Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1vf1_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 4.A N GLU 57.A O no hydrogen 3.054 N/A LEU 5.A N GLU 29.A O no hydrogen 2.828 N/A TYR 6.A N MET 55.A O no hydrogen 2.871 N/A TYR 6.A OH GLU 57.A OE1 no hydrogen 2.799 N/A TYR 7.A N VAL 31.A O no hydrogen 3.202 N/A GLY 10.A N PHE 8.A O no hydrogen 2.782 N/A ARG 11.A NE LYS 203.A O no hydrogen 2.885 N/A ARG 11.A NH1 GLU 167.A OE1 no hydrogen 2.741 N/A ARG 11.A NH1 GLU 167.A OE2 no hydrogen 3.509 N/A ARG 11.A NH2 GLU 167.A OE1 no hydrogen 3.552 N/A ARG 11.A NH2 GLU 167.A OE2 no hydrogen 2.769 N/A ARG 11.A NH2 LYS 203.A O no hydrogen 3.544 N/A LYS 13.A N TYR 7.A OH no hydrogen 3.001 N/A MET 14.A N ARG 11.A O no hydrogen 3.192 N/A GLU 15.A N ARG 11.A O no hydrogen 3.018 N/A SER 16.A OG GLU 160.A OE1 no hydrogen 2.847 N/A ILE 17.A N MET 14.A O no hydrogen 2.976 N/A ARG 18.A N MET 14.A O no hydrogen 3.029 N/A ARG 18.A NE GLU 30.A OE1 no hydrogen 2.731 N/A ARG 18.A NH1 GLY 10.A O no hydrogen 2.912 N/A ARG 18.A NH1 ARG 11.A O no hydrogen 3.395 N/A ARG 18.A NH1 GLU 15.A OE1 no hydrogen 2.824 N/A ARG 18.A NH2 PHE 8.A O no hydrogen 3.355 N/A ARG 18.A NH2 GLY 10.A O no hydrogen 3.002 N/A ARG 18.A NH2 GLU 30.A OE1 no hydrogen 3.302 N/A TRP 19.A N GLU 15.A O no hydrogen 2.893 N/A LEU 20.A N SER 16.A O no hydrogen 3.013 N/A LEU 21.A N ILE 17.A O no hydrogen 3.059 N/A ALA 22.A N ARG 18.A O no hydrogen 2.994 N/A ALA 23.A N TRP 19.A O no hydrogen 2.822 N/A ALA 24.A N LEU 20.A O no hydrogen 2.987 N/A GLY 25.A N ALA 22.A O no hydrogen 2.881 N/A VAL 26.A N LEU 21.A O no hydrogen 2.834 N/A GLU 29.A N PRO 3.A O no hydrogen 2.881 N/A VAL 31.A N LEU 5.A O no hydrogen 2.871 N/A LEU 33.A N TYR 7.A O no hydrogen 2.928 N/A GLU 34.A N GLN 38.A OE1 no hydrogen 2.802 N/A ARG 36.A NE GLU 40.A OE2 no hydrogen 3.369 N/A ARG 36.A NH1 VAL 217.A O no hydrogen 2.921 N/A GLN 38.A N THR 35.A OG1 no hydrogen 3.103 N/A GLN 38.A NE2 PHE 32.A O no hydrogen 2.957 N/A TYR 39.A N THR 35.A O no hydrogen 3.285 N/A TYR 39.A OH GLN 51.A O no hydrogen 2.600 N/A GLU 40.A N ARG 36.A O no hydrogen 2.889 N/A LYS 41.A N GLU 37.A O no hydrogen 2.919 N/A LEU 42.A N GLN 38.A O no hydrogen 3.164 N/A LEU 43.A N TYR 39.A O no hydrogen 2.930 N/A GLN 44.A N GLU 40.A O no hydrogen 2.968 N/A SER 45.A N LYS 41.A O no hydrogen 3.056 N/A SER 45.A OG LEU 42.A O no hydrogen 2.628 N/A GLY 46.A N LEU 43.A O no hydrogen 3.169 N/A ILE 47.A N SER 45.A OG no hydrogen 3.377 N/A GLN 51.A N LEU 48.A O no hydrogen 