/A ARG 172.A NH1 LEU 233.A O no hydrogen 2.939 N/A GLN 173.A N SER 235.A O no hydrogen 3.246 N/A GLN 173.A NE2 ASP 196.A OD1 no hydrogen 2.440 N/A GLN 175.A N PHE 171.A O no hydrogen 3.038 N/A ARG 176.A N ARG 172.A O no hydrogen 2.778 N/A ARG 176.A NH1 GLY 234.A O no hydrogen 3.023 N/A ARG 176.A NH2 GLY 234.A O no hydrogen 3.177 N/A GLY 177.A N GLN 173.A O no hydrogen 3.128 N/A PHE 178.A N ILE 174.A O no hydrogen 3.136 N/A ARG 179.A N GLN 175.A O no hydrogen 2.922 N/A THR 181.A N PHE 178.A O no hydrogen 2.947 N/A THR 181.A OG1 PHE 178.A O no hydrogen 3.208 N/A LEU 182.A N ARG 179.A O no hydrogen 3.066 N/A ASP 184.A N THR 180.A O no hydrogen 3.179 N/A SER 186.A OG ASP 184.A OD1 no hydrogen 2.715 N/A GLY 187.A N ASP 184.A O no hydrogen 3.487 N/A ARG 188.A N ASP 184.A OD1 no hydrogen 3.325 N/A SER 189.A OG TYR 190.A O no hydrogen 3.513 N/A TYR 190.A N ILE 130.A O no hydrogen 2.865 N/A TYR 190.A OH ASP 196.A OD2 no hydrogen 2.555 N/A MET 192.A N MET 128.A O no hydrogen 2.973 N/A ASP 196.A N THR 193.A OG1 no hydrogen 3.213 N/A VAL 197.A N THR 193.A O no hydrogen 2.955 N/A ASP 198.A N ALA 194.A O no hydrogen 2.837 N/A LEU 199.A N GLU 195.A O no hydrogen 3.129 N/A LEU 199.A N ASP 196.A O no hydrogen 3.273 N/A THR 200.A N ASP 196.A O no hydrogen 3.353 N/A THR 200.A OG1 VAL 197.A O no hydrogen 2.839 N/A LEU 201.A N VAL 197.A O no hydrogen 3.044 N/A ASN 202.A N LEU 199.A O no hydrogen 2.995 N/A ASN 202.A ND2 ASP 198.A O no hydrogen 2.839 N/A TRP 203.A NE1 LEU 238.A O no hydrogen 2.779 N/A ARG 205.A NH2 ASN 202.A OD1 no hydrogen 2.835 N/A LEU 206.A N ASN 202.A O no hydrogen 2.899 N/A SER 207.A N TRP 203.A O no hydrogen 2.939 N/A SER 207.A OG TRP 203.A O no hydrogen 2.784 N/A SER 208.A N GLY 204.A O no hydrogen 3.036 N/A SER 208.A OG VAL 254.A O no hydrogen 3.220 N/A VAL 209.A N ARG 205.A O no hydrogen 3.042 N/A LEU 210.A N LEU 206.A O no hydrogen 2.793 N/A ASP 212.A N VAL 209.A O no hydrogen 2.929 N/A TYR 213.A N LEU 210.A O no hydrogen 3.063 N/A TYR 213.A OH GLN 216.A O no hydrogen 3.192 N/A HIS 214.A N GLN 216.A OE1 no hydrogen 2.917 N/A GLN 216.A N GLN 216.A OE1 no hydrogen 2.690 N/A GLN 216.A NE2 THR 258.A OG1 no hydrogen 2.958 N/A ASP 217.A N LYS 261.A O no hydrogen 2.803 N/A VAL 219.A N PHE 226.A O no hydrogen 3.320 N/A ARG 220.A N LEU 263.A O no hydrogen 2.845 N/A VAL 221.A N ILE 224.A O no hydrogen 3.144 N/A GLY 222.A N THR 268.A OG1 no hydrogen 3.076 N/A ARG 223.A NE ASP 198.A OD2 no hydrogen 2.981 N/A ILE 224.A N VAL 221.A O no hydrogen 3.005 N/A PHE 226.A N VAL 219.A O no hydrogen 2.941 N/A ASN 230.A N SER 228.A OG no hydrogen 3.266 N/A ASN 230.A ND2 SER 33.A OG no hydrogen 3.229 N/A ALA 231.A N SER 228.A O no hydrogen 2.925 N/A ALA 231.A N SER 228.A OG no hydrogen 3.368 N/A ILE 232.A N SER 228.A O no hydrogen 3.112 N/A LEU 233.A N ILE 229.A O no hydrogen 3.054 N/A GLY 234.A N ASN 230.A O no hydrogen 3.117 N/A SER 235.A N ILE 232.A O no hydrogen 2.916 N/A SER 235.A OG GLN 173.A OE1 no hydrogen 2.683 N/A VAL 236.A N ILE 232.A O no hydrogen 2.828 N/A ALA 237.A N ARG 170.A O no hydrogen 2.867 N/A LEU 238.A N ARG 170.A O no hydrogen 3.176 N/A ILE 239.A N LEU 39.A O no hydrogen 2.840 N/A LEU 240.A N SER 207.A OG no hydrogen 3.118 N/A HIS 243.A N ASN 241.A OD1 no hydrogen 3.167 N/A MET 247.A N ASN 75.A OD1 no hydrogen 2.821 N/A CYS 248.A N SER 246.A OG no hydrogen 3.088 N/A CYS 248.A SG ASN 241.A O no hydrogen 3.854 N/A CYS 248.A SG SER 246.A OG no hydrogen 3.594 N/A ARG 255.A N SER 266.A OG no hydrogen 3.028 N/A ILE 257.A N TRP 264.A O no hydrogen 2.968 N/A HIS 259.A N ILE 262.A O no hydrogen 2.954 N/A ILE 262.A N HIS 259.A O no hydrogen 3.220 N/A LEU 263.A N SER 218.A O no hydrogen 2.883 N/A TRP 264.A N ILE 257.A O no hydrogen 2.988 N/A SER 266.A N ARG 255.A O no hydrogen 2.878 N/A SER 266.A OG ARG 255.A O no hydrogen 2.969 N/A SER 267.A N ASP 265.A OD1 no hydrogen 2.992 N/A THR 268.A N ASP 265.A OD1 no hydrogen 3.155 N/A THR 268.A OG1 ASP 265.A OD2 no hydrogen 2.360 N/A LEU 269.A N ASP 265.A O no hydrogen 3.209 N/A GLY 270.A N SER 266.A O no hydrogen 2.878 N/A ALA 271.A N SER 267.A O no hydrogen 2.969 N/A ILE 272.A N THR 268.A O no hydrogen 3.329 N/A ARG 275.A NH1 ILE 272.A O no hydrogen 3.182 N/A