Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4jta_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 4.A OH GLY 45.A O no hydrogen 2.587 N/A ARG 5.A N VAL 14.A O no hydrogen 2.804 N/A ARG 5.A NH1 VAL 282.A O no hydrogen 2.806 N/A ARG 5.A NH2 LEU 277.A O no hydrogen 3.428 N/A ASN 6.A ND2 SER 10.A O no hydrogen 2.750 N/A LEU 7.A N LEU 12.A O no hydrogen 2.788 N/A GLY 8.A N SER 283.A OG no hydrogen 2.937 N/A LYS 9.A N GLY 202.A O no hydrogen 2.886 N/A LYS 9.A NZ HIS 199.A O no hydrogen 3.346 N/A SER 10.A N LEU 7.A O no hydrogen 3.195 N/A SER 10.A OG LEU 7.A O no hydrogen 2.778 N/A LEU 12.A N SER 10.A OG no hydrogen 3.274 N/A ARG 13.A NH1 ASN 6.A OD1 no hydrogen 2.858 N/A VAL 14.A N ARG 5.A O no hydrogen 2.779 N/A SER 15.A N ASN 47.A OD1 no hydrogen 3.095 N/A SER 15.A OG LEU 17.A O no hydrogen 2.767 N/A SER 15.A OG ASN 47.A OD1 no hydrogen 3.328 N/A CYS 16.A N PHE 3.A O no hydrogen 2.782 N/A CYS 16.A SG PHE 3.A O no hydrogen 3.479 N/A GLY 18.A N VAL 285.A O no hydrogen 2.843 N/A LEU 19.A N LEU 48.A O no hydrogen 2.859 N/A GLY 20.A N LEU 287.A O no hydrogen 2.765 N/A THR 21.A OG1 ASP 50.A O no hydrogen 2.986 N/A THR 21.A OG1 THR 51.A OG1 no hydrogen 3.139 N/A THR 24.A N TRP 22.A O no hydrogen 2.773 N/A GLY 27.A N THR 24.A O no hydrogen 2.966 N/A GLN 28.A N VAL 23.A O no hydrogen 2.914 N/A ILE 29.A N THR 24.A O no hydrogen 3.055 N/A THR 30.A OG1 GLU 32.A OE1 no hydrogen 3.385 N/A MET 33.A N THR 30.A OG1 no hydrogen 3.034 N/A ALA 34.A N THR 30.A O no hydrogen 2.927 N/A GLU 35.A N ASP 31.A O no hydrogen 2.901 N/A HIS 36.A N GLU 32.A O no hydrogen 3.047 N/A LEU 37.A N MET 33.A O no hydrogen 2.795 N/A MET 38.A N ALA 34.A O no hydrogen 2.943 N/A THR 39.A N GLU 35.A O no hydrogen 2.906 N/A THR 39.A OG1 GLU 35.A O no hydrogen 2.730 N/A LEU 40.A N HIS 36.A O no hydrogen 2.973 N/A ALA 41.A N LEU 37.A O no hydrogen 2.977 N/A TYR 42.A N MET 38.A O no hydrogen 2.858 N/A TYR 42.A OH SER 77.A OG no hydrogen 2.773 N/A ASP 43.A N THR 39.A O no hydrogen 2.890 N/A ASN 44.A N LEU 40.A O no hydrogen 3.145 N/A ASN 44.A N ALA 41.A O no hydrogen 3.061 N/A ASN 44.A ND2 LEU 40.A O no hydrogen 2.910 N/A GLY 45.A N TYR 42.A O no hydrogen 3.035 N/A ILE 46.A N ALA 41.A O no hydrogen 3.027 N/A ASN 47.A N SER 15.A OG no hydrogen 3.032 N/A ASN 47.A ND2 ARG 13.A O no hydrogen 3.051 N/A PHE 49.A N VAL 79.A O no hydrogen 3.142 N/A ASP 50.A N LEU 19.A O no hydrogen 3.095 N/A THR 51.A N THR 81.A O no hydrogen 3.033 N/A THR 51.A OG1 THR 21.A OG1 no hydrogen 3.139 N/A ALA 52.A N THR 51.A OG1 no hydrogen 