Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4phe_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 5.A N GLN 2.A O no hydrogen 3.192 N/A ASN 6.A ND2 HIS 45.A O no hydrogen 2.828 N/A THR 10.A N ASN 6.A O no hydrogen 2.939 N/A THR 10.A OG1 ASN 6.A O no hydrogen 3.223 N/A THR 10.A OG1 GLY 7.A O no hydrogen 3.115 N/A ASP 11.A N GLY 7.A O no hydrogen 2.876 N/A MET 12.A N GLY 8.A O no hydrogen 3.095 N/A LEU 13.A N ILE 9.A O no hydrogen 2.967 N/A THR 14.A N THR 10.A O no hydrogen 2.970 N/A THR 14.A OG1 THR 10.A O no hydrogen 2.859 N/A GLU 15.A N ASP 11.A O no hydrogen 2.918 N/A LEU 16.A N MET 12.A O no hydrogen 2.981 N/A ALA 17.A N LEU 13.A O no hydrogen 2.833 N/A ASN 18.A N THR 14.A O no hydrogen 3.060 N/A PHE 19.A N GLU 15.A O no hydrogen 3.281 N/A GLU 20.A N LEU 16.A O no hydrogen 3.185 N/A LYS 21.A N ALA 17.A O no hydrogen 3.093 N/A LYS 21.A NZ ASN 22.A OD1 no hydrogen 2.810 N/A ASN 22.A N ASN 18.A O no hydrogen 2.816 N/A ASN 22.A ND2 ASN 92.A OD1 no hydrogen 2.704 N/A VAL 23.A N PHE 19.A O no hydrogen 2.886 N/A SER 24.A N PHE 19.A O no hydrogen 3.051 N/A ALA 26.A N GLU 20.A O no hydrogen 2.785 N/A TYR 30.A N ALA 26.A O no hydrogen 3.018 N/A ASN 31.A N ILE 27.A O no hydrogen 3.056 N/A ALA 32.A N HIS 28.A O no hydrogen 2.956 N/A TYR 33.A N LYS 29.A O no hydrogen 3.016 N/A ARG 34.A N TYR 30.A O no hydrogen 3.179 N/A LYS 35.A N ASN 31.A O no hydrogen 2.909 N/A ALA 36.A N ALA 32.A O no hydrogen 3.028 N/A ALA 37.A N TYR 33.A O no hydrogen 2.767 N/A SER 38.A N ARG 34.A O no hydrogen 2.793 N/A SER 38.A OG ARG 34.A O no hydrogen 2.712 N/A VAL 39.A N LYS 35.A O no hydrogen 3.150 N/A ILE 40.A N ALA 36.A O no hydrogen 3.204 N/A ALA 41.A N ALA 37.A O no hydrogen 2.947 N/A LYS 42.A N SER 38.A O no hydrogen 3.182 N/A TYR 43.A N VAL 39.A O no hydrogen 3.216 N/A TYR 43.A N ILE 40.A O no hydrogen 3.115 N/A TYR 43.A OH GLU 52.A OE2 no hydrogen 2.768 N/A ILE 47.A N ASN 6.A OD1 no hydrogen 2.788 N/A LYS 48.A N GLU 52.A OE1 no hydrogen 2.720 N/A GLY 50.A N ASP 68.A OD1 no hydrogen 2.845 N/A GLU 52.A N SER 49.A OG no hydrogen 3.114 N/A ALA 53.A N SER 49.A O no hydrogen 3.241 N/A LYS 54.A N GLY 50.A O no hydrogen 2.934 N/A LYS 55.A N GLU 52.A O no hydrogen 3.412 N/A LEU 56.A N ALA 53.A O no hydrogen 3.018 N/A VAL 59.A N LEU 56.A O no hydrogen 3.293 N/A ALA 64.A N GLY 60.A O no hydrogen 3.074 N/A GLU 65.A N THR 61.A O no hydrogen 2.983 N/A LYS 66.A N LYS 62.A O no hydrogen 2.973 N/A ILE 67.A N ILE 