Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3mvl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A N VAL 16.A O no hydrogen 3.257 N/A TYR 5.A OH TYR 20.A O no hydrogen 2.741 N/A GLN 7.A N TRP 14.A O no hydrogen 3.078 N/A LEU 9.A N THR 12.A O no hydrogen 3.033 N/A TRP 14.A N GLN 7.A O no hydrogen 2.693 N/A GLU 15.A N TYR 99.A OH no hydrogen 3.029 N/A VAL 16.A N TYR 5.A O no hydrogen 3.011 N/A GLU 18.A N THR 3.A O no hydrogen 2.726 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 2.828 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 2.711 N/A ARG 19.A NH2 ASP 39.A OD2 no hydrogen 3.084 N/A TYR 20.A N PRO 17.A O no hydrogen 3.242 N/A TYR 20.A OH ASP 84.A OD2 no hydrogen 2.500 N/A GLN 21.A N PHE 38.A O no hydrogen 3.072 N/A SER 33.A N LYS 50.A O no hydrogen 3.078 N/A CYS 35.A N VAL 48.A O no hydrogen 2.606 N/A CYS 35.A SG VAL 34.A O no hydrogen 3.780 N/A ALA 36.A N SER 24.A O no hydrogen 2.980 N/A ALA 37.A N VAL 46.A O no hydrogen 2.897 N/A PHE 38.A N GLN 21.A O no hydrogen 2.757 N/A ASP 39.A N LEU 44.A O no hydrogen 2.904 N/A THR 40.A N ASP 39.A OD1 no hydrogen 2.765 N/A ARG 45.A NH1 ALA 37.A O no hydrogen 2.738 N/A VAL 46.A N ALA 37.A O no hydrogen 2.827 N/A ALA 47.A N THR 102.A O no hydrogen 2.574 N/A VAL 48.A N CYS 35.A O no hydrogen 2.756 N/A LYS 49.A N LEU 100.A O no hydrogen 2.912 N/A LYS 49.A NZ ALA 30.A O no hydrogen 2.703 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 3.246 N/A LYS 49.A NZ GLU 67.A OE2 no hydrogen 2.561 N/A LYS 50.A N SER 33.A O no hydrogen 2.796 N/A LYS 50.A NZ ILE 13.A O no hydrogen 2.776 N/A LEU 51.A N VAL 98.A O no hydrogen 3.148 N/A GLN 56.A N ARG 53.A O no hydrogen 3.085 N/A HIS 60.A N SER 57.A OG no hydrogen 2.835 N/A HIS 60.A ND1 SER 52.A O no hydrogen 2.866 N/A ALA 61.A N SER 57.A O no hydrogen 2.826 N/A LYS 62.A N ILE 58.A O no hydrogen 3.042 N/A LYS 62.A NZ GLU 314.A O no hydrogen 2.644 N/A ARG 63.A N ILE 59.A O no hydrogen 2.875 N/A ARG 63.A N HIS 60.A O no hydrogen 3.161 N/A THR 64.A N HIS 60.A O no hydrogen 2.784 N/A THR 64.A OG1 PRO 54.A O no hydrogen 2.523 N/A THR 64.A OG1 HIS 60.A O no hydrogen 2.545 N/A TYR 65.A N ALA 61.A O no hydrogen 3.376 N/A ARG 66.A N LYS 62.A O no hydrogen 3.439 N/A GLU 67.A N ARG 63.A O no hydrogen 3.510 N/A LEU 68.A N THR 64.A O no hydrogen 3.398 N/A ARG 69.A N TYR 65.A O no hydrogen 3.310 N/A ARG 69.A N ARG 66.A O no hydrogen 3.252 N/A ARG 69.A NH2 ASP 310.A OD1 no hydrogen 3.454 N/A