Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1wkm_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A NZ ASP 88.A OD2 no hydrogen 2.896 N/A LEU 6.A N ASP 2.A O no hydrogen 3.114 N/A MET 7.A N THR 3.A O no hydrogen 2.942 N/A LYS 8.A N GLU 4.A O no hydrogen 2.583 N/A LYS 8.A NZ GLU 11.A OE2 no hydrogen 3.075 N/A ALA 9.A N LYS 5.A O no hydrogen 2.901 N/A GLY 10.A N LEU 6.A O no hydrogen 3.010 N/A GLU 11.A N MET 7.A O no hydrogen 2.859 N/A ILE 12.A N LYS 8.A O no hydrogen 2.990 N/A ALA 13.A N ALA 9.A O no hydrogen 2.838 N/A LYS 14.A N GLY 10.A O no hydrogen 3.016 N/A LYS 14.A NZ GLU 295.A O no hydrogen 2.963 N/A LYS 15.A N GLU 11.A O no hydrogen 2.995 N/A VAL 16.A N ILE 12.A O no hydrogen 3.101 N/A ARG 17.A N ALA 13.A O no hydrogen 2.978 N/A ARG 17.A N LYS 14.A O no hydrogen 3.139 N/A ARG 17.A NE THR 94.A OG1 no hydrogen 3.305 N/A ARG 17.A NH1 GLU 18.A OE2 no hydrogen 2.984 N/A ARG 17.A NH2 THR 94.A OG1 no hydrogen 3.124 N/A ARG 17.A NH2 THR 294.A O no hydrogen 2.372 N/A GLU 18.A N LYS 14.A O no hydrogen 2.927 N/A LYS 19.A N LYS 15.A O no hydrogen 3.233 N/A ALA 20.A N VAL 16.A O no hydrogen 3.092 N/A ILE 21.A N ARG 17.A O no hydrogen 3.152 N/A LYS 22.A N LYS 19.A O no hydrogen 3.058 N/A LEU 23.A N LYS 19.A O no hydrogen 3.156 N/A ALA 24.A N ALA 20.A O no hydrogen 3.014 N/A ARG 25.A N LEU 23.A O no hydrogen 2.603 N/A GLY 27.A N LEU 73.A O no hydrogen 2.629 N/A MET 28.A N ARG 25.A O no hydrogen 3.039 N/A LEU 30.A N THR 71.A O no hydrogen 3.058 N/A LEU 33.A N LEU 29.A O no hydrogen 2.961 N/A ALA 34.A N LEU 30.A O no hydrogen 2.959 N/A GLU 35.A N LEU 31.A O no hydrogen 3.169 N/A SER 36.A N GLU 32.A O no hydrogen 3.094 N/A SER 36.A OG GLU 32.A O no hydrogen 2.935 N/A ILE 37.A N LEU 33.A O no hydrogen 3.210 N/A GLU 38.A N ALA 34.A O no hydrogen 3.011 N/A LYS 39.A N GLU 35.A O no hydrogen 3.204 N/A MET 40.A N SER 36.A O no hydrogen 2.950 N/A ILE 41.A N ILE 37.A O no hydrogen 3.194 N/A ILE 41.A N GLU 38.A O no hydrogen 3.213 N/A GLU 43.A N LYS 39.A O no hydrogen 3.346 N/A GLY 45.A N MET 42.A O no hydrogen 2.866 N/A GLY 46.A N ILE 41.A O no hydrogen 2.683 N/A LYS 47.A N HIS 86.A O no hydrogen 3.344 N/A ALA 49.A N GLY 84.A O no hydrogen 2.795 N/A VAL 52.A N GLU 38.A OE2 no hydrogen 3.101 N/A ASN 53.A N ASP 82.A O no hydrogen 2.992 N/A ASN 53.A ND2 PRO 51.A O no hydrogen 2.726 N/A LEU 54.A N TYR 63.A O no hydrogen 2.621 N/A SER 55.A N LYS 80.A O no hydrogen 3.076 N/A ASN 57.A N TYR 78.A O no hydrogen 2.858 N/A ASN 57.A ND2 ASP 77.A OD2 no hydrogen 