Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4d6v_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 3.A N VAL 312.A O no hydrogen 2.599 N/A MET 5.A N ALA 310.A O no hydrogen 3.057 N/A LYS 7.A N VAL 308.A O no hydrogen 2.680 N/A LEU 10.A N VAL 306.A O no hydrogen 2.786 N/A HIS 13.A ND1 ASP 36.A OD2 no hydrogen 2.825 N/A HIS 13.A NE2 THR 32.A OG1 no hydrogen 2.678 N/A ASN 14.A N ASP 36.A OD2 no hydrogen 2.817 N/A VAL 17.A N PHE 301.A O no hydrogen 3.393 N/A THR 18.A N ALA 33.A O no hydrogen 2.854 N/A THR 18.A OG1 VAL 65.A O no hydrogen 2.570 N/A ALA 21.A N LEU 31.A O no hydrogen 2.792 N/A THR 22.A OG1 TRP 290.A O no hydrogen 3.445 N/A ASN 26.A N SER 23.A OG no hydrogen 3.301 N/A ASP 28.A N ASN 26.A OD1 no hydrogen 3.086 N/A MET 29.A N ASN 26.A O no hydrogen 3.283 N/A ILE 30.A N TRP 42.A O no hydrogen 3.192 N/A LEU 31.A N ALA 21.A O no hydrogen 2.937 N/A THR 32.A N ILE 40.A O no hydrogen 2.941 N/A THR 32.A OG1 HIS 13.A NE2 no hydrogen 2.678 N/A THR 32.A OG1 ILE 40.A O no hydrogen 3.510 N/A ALA 33.A N ALA 19.A O no hydrogen 2.815 N/A SER 34.A N THR 38.A O no hydrogen 3.150 N/A SER 34.A OG GLY 15.A O no hydrogen 2.820 N/A SER 34.A OG TRP 16.A O no hydrogen 2.872 N/A ARG 35.A N TRP 16.A O no hydrogen 2.887 N/A ASP 36.A N SER 34.A OG no hydrogen 3.070 N/A LYS 37.A N SER 34.A O no hydrogen 3.085 N/A THR 38.A N ASP 36.A OD1 no hydrogen 2.812 N/A THR 38.A OG1 ASP 36.A OD1 no hydrogen 2.615 N/A VAL 39.A N LEU 58.A O no hydrogen 3.428 N/A ILE 40.A N THR 32.A O no hydrogen 2.877 N/A ALA 41.A N LYS 56.A O no hydrogen 2.922 N/A TRP 42.A N ILE 30.A O no hydrogen 2.826 N/A TRP 42.A NE1 THR 32.A OG1 no hydrogen 2.801 N/A GLN 43.A N PHE 53.A O no hydrogen 2.999 N/A LEU 44.A N ASP 28.A O no hydrogen 2.757 N/A THR 45.A N TYR 51.A O no hydrogen 2.882 N/A THR 45.A OG1 TYR 51.A O no hydrogen 3.200 N/A ARG 46.A N TYR 51.A O no hydrogen 2.786 N/A ARG 46.A NH1 ASP 28.A OD1 no hydrogen 2.368 N/A ARG 46.A NH2 PRO 27.A O no hydrogen 3.141 N/A GLU 47.A N THR 45.A OG1 no hydrogen 3.337 N/A ASP 48.A N GLU 47.A OE1 no hydrogen 2.319 N/A PHE 53.A N GLN 43.A O no hydrogen 3.128 N/A LYS 55.A N ALA 41.A O no hydrogen 2.744 N/A LYS 55.A NZ GLN 43.A OE1 no hydrogen 3.055 N/A LYS 56.A N ALA 41.A O no hydrogen 3.234 N/A LEU 58.A N VAL 39.A O no hydrogen 2.781 N/A HIS 61.A ND1 ASP 83.A OD2 no hydrogen 3.105 N/A HIS 61.A NE2 SER 79.A OG no hydrogen 2.610 N/A ASN 