Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2vkt_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 2.A N SER 1.A OG no hydrogen 2.805 N/A CYS 5.A N LYS 36.A O no hydrogen 2.961 N/A SER 6.A N ASP 70.A OD2 no hydrogen 2.850 N/A ILE 7.A N ASN 38.A O no hydrogen 2.999 N/A ALA 8.A N GLY 71.A O no hydrogen 3.076 N/A LEU 9.A N MET 40.A O no hydrogen 2.810 N/A VAL 10.A N LEU 73.A O no hydrogen 2.969 N/A GLY 11.A N ILE 42.A O no hydrogen 2.969 N/A LYS 12.A N TYR 19.A OH no hydrogen 3.176 N/A LYS 12.A NZ TYR 13.A OH no hydrogen 3.527 N/A TYR 19.A N ARG 16.A O no hydrogen 2.862 N/A ALA 20.A N ASP 17.A O no hydrogen 3.173 N/A PHE 23.A N TYR 19.A O no hydrogen 2.948 N/A LYS 24.A N ALA 20.A O no hydrogen 3.154 N/A ALA 25.A N SER 21.A O no hydrogen 2.902 N/A LEU 26.A N VAL 22.A O no hydrogen 3.049 N/A GLU 27.A N PHE 23.A O no hydrogen 2.852 N/A HIS 28.A N LYS 24.A O no hydrogen 3.017 N/A HIS 28.A ND1 SER 229.A OG no hydrogen 3.004 N/A SER 29.A OG ALA 25.A O no hydrogen 3.007 N/A ALA 30.A N LEU 26.A O no hydrogen 2.977 N/A LEU 31.A N GLU 27.A O no hydrogen 2.851 N/A ALA 32.A N HIS 28.A O no hydrogen 2.938 N/A ILE 33.A N SER 29.A O no hydrogen 3.271 N/A ASN 34.A N LEU 31.A O no hydrogen 3.001 N/A HIS 35.A N ALA 30.A O no hydrogen 2.836 N/A HIS 35.A ND1 ILE 33.A O no hydrogen 3.081 N/A LYS 36.A N LYS 3.A O no hydrogen 2.898 N/A LYS 36.A NZ LEU 37.A O no hydrogen 3.042 N/A ASN 38.A N CYS 5.A O no hydrogen 2.931 N/A ASN 38.A ND2 SER 6.A OG no hydrogen 2.750 N/A MET 40.A N ILE 7.A O no hydrogen 2.774 N/A ILE 42.A N LEU 9.A O no hydrogen 2.919 N/A SER 44.A N GLY 11.A O no hydrogen 2.810 N/A SER 44.A OG GLY 82.A O no hydrogen 2.699 N/A ILE 45.A N ASP 43.A OD1 no hydrogen 3.189 N/A ASP 46.A N ASP 43.A O no hydrogen 2.715 N/A LEU 47.A N SER 44.A O no hydrogen 3.289 N/A GLU 48.A N ILE 45.A O no hydrogen 3.000 N/A THR 51.A N GLU 48.A O no hydrogen 3.193 N/A THR 51.A OG1 ILE 45.A O no hydrogen 2.823 N/A THR 53.A N LYS 49.A O no hydrogen 3.226 N/A GLU 54.A N ILE 50.A O no hydrogen 3.039 N/A ASP 55.A N THR 51.A O no hydrogen 2.559 N/A PHE 59.A N ASP 55.A O no hydrogen 3.152 N/A HIS 60.A N PRO 56.A O no hydrogen 2.993 N/A GLU 61.A N VAL 57.A O no hydrogen 3.015 N/A ALA 62.A N LYS 58.A O no hydrogen 2.942 N/A TRP 63.A N PHE 59.A O no hydrogen 2.925 N/A TRP 63.A NE1 LEU 47.A O no hydrogen 3.027 N/A GLN 64.A N HIS 60.A O no hydrogen 3.028 N/A LYS 65.A N GLU 61.A O no hydrogen 3.277 N/A LEU 66.A N ALA 62.A O no hydrogen 3.064 N/A CYS 67.A N TRP 63.A O no hydrogen 2.981 N/A CYS 67.A SG TRP 63.A O no hydrogen 3.161 N/A LYS 68.A N GLN 64.A O no hydrogen 3.124 N/A ALA 69.A N LEU 66.A O no hydrogen 