LEU 70.A N ARG 66.A O no hydrogen 3.065 N/A LEU 70.A N GLU 67.A O no hydrogen 2.657 N/A LEU 71.A N GLU 67.A O no hydrogen 3.101 N/A LYS 72.A NZ GLU 330.A O no hydrogen 2.923 N/A LYS 72.A NZ GLU 330.A OE1 no hydrogen 2.985 N/A LYS 72.A NZ SER 333.A OG no hydrogen 3.388 N/A HIS 73.A N LEU 70.A O no hydrogen 3.239 N/A HIS 73.A NE2 ASP 307.A O no hydrogen 2.500 N/A MET 74.A N LEU 70.A O no hydrogen 3.009 N/A LYS 75.A N TYR 136.A OH no hydrogen 2.886 N/A ASN 78.A ND2 LEU 160.A O no hydrogen 3.662 N/A VAL 79.A N HIS 76.A O no hydrogen 2.824 N/A ILE 80.A N ILE 162.A O no hydrogen 3.179 N/A LEU 83.A N VAL 101.A O no hydrogen 2.743 N/A ASP 84.A N VAL 101.A O no hydrogen 3.410 N/A PHE 86.A N TYR 99.A O no hydrogen 2.894 N/A THR 87.A OG1 ASP 97.A O no hydrogen 2.899 N/A ARG 90.A N GLU 94.A OE2 no hydrogen 3.340 N/A GLU 93.A N GLU 93.A OE1 no hydrogen 2.762 N/A PHE 95.A N SER 91.A O no hydrogen 3.373 N/A ASN 96.A ND2 GLU 94.A O no hydrogen 2.645 N/A TYR 99.A N PHE 86.A O no hydrogen 3.082 N/A LEU 100.A N LYS 49.A O no hydrogen 3.071 N/A VAL 101.A N ASP 84.A O no hydrogen 2.731 N/A THR 102.A N ALA 47.A O no hydrogen 3.080 N/A THR 102.A OG1 GLY 81.A O no hydrogen 3.238 N/A LEU 104.A N ARG 45.A O no hydrogen 2.621 N/A GLY 106.A N VAL 154.A O no hydrogen 2.818 N/A ALA 107.A N VAL 154.A O no hydrogen 3.116 N/A LEU 109.A N LEU 152.A O no hydrogen 2.806 N/A ASN 110.A N ASP 108.A OD1 no hydrogen 3.211 N/A ASN 111.A N ASP 108.A O no hydrogen 2.839 N/A ASN 111.A N ASP 108.A OD1 no hydrogen 3.137 N/A ILE 112.A N ASP 108.A O no hydrogen 3.012 N/A VAL 113.A N LEU 109.A O no hydrogen 3.270 N/A CYS 115.A N ILE 112.A O no hydrogen 3.303 N/A CYS 115.A SG ASN 111.A O no hydrogen 3.631 N/A GLN 116.A NE2 LYS 114.A O no hydrogen 2.810 N/A LYS 117.A NZ LEU 203.A O no hydrogen 2.748 N/A LEU 118.A N LEU 202.A O no hydrogen 3.388 N/A VAL 123.A N THR 119.A O no hydrogen 3.248 N/A GLN 124.A NE2 ASP 120.A O no hydrogen 3.482 N/A PHE 125.A N ASP 121.A O no hydrogen 3.140 N/A LEU 126.A N HIS 122.A O no hydrogen 2.942 N/A ILE 127.A N VAL 123.A O no hydrogen 2.944 N/A TYR 128.A N GLN 124.A O no hydrogen 3.151 N/A TYR 128.A OH GLU 303.A OE2 no hydrogen 2.601 N/A GLN 129.A N PHE 125.A O no hydrogen 3.458 N/A GLN 129.A NE2 PHE 125.A O no hydrogen 3.289 N/A GLN 129.A NE2 CYS 158.A O no hydrogen 2.779 N/A ILE 130.A N LEU 126.A O no hydrogen 3.026 N/A LEU 131.A N ILE 127.A O no hydrogen 2.957 N/A ARG 132.A N TYR 128.A O no hydrogen 