2.742 N/A GLU 53.A N LYS 83.A O no hydrogen 3.146 N/A TYR 55.A N ALA 52.A O no hydrogen 3.276 N/A ALA 57.A N VAL 54.A O no hydrogen 3.146 N/A GLY 58.A N TYR 55.A O no hydrogen 3.160 N/A LYS 59.A N ALA 56.A O no hydrogen 2.997 N/A ALA 60.A N TYR 55.A O no hydrogen 3.477 N/A VAL 62.A N GLY 58.A O no hydrogen 3.272 N/A VAL 63.A N LYS 59.A O no hydrogen 2.947 N/A LEU 64.A N ALA 60.A O no hydrogen 2.933 N/A GLY 65.A N GLU 61.A O no hydrogen 2.860 N/A ASN 66.A N VAL 62.A O no hydrogen 2.970 N/A ILE 67.A N VAL 63.A O no hydrogen 3.186 N/A ILE 68.A N LEU 64.A O no hydrogen 3.224 N/A LYS 69.A N GLY 65.A O no hydrogen 3.012 N/A LYS 70.A N ASN 66.A O no hydrogen 2.933 N/A LYS 70.A NZ GLU 35.A OE1 no hydrogen 3.246 N/A LYS 70.A NZ GLU 35.A OE2 no hydrogen 2.684 N/A LYS 71.A N ILE 67.A O no hydrogen 2.727 N/A LYS 71.A NZ THR 39.A OG1 no hydrogen 3.238 N/A GLY 72.A N ILE 68.A O no hydrogen 3.053 N/A ARG 75.A NH1 ARG 75.A O no hydrogen 3.070 N/A ARG 75.A NH1 LEU 78.A O no hydrogen 3.287 N/A ARG 75.A NH1 ASP 118.A OD2 no hydrogen 2.852 N/A ARG 75.A NH2 TYR 116.A O no hydrogen 2.691 N/A ARG 75.A NH2 ASP 118.A OD2 no hydrogen 2.936 N/A SER 77.A N ARG 74.A O no hydrogen 2.928 N/A SER 77.A OG TYR 42.A OH no hydrogen 2.773 N/A SER 77.A OG ARG 74.A O no hydrogen 2.569 N/A LEU 78.A N ARG 75.A O no hydrogen 3.096 N/A VAL 79.A N ASN 47.A O no hydrogen 2.749 N/A ILE 80.A N ASP 118.A OD2 no hydrogen 2.756 N/A THR 81.A N PHE 49.A O no hydrogen 2.949 N/A THR 81.A OG1 PHE 49.A O no hydrogen 3.522 N/A THR 81.A OG1 ASP 50.A OD2 no hydrogen 2.557 N/A THR 82.A N VAL 119.A O no hydrogen 3.148 N/A THR 82.A OG1 GLU 61.A OE1 no hydrogen 2.698 N/A LYS 83.A N THR 51.A O no hydrogen 3.195 N/A LYS 83.A NZ ASP 50.A OD1 no hydrogen 2.468 N/A LYS 83.A NZ THR 51.A O no hydrogen 3.537 N/A LYS 83.A NZ TYR 55.A OH no hydrogen 2.581 N/A ILE 84.A N PHE 121.A O no hydrogen 2.792 N/A PHE 85.A N GLU 53.A OE1 no hydrogen 2.470 N/A GLY 87.A N GLU 93.A O no hydrogen 2.936 N/A ALA 90.A N GLU 93.A OE1 no hydrogen 2.969 N/A GLU 93.A N ALA 90.A O no hydrogen 2.983 N/A ARG 94.A NH2 GLU 91.A OE1 no hydrogen 3.305 N/A GLY 95.A N PHE 85.A O no hydrogen 2.839 N/A LEU 96.A N ASP 126.A OD2 no hydrogen 2.790 N/A ARG 98.A N GLU 133.A OE2 no hydrogen 2.764 N/A LYS 99.A NZ GLU 103.A OE1 no hydrogen 3.538 N/A LYS 99.A NZ GLU 103.A OE2 no hydrogen 2.992 N/A HIS 100.A N SER 97.A OG no hydrogen 3.145 N/A HIS 100.A NE2 GLU 53.A OE1 no hydrogen 2.837 N/A ILE 101.A N SER 97.A O no hydrogen 3.109 N/A ILE 102.A N ARG 98.A O no hydrogen 3.181 N/A