62.A N ASP 83.A OD2 no hydrogen 2.834 N/A PHE 64.A N HIS 63.A ND1 no hydrogen 2.720 N/A VAL 65.A N SER 34.A O no hydrogen 3.018 N/A SER 66.A N SER 80.A O no hydrogen 2.965 N/A SER 66.A OG SER 80.A O no hydrogen 3.436 N/A SER 66.A OG SER 80.A OG no hydrogen 3.009 N/A SER 66.A OG VAL 107.A O no hydrogen 2.651 N/A VAL 68.A N ASP 67.A OD1 no hydrogen 2.770 N/A ALA 69.A N LEU 78.A O no hydrogen 2.822 N/A SER 71.A N PHE 76.A O no hydrogen 2.838 N/A SER 71.A OG ASP 73.A OD1 no hydrogen 2.686 N/A SER 71.A OG PHE 76.A O no hydrogen 3.237 N/A SER 72.A N ASN 116.A OD1 no hydrogen 2.694 N/A SER 72.A OG ASN 116.A OD1 no hydrogen 3.258 N/A GLY 74.A N SER 71.A O no hydrogen 2.834 N/A GLN 75.A N ASP 73.A OD1 no hydrogen 2.855 N/A GLN 75.A NE2 ASN 92.A OD1 no hydrogen 3.243 N/A PHE 76.A N SER 71.A OG no hydrogen 2.918 N/A ALA 77.A N TRP 89.A O no hydrogen 2.931 N/A LEU 78.A N ALA 69.A O no hydrogen 2.849 N/A SER 79.A N ARG 87.A O no hydrogen 2.958 N/A SER 79.A OG HIS 61.A NE2 no hydrogen 2.610 N/A SER 80.A N ASP 67.A O no hydrogen 3.088 N/A SER 80.A OG SER 66.A OG no hydrogen 3.009 N/A SER 81.A N THR 85.A O no hydrogen 3.098 N/A SER 81.A OG HIS 63.A O no hydrogen 3.234 N/A SER 81.A OG PHE 64.A O no hydrogen 2.961 N/A TRP 82.A N PHE 64.A O no hydrogen 2.928 N/A ASP 83.A N SER 81.A OG no hydrogen 2.990 N/A HIS 84.A N SER 81.A O no hydrogen 3.124 N/A HIS 84.A ND1 TRP 82.A O no hydrogen 3.242 N/A THR 85.A N ASP 83.A OD1 no hydrogen 3.020 N/A THR 85.A OG1 ASP 83.A OD1 no hydrogen 2.648 N/A LEU 86.A N PHE 100.A O no hydrogen 3.239 N/A ARG 87.A N SER 79.A O no hydrogen 2.914 N/A ARG 87.A NH1 THR 96.A OG1 no hydrogen 2.910 N/A LEU 88.A N LYS 98.A O no hydrogen 2.949 N/A TRP 89.A N ALA 77.A O no hydrogen 2.721 N/A ASP 90.A N LEU 95.A O no hydrogen 2.938 N/A LEU 91.A N GLN 75.A O no hydrogen 2.902 N/A ASN 92.A N ASP 90.A OD1 no hydrogen 2.843 N/A THR 93.A N ASP 90.A OD1 no hydrogen 2.896 N/A THR 93.A OG1 ASP 90.A O no hydrogen 3.511 N/A GLY 94.A N ASP 90.A O no hydrogen 2.678 N/A LEU 95.A N THR 93.A OG1 no hydrogen 3.229 N/A THR 97.A N LEU 88.A O no hydrogen 2.719 N/A THR 97.A OG1 LEU 88.A O no hydrogen 3.037 N/A PHE 100.A N LEU 86.A O no hydrogen 2.882 N/A HIS 103.A ND1 ASP 125.A OD2 no hydrogen 2.798 N/A HIS 103.A NE2 SER 121.A OG no hydrogen 2.810 N/A THR 104.A N ASP 125.A OD2 no hydrogen 2.917 N/A VAL 107.A N SER 81.A O no hydrogen 3.177 N/A LEU 108.A N