3.291 N/A ASP 70.A N SER 6.A O no hydrogen 2.809 N/A GLY 71.A N SER 6.A O no hydrogen 3.427 N/A ILE 72.A N PRO 99.A O no hydrogen 2.756 N/A LEU 73.A N ALA 8.A O no hydrogen 2.912 N/A VAL 74.A N LEU 101.A O no hydrogen 2.917 N/A THR 83.A N ILE 80.A O no hydrogen 3.355 N/A THR 83.A OG1 ILE 80.A O no hydrogen 2.815 N/A GLY 85.A N GLU 48.A OE1 no hydrogen 3.291 N/A LYS 86.A N GLY 82.A O no hydrogen 3.092 N/A LEU 87.A N THR 83.A O no hydrogen 3.097 N/A GLN 88.A N LEU 84.A O no hydrogen 3.150 N/A ALA 89.A N GLY 85.A O no hydrogen 2.996 N/A ILE 90.A N LYS 86.A O no hydrogen 2.971 N/A SER 91.A N LEU 87.A O no hydrogen 2.975 N/A SER 91.A OG LEU 87.A O no hydrogen 3.224 N/A SER 91.A OG GLU 113.A OE2 no hydrogen 2.532 N/A TRP 92.A N GLN 88.A O no hydrogen 3.247 N/A ALA 93.A N ALA 89.A O no hydrogen 3.071 N/A ARG 94.A N ILE 90.A O no hydrogen 2.942 N/A ARG 94.A NH1 GLU 113.A OE1 no hydrogen 2.672 N/A THR 95.A N SER 91.A O no hydrogen 2.839 N/A THR 95.A OG1 SER 91.A O no hydrogen 2.975 N/A LYS 96.A N TRP 92.A O no hydrogen 2.916 N/A LYS 97.A N ARG 94.A O no hydrogen 3.497 N/A LYS 97.A NZ ASN 214.A O no hydrogen 3.147 N/A ILE 98.A N ALA 93.A O no hydrogen 3.008 N/A PHE 100.A N TYR 217.A O no hydrogen 2.867 N/A LEU 101.A N ILE 72.A O no hydrogen 2.995 N/A GLY 102.A N VAL 219.A O no hydrogen 2.930 N/A VAL 103.A N VAL 74.A O no hydrogen 2.972 N/A CYS 104.A N VAL 221.A O no hydrogen 2.527 N/A CYS 104.A SG ARG 177.A O no hydrogen 3.891 N/A GLY 106.A N VAL 103.A O no hydrogen 3.005 N/A MET 107.A N CYS 104.A O no hydrogen 2.810 N/A GLN 108.A N CYS 104.A O no hydrogen 3.093 N/A GLN 108.A NE2 GLN 222.A OE1 no hydrogen 3.113 N/A LEU 109.A N LEU 105.A O no hydrogen 3.000 N/A ALA 110.A N GLY 106.A O no hydrogen 3.188 N/A VAL 111.A N MET 107.A O no hydrogen 3.060 N/A ILE 112.A N GLN 108.A O no hydrogen 3.189 N/A GLU 113.A N LEU 109.A O no hydrogen 2.905 N/A PHE 114.A N ALA 110.A O no hydrogen 3.164 N/A ALA 115.A N VAL 111.A O no hydrogen 3.097 N/A ARG 116.A N ILE 112.A O no hydrogen 2.918 N/A ARG 116.A NE ALA 124.A O no hydrogen 2.844 N/A ARG 116.A NH2 ALA 124.A O no hydrogen 2.852 N/A ASN 117.A N GLU 113.A O no hydrogen 3.032 N/A ASN 117.A ND2 GLU 113.A OE2 no hydrogen 2.830 N/A CYS 118.A N PHE 114.A O no hydrogen 2.796 N/A LEU 119.A N PHE 114.A O no hydrogen 3.202 N/A LEU 119.A N ALA 115.A O no hydrogen 3.143 N/A LEU 121.A N ALA 115.A O no hydrogen 3.157 N/A LYS 122.A NZ ARG 116.A O no hydrogen 3.122 N/A ALA 124.A N LEU 121.A O no hydrogen 3.226 N/A ASP 125.A N VAL 135.A O no hydrogen 3.079 N/A SER 126.A N ASP 125.A OD1 no hydrogen 2.894 N/A THR 127.A N VAL 138.A O no hydrogen 2.995 N/A