GLU 103.A N LYS 99.A O no hydrogen 3.052 N/A GLY 104.A N HIS 100.A O no hydrogen 2.642 N/A LEU 105.A N ILE 101.A O no hydrogen 2.970 N/A LYS 106.A N ILE 102.A O no hydrogen 2.992 N/A ALA 107.A N GLU 103.A O no hydrogen 2.957 N/A SER 108.A N GLY 104.A O no hydrogen 2.935 N/A SER 108.A OG GLU 61.A OE1 no hydrogen 2.631 N/A SER 108.A OG GLU 61.A OE2 no hydrogen 3.244 N/A SER 108.A OG GLY 104.A O no hydrogen 3.390 N/A LEU 109.A N LEU 105.A O no hydrogen 2.919 N/A GLU 110.A N LYS 106.A O no hydrogen 3.101 N/A ARG 111.A N ALA 107.A O no hydrogen 2.968 N/A ARG 111.A NE GLU 61.A OE2 no hydrogen 2.879 N/A ARG 111.A NH2 GLU 61.A OE2 no hydrogen 2.974 N/A LEU 112.A N SER 108.A O no hydrogen 2.789 N/A GLN 113.A N GLU 110.A O no hydrogen 3.181 N/A LEU 114.A N LEU 109.A O no hydrogen 3.136 N/A VAL 117.A N MET 146.A O no hydrogen 3.153 N/A ASP 118.A N ILE 80.A O no hydrogen 2.814 N/A VAL 119.A N ILE 80.A O no hydrogen 3.437 N/A VAL 120.A N TYR 149.A O no hydrogen 2.946 N/A PHE 121.A N THR 82.A O no hydrogen 2.942 N/A ALA 122.A N GLY 151.A O no hydrogen 2.935 N/A ASN 123.A N ILE 84.A O no hydrogen 2.781 N/A ARG 124.A NE PRO 125.A O no hydrogen 2.802 N/A ARG 124.A NH2 PRO 125.A O no hydrogen 2.975 N/A ASN 128.A N ASP 126.A OD1 no hydrogen 2.836 N/A THR 129.A N ASP 126.A O no hydrogen 3.398 N/A THR 129.A OG1 ASP 126.A OD2 no hydrogen 2.824 N/A THR 134.A N PRO 130.A O no hydrogen 3.336 N/A THR 134.A OG1 LEU 96.A O no hydrogen 3.090 N/A VAL 135.A N MET 131.A O no hydrogen 2.855 N/A ARG 136.A N GLU 132.A O no hydrogen 2.860 N/A ARG 136.A NE GLU 132.A OE2 no hydrogen 3.049 N/A ARG 136.A NH2 GLU 132.A OE2 no hydrogen 3.541 N/A ALA 137.A N GLU 133.A O no hydrogen 2.965 N/A MET 138.A N THR 134.A O no hydrogen 2.978 N/A THR 139.A N VAL 135.A O no hydrogen 2.959 N/A THR 139.A OG1 VAL 135.A O no hydrogen 2.872 N/A HIS 140.A N ARG 136.A O no hydrogen 2.896 N/A VAL 141.A N ALA 137.A O no hydrogen 2.951 N/A ILE 142.A N MET 138.A O no hydrogen 3.115 N/A ASN 143.A N THR 139.A O no hydrogen 2.960 N/A GLN 144.A N HIS 140.A O no hydrogen 2.963 N/A GLY 145.A N ILE 142.A O no hydrogen 2.877 N/A MET 146.A N VAL 141.A O no hydrogen 2.834 N/A MET 148.A N VAL 117.A O no hydrogen 3.182 N/A MET 148.A N ASP 118.A O no hydrogen 3.287 N/A TYR 149.A N ASP 118.A O no hydrogen 2.809 N/A TRP 150.A NE1 ILE 173.A O no hydrogen 2.858 N/A GLY 151.A N VAL 120.A O no hydrogen 2.791 N/A THR 152.A N CYS 177.A O no hydrogen 2.792 N/A THR 152.A OG1 CYS 177.A O no hydrogen 3.552 N/A THR 152.A OG1 GLU 178.A OE1 no hydrogen 2.620 