Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6m3i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 22.A OE2 no hydrogen 3.119 N/A ALA 2.A N GLU 22.A OE2 no hydrogen 2.780 N/A VAL 4.A N ALA 2.A O no hydrogen 2.884 N/A LEU 8.A N SER 5.A OG no hydrogen 3.008 N/A ARG 9.A N SER 5.A O no hydrogen 3.123 N/A ARG 9.A NE VAL 4.A O no hydrogen 3.036 N/A ARG 9.A NH1 GLU 22.A OE1 no hydrogen 2.886 N/A ARG 9.A NH1 GLU 22.A OE2 no hydrogen 3.542 N/A ARG 9.A NH2 ALA 2.A O no hydrogen 3.114 N/A ARG 9.A NH2 GLU 22.A OE2 no hydrogen 2.645 N/A LYS 10.A N SER 6.A O no hydrogen 2.910 N/A GLU 11.A N ASP 7.A O no hydrogen 2.996 N/A VAL 12.A N LEU 8.A O no hydrogen 3.108 N/A GLU 13.A N ARG 9.A O no hydrogen 2.805 N/A ASN 14.A N LYS 10.A O no hydrogen 2.750 N/A HIS 15.A N GLU 11.A O no hydrogen 3.421 N/A TYR 16.A N VAL 12.A O no hydrogen 3.201 N/A LYS 17.A NZ GLU 298.A OE1 no hydrogen 2.365 N/A LYS 17.A NZ GLU 298.A OE2 no hydrogen 3.210 N/A LEU 18.A N GLU 13.A O no hydrogen 3.246 N/A LEU 20.A N GLU 13.A OE2 no hydrogen 3.101 N/A PHE 24.A N PRO 21.A O no hydrogen 3.030 N/A TYR 25.A OH GLU 13.A OE2 no hydrogen 2.952 N/A HIS 26.A N GLU 22.A O no hydrogen 3.012 N/A PHE 27.A N ASP 23.A O no hydrogen 2.914 N/A TRP 28.A N PHE 24.A O no hydrogen 3.219 N/A LYS 29.A N TYR 25.A O no hydrogen 3.180 N/A LYS 29.A NZ GLU 32.A OE1 no hydrogen 2.751 N/A PHE 30.A N HIS 26.A O no hydrogen 2.926 N/A CYS 31.A N PHE 27.A O no hydrogen 2.853 N/A CYS 31.A SG PHE 27.A O no hydrogen 3.605 N/A CYS 31.A SG SER 42.A OG no hydrogen 3.522 N/A GLU 32.A N TRP 28.A O no hydrogen 2.901 N/A GLU 33.A N LYS 29.A O no hydrogen 3.146 N/A LEU 34.A N PHE 30.A O no hydrogen 3.060 N/A ASP 35.A N CYS 31.A O no hydrogen 2.917 N/A LYS 38.A N ASP 35.A OD1 no hydrogen 2.863 N/A ASP 41.A N LYS 38.A O no hydrogen 3.027 N/A SER 42.A N PRO 39.A O no hydrogen 3.111 N/A SER 42.A OG PRO 39.A O no hydrogen 2.969 N/A SER 44.A N ASP 41.A O no hydrogen 2.972 N/A SER 46.A OG LEU 43.A O no hydrogen 3.427 N/A LEU 47.A N LEU 43.A O no hydrogen 2.890 N/A GLY 48.A N SER 44.A O no hydrogen 2.909 N/A LEU 49.A N LEU 43.A O no hydrogen 3.512 N/A GLN 50.A N ILE 91.A O no hydrogen 2.941 N/A LEU 51.A N SER 40.A O no hydrogen 3.062 N/A VAL 52.A N ILE 89.A O no hydrogen 2.889 N/A GLY 53.A N ASP 56.A OD2 no hydrogen 3.142 N/A TYR 55.A N VAL 52.A O no hydrogen 3.177 N/A TYR 55.A OH PHE 24.A O no hydrogen 2.940 N/A ASP 56.A N GLY 53.A O no hydrogen 2.968 N/A ILE 57.A N PRO 54.A O no hydrogen 3.068 N/A LEU 58.A N PRO 54.A