63.A O no hydrogen 2.807 N/A ASP 68.A N ALA 64.A O no hydrogen 3.106 N/A GLU 69.A N GLU 65.A O no hydrogen 3.195 N/A PHE 70.A N LYS 66.A O no hydrogen 2.964 N/A LEU 71.A N ILE 67.A O no hydrogen 2.803 N/A ALA 72.A N ASP 68.A O no hydrogen 3.112 N/A THR 73.A N GLU 69.A O no hydrogen 2.932 N/A THR 73.A OG1 GLU 69.A O no hydrogen 2.672 N/A GLY 74.A N PHE 70.A O no hydrogen 2.571 N/A LYS 75.A N THR 73.A OG1 no hydrogen 3.188 N/A ARG 77.A N GLU 69.A OE2 no hydrogen 2.845 N/A GLU 80.A N LEU 76.A O no hydrogen 2.832 N/A LYS 81.A N ARG 77.A O no hydrogen 3.006 N/A LYS 81.A NZ GLN 84.A OE1 no hydrogen 3.140 N/A ILE 82.A N LYS 78.A O no hydrogen 3.052 N/A ARG 83.A N LEU 79.A O no hydrogen 2.929 N/A ARG 83.A NE GLU 15.A OE1 no hydrogen 3.480 N/A ARG 83.A NE GLU 15.A OE2 no hydrogen 2.801 N/A ARG 83.A NH2 GLU 15.A OE1 no hydrogen 3.284 N/A GLN 84.A N GLU 80.A O no hydrogen 3.314 N/A GLN 84.A N LYS 81.A O no hydrogen 3.165 N/A ASP 85.A N LYS 81.A O no hydrogen 3.168 N/A SER 88.A N ASP 85.A OD2 no hydrogen 2.973 N/A SER 88.A OG ASP 85.A OD2 no hydrogen 3.420 N/A SER 89.A N ASP 85.A O no hydrogen 2.931 N/A SER 89.A OG ASP 85.A O no hydrogen 2.865 N/A SER 89.A OG ASP 86.A O no hydrogen 3.477 N/A SER 90.A N ASP 86.A O no hydrogen 3.131 N/A SER 90.A OG ASP 86.A O no hydrogen 2.718 N/A ILE 91.A N THR 87.A O no hydrogen 3.042 N/A ASN 92.A N SER 88.A O no hydrogen 2.965 N/A PHE 93.A N SER 89.A O no hydrogen 3.052 N/A LEU 94.A N SER 90.A O no hydrogen 3.011 N/A THR 95.A OG1 ASN 92.A O no hydrogen 2.602 N/A ARG 96.A N PHE 93.A O no hydrogen 2.921 N/A ARG 96.A NE GLU 141.A OE2 no hydrogen 2.828 N/A ARG 96.A NH2 GLU 141.A OE1 no hydrogen 2.876 N/A ARG 96.A NH2 GLU 141.A OE2 no hydrogen 3.346 N/A VAL 97.A N LEU 94.A O no hydrogen 2.968 N/A SER 98.A OG HIS 129.A NE2 no hydrogen 2.745 N/A ILE 100.A N VAL 97.A O no hydrogen 2.946 N/A ALA 105.A N GLY 101.A O no hydrogen 2.940 N/A ARG 106.A N PRO 102.A O no hydrogen 3.080 N/A ARG 106.A NE GLN 25.A OE1 no hydrogen 3.368 N/A ARG 106.A NH1 VAL 23.A O no hydrogen 3.313 N/A ARG 106.A NH2 VAL 23.A O no hydrogen 2.448 N/A ARG 106.A NH2 GLN 25.A OE1 no hydrogen 2.742 N/A LYS 107.A N SER 103.A O no hydrogen 3.159 N/A PHE 108.A N ALA 104.A O no hydrogen 2.925 N/A VAL 109.A N ALA 105.A O no hydrogen 3.084 N/A ASP 110.A N ARG 106.A O no hydrogen 2.751 N/A GLU 111.A N LYS 107.A O no hydrogen 3.256 N/A GLU 111.A N PHE 108.A O no hydrogen 3.130 N/A GLY 112.A N VAL 109.A O no