ALA 122.A O no hydrogen 2.900 N/A SER 109.A N ALA 122.A O no hydrogen 3.390 N/A SER 109.A OG ASP 67.A OD2 no hydrogen 3.475 N/A VAL 110.A N ASP 67.A OD2 no hydrogen 3.090 N/A SER 111.A N VAL 120.A O no hydrogen 2.879 N/A SER 111.A OG PHE 112.A O no hydrogen 3.499 N/A SER 113.A N GLN 118.A O no hydrogen 2.939 N/A SER 113.A OG ASP 115.A OD1 no hydrogen 2.662 N/A SER 113.A OG GLN 118.A O no hydrogen 3.115 N/A ASN 116.A N SER 113.A O no hydrogen 2.794 N/A ASN 116.A ND2 SER 113.A O no hydrogen 2.769 N/A ARG 117.A N ASP 115.A OD1 no hydrogen 3.512 N/A GLN 118.A N SER 113.A OG no hydrogen 2.973 N/A ILE 119.A N TRP 131.A O no hydrogen 3.136 N/A VAL 120.A N SER 111.A O no hydrogen 2.949 N/A SER 121.A N LYS 129.A O no hydrogen 3.060 N/A SER 121.A OG HIS 103.A NE2 no hydrogen 2.810 N/A ALA 122.A N SER 109.A O no hydrogen 3.090 N/A SER 123.A N SER 127.A O no hydrogen 3.358 N/A SER 123.A OG ASP 106.A O no hydrogen 2.770 N/A ARG 124.A N ASP 106.A O no hydrogen 2.694 N/A ARG 124.A NH1 ASP 106.A OD2 no hydrogen 2.602 N/A ASP 125.A N SER 123.A OG no hydrogen 3.115 N/A ARG 126.A N SER 123.A O no hydrogen 3.096 N/A SER 127.A N ASP 125.A OD1 no hydrogen 2.854 N/A SER 127.A OG ASP 125.A OD1 no hydrogen 2.570 N/A SER 127.A OG ASP 125.A OD2 no hydrogen 3.444 N/A ILE 128.A N ILE 141.A O no hydrogen 3.308 N/A LYS 129.A N SER 121.A O no hydrogen 2.979 N/A LYS 129.A NZ ASP 140.A OD1 no hydrogen 2.716 N/A LYS 129.A NZ ASP 140.A OD2 no hydrogen 3.322 N/A LEU 130.A N PHE 139.A O no hydrogen 3.016 N/A TRP 131.A N ILE 119.A O no hydrogen 2.813 N/A ASN 132.A N GLU 136.A O no hydrogen 3.077 N/A ASN 132.A ND2 GLU 136.A OE1 no hydrogen 3.264 N/A LEU 134.A N ASN 132.A OD1 no hydrogen 2.724 N/A GLY 135.A N ASN 132.A O no hydrogen 3.349 N/A GLU 136.A N ASN 132.A OD1 no hydrogen 3.181 N/A CYS 137.A SG LEU 130.A O no hydrogen 4.029 N/A CYS 137.A SG PHE 139.A O no hydrogen 3.727 N/A LYS 138.A N LEU 130.A O no hydrogen 2.543 N/A LYS 138.A NZ GLU 136.A OE1 no hydrogen 3.559 N/A PHE 139.A N LEU 130.A O no hydrogen 3.297 N/A ILE 141.A N ILE 128.A O no hydrogen 2.678 N/A GLY 145.A N VAL 142.A O no hydrogen 2.739 N/A HIS 146.A ND1 ASP 170.A OD1 no hydrogen 3.132 N/A HIS 146.A ND1 ASP 170.A OD2 no hydrogen 3.111 N/A HIS 146.A NE2 SER 166.A OG no hydrogen 2.706 N/A THR 147.A N ASP 170.A OD2 no hydrogen 3.395 N/A VAL 150.A N SER 123.A O no hydrogen 3.318 N/A SER 151.A N ALA 167.A O