O no hydrogen 3.307 N/A ALA 59.A N TYR 55.A O no hydrogen 2.931 N/A GLY 60.A N ILE 57.A O no hydrogen 3.076 N/A LYS 61.A N ASP 56.A O no hydrogen 3.020 N/A HIS 62.A NE2 GLU 11.A OE2 no hydrogen 2.587 N/A LYS 63.A N GLY 60.A O no hydrogen 3.258 N/A THR 64.A OG1 LYS 63.A O no hydrogen 2.711 N/A LYS 65.A N HIS 62.A O no hydrogen 3.101 N/A LYS 65.A NZ LYS 61.A O no hydrogen 3.547 N/A LYS 66.A N THR 69.A OG1 no hydrogen 3.065 N/A THR 69.A OG1 LYS 66.A O no hydrogen 3.052 N/A GLY 70.A N LYS 67.A O no hydrogen 3.130 N/A LEU 71.A N LYS 66.A O no hydrogen 3.132 N/A ASN 72.A N GLN 314.A OE1 no hydrogen 2.936 N/A ASN 72.A ND2 GLU 302.A OE1 no hydrogen 2.972 N/A ASN 74.A N ASN 72.A OD1 no hydrogen 3.017 N/A ASN 74.A ND2 GLU 298.A OE1 no hydrogen 2.876 N/A ASN 74.A ND2 GLU 302.A OE1 no hydrogen 2.913 N/A LEU 75.A N ASN 72.A O no hydrogen 3.275 N/A HIS 76.A N PHE 73.A O no hydrogen 3.329 N/A HIS 76.A NE2 ASP 56.A OD2 no hydrogen 2.747 N/A TRP 77.A N ILE 312.A O no hydrogen 2.777 N/A ARG 78.A N LEU 75.A O no hydrogen 3.190 N/A ARG 78.A NE ASN 74.A O no hydrogen 2.800 N/A ARG 78.A NH1 ASP 82.A O no hydrogen 2.995 N/A ARG 78.A NH1 PRO 83.A O no hydrogen 2.840 N/A ARG 78.A NH1 PHE 86.A O no hydrogen 3.095 N/A ARG 78.A NH2 PHE 86.A O no hydrogen 3.062 N/A PHE 79.A N ASP 82.A OD2 no hydrogen 3.046 N/A TYR 80.A OH GLY 272.A O no hydrogen 2.573 N/A ASP 82.A N PHE 79.A O no hydrogen 3.036 N/A GLU 85.A N GLU 85.A OE1 no hydrogen 2.708 N/A PHE 86.A N PRO 83.A O no hydrogen 2.843 N/A GLN 87.A N TYR 102.A O no hydrogen 2.863 N/A THR 88.A OG1 TRP 77.A O no hydrogen 2.760 N/A ILE 89.A N MET 100.A O no hydrogen 2.848 N/A ILE 90.A N MET 100.A O no hydrogen 3.178 N/A ILE 91.A N GLN 50.A O no hydrogen 2.955 N/A GLY 92.A N TYR 98.A O no hydrogen 2.891 N/A ASN 94.A ND2 ASN 94.A O no hydrogen 2.598 N/A LYS 95.A N ASP 93.A OD1 no hydrogen 2.849 N/A THR 96.A OG1 ASP 93.A O no hydrogen 3.554 N/A GLN 97.A NE2 GLN 309.A O no hydrogen 3.089 N/A TYR 98.A N ASP 93.A O no hydrogen 3.123 N/A HIS 99.A N ASN 117.A O no hydrogen 2.967 N/A HIS 99.A ND1 GLN 97.A O no hydrogen 2.931 N/A HIS 99.A NE2 ASP 82.A OD1 no hydrogen 2.689 N/A MET 100.A N ILE 90.A O no hydrogen 2.789 N/A GLY 101.A N GLY 115.A O no hydrogen 2.918 N/A TYR 102.A N GLN 87.A O no hydrogen 2.947 N/A TYR 102.A OH ASP 23.A OD2 no hydrogen 2.785 N/A PHE 103.A N TYR 113.A O no hydrogen 2.859 N/A ARG 104.A N GLU 85.A O no hydrogen 2.899 N/A ARG 104.A NH1 GLN 87.A OE1 no hydrogen 2.929 N/A ARG 104.A NH2 SER 19.A O no