Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3dpi_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLN 7.A NE2 ASP 249.A OD1 no hydrogen 2.903 N/A ALA 8.A N ASP 6.A OD2 no hydrogen 3.259 N/A ARG 10.A N ASP 6.A O no hydrogen 2.719 N/A ARG 10.A NH1 ASP 260.A OD2 no hydrogen 3.103 N/A ARG 10.A NH2 ASP 260.A OD1 no hydrogen 2.665 N/A ARG 10.A NH2 ASP 260.A OD2 no hydrogen 3.489 N/A ARG 11.A N GLN 7.A O no hydrogen 2.778 N/A ARG 11.A NE PHE 241.A O no hydrogen 2.927 N/A ARG 11.A NH2 ASP 240.A O no hydrogen 2.977 N/A ARG 11.A NH2 LYS 245.A O no hydrogen 2.791 N/A ARG 12.A N ALA 8.A O no hydrogen 3.107 N/A ARG 12.A N ALA 9.A O no hydrogen 2.978 N/A ILE 14.A N ARG 10.A O no hydrogen 3.123 N/A ALA 15.A N ARG 11.A O no hydrogen 3.108 N/A GLU 17.A N ALA 13.A O no hydrogen 2.881 N/A LEU 18.A N ILE 14.A O no hydrogen 2.962 N/A HIS 19.A N ALA 16.A O no hydrogen 3.049 N/A VAL 20.A N ALA 15.A O no hydrogen 2.852 N/A SER 21.A OG THR 23.A O no hydrogen 2.833 N/A ASP 28.A N ASP 25.A OD2 no hydrogen 3.240 N/A GLU 29.A N ASP 25.A O no hydrogen 3.289 N/A ALA 30.A N ALA 26.A O no hydrogen 3.132 N/A ARG 32.A N ASP 28.A O no hydrogen 3.201 N/A ARG 33.A N ALA 30.A O no hydrogen 3.133 N/A ARG 33.A NE GLU 29.A OE1 no hydrogen 2.986 N/A ARG 33.A NH1 PRO 189.A O no hydrogen 2.750 N/A ARG 33.A NH1 ALA 191.A O no hydrogen 2.679 N/A ARG 33.A NH2 GLU 29.A OE1 no hydrogen 3.213 N/A ARG 33.A NH2 ALA 191.A O no hydrogen 2.927 N/A ILE 34.A N ALA 30.A O no hydrogen 3.121 N/A GLY 35.A N GLU 31.A O no hydrogen 3.363 N/A PHE 36.A N ARG 32.A O no hydrogen 3.392 N/A VAL 37.A N ARG 33.A O no hydrogen 3.217 N/A VAL 37.A N ILE 34.A O no hydrogen 2.701 N/A ALA 38.A N ILE 34.A O no hydrogen 3.161 N/A ASP 39.A N GLY 35.A O no hydrogen 2.837 N/A TYR 40.A N PHE 36.A O no hydrogen 3.085 N/A TYR 40.A N VAL 37.A O no hydrogen 3.124 N/A LEU 41.A N VAL 37.A O no hydrogen 3.176 N/A ARG 42.A N ALA 38.A O no hydrogen 3.302 N/A ARG 42.A NH1 SER 76.A OG no hydrogen 1.523 N/A THR 43.A N ASP 39.A O no hydrogen 3.103 N/A THR 43.A OG1 ASP 39.A O no hydrogen 3.156 N/A ALA 44.A N TYR 40.A O no hydrogen 3.167 N/A ALA 44.A N LEU 41.A O no hydrogen 2.907 N/A GLY 45.A N LEU 41.A O no hydrogen 2.985 N/A GLY 45.A N ARG 42.A O no hydrogen 2.705 N/A ARG 47.A N ASN 160.A O no hydrogen 3.286 N/A ARG 47.A NH1 ASP 79.A O no hydrogen 3.161 N/A CYS 49.A N ARG 81.A O no hydrogen 3.003 N/A VAL 50.A N VAL 162.A O no hydrogen 2.885 N/A LEU 51.A N VAL 83.A O no hydrogen 3.121 N/A GLY 52.A