no hydrogen 2.965 N/A SER 151.A OG ALA 167.A O no hydrogen 3.180 N/A SER 151.A OG LEU 194.A O no hydrogen 2.553 N/A CYS 152.A N ALA 167.A O no hydrogen 3.409 N/A CYS 152.A SG LEU 197.A O no hydrogen 3.642 N/A VAL 153.A N SER 109.A OG no hydrogen 3.178 N/A ARG 154.A N ILE 165.A O no hydrogen 2.884 N/A ARG 154.A NH1 ASP 67.A OD2 no hydrogen 3.303 N/A ARG 154.A NH1 VAL 153.A O no hydrogen 2.957 N/A ARG 154.A NH2 ASP 67.A OD2 no hydrogen 3.141 N/A SER 156.A N VAL 163.A O no hydrogen 3.214 N/A ASN 158.A N SER 156.A OG no hydrogen 3.126 N/A ASN 158.A ND2 ASP 202.A O no hydrogen 3.490 N/A ALA 160.A N ASN 158.A OD1 no hydrogen 2.898 N/A LEU 161.A N ASN 158.A OD1 no hydrogen 3.383 N/A ILE 164.A N TRP 176.A O no hydrogen 2.917 N/A ILE 165.A N ARG 154.A O no hydrogen 2.809 N/A SER 166.A N LYS 174.A O no hydrogen 2.853 N/A SER 166.A OG HIS 146.A NE2 no hydrogen 2.706 N/A ALA 167.A N CYS 152.A O no hydrogen 2.897 N/A GLY 168.A N THR 172.A O no hydrogen 3.282 N/A TRP 169.A N TRP 149.A O no hydrogen 2.851 N/A LYS 171.A N GLY 168.A O no hydrogen 3.275 N/A THR 172.A N ASP 170.A OD1 no hydrogen 3.092 N/A THR 172.A OG1 ASP 170.A OD1 no hydrogen 3.205 N/A THR 172.A OG1 ASP 170.A OD2 no hydrogen 3.409 N/A VAL 173.A N HIS 187.A O no hydrogen 3.141 N/A LYS 174.A N SER 166.A O no hydrogen 2.771 N/A LYS 174.A NZ ASP 144.A O no hydrogen 2.989 N/A LYS 174.A NZ THR 186.A OG1 no hydrogen 3.080 N/A VAL 175.A N THR 185.A O no hydrogen 2.883 N/A TRP 176.A N ILE 164.A O no hydrogen 2.839 N/A TRP 176.A NE1 SER 166.A OG no hydrogen 2.915 N/A GLU 177.A N LYS 182.A O no hydrogen 3.051 N/A LEU 178.A N PRO 162.A O no hydrogen 2.943 N/A CYS 181.A N GLU 177.A O no hydrogen 2.777 N/A CYS 181.A SG LEU 178.A O no hydrogen 4.018 N/A LYS 182.A N ASN 180.A OD1 no hydrogen 3.027 N/A LYS 184.A N VAL 175.A O no hydrogen 2.707 N/A THR 185.A N VAL 175.A O no hydrogen 3.215 N/A HIS 187.A N VAL 173.A O no hydrogen 2.693 N/A HIS 187.A NE2 GLY 223.A O no hydrogen 3.031 N/A HIS 190.A ND1 ASP 212.A OD2 no hydrogen 3.254 N/A HIS 190.A NE2 SER 208.A OG no hydrogen 2.649 N/A THR 191.A N ASP 212.A OD2 no hydrogen 3.029 N/A THR 191.A OG1 ASP 212.A OD2 no hydrogen 3.502 N/A GLY 192.A N ASP 212.A OD2 no hydrogen 3.254 N/A LEU 194.A N GLY 168.A O no hydrogen 3.244 N/A ASN 195.A N GLY 209.A O no hydrogen 2.955 N/A ASN 195.A ND2 ILE 235.A O no hydrogen 2.919 N/A THR 196.A N GLY 209.A O no hydrogen 