2.976 N/A MET 55.A N TYR 6.A O no hydrogen 3.429 N/A VAL 56.A N LEU 63.A O no hydrogen 2.836 N/A GLU 57.A N VAL 4.A O no hydrogen 2.932 N/A ILE 58.A N MET 61.A O no hydrogen 3.039 N/A MET 61.A N ILE 58.A O no hydrogen 2.882 N/A LYS 62.A NZ GLU 57.A OE2 no hydrogen 3.015 N/A LEU 63.A N VAL 56.A O no hydrogen 3.031 N/A ARG 67.A NH2 ASP 98.A OD2 no hydrogen 3.066 N/A ILE 69.A N GLN 65.A O no hydrogen 3.112 N/A LEU 70.A N THR 66.A O no hydrogen 3.027 N/A ASN 71.A N ARG 67.A O no hydrogen 2.803 N/A TYR 72.A N ALA 68.A O no hydrogen 3.068 N/A TYR 72.A OH ASP 59.A OD2 no hydrogen 2.507 N/A ILE 73.A N ILE 69.A O no hydrogen 3.041 N/A ALA 74.A N LEU 70.A O no hydrogen 2.840 N/A GLY 75.A N ASN 71.A O no hydrogen 3.051 N/A LYS 76.A N TYR 72.A O no hydrogen 2.821 N/A LYS 76.A NZ ASP 59.A OD1 no hydrogen 3.142 N/A LYS 76.A NZ ASP 59.A OD2 no hydrogen 2.919 N/A LYS 76.A NZ TYR 77.A OH no hydrogen 3.127 N/A TYR 77.A N ILE 73.A O no hydrogen 3.000 N/A ASN 78.A N GLY 75.A O no hydrogen 3.298 N/A LEU 79.A N ALA 74.A O no hydrogen 2.817 N/A TYR 80.A OH ASN 71.A OD1 no hydrogen 3.295 N/A TYR 80.A OH ASP 91.A OD1 no hydrogen 2.631 N/A TYR 80.A OH ASP 91.A OD2 no hydrogen 3.329 N/A LYS 82.A N GLU 86.A OE1 no hydrogen 2.733 N/A LYS 82.A NZ LYS 82.A O no hydrogen 3.338 N/A GLU 86.A N ASP 83.A OD1 no hydrogen 2.889 N/A ARG 87.A N ASP 83.A O no hydrogen 2.993 N/A ARG 87.A NE ASP 91.A OD2 no hydrogen 2.912 N/A ALA 88.A N LEU 84.A O no hydrogen 2.993 N/A LEU 89.A N LYS 85.A O no hydrogen 3.112 N/A ILE 90.A N GLU 86.A O no hydrogen 2.988 N/A ASP 91.A N ARG 87.A O no hydrogen 2.745 N/A MET 92.A N ALA 88.A O no hydrogen 2.893 N/A TYR 93.A N LEU 89.A O no hydrogen 2.906 N/A VAL 94.A N ILE 90.A O no hydrogen 2.831 N/A GLY 95.A N ASP 91.A O no hydrogen 2.897 N/A GLY 96.A N MET 92.A O no hydrogen 3.343 N/A THR 97.A N TYR 93.A O no hydrogen 3.237 N/A THR 97.A OG1 TYR 93.A O no hydrogen 3.346 N/A THR 97.A OG1 VAL 94.A O no hydrogen 3.220 N/A THR 97.A OG1 HIS 157.A ND1 no hydrogen 2.571 N/A ASP 98.A N VAL 94.A O no hydrogen 2.763 N/A ASP 99.A N GLY 95.A O no hydrogen 3.035 N/A LEU 100.A N GLY 96.A O no hydrogen 3.028 N/A MET 101.A N THR 97.A O no hydrogen 2.916 N/A GLY 102.A N ASP 98.A O no hydrogen 2.795 N/A PHE 103.A N ASP 99.A O no hydrogen 3.019 N/A PHE 103.A N LEU 100.A O no hydrogen 3.230 N/A LEU 104.A N MET 101.A O no hydrogen 2.920 N/A LEU 105.A N GLY 102.A O no hydrogen 3.157 N/A PHE 107.A N LEU 104.A O no hydrogen 3.200 N/A PHE 109.A N SER 106.A O no hydrogen 2.766 N/A LEU 