N GLN 152.A OE1 no hydrogen 2.966 N/A ILE 53.A N MET 85.A O no hydrogen 2.735 N/A SER 54.A N SER 59.A OG no hydrogen 3.056 N/A SER 54.A OG SER 59.A OG no hydrogen 3.116 N/A SER 54.A OG ASP 219.A OD1 no hydrogen 2.664 N/A SER 54.A OG ASP 219.A OD2 no hydrogen 3.331 N/A GLY 56.A N SER 54.A OG no hydrogen 3.059 N/A SER 59.A OG SER 54.A OG no hydrogen 3.116 N/A SER 59.A OG GLY 56.A O no hydrogen 3.112 N/A SER 60.A N GLY 56.A O no hydrogen 3.056 N/A SER 60.A OG GLY 56.A O no hydrogen 3.067 N/A THR 61.A N ILE 57.A O no hydrogen 2.912 N/A THR 61.A OG1 ILE 57.A O no hydrogen 2.757 N/A ALA 62.A N ASP 58.A O no hydrogen 2.880 N/A GLY 63.A N SER 59.A O no hydrogen 2.888 N/A ARG 64.A N SER 60.A O no hydrogen 3.057 N/A ARG 64.A NH1 VAL 102.A O no hydrogen 2.970 N/A LEU 65.A N THR 61.A O no hydrogen 3.091 N/A ALA 66.A N ALA 62.A O no hydrogen 3.047 N/A ALA 66.A N GLY 63.A O no hydrogen 2.987 N/A GLN 67.A N GLY 63.A O no hydrogen 3.020 N/A GLN 67.A NE2 GLU 71.A OE2 no hydrogen 3.276 N/A GLN 67.A NE2 ASP 105.A OD1 no hydrogen 3.098 N/A LEU 68.A N ARG 64.A O no hydrogen 3.015 N/A ALA 69.A N LEU 65.A O no hydrogen 3.053 N/A VAL 70.A N ALA 66.A O no hydrogen 3.197 N/A GLU 71.A N GLN 67.A O no hydrogen 3.211 N/A ARG 72.A N LEU 68.A O no hydrogen 3.010 N/A ARG 72.A N ALA 69.A O no hydrogen 3.194 N/A ARG 72.A NH1 GLU 31.A OE2 no hydrogen 2.167 N/A LEU 73.A N ALA 69.A O no hydrogen 2.909 N/A ARG 74.A N VAL 70.A O no hydrogen 3.003 N/A ARG 74.A NH1 ALA 80.A O no hydrogen 2.973 N/A ARG 74.A NH1 ASP 105.A OD1 no hydrogen 3.528 N/A ARG 74.A NH1 ASP 105.A OD2 no hydrogen 2.950 N/A ARG 74.A NH2 ASP 105.A OD1 no hydrogen 3.140 N/A ALA 75.A N GLU 71.A O no hydrogen 3.535 N/A SER 76.A N ARG 72.A O no hydrogen 2.969 N/A GLY 77.A N ARG 74.A O no hydrogen 2.192 N/A TYR 78.A OH LEU 46.A O no hydrogen 2.916 N/A ARG 81.A N ARG 47.A O no hydrogen 3.018 N/A PHE 82.A N ASP 105.A OD2 no hydrogen 2.992 N/A VAL 83.A N CYS 49.A O no hydrogen 2.792 N/A ALA 84.A N GLU 106.A O no hydrogen 2.743 N/A MET 85.A N LEU 51.A O no hydrogen 2.722 N/A ARG 86.A N LEU 108.A O no hydrogen 2.813 N/A TYR 89.A OH ASP 117.A OD1 no hydrogen 2.788 N/A GLY 90.A N ASP 111.A OD1 no hydrogen 2.935 N/A ARG 97.A N ALA 93.A O no hydrogen 3.394 N/A ARG 97.A NH1 ASP 208.A OD2 no hydrogen 2.851 N/A ALA 98.A N ASP 94.A O no hydrogen 3.130 N/A LEU 99.A N ALA 95.A O no hydrogen 2.992 N/A ALA 100.A N ARG 96.A O no hydrogen 3.288 N/A PHE 101.A N ALA 98.A O no hydrogen 3.081 N/A VAL 102.A N ALA 