3.308 N/A GLU 58.A N GLU 58.A OE2 no hydrogen 3.023 N/A ILE 59.A N ILE 56.A O no hydrogen 2.994 N/A ALA 60.A N LEU 268.A O no hydrogen 2.797 N/A ALA 61.A N LEU 268.A O no hydrogen 3.489 N/A TYR 63.A OH ASP 69.A OD1 no hydrogen 2.647 N/A THR 64.A OG1 VAL 52.A O no hydrogen 2.860 N/A LYS 67.A N GLN 241.A OE1 no hydrogen 2.512 N/A LYS 67.A NZ ARG 238.A O no hydrogen 3.442 N/A ASP 69.A N TYR 66.A O no hydrogen 2.803 N/A THR 71.A N ASP 69.A OD2 no hydrogen 2.738 N/A THR 71.A OG1 TYR 63.A OH no hydrogen 3.427 N/A THR 71.A OG1 ASP 69.A OD2 no hydrogen 2.583 N/A LEU 73.A N MET 28.A O no hydrogen 2.739 N/A LYS 74.A N ASP 77.A OD1 no hydrogen 3.351 N/A LYS 74.A NZ ASP 77.A OD1 no hydrogen 2.846 N/A LYS 74.A NZ ASP 77.A OD2 no hydrogen 2.853 N/A GLY 76.A N VAL 100.A O no hydrogen 2.870 N/A ASP 77.A N LYS 74.A O no hydrogen 3.221 N/A TYR 78.A N ASN 57.A OD1 no hydrogen 2.762 N/A TYR 78.A OH ASP 105.A OD2 no hydrogen 2.450 N/A LEU 79.A N VAL 98.A O no hydrogen 2.732 N/A LYS 80.A N SER 55.A O no hydrogen 2.606 N/A LYS 80.A NZ SER 55.A O no hydrogen 3.481 N/A LYS 80.A NZ ASN 57.A O no hydrogen 3.181 N/A LYS 80.A NZ TYR 78.A O no hydrogen 2.911 N/A LYS 80.A NZ VAL 276.A O no hydrogen 2.783 N/A ILE 81.A N VAL 96.A O no hydrogen 2.758 N/A ASP 82.A N ASN 53.A O no hydrogen 3.041 N/A VAL 83.A N THR 94.A O no hydrogen 2.793 N/A VAL 85.A N ALA 92.A O no hydrogen 2.955 N/A HIS 86.A N LYS 47.A O no hydrogen 2.806 N/A ILE 87.A N PHE 90.A O no hydrogen 2.726 N/A PHE 90.A N ILE 87.A O no hydrogen 3.126 N/A ALA 92.A N VAL 85.A O no hydrogen 2.670 N/A ASP 93.A N THR 282.A OG1 no hydrogen 2.821 N/A THR 94.A N VAL 83.A O no hydrogen 3.024 N/A THR 94.A OG1 GLU 280.A O no hydrogen 2.721 N/A ALA 95.A N GLU 280.A O no hydrogen 2.832 N/A VAL 96.A N ILE 81.A O no hydrogen 3.145 N/A THR 97.A OG1 GLN 278.A O no hydrogen 2.449 N/A VAL 98.A N LEU 79.A O no hydrogen 2.735 N/A ARG 99.A NE GLY 76.A O no hydrogen 3.409 N/A VAL 100.A N ASP 77.A O no hydrogen 2.911 N/A MET 102.A N ARG 99.A O no hydrogen 2.947 N/A GLU 103.A N GLU 103.A OE1 no hydrogen 2.786 N/A MET 108.A N ASP 105.A OD1 no hydrogen 3.148 N/A GLU 109.A N ASP 105.A O no hydrogen 2.986 N/A ALA 110.A N GLU 106.A O no hydrogen 2.869 N/A ALA 111.A N LEU 107.A O no hydrogen 3.328 N/A LYS 112.A N MET 108.A O no hydrogen 2.982 N/A LYS 112.A NZ GLU 104.A OE1 no hydrogen 2.754 N/A LYS 112.A NZ GLU 104.A OE2 no hydrogen 3.123 N/A GLU 113.A N GLU 109.A O no hydrogen 2.799 N/A ALA 114.A N ALA 110.A O no hydrogen 2.967 N/A LEU 115.A N ALA 