THR 127.A OG1 VAL 138.A O no hydrogen 3.293 N/A GLU 128.A N SER 126.A OG no hydrogen 3.297 N/A PHE 129.A N SER 126.A O no hydrogen 3.122 N/A ARG 130.A N SER 126.A O no hydrogen 3.311 N/A ARG 130.A NE ASP 125.A OD1 no hydrogen 3.351 N/A ARG 130.A NE ASP 125.A OD2 no hydrogen 2.632 N/A ARG 130.A NH2 ASP 125.A OD1 no hydrogen 3.376 N/A ALA 133.A N ARG 130.A O no hydrogen 3.007 N/A LEU 137.A N VAL 135.A O no hydrogen 2.914 N/A VAL 138.A N ASP 125.A O no hydrogen 3.179 N/A ILE 139.A N GLU 181.A O no hydrogen 2.775 N/A MET 141.A N ARG 179.A O no hydrogen 2.883 N/A THR 145.A OG1 GLU 143.A O no hydrogen 3.483 N/A ARG 147.A N HIS 178.A O no hydrogen 3.015 N/A ARG 147.A NE GLU 208.A OE1 no hydrogen 2.836 N/A ARG 147.A NH1 GLU 143.A OE2 no hydrogen 3.465 N/A ARG 147.A NH2 ARG 152.A O no hydrogen 3.144 N/A ARG 147.A NH2 GLU 208.A OE1 no hydrogen 3.356 N/A ARG 147.A NH2 GLU 208.A OE2 no hydrogen 3.083 N/A ARG 151.A N GLU 174.A O no hydrogen 3.023 N/A ARG 151.A NE LEU 148.A O no hydrogen 2.836 N/A ARG 151.A NH1 GLU 143.A OE2 no hydrogen 2.649 N/A ARG 151.A NH2 GLU 143.A OE1 no hydrogen 2.648 N/A ARG 151.A NH2 LEU 148.A O no hydrogen 3.486 N/A THR 153.A N ILE 172.A O no hydrogen 2.873 N/A THR 153.A OG1 GLU 208.A OE2 no hydrogen 2.890 N/A VAL 154.A N GLN 200.A O no hydrogen 2.754 N/A PHE 155.A N PRO 170.A O no hydrogen 3.258 N/A LYS 156.A N VAL 198.A O no hydrogen 3.086 N/A LYS 156.A NZ GLN 200.A OE1 no hydrogen 3.074 N/A ASN 159.A N THR 157.A OG1 no hydrogen 3.321 N/A SER 160.A N GLU 158.A O no hydrogen 3.121 N/A SER 160.A OG GLU 211.A OE1 no hydrogen 3.478 N/A SER 160.A OG GLU 211.A OE2 no hydrogen 2.626 N/A ILE 161.A N GLU 211.A OE1 no hydrogen 3.195 N/A LEU 162.A N GLU 211.A OE2 no hydrogen 3.032 N/A ARG 163.A N SER 160.A OG no hydrogen 3.186 N/A ARG 163.A NE ASP 168.A O no hydrogen 3.436 N/A ARG 163.A NH1 THR 157.A O no hydrogen 2.903 N/A LYS 164.A N SER 160.A O no hydrogen 3.236 N/A LEU 165.A N ILE 161.A O no hydrogen 3.013 N/A TYR 166.A N LEU 162.A O no hydrogen 2.912 N/A TYR 166.A OH GLU 174.A OE2 no hydrogen 2.702 N/A GLY 167.A N LYS 164.A O no hydrogen 3.001 N/A ASP 168.A N ARG 163.A O no hydrogen 2.856 N/A ILE 172.A N THR 153.A O no hydrogen 2.927 N/A GLU 174.A N ARG 151.A O no hydrogen 3.275 N/A HIS 176.A N GLY 149.A O no hydrogen 3.104 N/A HIS 176.A ND1 HIS 178.A NE2 no hydrogen 3.039 N/A HIS 178.A N ARG 147.A O no hydrogen 3.347 N/A HIS 178.A ND1 GLU 181.A OE1 no hydrogen 2.463 N/A HIS 178.A NE2 HIS 176.A ND1 no hydrogen 3.039 N/A ARG 179.A NH1 ASP 140.A OD1 no hydrogen 2.923 N/A GLU 181.A N ILE 139.A O no hydrogen 2.778 N/A ASN 183.A N LEU 137.A O no hydrogen 2.767 N/A