98.A O no hydrogen 3.018 N/A ARG 103.A N LEU 99.A O no hydrogen 2.936 N/A ARG 103.A NE PHE 101.A O no hydrogen 2.938 N/A ARG 103.A NH2 PHE 101.A O no hydrogen 2.937 N/A ASP 105.A N GLN 67.A OE1 no hydrogen 2.880 N/A LEU 108.A N ALA 84.A O no hydrogen 2.997 N/A VAL 110.A N ARG 86.A O no hydrogen 2.923 N/A VAL 112.A N PRO 88.A O no hydrogen 3.085 N/A LYS 113.A N ASP 111.A OD1 no hydrogen 2.960 N/A LYS 113.A NZ ASP 117.A OD2 no hydrogen 2.687 N/A ALA 116.A N VAL 112.A O no hydrogen 2.884 N/A ASP 117.A N LYS 113.A O no hydrogen 2.828 N/A ALA 118.A N PRO 114.A O no hydrogen 3.116 N/A MET 119.A N ALA 115.A O no hydrogen 2.971 N/A LEU 120.A N ALA 116.A O no hydrogen 3.024 N/A ALA 121.A N ASP 117.A O no hydrogen 2.999 N/A ALA 122.A N ALA 118.A O no hydrogen 3.072 N/A LEU 123.A N MET 119.A O no hydrogen 2.871 N/A ALA 124.A N LEU 120.A O no hydrogen 2.964 N/A ALA 125.A N ALA 121.A O no hydrogen 2.737 N/A GLY 126.A N LEU 123.A O no hydrogen 3.129 N/A GLY 127.A N ALA 124.A O no hydrogen 3.079 N/A LEU 128.A N LEU 123.A O no hydrogen 2.858 N/A ASP 132.A N GLN 135.A OE1 no hydrogen 2.917 N/A ALA 134.A N ASP 132.A OD1 no hydrogen 3.120 N/A GLN 135.A N ASP 132.A OD1 no hydrogen 2.908 N/A GLN 136.A N ASP 132.A O no hydrogen 2.979 N/A ASP 137.A N HIS 133.A O no hydrogen 3.203 N/A PHE 138.A N ALA 134.A O no hydrogen 2.930 N/A VAL 139.A N GLN 135.A O no hydrogen 3.005 N/A LEU 140.A N GLN 136.A O no hydrogen 2.681 N/A GLY 141.A N ASP 137.A O no hydrogen 2.910 N/A ASN 142.A ND2 GLY 181.A O no hydrogen 3.026 N/A ILE 143.A N VAL 139.A O no hydrogen 3.354 N/A LYS 144.A N LEU 140.A O no hydrogen 3.107 N/A LYS 144.A NZ GLU 221.A OE1 no hydrogen 3.457 N/A LYS 144.A NZ GLU 221.A OE2 no hydrogen 2.825 N/A ALA 145.A N GLY 141.A O no hydrogen 3.332 N/A ARG 146.A N ASN 142.A O no hydrogen 3.057 N/A ARG 146.A NE ASN 142.A OD1 no hydrogen 2.814 N/A GLU 147.A N ILE 143.A O no hydrogen 2.750 N/A ARG 148.A N LYS 144.A O no hydrogen 2.939 N/A ARG 148.A NE LEU 87.A O no hydrogen 2.895 N/A ARG 148.A NH1 LEU 87.A O no hydrogen 3.009 N/A MET 149.A N ALA 145.A O no hydrogen 3.256 N/A ILE 150.A N ARG 146.A O no hydrogen 3.013 N/A ALA 151.A N GLU 147.A O no hydrogen 3.086 N/A GLN 152.A N ARG 148.A O no hydrogen 3.281 N/A GLN 152.A NE2 ARG 148.A O no hydrogen 3.028 N/A TYR 153.A N MET 149.A O no hydrogen 3.037 N/A TYR 153.A OH GLY 184.A O no hydrogen 3.187 N/A TYR 153.A OH ASP 186.A OD1 no hydrogen 2.918 N/A ALA 154.A N ILE 150.A O no hydrogen 2.918 N/A VAL 155.A