2.793 N/A ARG 132.A NE ASP 302.A O no hydrogen 2.673 N/A ARG 132.A NH1 GLU 77.A OE1 no hydrogen 2.764 N/A ARG 132.A NH1 ASN 78.A OD1 no hydrogen 2.988 N/A ARG 132.A NH2 GLU 77.A OE1 no hydrogen 2.807 N/A ARG 132.A NH2 ASP 302.A O no hydrogen 2.845 N/A GLY 133.A N GLN 129.A O no hydrogen 3.081 N/A LEU 134.A N ILE 130.A O no hydrogen 2.918 N/A LYS 135.A N LEU 131.A O no hydrogen 2.901 N/A LYS 135.A NZ GLU 303.A O no hydrogen 2.715 N/A TYR 136.A N GLY 133.A O no hydrogen 3.079 N/A TYR 136.A OH HIS 73.A O no hydrogen 2.983 N/A ILE 137.A N GLY 133.A O no hydrogen 3.305 N/A HIS 138.A N LEU 134.A O no hydrogen 2.818 N/A HIS 138.A ND1 ILE 142.A O no hydrogen 2.834 N/A SER 139.A N LYS 135.A O no hydrogen 3.388 N/A SER 139.A OG LYS 135.A O no hydrogen 3.414 N/A SER 139.A OG TYR 136.A O no hydrogen 3.265 N/A ASP 141.A N HIS 138.A O no hydrogen 2.721 N/A HIS 144.A N ASP 191.A OD2 no hydrogen 2.684 N/A HIS 144.A NE2 LEU 163.A O no hydrogen 2.586 N/A ARG 145.A N ASP 191.A OD1 no hydrogen 3.157 N/A ARG 145.A NE ALA 168.A O no hydrogen 2.758 N/A LYS 148.A N ASN 151.A OD1 no hydrogen 3.134 N/A LYS 148.A NZ ASP 146.A OD1 no hydrogen 2.785 N/A LYS 148.A NZ ASP 146.A OD2 no hydrogen 2.680 N/A ASN 151.A N LYS 148.A O no hydrogen 3.034 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.740 N/A LEU 152.A N PRO 149.A O no hydrogen 3.110 N/A ALA 153.A N LYS 161.A O no hydrogen 2.842 N/A VAL 154.A N ALA 107.A O no hydrogen 2.765 N/A ASN 155.A N GLU 159.A O no hydrogen 3.021 N/A CYS 158.A N ASN 155.A O no hydrogen 3.100 N/A LEU 160.A N GLN 129.A OE1 no hydrogen 2.863 N/A LYS 161.A N ALA 153.A O no hydrogen 2.794 N/A LYS 161.A NZ GLU 77.A O no hydrogen 2.556 N/A ILE 162.A N ASN 78.A O no hydrogen 3.182 N/A LEU 163.A N ASN 151.A O no hydrogen 2.753 N/A ARG 169.A NH1 GLY 166.A O no hydrogen 3.344 N/A ARG 169.A NH1 ALA 168.A O no hydrogen 2.694 N/A TRP 173.A NE1 GLY 211.A O no hydrogen 2.949 N/A TYR 174.A N THR 171.A O no hydrogen 3.403 N/A TYR 174.A OH GLU 201.A OE1 no hydrogen 3.409 N/A ARG 175.A N ARG 172.A O no hydrogen 3.121 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.936 N/A MET 180.A N PRO 177.A O no hydrogen 3.225 N/A LEU 181.A N PRO 177.A O no hydrogen 2.810 N/A TRP 183.A N GLU 178.A O no hydrogen 3.324 N/A GLN 188.A NE2 HIS 138.A O no hydrogen 2.563 N/A THR 189.A OG1 ASN 187.A OD1 no hydrogen 2.764 N/A THR 189.A OG1 SER 279.A O no hydrogen 3.190 N/A SER 194.A OG LEU 147.A O no hydrogen 