hydrogen 3.271 N/A ILE 113.A N PHE 108.A O no hydrogen 2.759 N/A LYS 114.A N ASP 118.A OD2 no hydrogen 2.919 N/A LYS 114.A NZ ASP 86.A OD2 no hydrogen 2.490 N/A THR 115.A N ASP 118.A OD2 no hydrogen 3.178 N/A THR 115.A OG1 GLU 117.A OE1 no hydrogen 3.510 N/A GLU 117.A N GLU 117.A OE1 no hydrogen 2.324 N/A ASP 118.A N THR 115.A OG1 no hydrogen 2.939 N/A LEU 119.A N THR 115.A O no hydrogen 2.874 N/A ARG 120.A N LEU 116.A O no hydrogen 2.665 N/A LYS 121.A N GLU 117.A O no hydrogen 2.982 N/A LYS 121.A N ASP 118.A O no hydrogen 3.267 N/A ASN 122.A N ASP 118.A O no hydrogen 3.152 N/A ASN 122.A N LEU 119.A O no hydrogen 3.003 N/A ASN 122.A ND2 ASP 118.A O no hydrogen 2.811 N/A LYS 125.A N ASN 122.A O no hydrogen 3.093 N/A LYS 125.A NZ GLU 111.A OE2 no hydrogen 2.449 N/A LEU 126.A N GLU 123.A O no hydrogen 2.951 N/A ASN 127.A N GLN 130.A OE1 no hydrogen 3.090 N/A HIS 128.A NE2 THR 219.A O no hydrogen 2.810 N/A HIS 129.A NE2 SER 98.A OG no hydrogen 2.745 N/A GLN 130.A N ASN 127.A OD1 no hydrogen 2.785 N/A GLN 130.A NE2 GLY 99.A O no hydrogen 2.992 N/A ARG 131.A N ASN 127.A O no hydrogen 3.139 N/A ARG 131.A NE GLU 123.A O no hydrogen 3.268 N/A ARG 131.A NE LEU 126.A O no hydrogen 2.991 N/A ARG 131.A NH2 LEU 126.A O no hydrogen 3.101 N/A ILE 132.A N HIS 128.A O no hydrogen 3.254 N/A GLY 133.A N HIS 129.A O no hydrogen 2.884 N/A LEU 134.A N GLN 130.A O no hydrogen 2.926 N/A LYS 135.A N ARG 131.A O no hydrogen 2.770 N/A LYS 135.A NZ TYR 136.A OH no hydrogen 3.396 N/A TYR 136.A N ILE 132.A O no hydrogen 2.994 N/A TYR 136.A OH ASP 218.A OD2 no hydrogen 2.705 N/A PHE 137.A N LEU 134.A O no hydrogen 3.284 N/A PHE 140.A N TYR 136.A O no hydrogen 2.868 N/A GLU 141.A N GLY 138.A O no hydrogen 3.119 N/A LYS 142.A N ASP 139.A O no hydrogen 3.130 N/A ARG 143.A NE SER 181.A OG no hydrogen 2.832 N/A ARG 143.A NH2 SER 181.A O no hydrogen 3.108 N/A ILE 144.A N SER 182.A O no hydrogen 2.641 N/A ARG 146.A N GLU 180.A O no hydrogen 3.084 N/A ARG 146.A NH1 PHE 175.A O no hydrogen 2.929 N/A ARG 146.A NH1 ALA 179.A O no hydrogen 3.039 N/A ARG 146.A NH2 PHE 175.A O no hydrogen 3.389 N/A MET 149.A N PRO 145.A O no hydrogen 3.055 N/A LEU 150.A N ARG 146.A O no hydrogen 2.764 N/A GLN 151.A N GLU 147.A O no hydrogen 3.151 N/A GLN 151.A NE2 GLU 147.A OE2 no hydrogen 3.068 N/A MET 152.A N GLU 148.A O no hydrogen 2.839 N/A GLN 153.A N MET 149.A O no hydrogen 2.834 N/A ASP 154.A N LEU 150.A O no hydrogen 2.966 N/A ILE 155.A N GLN 