N ALA 151.A O no hydrogen 3.237 N/A ALA 156.A N GLN 152.A O no hydrogen 2.924 N/A GLY 157.A N TYR 153.A O no hydrogen 2.663 N/A ALA 158.A N ALA 154.A O no hydrogen 2.859 N/A ARG 159.A N VAL 155.A O no hydrogen 3.087 N/A ARG 159.A N ALA 156.A O no hydrogen 3.241 N/A ARG 159.A NH1 GLU 106.A OE1 no hydrogen 2.892 N/A ARG 159.A NH1 GLU 106.A OE2 no hydrogen 3.564 N/A ARG 159.A NH2 GLU 106.A OE2 no hydrogen 3.300 N/A ASN 160.A N GLY 157.A O no hydrogen 3.346 N/A GLY 161.A N ALA 156.A O no hydrogen 2.991 N/A VAL 162.A N ALA 48.A O no hydrogen 3.018 N/A VAL 163.A N ASP 186.A OD2 no hydrogen 2.888 N/A ILE 164.A N VAL 50.A O no hydrogen 2.702 N/A GLY 165.A N VAL 187.A O no hydrogen 2.832 N/A ASP 167.A N ASP 167.A OD2 no hydrogen 2.470 N/A HIS 168.A NE2 ASP 58.A OD2 no hydrogen 3.028 N/A ALA 170.A N LEU 193.A O no hydrogen 3.383 N/A GLU 171.A N HIS 168.A ND1 no hydrogen 2.969 N/A SER 172.A N HIS 168.A O no hydrogen 2.948 N/A SER 172.A OG HIS 168.A O no hydrogen 3.117 N/A VAL 173.A N ALA 169.A O no hydrogen 3.163 N/A MET 174.A N ALA 170.A O no hydrogen 3.014 N/A GLY 175.A N GLU 171.A O no hydrogen 2.952 N/A PHE 176.A N VAL 173.A O no hydrogen 2.993 N/A PHE 177.A N MET 174.A O no hydrogen 2.808 N/A THR 178.A N MET 174.A O no hydrogen 2.923 N/A THR 178.A OG1 MET 174.A O no hydrogen 3.444 N/A LYS 179.A N GLY 175.A O no hydrogen 2.888 N/A LYS 179.A NZ PHE 176.A O no hydrogen 3.326 N/A PHE 180.A N THR 178.A OG1 no hydrogen 3.124 N/A GLY 184.A N ASP 182.A OD1 no hydrogen 3.321 N/A ASP 186.A N VAL 163.A O no hydrogen 2.967 N/A VAL 187.A N VAL 163.A O no hydrogen 3.324 N/A ALA 191.A N LEU 188.A O no hydrogen 3.215 N/A LEU 193.A N LEU 190.A O no hydrogen 3.069 N/A THR 194.A OG1 GLU 243.A OE2 no hydrogen 2.758 N/A LYS 195.A N ASP 239.A OD1 no hydrogen 2.890 N/A ARG 196.A N ASP 239.A OD2 no hydrogen 2.680 N/A ARG 196.A NH1 ASP 240.A OD1 no hydrogen 3.206 N/A ARG 196.A NH1 GLU 243.A OE1 no hydrogen 2.539 N/A ARG 196.A NH2 GLU 236.A OE2 no hydrogen 3.339 N/A ARG 196.A NH2 ASP 240.A OD1 no hydrogen 2.946 N/A ARG 197.A N THR 194.A OG1 no hydrogen 3.369 N/A ARG 197.A NH1 SER 21.A O no hydrogen 2.884 N/A ARG 197.A NH2 SER 21.A O no hydrogen 3.376 N/A VAL 198.A N THR 194.A O no hydrogen 3.019 N/A ARG 199.A N LYS 195.A O no hydrogen 3.155 N/A ALA 200.A N ARG 196.A O no hydrogen 2.929 N/A LEU 201.A N ARG 197.A O no hydrogen 2.814 N/A ALA 202.A N VAL 198.A O no hydrogen 2.864 N/A ARG 203.A N ARG 199.A O no hydrogen 2.991 N/A ARG 203.A NE GLU 209.A