hydrogen 2.921 N/A ARG 104.A NH2 GLN 87.A OE1 no hydrogen 3.041 N/A ASP 108.A N SER 106.A OG no hydrogen 3.136 N/A GLU 109.A N SER 106.A O no hydrogen 3.106 N/A VAL 112.A N PHE 103.A O no hydrogen 2.723 N/A TYR 113.A OH ALA 196.A O no hydrogen 3.090 N/A VAL 114.A N GLY 129.A O no hydrogen 2.989 N/A GLY 115.A N GLY 101.A O no hydrogen 2.774 N/A ILE 116.A N VAL 126.A O no hydrogen 2.824 N/A ASN 117.A N HIS 99.A O no hydrogen 3.078 N/A ASN 117.A ND2 ASN 122.A O no hydrogen 2.840 N/A ASN 117.A ND2 ILE 124.A O no hydrogen 3.023 N/A ALA 119.A N GLN 97.A O no hydrogen 3.235 N/A LYS 120.A N THR 96.A O no hydrogen 3.100 N/A LYS 120.A NZ GLU 310.A OE2 no hydrogen 2.448 N/A LYS 121.A N GLU 118.A O no hydrogen 2.767 N/A LYS 121.A NZ GLU 118.A OE1 no hydrogen 3.284 N/A LYS 121.A NZ GLU 118.A OE2 no hydrogen 3.282 N/A ASN 122.A N GLU 118.A O no hydrogen 3.148 N/A CYS 123.A SG PHE 193.A O no hydrogen 3.721 N/A ILE 124.A N ASN 122.A OD1 no hydrogen 3.044 N/A ILE 125.A N HIS 194.A O no hydrogen 2.914 N/A VAL 126.A N ILE 116.A O no hydrogen 2.911 N/A ASN 128.A N VAL 114.A O no hydrogen 2.827 N/A ASN 128.A ND2 ALA 135.A O no hydrogen 3.033 N/A GLY 129.A N GLN 176.A O no hydrogen 3.110 N/A ASN 131.A ND2 ASP 130.A OD1 no hydrogen 2.711 N/A ASN 131.A ND2 SER 173.A O no hydrogen 3.012 N/A VAL 132.A N ASP 23.A OD2 no hydrogen 2.907 N/A ALA 134.A N ASN 131.A OD1 no hydrogen 3.040 N/A ALA 135.A N ASN 131.A O no hydrogen 3.055 N/A VAL 136.A N VAL 132.A O no hydrogen 2.996 N/A LYS 137.A N PHE 133.A O no hydrogen 2.942 N/A LYS 137.A NZ ASP 160.A OD1 no hydrogen 2.529 N/A LYS 137.A NZ ASP 160.A OD2 no hydrogen 3.382 N/A LYS 137.A NZ THR 164.A OG1 no hydrogen 2.773 N/A LEU 138.A N ALA 134.A O no hydrogen 2.769 N/A PHE 139.A N ALA 135.A O no hydrogen 3.247 N/A LEU 140.A N VAL 136.A O no hydrogen 2.824 N/A THR 141.A N LYS 137.A O no hydrogen 2.907 N/A THR 141.A OG1 LYS 137.A O no hydrogen 2.767 N/A LYS 142.A N LEU 138.A O no hydrogen 2.981 N/A LYS 143.A N PHE 139.A O no hydrogen 2.974 N/A LEU 144.A N LEU 140.A O no hydrogen 2.991 N/A ARG 145.A N THR 141.A O no hydrogen 3.210 N/A ARG 145.A N LYS 142.A O no hydrogen 2.982 N/A GLU 146.A N LYS 143.A O no hydrogen 3.018 N/A LYS 152.A N ASP 149.A OD1 no hydrogen 2.556 N/A ILE 153.A N ASP 149.A O no hydrogen 2.926 N/A ASN 154.A N LYS 150.A O no hydrogen 3.014 N/A LEU 155.A N LYS 151.A O no hydrogen 3.102 N/A LEU 156.A N LYS 152.A O no hydrogen 2.956 N/A LYS 157.A N ILE 153.A O no hydrogen 2.996 N/A ASN 158.A N ASN 154.A