151.A O no hydrogen 3.353 N/A VAL 156.A N MET 152.A O no hydrogen 3.157 N/A LEU 157.A N GLN 153.A O no hydrogen 2.949 N/A ASN 158.A N ASP 154.A O no hydrogen 3.046 N/A GLU 159.A N ILE 155.A O no hydrogen 2.918 N/A VAL 160.A N VAL 156.A O no hydrogen 2.981 N/A LYS 161.A N LEU 157.A O no hydrogen 3.164 N/A LYS 162.A N ASN 158.A O no hydrogen 2.986 N/A LYS 162.A NZ GLU 159.A OE1 no hydrogen 2.875 N/A LYS 162.A NZ GLU 159.A OE2 no hydrogen 3.262 N/A VAL 163.A N GLU 159.A O no hydrogen 3.162 N/A ASP 164.A N VAL 160.A O no hydrogen 3.275 N/A GLU 166.A N ASP 164.A OD1 no hydrogen 3.088 N/A TYR 167.A N ASP 164.A O no hydrogen 2.925 N/A TYR 167.A OH LEU 202.A O no hydrogen 2.459 N/A ILE 168.A N THR 190.A O no hydrogen 2.821 N/A THR 170.A N LEU 188.A O no hydrogen 2.959 N/A THR 170.A OG1 TYR 255.A OH no hydrogen 2.814 N/A CYS 172.A N ASP 186.A O no hydrogen 2.886 N/A CYS 172.A SG THR 170.A O no hydrogen 3.579 N/A GLY 173.A N PHE 262.A O no hydrogen 2.855 N/A SER 174.A OG SER 182.A OG no hydrogen 3.001 N/A ARG 176.A N GLY 173.A O no hydrogen 3.185 N/A ARG 176.A NH1 THR 263.A OG1 no hydrogen 2.875 N/A ARG 176.A NH1 GLU 306.A OE1 no hydrogen 3.493 N/A ARG 176.A NH1 GLU 306.A OE2 no hydrogen 3.278 N/A ARG 176.A NH2 GLU 306.A OE2 no hydrogen 2.708 N/A ARG 177.A NH1 THR 263.A O no hydrogen 2.724 N/A GLY 178.A N PHE 175.A O no hydrogen 2.952 N/A ALA 179.A N SER 174.A O no hydrogen 3.139 N/A SER 182.A N ILE 144.A O no hydrogen 2.838 N/A SER 182.A OG SER 174.A OG no hydrogen 3.001 N/A MET 185.A N ARG 244.A O no hydrogen 2.954 N/A VAL 187.A N ASP 246.A O no hydrogen 2.836 N/A LEU 188.A N THR 170.A O no hydrogen 2.904 N/A LEU 189.A N ARG 248.A O no hydrogen 2.620 N/A THR 190.A N ILE 168.A O no hydrogen 2.928 N/A THR 190.A OG1 ILE 250.A O no hydrogen 2.778 N/A HIS 191.A NE2 ASP 164.A OD2 no hydrogen 2.724 N/A SER 193.A N HIS 191.A ND1 no hydrogen 3.139 N/A SER 193.A OG HIS 191.A ND1 no hydrogen 2.580 N/A PHE 194.A N HIS 191.A O no hydrogen 2.861 N/A SER 196.A N ASP 253.A OD1 no hydrogen 3.055 N/A SER 196.A OG ASP 253.A OD1 no hydrogen 3.041 N/A SER 196.A OG ASP 253.A OD2 no hydrogen 2.334 N/A SER 198.A N THR 195.A O no hydrogen 3.274 N/A SER 198.A OG SER 193.A O no hydrogen 3.389 N/A LEU 202.A N GLN 199.A O no hydrogen 3.336 N/A HIS 204.A NE2 GLU 208.A OE1 no hydrogen 3.069 N/A GLN 205.A N LYS 201.A O no hydrogen 2.846 N/A VAL 207.A N LEU 203.A O no hydrogen 3.070 N/A GLU 208.A N HIS 204.A O no hydrogen 