OE1 no hydrogen 2.807 N/A ARG 203.A NE GLU 209.A OE2 no hydrogen 3.284 N/A ARG 203.A NH1 GLU 209.A OE2 no hydrogen 2.712 N/A MET 204.A N ALA 200.A O no hydrogen 2.997 N/A LEU 205.A N LEU 201.A O no hydrogen 2.893 N/A GLY 206.A N ARG 203.A O no hydrogen 2.918 N/A ALA 207.A N ALA 202.A O no hydrogen 2.867 N/A VAL 212.A N ASP 208.A O no hydrogen 3.013 N/A LEU 213.A N GLU 209.A O no hydrogen 3.105 N/A LYS 214.A N LEU 211.A O no hydrogen 3.375 N/A THR 215.A OG1 THR 215.A O no hydrogen 2.485 N/A ASP 219.A N PRO 216.A O no hydrogen 2.875 N/A LEU 220.A N PRO 216.A O no hydrogen 3.027 N/A GLU 221.A N THR 217.A O no hydrogen 2.831 N/A THR 222.A N ASP 219.A O no hydrogen 3.157 N/A THR 222.A OG1 ASP 219.A O no hydrogen 2.692 N/A LEU 223.A N LEU 220.A O no hydrogen 3.057 N/A ARG 224.A N GLU 221.A O no hydrogen 3.363 N/A ARG 224.A NH1 ASP 137.A OD1 no hydrogen 3.507 N/A ARG 224.A NH1 ASP 137.A OD2 no hydrogen 2.984 N/A ARG 224.A NH2 ASP 137.A O no hydrogen 3.421 N/A ARG 224.A NH2 ASP 137.A OD1 no hydrogen 3.459 N/A THR 234.A N GLN 237.A OE1 no hydrogen 3.212 N/A GLN 237.A N THR 234.A OG1 no hydrogen 3.178 N/A ILE 238.A N THR 234.A O no hydrogen 3.135 N/A ASP 239.A N TYR 235.A O no hydrogen 2.868 N/A ASP 240.A N GLU 236.A O no hydrogen 3.154 N/A PHE 241.A N GLN 237.A O no hydrogen 3.083 N/A LEU 242.A N ILE 238.A O no hydrogen 3.019 N/A GLU 243.A N ASP 239.A O no hydrogen 2.892 N/A GLY 244.A N PHE 241.A O no hydrogen 3.309 N/A LYS 245.A N ASP 240.A O no hydrogen 2.957 N/A VAL 251.A N ASP 248.A OD2 no hydrogen 2.944 N/A ALA 252.A N ASP 248.A O no hydrogen 2.962 N/A GLU 253.A N ASP 249.A O no hydrogen 2.859 N/A THR 254.A N ALA 250.A O no hydrogen 2.930 N/A THR 254.A OG1 ALA 250.A O no hydrogen 3.151 N/A VAL 255.A N VAL 251.A O no hydrogen 3.164 N/A LEU 256.A N ALA 252.A O no hydrogen 3.219 N/A ARG 257.A N GLU 253.A O no hydrogen 3.062 N/A PHE 258.A N THR 254.A O no hydrogen 3.047 N/A TYR 259.A N VAL 255.A O no hydrogen 3.016 N/A TYR 259.A OH GLU 17.A OE1 no hydrogen 2.049 N/A ASP 260.A N LEU 256.A O no hydrogen 2.815 N/A ALA 261.A N ARG 257.A O no hydrogen 2.993 N/A THR 262.A N TYR 259.A O no hydrogen 3.259 N/A THR 262.A OG1 PHE 258.A O no hydrogen 3.109 N/A ARG 263.A N TYR 259.A O no hydrogen 2.919 N/A ARG 263.A N ASP 260.A O no hydrogen 2.811 N/A ARG 263.A NH2 HIS 264.A NE2 no hydrogen 2.839 N/A HIS 264.A N ASP 260.A O no hydrogen 3.224 N/A ARG 266.A N THR 262.A O no hydrogen 3.414 N/A ALA 267.A N HIS 264.A O no hydrogen 2.295 N/A