3.225 N/A ALA 198.A N ALA 207.A O no hydrogen 2.909 N/A SER 200.A N LEU 205.A O no hydrogen 2.788 N/A SER 200.A OG ASP 202.A OD1 no hydrogen 2.857 N/A GLY 203.A N SER 200.A O no hydrogen 2.909 N/A SER 204.A N ASP 202.A OD1 no hydrogen 3.147 N/A SER 204.A OG ASP 202.A OD1 no hydrogen 2.525 N/A SER 204.A OG ASP 202.A OD2 no hydrogen 2.893 N/A ALA 206.A N TRP 218.A O no hydrogen 3.084 N/A ALA 207.A N ALA 198.A O no hydrogen 2.813 N/A SER 208.A N MET 216.A O no hydrogen 3.101 N/A SER 208.A OG HIS 190.A NE2 no hydrogen 2.649 N/A GLY 209.A N THR 196.A O no hydrogen 3.145 N/A LYS 211.A N TYR 193.A O no hydrogen 2.855 N/A ILE 214.A N ASP 212.A OD1 no hydrogen 3.072 N/A THR 215.A N LEU 229.A O no hydrogen 2.818 N/A THR 215.A OG1 SER 208.A O no hydrogen 3.551 N/A MET 216.A N SER 208.A O no hydrogen 3.065 N/A LEU 217.A N TYR 227.A O no hydrogen 2.921 N/A TRP 218.A N ALA 206.A O no hydrogen 2.854 N/A TRP 218.A NE1 SER 208.A OG no hydrogen 2.928 N/A ASP 219.A N LYS 224.A O no hydrogen 2.966 N/A LEU 220.A N SER 204.A O no hydrogen 2.838 N/A GLU 222.A N ASP 219.A OD1 no hydrogen 2.727 N/A HIS 225.A NE2 SER 228.A OG no hydrogen 2.728 N/A LEU 226.A N LEU 217.A O no hydrogen 2.845 N/A SER 228.A OG HIS 225.A NE2 no hydrogen 2.728 N/A LEU 229.A N THR 215.A O no hydrogen 2.766 N/A VAL 234.A N ASP 233.A OD1 no hydrogen 2.623 N/A ILE 235.A N GLY 210.A O no hydrogen 2.756 N/A ASN 236.A N ALA 250.A O no hydrogen 2.688 N/A ASN 236.A ND2 GLU 284.A OE1 no hydrogen 3.098 N/A ALA 237.A N ALA 250.A O no hydrogen 3.197 N/A LEU 238.A N THR 196.A OG1 no hydrogen 3.309 N/A VAL 239.A N CYS 248.A O no hydrogen 3.068 N/A SER 241.A N TRP 246.A O no hydrogen 3.153 N/A ASN 243.A N SER 241.A OG no hydrogen 3.280 N/A ASN 243.A ND2 GLN 295.A OE1 no hydrogen 3.129 N/A ARG 244.A N SER 241.A OG no hydrogen 3.060 N/A ARG 244.A NH2 GLN 295.A OE1 no hydrogen 2.936 N/A TRP 246.A N ARG 244.A O no hydrogen 2.842 N/A LEU 247.A N PHE 258.A O no hydrogen 3.004 N/A CYS 248.A N VAL 239.A O no hydrogen 2.922 N/A CYS 248.A SG VAL 239.A O no hydrogen 3.913 N/A ALA 249.A N LYS 256.A O no hydrogen 2.716 N/A ALA 250.A N ALA 237.A O no hydrogen 2.774 N/A THR 251.A N SER 254.A O no hydrogen 2.781 N/A THR 251.A OG1 SER 254.A O no hydrogen 3.077 N/A ALA 252.A N VAL 234.A O no hydrogen 3.109 N/A SER 253.A N THR 251.A OG1 no hydrogen 3.107 N/A SER 254.A N THR 251.A OG1 no hydrogen 3.040 N/A SER 254.A