O no hydrogen 3.189 N/A ASN 158.A ND2 ASN 154.A OD1 no hydrogen 3.554 N/A ILE 159.A N LEU 155.A O no hydrogen 3.191 N/A ASP 160.A N LEU 156.A O no hydrogen 2.739 N/A GLU 161.A N LYS 157.A O no hydrogen 3.001 N/A LYS 162.A N ASN 158.A O no hydrogen 3.031 N/A LEU 163.A N ILE 159.A O no hydrogen 2.809 N/A THR 164.A N ASP 160.A O no hydrogen 2.909 N/A THR 164.A OG1 ASP 160.A O no hydrogen 2.820 N/A THR 164.A OG1 ASP 160.A OD1 no hydrogen 3.311 N/A GLU 165.A N GLU 161.A O no hydrogen 3.124 N/A ALA 166.A N LYS 162.A O no hydrogen 2.994 N/A ALA 167.A N LEU 163.A O no hydrogen 3.016 N/A ARG 168.A N THR 164.A O no hydrogen 2.969 N/A GLU 169.A N GLU 165.A O no hydrogen 2.950 N/A LEU 170.A N ALA 166.A O no hydrogen 3.015 N/A GLY 171.A N ARG 168.A O no hydrogen 3.332 N/A TYR 172.A N ALA 167.A O no hydrogen 2.978 N/A GLU 175.A N SER 173.A OG no hydrogen 3.023 N/A GLN 176.A NE2 PRO 127.A O no hydrogen 3.300 N/A ARG 177.A NH1 ASP 185.A OD2 no hydrogen 2.826 N/A THR 178.A OG1 ASP 130.A OD2 no hydrogen 2.934 N/A LYS 180.A NZ PRO 111.A O no hydrogen 3.236 N/A LYS 180.A NZ ASP 130.A O no hydrogen 3.488 N/A MET 181.A N THR 178.A OG1 no hydrogen 3.361 N/A LYS 182.A N THR 178.A O no hydrogen 2.865 N/A GLN 183.A N VAL 179.A O no hydrogen 2.879 N/A ARG 184.A N LYS 180.A O no hydrogen 3.066 N/A ARG 184.A NE ASP 105.A OD2 no hydrogen 2.878 N/A ARG 184.A NH1 ASP 185.A OD1 no hydrogen 3.170 N/A ARG 184.A NH1 ALA 196.A O no hydrogen 2.846 N/A ARG 184.A NH2 ASP 105.A OD1 no hydrogen 2.798 N/A ARG 184.A NH2 ALA 196.A O no hydrogen 3.202 N/A ARG 184.A NH2 GLY 197.A O no hydrogen 3.144 N/A ASP 185.A N MET 181.A O no hydrogen 2.856 N/A LYS 186.A N LYS 182.A O no hydrogen 3.238 N/A LYS 186.A N GLN 183.A O no hydrogen 3.258 N/A LYS 186.A NZ GLN 183.A OE1 no hydrogen 2.881 N/A LYS 187.A N ARG 184.A O no hydrogen 2.977 N/A VAL 188.A N ASP 185.A O no hydrogen 3.262 N/A VAL 189.A N LEU 198.A O no hydrogen 3.022 N/A THR 190.A OG1 GLU 263.A OE2 no hydrogen 2.760 N/A THR 192.A OG1 LYS 191.A O no hydrogen 2.741 N/A PHE 193.A N ASP 267.A OD1 no hydrogen 2.873 N/A HIS 194.A N THR 192.A OG1 no hydrogen 3.106 N/A GLY 195.A N THR 192.A O no hydrogen 3.057 N/A ALA 196.A N HIS 194.A ND1 no hydrogen 2.918 N/A GLY 197.A N LYS 191.A O no hydrogen 3.084 N/A LEU 198.A N THR 190.A O no hydrogen 2.926 N/A ASP 203.A N VAL 207.A O no hydrogen 2.996 N/A LYS 204.A NZ ASN 205.A OD1 no hydrogen 3.092 N/A ASN 205.A N ASP 203.A OD1 no hydrogen 2.767 N/A ASP 206.A N ASP 203.A O no hydrogen 2.875 