N/A SER 153.A OG GLN 179.A O no hydrogen 2.988 N/A ARG 154.A N GLU 178.A OE2 no hydrogen 2.885 N/A TRP 155.A N GLU 178.A OE1 no hydrogen 3.465 N/A SER 156.A N GLU 159.A OE2 no hydrogen 2.748 N/A SER 156.A OG GLU 159.A OE2 no hydrogen 2.997 N/A GLU 159.A N SER 156.A OG no hydrogen 3.218 N/A ILE 160.A N SER 156.A O no hydrogen 3.111 N/A MET 161.A N SER 157.A O no hydrogen 2.972 N/A GLU 162.A N MET 158.A O no hydrogen 3.038 N/A ALA 163.A N GLU 159.A O no hydrogen 3.030 N/A TYR 164.A N ILE 160.A O no hydrogen 3.056 N/A SER 165.A N MET 161.A O no hydrogen 2.865 N/A SER 165.A OG MET 161.A O no hydrogen 3.332 N/A SER 165.A OG GLU 162.A O no hydrogen 2.998 N/A VAL 166.A N GLU 162.A O no hydrogen 2.830 N/A ALA 167.A N ALA 163.A O no hydrogen 2.880 N/A ARG 168.A N TYR 164.A O no hydrogen 3.008 N/A GLN 169.A N SER 165.A O no hydrogen 2.887 N/A PHE 170.A N VAL 166.A O no hydrogen 3.055 N/A ASN 171.A N ARG 168.A O no hydrogen 3.494 N/A LEU 172.A N ALA 167.A O no hydrogen 2.696 N/A ILE 173.A N THR 139.A OG1 no hydrogen 3.094 N/A ILE 176.A N TRP 150.A O no hydrogen 3.064 N/A CYS 177.A SG GLU 178.A O no hydrogen 3.662 N/A CYS 177.A SG GLY 204.A O no hydrogen 3.561 N/A GLU 178.A N GLY 204.A O no hydrogen 2.919 N/A GLN 179.A N THR 152.A O no hydrogen 2.718 N/A GLN 179.A NE2 ASP 50.A OD2 no hydrogen 2.940 N/A TYR 182.A N TRP 208.A O no hydrogen 3.164 N/A TYR 182.A OH GLU 191.A OE2 no hydrogen 2.691 N/A HIS 183.A NE2 GLU 181.A OE1 no hydrogen 3.020 N/A PHE 185.A N HIS 183.A ND1 no hydrogen 3.042 N/A GLN 186.A N HIS 183.A O no hydrogen 2.969 N/A ARG 187.A NE GLU 191.A OE2 no hydrogen 2.926 N/A ARG 187.A NH1 ASP 317.A OD1 no hydrogen 2.904 N/A ARG 187.A NH1 ASN 322.A OD1 no hydrogen 3.115 N/A ARG 187.A NH2 GLU 191.A OE1 no hydrogen 3.012 N/A ARG 187.A NH2 GLU 191.A OE2 no hydrogen 3.371 N/A ARG 187.A NH2 ASP 317.A OD1 no hydrogen 2.885 N/A LYS 189.A NZ TRP 155.A O no hydrogen 3.285 N/A LYS 189.A NZ GLU 178.A OE2 no hydrogen 3.034 N/A GLU 191.A N ARG 187.A O no hydrogen 3.120 N/A VAL 192.A N GLU 188.A O no hydrogen 2.800 N/A GLN 193.A N LYS 189.A O no hydrogen 3.094 N/A LEU 194.A N LYS 189.A O no hydrogen 3.002 N/A PHE 198.A N LEU 194.A O no hydrogen 2.970 N/A HIS 199.A N PRO 195.A O no hydrogen 3.047 N/A LYS 200.A N GLU 196.A O no hydrogen 2.779 N/A ILE 201.A N LEU 197.A O no hydrogen 2.959 N/A VAL 203.A N LEU 197.A O no hydrogen 3.423 N/A GLY 204.A N ILE 176.A O no hydrogen 3.183 N/A ALA 205.A N GLY 281.A O no hydrogen 3.212 N/A MET 206.A N GLU 178.A O no hydrogen 2.931 N/A THR 207.A N