OG ASP 268.A OD1 no hydrogen 3.105 N/A ILE 255.A N LEU 269.A O no hydrogen 3.037 N/A LYS 256.A N ALA 249.A O no hydrogen 2.952 N/A LYS 256.A NZ ASP 268.A OD2 no hydrogen 2.623 N/A ILE 257.A N ASP 267.A O no hydrogen 2.980 N/A PHE 258.A N LEU 247.A O no hydrogen 2.732 N/A ASP 259.A N SER 264.A O no hydrogen 2.763 N/A LEU 260.A N TYR 245.A O no hydrogen 3.068 N/A SER 262.A N ASP 259.A OD2 no hydrogen 2.579 N/A SER 262.A OG ASP 259.A OD2 no hydrogen 2.761 N/A LYS 263.A N ASP 259.A O no hydrogen 2.674 N/A SER 264.A N SER 262.A OG no hydrogen 3.373 N/A VAL 266.A N ILE 257.A O no hydrogen 2.778 N/A ASP 268.A N ASP 267.A OD1 no hydrogen 2.918 N/A LEU 269.A N ILE 255.A O no hydrogen 2.748 N/A GLN 270.A NE2 SER 253.A O no hydrogen 3.476 N/A SER 277.A OG SER 277.A O no hydrogen 2.384 N/A GLU 284.A N SER 302.A OG no hydrogen 2.707 N/A CYS 285.A SG SER 287.A O no hydrogen 3.280 N/A CYS 285.A SG GLY 300.A O no hydrogen 3.405 N/A THR 286.A N GLY 300.A O no hydrogen 2.830 N/A THR 286.A OG1 VAL 17.A O no hydrogen 2.593 N/A THR 286.A OG1 GLY 300.A O no hydrogen 3.555 N/A SER 287.A N GLY 300.A O no hydrogen 3.363 N/A SER 287.A OG VAL 17.A O no hydrogen 3.111 N/A ALA 289.A N PHE 298.A O no hydrogen 2.900 N/A SER 291.A N THR 296.A O no hydrogen 2.800 N/A SER 291.A OG ASP 293.A OD1 no hydrogen 2.636 N/A SER 291.A OG THR 296.A O no hydrogen 3.521 N/A GLY 294.A N SER 291.A O no hydrogen 2.892 N/A GLN 295.A N ASP 293.A OD1 no hydrogen 3.226 N/A THR 296.A N SER 291.A OG no hydrogen 3.084 N/A LEU 297.A N TRP 309.A O no hydrogen 2.798 N/A PHE 298.A N ALA 289.A O no hydrogen 2.737 N/A ALA 299.A N ARG 307.A O no hydrogen 2.936 N/A GLY 300.A N SER 287.A O no hydrogen 2.902 N/A PHE 301.A N LEU 305.A O no hydrogen 2.954 N/A SER 302.A N GLU 284.A O no hydrogen 2.818 N/A SER 302.A OG GLU 284.A O no hydrogen 3.358 N/A ASN 304.A N PHE 301.A O no hydrogen 3.047 N/A LEU 305.A N ASP 303.A OD1 no hydrogen 3.295 N/A VAL 306.A N LEU 10.A O no hydrogen 3.181 N/A ARG 307.A N ALA 299.A O no hydrogen 2.679 N/A ARG 307.A NH1 ASP 303.A OD1 no hydrogen 3.039 N/A ARG 307.A NH1 ASP 303.A OD2 no hydrogen 3.044 N/A ARG 307.A NH2 ASP 303.A OD2 no hydrogen 2.794 N/A VAL 308.A N GLY 8.A O no hydrogen 2.845 N/A TRP 309.A N LEU 297.A O no hydrogen 2.995 N/A ALA 310.A N MET 5.A O no hydrogen 2.917 N/A VAL 311.A N GLN 295.A O no hydrogen 2.873 N/A VAL 312.A N HIS 3.A O no hydrogen 2.895 N/A