N/A VAL 207.A N ASP 203.A OD1 no hydrogen 2.767 N/A GLY 208.A N ASP 257.A OD1 no hydrogen 2.705 N/A TYR 209.A OH GLU 263.A OE1 no hydrogen 2.402 N/A TYR 209.A OH GLU 263.A OE2 no hydrogen 3.406 N/A ARG 210.A NE ASP 257.A OD2 no hydrogen 2.923 N/A ARG 210.A NH2 GLU 255.A OE1 no hydrogen 2.702 N/A ARG 210.A NH2 ASP 257.A OD2 no hydrogen 3.112 N/A ASP 218.A N THR 215.A OG1 no hydrogen 3.165 N/A LEU 219.A N THR 215.A O no hydrogen 2.908 N/A LYS 220.A N ASP 216.A O no hydrogen 2.936 N/A ARG 221.A N ALA 217.A O no hydrogen 3.165 N/A ARG 221.A NE ASP 218.A OD1 no hydrogen 3.264 N/A ARG 221.A NH2 ASP 218.A OD1 no hydrogen 3.304 N/A ILE 222.A N ASP 218.A O no hydrogen 3.015 N/A CYS 223.A N LEU 219.A O no hydrogen 2.914 N/A CYS 223.A SG LEU 219.A O no hydrogen 3.297 N/A LYS 224.A N LYS 220.A O no hydrogen 2.934 N/A LYS 224.A NZ GLU 228.A OE2 no hydrogen 2.596 N/A THR 225.A N ARG 221.A O no hydrogen 3.123 N/A THR 225.A OG1 ILE 222.A O no hydrogen 2.778 N/A ILE 226.A N ILE 222.A O no hydrogen 3.139 N/A VAL 227.A N CYS 223.A O no hydrogen 2.995 N/A GLU 228.A N LYS 224.A O no hydrogen 2.891 N/A ALA 229.A N ILE 226.A O no hydrogen 3.439 N/A ALA 230.A N GLU 234.A OE2 no hydrogen 2.782 N/A GLU 234.A N SER 231.A OG no hydrogen 3.089 N/A ARG 235.A N SER 231.A O no hydrogen 2.940 N/A ARG 235.A NE ILE 226.A O no hydrogen 3.038 N/A ARG 235.A NH2 ILE 226.A O no hydrogen 3.153 N/A ARG 235.A NH2 VAL 227.A O no hydrogen 3.163 N/A LEU 236.A N ASP 232.A O no hydrogen 2.945 N/A LYS 237.A N GLU 233.A O no hydrogen 3.231 N/A ALA 238.A N GLU 234.A O no hydrogen 2.901 N/A PHE 239.A N ARG 235.A O no hydrogen 2.912 N/A PHE 239.A N LEU 236.A O no hydrogen 3.260 N/A ALA 240.A N LYS 237.A O no hydrogen 3.068 N/A GLN 243.A N PHE 239.A O no hydrogen 3.039 N/A GLU 244.A N ALA 240.A O no hydrogen 3.053 N/A MET 245.A N PRO 241.A O no hydrogen 3.075 N/A MET 246.A N ILE 242.A O no hydrogen 2.836 N/A THR 247.A N GLN 243.A O no hydrogen 3.023 N/A THR 247.A OG1 GLN 243.A O no hydrogen 3.251 N/A PHE 248.A N GLU 244.A O no hydrogen 3.104 N/A VAL 249.A N MET 245.A O no hydrogen 2.909 N/A GLN 250.A N MET 246.A O no hydrogen 3.229 N/A PHE 251.A N THR 247.A O no hydrogen 3.354 N/A ALA 252.A N PHE 248.A O no hydrogen 3.016 N/A ASN 253.A N VAL 249.A O no hydrogen 2.814 N/A ASP 254.A N GLN 250.A O no hydrogen 2.966 N/A GLU 255.A N PHE 251.A O no hydrogen 3.187 N/A GLU 255.A N ALA 252.A O no hydrogen 3.126 N/A CYS 256.A N ASN 253.A O no hydrogen 2.947 N/A CYS 256.A SG TYR 258.A OH no hydrogen 