SER 284.A O no hydrogen 3.004 N/A TRP 208.A N ALA 180.A O no hydrogen 2.952 N/A TRP 208.A NE1 GLN 179.A O no hydrogen 2.944 N/A ALA 212.A N SER 209.A O no hydrogen 2.834 N/A GLY 214.A N LEU 211.A O no hydrogen 2.891 N/A ILE 215.A N ALA 212.A O no hydrogen 3.380 N/A VAL 216.A N LEU 211.A O no hydrogen 2.883 N/A SER 217.A N GLY 214.A O no hydrogen 2.846 N/A SER 217.A OG GLY 214.A O no hydrogen 2.551 N/A LYS 219.A N SER 217.A OG no hydrogen 3.155 N/A ASP 221.A N GLY 218.A O no hydrogen 3.245 N/A SER 222.A OG ASP 221.A OD1 no hydrogen 3.381 N/A SER 228.A OG PRO 225.A O no hydrogen 2.794 N/A ALA 230.A N TYR 220.A OH no hydrogen 3.210 N/A SER 231.A N SER 228.A O no hydrogen 2.869 N/A SER 231.A OG SER 228.A O no hydrogen 2.798 N/A LEU 232.A N ARG 229.A O no hydrogen 3.034 N/A TYR 235.A N LEU 232.A O no hydrogen 3.136 N/A GLN 236.A NE2 ASP 240.A OD1 no hydrogen 2.583 N/A LEU 238.A N TYR 235.A O no hydrogen 2.900 N/A LYS 239.A N TYR 235.A O no hydrogen 3.195 N/A ASP 240.A N GLN 236.A O no hydrogen 2.798 N/A LYS 241.A N TRP 237.A O no hydrogen 3.203 N/A ILE 242.A N LEU 238.A O no hydrogen 3.150 N/A LEU 243.A N LYS 239.A O no hydrogen 3.213 N/A SER 244.A N LYS 241.A O no hydrogen 3.099 N/A SER 244.A OG LYS 241.A O no hydrogen 2.797 N/A GLY 247.A N SER 244.A OG no hydrogen 2.749 N/A ARG 248.A N SER 244.A O no hydrogen 2.881 N/A ARG 249.A N GLU 245.A O no hydrogen 3.131 N/A ARG 249.A NE GLU 246.A OE1 no hydrogen 2.981 N/A ARG 249.A NH1 GLU 245.A OE2 no hydrogen 3.066 N/A ARG 249.A NH2 GLU 245.A OE2 no hydrogen 3.338 N/A ARG 249.A NH2 GLU 246.A OE1 no hydrogen 3.277 N/A GLN 250.A N GLU 246.A O no hydrogen 3.056 N/A GLN 251.A N GLY 247.A O no hydrogen 3.176 N/A ALA 252.A N ARG 248.A O no hydrogen 2.998 N/A LYS 253.A N ARG 249.A O no hydrogen 3.107 N/A LYS 253.A NZ LEU 320.A O no hydrogen 2.925 N/A LEU 254.A N GLN 250.A O no hydrogen 2.857 N/A LYS 255.A N GLN 251.A O no hydrogen 3.326 N/A LYS 255.A N ALA 252.A O no hydrogen 3.152 N/A LYS 255.A NZ ASP 221.A O no hydrogen 3.197 N/A GLU 256.A N LYS 253.A O no hydrogen 2.987 N/A LEU 257.A N LYS 253.A O no hydrogen 3.006 N/A GLN 258.A N LEU 254.A O no hydrogen 2.997 N/A ALA 261.A N LEU 257.A O no hydrogen 3.060 N/A GLU 262.A N GLN 258.A O no hydrogen 2.977 N/A ARG 263.A N ALA 259.A O no hydrogen 3.047 N/A ARG 263.A NH1 GLU 315.A OE1 no hydrogen 3.009 N/A ARG 263.A NH1 GLU 315.A OE2 no hydrogen 2.978 N/A ARG 263.A NH2 GLU 315.A OE2 no hydrogen 2.785 N/A LEU 264.A N ILE 260.A O no hydrogen 2.967 N/A GLY 265.A N GLU 262.A O no hydrogen 3.019 