ASN 183.A ND2 PRO 136.A O no hydrogen 2.809 N/A ASN 185.A N ASN 183.A OD1 no hydrogen 2.762 N/A LEU 186.A N ASN 183.A O no hydrogen 2.976 N/A ILE 187.A N PRO 184.A O no hydrogen 3.385 N/A GLN 189.A N LEU 186.A O no hydrogen 3.236 N/A PHE 190.A N ILE 187.A O no hydrogen 3.048 N/A GLU 191.A N LYS 188.A O no hydrogen 3.151 N/A ASN 193.A N PHE 190.A O no hydrogen 3.176 N/A SER 196.A N GLU 211.A O no hydrogen 2.837 N/A VAL 198.A N ILE 209.A O no hydrogen 2.905 N/A GLN 200.A N VAL 154.A O no hydrogen 3.158 N/A ASP 201.A N ARG 206.A O no hydrogen 3.085 N/A GLY 204.A N ASP 201.A O no hydrogen 3.127 N/A ASP 205.A N ASP 201.A OD1 no hydrogen 2.948 N/A ARG 206.A N ASP 201.A OD1 no hydrogen 3.108 N/A ARG 206.A NH1 MET 141.A O no hydrogen 2.621 N/A ARG 206.A NH2 MET 141.A O no hydrogen 2.963 N/A GLU 208.A N GLY 199.A O no hydrogen 2.927 N/A ILE 210.A N GLY 220.A O no hydrogen 2.959 N/A GLU 211.A N SER 196.A O no hydrogen 3.027 N/A LEU 212.A N PHE 218.A O no hydrogen 3.232 N/A ALA 213.A N ASP 194.A O no hydrogen 3.041 N/A ASN 214.A ND2 ASP 194.A OD2 no hydrogen 2.974 N/A HIS 215.A NE2 ILE 98.A O no hydrogen 2.872 N/A TYR 217.A OH PRO 237.A O no hydrogen 2.514 N/A VAL 219.A N PHE 100.A O no hydrogen 3.029 N/A GLY 220.A N ILE 210.A O no hydrogen 2.990 N/A VAL 221.A N GLY 102.A O no hydrogen 2.797 N/A GLN 222.A N GLU 208.A O no hydrogen 2.920 N/A GLN 222.A NE2 PHE 180.A O no hydrogen 3.194 N/A GLN 222.A NE2 GLU 181.A OE2 no hydrogen 3.335 N/A HIS 224.A N ARG 175.A O no hydrogen 2.934 N/A GLU 226.A N GLU 226.A OE1 no hydrogen 2.781 N/A PHE 227.A N HIS 224.A O no hydrogen 3.445 N/A SER 228.A OG GLU 174.A OE1 no hydrogen 2.786 N/A SER 229.A N GLU 226.A O no hydrogen 3.003 N/A SER 229.A OG HIS 28.A ND1 no hydrogen 3.004 N/A ARG 230.A N LYS 233.A O no hydrogen 3.012 N/A LYS 233.A N ARG 230.A O no hydrogen 2.936 N/A SER 235.A N SER 229.A OG no hydrogen 2.879 N/A SER 235.A OG PRO 225.A O no hydrogen 2.957 N/A LEU 239.A N SER 235.A O no hydrogen 2.922 N/A GLY 240.A N PRO 236.A O no hydrogen 2.780 N/A LEU 241.A N PRO 237.A O no hydrogen 3.258 N/A LEU 242.A N TYR 238.A O no hydrogen 3.157 N/A LEU 243.A N LEU 239.A O no hydrogen 2.866 N/A ALA 244.A N GLY 240.A O no hydrogen 2.907 N/A ALA 245.A N LEU 241.A O no hydrogen 2.856 N/A THR 246.A N LEU 242.A O no hydrogen 3.240 N/A THR 246.A N LEU 243.A O no hydrogen 3.315 N/A THR 246.A OG1 LEU 242.A O no hydrogen 3.088 N/A THR 246.A OG1 LEU 243.A O no hydrogen 3.055 N/A GLY 247.A N ALA 244.A O no hydrogen 3.167 N/A ASN 248.A N LEU 243.A O no hydrogen 2.939 N/A ASN 248.A ND2 THR 246.A OG1 no hydrogen 2.790 N/A TYR 252.A N LEU 249.A O no hydrogen 3.179 N/A