3.520 N/A ASP 257.A N ALA 252.A O no hydrogen 2.844 N/A GLY 259.A N GLY 208.A O no hydrogen 2.977 N/A MET 260.A N ASP 257.A O no hydrogen 3.311 N/A LEU 262.A N TYR 258.A O no hydrogen 3.429 N/A GLU 263.A N GLY 259.A O no hydrogen 2.937 N/A LEU 264.A N MET 260.A O no hydrogen 2.957 N/A GLY 265.A N GLY 261.A O no hydrogen 2.956 N/A MET 266.A N LEU 262.A O no hydrogen 2.901 N/A ASP 267.A N GLU 263.A O no hydrogen 3.044 N/A LEU 268.A N LEU 264.A O no hydrogen 3.134 N/A PHE 269.A N GLY 265.A O no hydrogen 2.951 N/A CYS 270.A N MET 266.A O no hydrogen 2.744 N/A CYS 270.A SG MET 266.A O no hydrogen 3.123 N/A TYR 271.A N ASP 267.A O no hydrogen 2.835 N/A TYR 275.A N SER 273.A OG no hydrogen 2.955 N/A PHE 276.A N SER 273.A O no hydrogen 3.067 N/A HIS 277.A N HIS 274.A O no hydrogen 3.133 N/A ALA 280.A N PHE 276.A O no hydrogen 2.914 N/A GLY 281.A N HIS 277.A O no hydrogen 2.880 N/A GLN 282.A N VAL 279.A O no hydrogen 3.095 N/A LEU 283.A N VAL 279.A O no hydrogen 2.919 N/A LEU 284.A N ALA 280.A O no hydrogen 2.952 N/A ALA 287.A N LEU 283.A O no hydrogen 3.067 N/A TYR 288.A N LEU 284.A O no hydrogen 2.920 N/A TYR 288.A OH GLU 85.A OE1 no hydrogen 3.178 N/A TYR 288.A OH GLU 85.A OE2 no hydrogen 2.601 N/A ASN 289.A N PRO 285.A O no hydrogen 2.952 N/A LEU 290.A N LEU 286.A O no hydrogen 2.826 N/A LEU 291.A N ALA 287.A O no hydrogen 2.906 N/A LYS 292.A N ASN 289.A O no hydrogen 3.047 N/A ARG 293.A N TYR 288.A O no hydrogen 2.700 N/A ARG 293.A NH1 VAL 199.A O no hydrogen 2.979 N/A ARG 293.A NH2 VAL 199.A O no hydrogen 2.879 N/A PHE 296.A N ARG 293.A O no hydrogen 2.931 N/A GLU 298.A N ASN 294.A O no hydrogen 3.075 N/A ILE 299.A N LEU 295.A O no hydrogen 2.890 N/A ILE 300.A N PHE 296.A O no hydrogen 3.012 N/A GLU 301.A N ALA 297.A O no hydrogen 3.194 N/A GLU 302.A N GLU 298.A O no hydrogen 3.162 N/A HIS 303.A N ILE 299.A O no hydrogen 2.765 N/A LEU 304.A N ILE 300.A O no hydrogen 2.913 N/A ALA 305.A N GLU 301.A O no hydrogen 3.247 N/A ASN 306.A N HIS 303.A O no hydrogen 3.100 N/A ARG 307.A NE TYR 80.A O no hydrogen 2.853 N/A ARG 307.A NH1 PHE 269.A O no hydrogen 3.492 N/A ARG 307.A NH1 HIS 277.A NE2 no hydrogen 3.089 N/A ARG 307.A NH2 TYR 80.A O no hydrogen 2.943 N/A ARG 307.A NH2 PHE 269.A O no hydrogen 2.837 N/A GLU 310.A N SER 308.A OG no hydrogen 3.333 N/A ASN 311.A N SER 308.A OG no hydrogen 3.027 N/A GLN 314.A N HIS 76.A ND1 no hydrogen 2.919 N/A LEU 315.A N ASP 313.A OD1 no hydrogen 2.725 N/A ALA 316.A N ASP 313.A O no hydrogen 3.256 N/A