N/A CYS 266.A N ALA 261.A O no hydrogen 2.923 N/A CYS 266.A SG ALA 261.A O no hydrogen 3.858 N/A CYS 266.A SG THR 267.A O no hydrogen 3.474 N/A THR 267.A N GLN 270.A OE1 no hydrogen 3.035 N/A THR 267.A OG1 GLU 297.A OE2 no hydrogen 2.611 N/A GLN 270.A NE2 GLU 297.A O no hydrogen 2.931 N/A LEU 271.A N THR 267.A O no hydrogen 3.129 N/A ALA 272.A N LEU 268.A O no hydrogen 2.841 N/A ILE 273.A N PRO 269.A O no hydrogen 2.999 N/A ALA 274.A N GLN 270.A O no hydrogen 2.988 N/A TRP 275.A N LEU 271.A O no hydrogen 2.862 N/A CYS 276.A N ALA 272.A O no hydrogen 3.472 N/A CYS 276.A SG TYR 182.A O no hydrogen 3.620 N/A CYS 276.A SG ALA 272.A O no hydrogen 3.349 N/A LEU 277.A N ALA 274.A O no hydrogen 3.144 N/A ARG 278.A N TRP 275.A O no hydrogen 3.132 N/A ARG 278.A NH1 TYR 182.A OH no hydrogen 3.137 N/A ARG 278.A NH1 TRP 275.A O no hydrogen 2.761 N/A ARG 278.A NH2 GLU 191.A OE2 no hydrogen 3.146 N/A VAL 282.A N ASN 279.A O no hydrogen 2.957 N/A SER 283.A N ALA 205.A O no hydrogen 2.755 N/A SER 283.A OG ASN 6.A O no hydrogen 3.257 N/A SER 284.A OG SER 15.A O no hydrogen 2.862 N/A VAL 285.A N CYS 16.A O no hydrogen 2.887 N/A LEU 286.A N THR 207.A O no hydrogen 2.811 N/A LEU 287.A N GLY 18.A O no hydrogen 2.764 N/A SER 290.A N GLN 294.A OE1 no hydrogen 3.056 N/A LEU 295.A N ASN 291.A O no hydrogen 3.462 N/A MET 296.A N ALA 292.A O no hydrogen 2.923 N/A GLU 297.A N GLU 293.A O no hydrogen 3.022 N/A ASN 298.A N GLN 294.A O no hydrogen 2.898 N/A ILE 299.A N LEU 295.A O no hydrogen 3.007 N/A GLY 300.A N GLU 297.A O no hydrogen 2.935 N/A ALA 301.A N ASN 298.A O no hydrogen 2.875 N/A ILE 302.A N ILE 299.A O no hydrogen 3.420 N/A GLN 303.A N GLY 300.A O no hydrogen 3.056 N/A VAL 304.A N ALA 301.A O no hydrogen 3.065 N/A LEU 305.A N ALA 301.A O no hydrogen 3.240 N/A LYS 307.A N VAL 304.A O no hydrogen 2.810 N/A LYS 307.A NZ GLN 303.A O no hydrogen 3.514 N/A LEU 308.A N LEU 305.A O no hydrogen 3.273 N/A SER 309.A N LYS 307.A O no hydrogen 2.731 N/A ILE 312.A N SER 309.A OG no hydrogen 3.153 N/A VAL 313.A N SER 309.A O no hydrogen 2.848 N/A HIS 314.A N SER 310.A O no hydrogen 2.811 N/A GLU 315.A N SER 311.A O no hydrogen 2.930 N/A ILE 316.A N ILE 312.A O no hydrogen 2.964 N/A ASP 317.A N VAL 313.A O no hydrogen 2.996 N/A SER 318.A N HIS 314.A O no hydrogen 3.103 N/A SER 318.A OG HIS 314.A O no hydrogen 3.274 N/A ILE 319.A N GLU 315.A O no hydrogen 3.136 N/A LEU 320.A N ILE 316.A O no hydrogen 2.952 N/A GLY 321.A N ASP 317.A O no hydrogen 2.587 N/A ASN 322.A ND2 MET 184.A O no hydrogen 2.759 N/A