2.814 N/A GLN 209.A N GLN 205.A O no hydrogen 3.106 N/A GLN 209.A NE2 GLU 159.A OE1 no hydrogen 2.724 N/A LEU 210.A N VAL 206.A O no hydrogen 3.033 N/A GLN 211.A N VAL 207.A O no hydrogen 2.872 N/A LYS 212.A N GLU 208.A O no hydrogen 2.863 N/A VAL 213.A N GLN 209.A O no hydrogen 3.177 N/A HIS 214.A N GLN 211.A O no hydrogen 2.855 N/A PHE 215.A N LEU 210.A O no hydrogen 2.824 N/A ILE 216.A N LEU 210.A O no hydrogen 2.999 N/A THR 217.A N VAL 230.A O no hydrogen 2.707 N/A THR 217.A OG1 ASP 218.A OD2 no hydrogen 2.816 N/A THR 217.A OG1 VAL 230.A O no hydrogen 3.345 N/A ASP 218.A N VAL 230.A O no hydrogen 3.331 N/A LEU 220.A N MET 228.A O no hydrogen 2.726 N/A SER 221.A N MET 228.A O no hydrogen 2.988 N/A LYS 222.A NZ HIS 204.A ND1 no hydrogen 3.339 N/A GLY 223.A N LYS 226.A O no hydrogen 3.092 N/A PHE 227.A N ILE 247.A O no hydrogen 2.812 N/A MET 228.A N SER 221.A O no hydrogen 2.775 N/A GLY 229.A N ILE 245.A O no hydrogen 3.031 N/A VAL 230.A N ASP 218.A O no hydrogen 2.954 N/A CYS 231.A N ARG 243.A O no hydrogen 2.839 N/A CYS 231.A SG ARG 243.A O no hydrogen 3.887 N/A GLN 232.A N PHE 215.A O no hydrogen 2.942 N/A GLN 232.A NE2 TYR 240.A O no hydrogen 2.610 N/A HIS 242.A N ASP 139.A OD2 no hydrogen 2.975 N/A ARG 243.A N CYS 231.A O no hydrogen 2.744 N/A ARG 243.A NH1 ARG 143.A O no hydrogen 3.328 N/A ARG 243.A NH2 ARG 143.A O no hydrogen 3.543 N/A ARG 243.A NH2 GLU 148.A OE1 no hydrogen 3.038 N/A ARG 244.A NH1 GLY 229.A O no hydrogen 3.049 N/A ARG 244.A NH1 ILE 245.A O no hydrogen 3.329 N/A ARG 244.A NH1 ASP 246.A OD1 no hydrogen 2.867 N/A ARG 244.A NH2 ASP 246.A OD1 no hydrogen 2.843 N/A ARG 244.A NH2 ASP 246.A OD2 no hydrogen 3.481 N/A ILE 245.A N GLY 229.A O no hydrogen 3.104 N/A ASP 246.A N MET 185.A O no hydrogen 2.828 N/A ILE 247.A N PHE 227.A O no hydrogen 2.850 N/A ARG 248.A N VAL 187.A O no hydrogen 2.884 N/A ARG 248.A NE ASP 186.A OD1 no hydrogen 3.441 N/A ARG 248.A NH2 ASP 186.A OD1 no hydrogen 3.426 N/A ARG 248.A NH2 ASP 186.A OD2 no hydrogen 3.185 N/A LEU 249.A N THR 225.A O no hydrogen 2.810 N/A ILE 250.A N LEU 189.A O no hydrogen 2.852 N/A LYS 252.A N PHE 194.A O no hydrogen 2.783 N/A GLN 254.A N PRO 251.A O no hydrogen 2.897 N/A TYR 255.A N LYS 252.A O no hydrogen 3.198 N/A TYR 255.A OH THR 170.A OG1 no hydrogen 2.814 N/A TYR 255.A OH LEU 188.A O no hydrogen 2.786 N/A GLY 258.A N GLN 254.A O no hydrogen 3.133 N/A VAL 259.A N TYR 255.A O no hydrogen 2.761 N/A LEU 260.A N TYR 