3.448 N/A SER 194.A OG TYR 174.A O no hydrogen 2.760 N/A SER 194.A OG VAL 190.A O no hydrogen 3.402 N/A VAL 195.A N ASP 191.A O no hydrogen 2.961 N/A CYS 197.A N TRP 193.A O no hydrogen 3.290 N/A CYS 197.A N SER 194.A O no hydrogen 3.101 N/A CYS 197.A SG TRP 193.A O no hydrogen 3.264 N/A ILE 198.A N SER 194.A O no hydrogen 2.920 N/A MET 199.A N VAL 195.A O no hydrogen 2.606 N/A LEU 202.A N ILE 198.A O no hydrogen 2.955 N/A LEU 203.A N MET 199.A O no hydrogen 3.089 N/A THR 204.A OG1 ALA 200.A O no hydrogen 3.254 N/A GLY 205.A N GLU 201.A O no hydrogen 2.841 N/A GLY 211.A N PHE 209.A O no hydrogen 2.826 N/A THR 212.A N ASP 216.A OD2 no hydrogen 3.210 N/A THR 212.A OG1 ASP 216.A OD2 no hydrogen 3.052 N/A ILE 215.A N ASP 213.A OD1 no hydrogen 3.300 N/A ASP 216.A N ASP 213.A OD2 no hydrogen 2.835 N/A GLN 217.A N ASP 213.A O no hydrogen 2.918 N/A GLN 217.A NE2 PHE 209.A O no hydrogen 3.295 N/A LYS 219.A N ILE 215.A O no hydrogen 3.132 N/A LEU 220.A N ASP 216.A O no hydrogen 2.987 N/A ILE 221.A N GLN 217.A O no hydrogen 2.999 N/A LEU 222.A N LEU 218.A O no hydrogen 3.008 N/A ARG 223.A N LYS 219.A O no hydrogen 3.137 N/A LEU 224.A N ILE 221.A O no hydrogen 3.139 N/A VAL 225.A N ILE 221.A O no hydrogen 3.111 N/A GLY 226.A N LEU 222.A O no hydrogen 2.786 N/A THR 227.A OG1 MET 251.A O no hydrogen 3.370 N/A LEU 233.A N GLY 229.A O no hydrogen 3.205 N/A LYS 235.A N LEU 232.A O no hydrogen 2.839 N/A LYS 235.A NZ ASP 278.A OD1 no hydrogen 2.836 N/A LYS 235.A NZ ASP 278.A OD2 no hydrogen 3.552 N/A SER 237.A N TRP 183.A O no hydrogen 3.503 N/A ARG 242.A N SER 238.A O no hydrogen 2.533 N/A ARG 242.A NH2 GLU 239.A OE2 no hydrogen 3.435 N/A ILE 245.A N ALA 241.A O no hydrogen 2.981 N/A SER 247.A OG ASN 243.A O no hydrogen 3.469 N/A SER 247.A OG TYR 244.A O no hydrogen 2.718 N/A LEU 248.A N ILE 245.A O no hydrogen 2.787 N/A LYS 253.A NZ GLU 272.A OE2 no hydrogen 3.031 N/A MET 254.A N LEU 224.A O no hydrogen 3.402 N/A PHE 256.A N GLU 272.A OE1 no hydrogen 3.450 N/A ALA 257.A N ASN 255.A OD1 no hydrogen 3.435 N/A PHE 260.A N PHE 256.A O no hydrogen 3.065 N/A ASN 264.A ND2 ASP 120.A OD2 no hydrogen 3.041 N/A LEU 266.A N ASN 264.A OD1 no hydrogen 2.786 N/A ALA 267.A N ASN 264.A O no hydrogen 2.785 N/A VAL 268.A N ASN 264.A O no hydrogen 3.373 N/A ASP 269.A N PRO 265.A O no hydrogen 3.145 N/A LEU 270.A N LEU 266.A O no hydrogen 3.074 N/A LEU 271.A N ALA 267.A O no hydrogen 2.887 N/A GLU 272.A N VAL 268.A O no