110.A N PHE 107.A O no hydrogen 3.129 N/A SER 111.A OG ASP 114.A OD2 no hydrogen 3.202 N/A ASP 114.A N SER 111.A OG no hydrogen 3.171 N/A LYS 115.A N SER 111.A O no hydrogen 2.923 N/A VAL 116.A N ALA 112.A O no hydrogen 3.412 N/A LYS 117.A N GLU 113.A O no hydrogen 3.267 N/A GLN 118.A N ASP 114.A O no hydrogen 2.748 N/A GLN 118.A NE2 PHE 103.A O no hydrogen 2.825 N/A CYS 119.A N LYS 115.A O no hydrogen 2.832 N/A CYS 119.A SG LYS 168.A O no hydrogen 3.992 N/A ALA 120.A N VAL 116.A O no hydrogen 3.165 N/A PHE 121.A N LYS 117.A O no hydrogen 2.969 N/A VAL 122.A N GLN 118.A O no hydrogen 2.838 N/A VAL 123.A N CYS 119.A O no hydrogen 3.009 N/A GLU 124.A N ALA 120.A O no hydrogen 3.025 N/A LYS 125.A N PHE 121.A O no hydrogen 3.072 N/A ALA 126.A N VAL 122.A O no hydrogen 2.889 N/A THR 127.A N VAL 123.A O no hydrogen 2.941 N/A THR 127.A OG1 VAL 123.A O no hydrogen 3.023 N/A THR 127.A OG1 GLU 124.A O no hydrogen 3.518 N/A SER 128.A N GLU 124.A O no hydrogen 2.914 N/A SER 128.A OG GLU 124.A O no hydrogen 2.677 N/A SER 128.A OG GLU 124.A OE2 no hydrogen 2.913 N/A ARG 129.A N LYS 125.A O no hydrogen 2.927 N/A TYR 130.A N LYS 125.A O no hydrogen 3.070 N/A PHE 131.A N ALA 126.A O no hydrogen 2.740 N/A TYR 134.A N TYR 130.A O no hydrogen 3.134 N/A TYR 134.A OH TYR 93.A O no hydrogen 2.550 N/A GLU 135.A N PHE 131.A O no hydrogen 2.855 N/A LYS 136.A N PRO 132.A O no hydrogen 3.031 N/A LYS 136.A NZ ASP 140.A OD2 no hydrogen 2.847 N/A VAL 137.A N ALA 133.A O no hydrogen 3.149 N/A LEU 138.A N TYR 134.A O no hydrogen 3.141 N/A LYS 139.A N GLU 135.A O no hydrogen 2.874 N/A ASP 140.A N LYS 136.A O no hydrogen 2.789 N/A HIS 141.A N VAL 137.A O no hydrogen 3.362 N/A HIS 141.A NE2 LEU 146.A O no hydrogen 3.147 N/A GLY 142.A N LEU 138.A O no hydrogen 2.693 N/A GLN 143.A N HIS 141.A ND1 no hydrogen 2.768 N/A LEU 146.A N ASP 155.A OD1 no hydrogen 2.890 N/A ARG 150.A N VAL 147.A O no hydrogen 3.511 N/A SER 152.A N ASP 155.A OD2 no hydrogen 2.904 N/A TRP 153.A N LEU 79.A O no hydrogen 2.797 N/A ALA 154.A N SER 152.A OG no hydrogen 3.242 N/A ASP 155.A N SER 152.A O no hydrogen 3.046 N/A ILE 156.A N SER 152.A O no hydrogen 3.389 N/A HIS 157.A N TRP 153.A O no hydrogen 2.875 N/A HIS 157.A ND1 THR 97.A OG1 no hydrogen 2.571 N/A LEU 158.A N ALA 154.A O no hydrogen 3.017 N/A LEU 159.A N ASP 155.A O no hydrogen 2.961 N/A GLU 160.A N ILE 156.A O no hydrogen 3.143 N/A ALA 161.A N HIS 157.A O no hydrogen 3.016 N/A ILE 162.A N LEU 158.A O no hydrogen 2.803 N/A LEU 163.A N LEU 159.A O no