111.A O no hydrogen 3.086 N/A ASN 116.A N LYS 112.A O no hydrogen 2.986 N/A ASN 116.A ND2 GLU 113.A OE1 no hydrogen 3.232 N/A ASN 116.A ND2 GLU 113.A OE2 no hydrogen 3.451 N/A ALA 117.A N GLU 113.A O no hydrogen 2.806 N/A ALA 118.A N ALA 114.A O no hydrogen 2.991 N/A ILE 119.A N LEU 115.A O no hydrogen 2.928 N/A SER 120.A N ASN 116.A O no hydrogen 3.060 N/A SER 120.A OG ALA 117.A O no hydrogen 2.687 N/A VAL 121.A N ALA 118.A O no hydrogen 3.306 N/A ALA 122.A N ALA 118.A O no hydrogen 3.055 N/A GLY 125.A N LEU 178.A O no hydrogen 2.805 N/A VAL 126.A N ARG 123.A O no hydrogen 2.918 N/A ILE 128.A N TYR 176.A O no hydrogen 2.992 N/A LYS 129.A N ASP 174.A O no hydrogen 2.975 N/A GLU 130.A N GLU 127.A O no hydrogen 2.938 N/A LEU 131.A N ILE 128.A O no hydrogen 2.905 N/A GLY 132.A N ILE 128.A O no hydrogen 3.284 N/A LYS 133.A N LYS 129.A O no hydrogen 2.919 N/A ALA 134.A N GLU 130.A O no hydrogen 3.044 N/A ILE 135.A N LEU 131.A O no hydrogen 2.849 N/A GLU 136.A N GLY 132.A O no hydrogen 2.825 N/A ASN 137.A N LYS 133.A O no hydrogen 3.028 N/A GLU 138.A N ILE 135.A O no hydrogen 3.246 N/A ILE 139.A N ILE 135.A O no hydrogen 3.281 N/A ARG 140.A N GLU 136.A O no hydrogen 2.924 N/A ARG 140.A NH1 GLU 136.A OE1 no hydrogen 2.870 N/A LYS 141.A N ASN 137.A O no hydrogen 3.119 N/A LYS 141.A NZ GLU 138.A OE2 no hydrogen 3.514 N/A ARG 142.A N ILE 139.A O no hydrogen 3.376 N/A ARG 142.A NH1 GLU 138.A O no hydrogen 2.721 N/A ARG 142.A NH1 GLU 138.A OE2 no hydrogen 2.711 N/A ARG 142.A NH2 GLU 138.A OE2 no hydrogen 3.550 N/A GLY 143.A N ARG 140.A O no hydrogen 2.579 N/A PHE 144.A N ILE 139.A O no hydrogen 3.074 N/A LYS 145.A N THR 191.A O no hydrogen 3.029 N/A LYS 145.A NZ GLY 193.A O no hydrogen 3.167 N/A ILE 147.A N PHE 189.A O no hydrogen 2.921 N/A VAL 148.A N GLY 195.A O no hydrogen 3.076 N/A ASN 149.A ND2 VAL 197.A O no hydrogen 2.580 N/A GLY 152.A N ILE 166.A O no hydrogen 3.154 N/A HIS 153.A N ALA 185.A O no hydrogen 2.870 N/A HIS 153.A ND1 LEU 160.A O no hydrogen 2.990 N/A LYS 154.A N ILE 164.A O no hydrogen 2.773 N/A LYS 154.A NZ GLU 156.A OE1 no hydrogen 2.733 N/A ILE 155.A N VAL 183.A O no hydrogen 2.525 N/A GLU 156.A N LYS 159.A O no hydrogen 2.968 N/A ARG 157.A NE ASP 88.A O no hydrogen 2.926 N/A ARG 157.A NH2 ASP 88.A O no hydrogen 3.253 N/A TYR 158.A N GLY 89.A O no hydrogen 2.964 N/A LYS 159.A N GLU 156.A O no hydrogen 2.738 N/A ALA 162.A N LYS 154.A O no hydrogen 2.951 N/A ILE 166.A N GLY 152.A O no hydrogen 3.055 N/A TYR 170.A N GLU 136.A OE2 no