hydrogen 3.073 N/A LYS 273.A N ASP 269.A O no hydrogen 3.268 N/A LYS 273.A NZ ASP 269.A OD1 no hydrogen 3.163 N/A MET 274.A N LEU 271.A O no hydrogen 2.806 N/A LEU 275.A N LEU 271.A O no hydrogen 3.115 N/A LEU 275.A N GLU 272.A O no hydrogen 3.332 N/A ARG 282.A N ASP 278.A O no hydrogen 2.946 N/A ARG 282.A NE VAL 276.A O no hydrogen 2.736 N/A ARG 282.A NH1 THR 189.A O no hydrogen 2.876 N/A ARG 282.A NH2 GLU 178.A OE1 no hydrogen 2.632 N/A ARG 282.A NH2 VAL 276.A O no hydrogen 3.120 N/A ILE 283.A N LYS 273.A O no hydrogen 3.425 N/A THR 284.A N GLN 287.A OE1 no hydrogen 2.728 N/A THR 284.A OG1 GLN 287.A OE1 no hydrogen 3.207 N/A ALA 288.A N THR 284.A O no hydrogen 2.822 N/A ALA 290.A N GLN 287.A O no hydrogen 3.169 N/A TYR 293.A N HIS 291.A ND1 no hydrogen 3.466 N/A TYR 293.A OH ASP 120.A OD1 no hydrogen 2.993 N/A TYR 293.A OH ASP 120.A OD2 no hydrogen 3.339 N/A PHE 294.A N HIS 291.A O no hydrogen 2.797 N/A ALA 295.A N ALA 292.A O no hydrogen 2.999 N/A GLN 296.A NE2 GLN 124.A OE1 no hydrogen 2.783 N/A TYR 297.A OH ASP 121.A OD1 no hydrogen 2.542 N/A HIS 298.A N PHE 294.A O no hydrogen 2.791 N/A HIS 298.A ND1 GLU 303.A OE2 no hydrogen 2.678 N/A ASP 299.A N GLU 303.A OE2 no hydrogen 3.499 N/A ASP 301.A N ASP 299.A OD1 no hydrogen 3.352 N/A ASP 302.A N ASP 299.A O no hydrogen 3.059 N/A ALA 306.A N SER 139.A OG no hydrogen 3.090 N/A SER 312.A N ASP 310.A OD1 no hydrogen 3.144 N/A SER 312.A OG ASP 310.A OD1 no hydrogen 2.510 N/A SER 312.A OG ASP 310.A OD2 no hydrogen 3.379 N/A GLU 314.A N GLN 311.A O no hydrogen 2.800 N/A SER 315.A OG SER 312.A O no hydrogen 3.552 N/A LEU 319.A N GLU 322.A OE1 no hydrogen 3.360 N/A TRP 323.A N LEU 319.A O no hydrogen 3.056 N/A LYS 324.A N ILE 320.A O no hydrogen 2.723 N/A LYS 324.A NZ ASN 96.A OD1 no hydrogen 3.408 N/A SER 325.A N ASP 321.A O no hydrogen 2.864 N/A SER 325.A N GLU 322.A O no hydrogen 3.101 N/A LEU 326.A N GLU 322.A O no hydrogen 2.969 N/A THR 327.A N TRP 323.A O no hydrogen 3.006 N/A THR 327.A OG1 TRP 323.A O no hydrogen 2.717 N/A TYR 328.A N LYS 324.A O no hydrogen 3.232 N/A ASP 329.A N SER 325.A O no hydrogen 2.767 N/A GLU 330.A N LEU 326.A O no hydrogen 3.003 N/A VAL 331.A N THR 327.A O no hydrogen 2.700 N/A ILE 332.A N TYR 328.A O no hydrogen 2.980 N/A SER 333.A N ASP 329.A O no hydrogen 3.271 N/A SER 333.A OG ASP 329.A O no hydrogen 2.619 N/A SER 333.A OG GLU 330.A O no hydrogen 3.354 N/A PHE 334.A N VAL 331.A O no hydrogen 3.468 N/A