256.A O no hydrogen 3.197 N/A TYR 261.A N CYS 257.A O no hydrogen 3.030 N/A PHE 262.A N GLY 258.A O no hydrogen 2.967 N/A THR 263.A N LEU 260.A O no hydrogen 3.365 N/A THR 263.A OG1 VAL 259.A O no hydrogen 2.462 N/A SER 265.A N ARG 323.A O no hydrogen 2.788 N/A SER 265.A OG ARG 323.A O no hydrogen 3.362 N/A SER 265.A OG SER 324.A O no hydrogen 2.919 N/A PHE 268.A N SER 265.A OG no hydrogen 3.012 N/A ASN 269.A N SER 265.A O no hydrogen 2.657 N/A ASN 269.A ND2 TYR 261.A O no hydrogen 2.898 N/A LYS 270.A N ASP 266.A O no hydrogen 2.894 N/A ASN 271.A N ILE 267.A O no hydrogen 3.498 N/A MET 272.A N PHE 268.A O no hydrogen 3.075 N/A ARG 273.A N ASN 269.A O no hydrogen 3.154 N/A ALA 274.A N LYS 270.A O no hydrogen 3.023 N/A HIS 275.A N ASN 271.A O no hydrogen 2.851 N/A LEU 277.A N ARG 273.A O no hydrogen 3.019 N/A GLU 278.A N ALA 274.A O no hydrogen 3.371 N/A LYS 279.A N ALA 276.A O no hydrogen 3.306 N/A LYS 279.A NZ GLN 314.A OE1 no hydrogen 1.702 N/A GLY 280.A N LEU 277.A O no hydrogen 2.749 N/A PHE 281.A N ALA 276.A O no hydrogen 2.807 N/A THR 282.A N ARG 289.A O no hydrogen 2.756 N/A ASN 284.A N THR 287.A O no hydrogen 3.080 N/A TYR 286.A N ASN 284.A OD1 no hydrogen 2.998 N/A THR 287.A N ASN 284.A OD1 no hydrogen 2.688 N/A THR 287.A OG1 ASN 284.A OD1 no hydrogen 3.234 N/A ARG 289.A N THR 282.A O no hydrogen 2.951 N/A LEU 291.A N GLY 280.A O no hydrogen 3.017 N/A GLY 292.A N VAL 296.A O no hydrogen 3.021 N/A GLY 295.A N GLY 292.A O no hydrogen 2.966 N/A GLY 298.A N PRO 290.A O no hydrogen 3.046 N/A LEU 301.A N ILE 288.A O no hydrogen 2.950 N/A ASP 304.A N ASP 308.A OD1 no hydrogen 2.897 N/A SER 305.A OG ASP 308.A OD2 no hydrogen 3.266 N/A LYS 307.A NZ ASP 311.A OD1 no hydrogen 3.277 N/A LYS 307.A NZ ASP 311.A OD2 no hydrogen 3.128 N/A ILE 309.A N GLU 306.A O no hydrogen 2.687 N/A ASP 311.A N LYS 307.A O no hydrogen 2.736 N/A TYR 312.A N ASP 308.A O no hydrogen 3.108 N/A TYR 312.A OH PRO 302.A O no hydrogen 2.952 N/A GLN 314.A N ASP 311.A O no hydrogen 2.898 N/A TRP 315.A N PHE 310.A O no hydrogen 2.619 N/A TYR 317.A OH GLU 306.A OE2 no hydrogen 2.817 N/A LYS 321.A NZ ASP 322.A OD1 no hydrogen 3.438 N/A ASP 322.A N GLU 319.A O no hydrogen 2.731 N/A ARG 323.A NE ARG 318.A O no hydrogen 2.926 N/A ARG 323.A NH1 GLU 306.A OE1 no hydrogen 2.824 N/A ARG 323.A NH2 GLU 306.A OE1 no hydrogen 3.315 N/A ARG 323.A NH2 GLU 306.A OE2 no hydrogen 2.836 N/A ARG 323.A NH2 ARG 318.A O no hydrogen 3.083 N/A