hydrogen 2.786 N/A ARG 171.A NE ASP 174.A OD2 no hydrogen 2.557 N/A ARG 171.A NH2 ASP 174.A OD1 no hydrogen 2.704 N/A ARG 171.A NH2 ASP 174.A OD2 no hydrogen 3.190 N/A ASP 174.A N ARG 171.A O no hydrogen 3.300 N/A ASN 175.A N HIS 173.A O no hydrogen 2.819 N/A ASN 175.A ND2 PRO 172.A O no hydrogen 3.114 N/A TYR 176.A OH ASP 182.A OD1 no hydrogen 3.390 N/A TYR 176.A OH ASP 182.A OD2 no hydrogen 2.754 N/A LEU 178.A N VAL 126.A O no hydrogen 3.204 N/A LYS 179.A N ASP 182.A OD2 no hydrogen 2.834 N/A LYS 179.A NZ TYR 176.A OH no hydrogen 3.056 N/A LYS 179.A NZ ASP 182.A OD1 no hydrogen 2.788 N/A GLY 181.A N VAL 285.A O no hydrogen 2.770 N/A ASP 182.A N LYS 179.A O no hydrogen 3.092 N/A PHE 184.A N ILE 283.A O no hydrogen 2.905 N/A ALA 185.A N HIS 153.A O no hydrogen 2.833 N/A ILE 186.A N HIS 281.A O no hydrogen 2.897 N/A PHE 189.A N ASN 168.A OD1 no hydrogen 3.154 N/A ALA 190.A N ALA 277.A O no hydrogen 2.898 N/A THR 191.A N LYS 145.A O no hydrogen 3.060 N/A THR 191.A OG1 GLY 274.A O no hydrogen 3.069 N/A THR 191.A OG1 ILE 275.A O no hydrogen 2.568 N/A ILE 192.A N ILE 275.A O no hydrogen 3.277 N/A GLY 193.A N THR 191.A OG1 no hydrogen 3.012 N/A GLY 195.A N GLU 270.A OE2 no hydrogen 2.756 N/A GLN 196.A N GLU 270.A OE2 no hydrogen 3.152 N/A VAL 197.A N ASN 149.A OD1 no hydrogen 2.919 N/A ILE 198.A N LYS 269.A O no hydrogen 2.728 N/A VAL 200.A N VAL 267.A O no hydrogen 2.899 N/A TYR 206.A N PHE 235.A O no hydrogen 2.921 N/A TYR 206.A OH THR 203.A O no hydrogen 3.345 N/A MET 207.A N TYR 263.A O no hydrogen 2.975 N/A VAL 209.A N ALA 261.A O no hydrogen 3.198 N/A ARG 210.A N ALA 261.A O no hydrogen 3.167 N/A ARG 210.A NH1 GLY 260.A O no hydrogen 3.179 N/A ARG 220.A N VAL 216.A O no hydrogen 3.136 N/A ARG 220.A NH1 VAL 214.A O no hydrogen 3.477 N/A PHE 221.A N ALA 217.A O no hydrogen 2.812 N/A LEU 222.A N GLN 218.A O no hydrogen 2.989 N/A LEU 223.A N ALA 219.A O no hydrogen 2.930 N/A ALA 224.A N ARG 220.A O no hydrogen 3.269 N/A LYS 225.A N PHE 221.A O no hydrogen 3.239 N/A LYS 225.A N LEU 222.A O no hydrogen 2.779 N/A LYS 225.A NZ GLU 229.A OE2 no hydrogen 2.665 N/A ILE 226.A N LEU 222.A O no hydrogen 2.814 N/A LYS 227.A N LEU 223.A O no hydrogen 2.904 N/A LYS 227.A NZ ASP 211.A OD1 no hydrogen 2.774 N/A ARG 228.A N ALA 224.A O no hydrogen 3.044 N/A GLU 229.A N LYS 225.A O no hydrogen 2.743 N/A TYR 230.A N ILE 226.A O no hydrogen 2.752 N/A THR 232.A OG1 TYR 158.A O no hydrogen 2.862 N/A LEU 233.A N TYR 230.A O no hydrogen 3.054 N/A PHE 235.A N TYR 206.A O no hydrogen 2.758 N/A TYR 237.A N LEU 204.A O no hydrogen 2.913 N/A ARG 238.A NH1 THR 64.A OG1 no hydrogen 3.184 N/A ARG 238.A NH1 PRO 65.A O no hydrogen 2.501 N/A ARG 238.A NH2 GLU 38.A OE1 no hydrogen 2.695 N/A TRP 239.A N ALA 236.A O no hydrogen 3.211 N/A TRP 239.A NE1 GLU 38.A OE1 no hydrogen 2.860 N/A LEU 240.A N TYR 237.A O no hydrogen 3.175 N/A GLN 241.A N ARG 238.A O no hydrogen 3.185 N/A GLN 241.A NE2 LYS 67.A O no hydrogen 3.108 N/A ASP 243.A N LEU 240.A O no hydrogen 3.052 N/A LEU 249.A N PRO 245.A O no hydrogen 2.922 N/A LYS 250.A N GLU 246.A O no hydrogen 2.972 N/A LEU 251.A N GLY 247.A O no hydrogen 3.171 N/A ALA 252.A N GLN 248.A O no hydrogen 2.909 N/A LEU 253.A N LEU 249.A O no hydrogen 2.906 N/A LYS 254.A N LYS 250.A O no hydrogen 2.777 N/A THR 255.A N LEU 251.A O no hydrogen 2.727 N/A THR 255.A OG1 LEU 251.A O no hydrogen 3.207 N/A LEU 256.A N ALA 252.A O no hydrogen 2.919 N/A GLU 257.A N LEU 253.A O no hydrogen 2.957 N/A LYS 258.A N LYS 254.A O no hydrogen 3.070 N/A ALA 259.A N THR 255.A O no hydrogen 2.785 N/A GLY 260.A N GLU 257.A O no hydrogen 3.242 N/A ALA 261.A N LEU 256.A O no hydrogen 2.672 N/A TYR 263.A N MET 207.A O no hydrogen 2.702 N/A TYR 265.A N ILE 205.A O no hydrogen 2.651 N/A VAL 267.A N PRO 202.A O no hydrogen 3.345 N/A LEU 268.A N ALA 61.A O no hydrogen 2.992 N/A LYS 269.A N ILE 198.A O no hydrogen 2.882 N/A LYS 269.A NZ ASN 273.A OD1 no hydrogen 3.005 N/A GLU 270.A N GLU 58.A O no hydrogen 2.904 N/A ILE 271.A N GLN 196.A O no hydrogen 2.692 N/A ARG 272.A N GLU 270.A OE1 no hydrogen 2.513 N/A ASN 273.A N GLU 270.A O no hydrogen 2.971 N/A GLY 274.A N GLU 270.A OE1 no hydrogen 3.295 N/A ALA 277.A N ALA 190.A O no hydrogen 2.777 N/A GLN 278.A N THR 97.A OG1 no hydrogen 2.675 N/A GLN 278.A NE2 ASP 82.A OD1 no hydrogen 3.106 N/A PHE 279.A N PRO 188.A O no hydrogen 3.400 N/A GLU 280.A N ALA 95.A O no hydrogen 2.859 N/A HIS 281.A N ILE 186.A O no hydrogen 3.072 N/A HIS 281.A ND1 THR 294.A OG1 no hydrogen 2.616 N/A THR 282.A N THR 294.A OG1 no hydrogen 3.182 N/A THR 282.A OG1 ASP 93.A O no hydrogen 2.650 N/A ILE 283.A N PHE 184.A O no hydrogen 2.722 N/A ILE 284.A N ILE 291.A O no hydrogen 2.828 N/A VAL 285.A N ASP 182.A O no hydrogen 2.799 N/A GLU 286.A N SER 289.A O no hydrogen 2.778 N/A ILE 291.A N ILE 284.A O no hydrogen 2.727 N/A THR 293.A N THR 282.A O no hydrogen 2.981 N/A THR 293.A OG1 THR 282.A O no hydrogen 3.352 N/A THR 294.A OG1 HIS 281.A ND1 no hydrogen 2.616 N/A GLU 295.A N VAL 292.A O no hydrogen 3.271 N/A