hydrogen 2.996 N/A MET 164.A N GLU 160.A O no hydrogen 3.019 N/A VAL 165.A N ALA 161.A O no hydrogen 2.996 N/A GLU 166.A N ILE 162.A O no hydrogen 2.953 N/A GLU 167.A N LEU 163.A O no hydrogen 2.999 N/A LYS 168.A N VAL 165.A O no hydrogen 2.869 N/A LYS 169.A N VAL 165.A O no hydrogen 2.829 N/A LYS 169.A NZ ASP 171.A OD1 no hydrogen 2.583 N/A LYS 169.A NZ ASP 171.A OD2 no hydrogen 3.509 N/A ALA 172.A N LYS 169.A O no hydrogen 2.990 N/A SER 174.A N ASP 171.A O no hydrogen 2.968 N/A PHE 176.A N LEU 173.A O no hydrogen 3.114 N/A LEU 178.A N GLU 135.A OE2 no hydrogen 2.872 N/A LEU 179.A N GLU 135.A OE1 no hydrogen 2.966 N/A GLN 180.A N PHE 176.A O no hydrogen 2.969 N/A ALA 181.A N PRO 177.A O no hydrogen 3.030 N/A PHE 182.A N LEU 178.A O no hydrogen 2.818 N/A LYS 183.A N LEU 179.A O no hydrogen 2.795 N/A LYS 183.A NZ GLU 166.A OE1 no hydrogen 2.716 N/A LYS 183.A NZ GLU 166.A OE2 no hydrogen 3.378 N/A LYS 184.A N GLN 180.A O no hydrogen 3.285 N/A ARG 185.A N ALA 181.A O no hydrogen 2.971 N/A ARG 185.A NH2 ASP 144.A O no hydrogen 2.847 N/A ILE 186.A N PHE 182.A O no hydrogen 2.978 N/A SER 187.A N LYS 183.A O no hydrogen 3.046 N/A SER 187.A OG LYS 183.A O no hydrogen 2.679 N/A SER 188.A N LYS 184.A O no hydrogen 3.207 N/A SER 188.A N ARG 185.A O no hydrogen 3.136 N/A SER 188.A OG LYS 184.A O no hydrogen 2.861 N/A ILE 189.A N ILE 186.A O no hydrogen 3.249 N/A THR 191.A OG1 ALA 23.A O no hydrogen 2.792 N/A LYS 193.A N ILE 189.A O no hydrogen 2.713 N/A LYS 194.A N PRO 190.A O no hydrogen 3.030 N/A PHE 195.A N THR 191.A O no hydrogen 3.216 N/A LEU 196.A N ILE 192.A O no hydrogen 3.030 N/A ALA 197.A N LYS 194.A O no hydrogen 3.121 N/A SER 200.A OG PHE 195.A O no hydrogen 2.610 N/A SER 200.A OG ALA 197.A O no hydrogen 3.479 N/A ARG 202.A N SER 200.A OG no hydrogen 3.181 N/A LYS 203.A N GLU 15.A OE2 no hydrogen 2.915 N/A LYS 203.A NZ GLU 30.A OE2 no hydrogen 2.787 N/A LYS 203.A NZ LYS 201.A O no hydrogen 2.621 N/A TYR 210.A N ASP 207.A OD1 no hydrogen 3.020 N/A VAL 211.A N ASP 207.A O no hydrogen 3.222 N/A GLU 212.A N ASP 208.A O no hydrogen 2.862 N/A THR 213.A N LYS 209.A O no hydrogen 2.954 N/A THR 213.A OG1 LYS 209.A O no hydrogen 3.226 N/A VAL 214.A N TYR 210.A O no hydrogen 2.954 N/A ARG 215.A N VAL 211.A O no hydrogen 2.948 N/A ARG 215.A NE TYR 221.A O no hydrogen 2.643 N/A ARG 215.A NH2 TYR 221.A O no hydrogen 3.215 N/A ARG 216.A N GLU 212.A O no hydrogen 2.956 N/A ARG 216.A NE GLU 34.A O no hydrogen 3.026 N/A ARG 216.A NH2 GLU 34.A O no hydrogen 2.845 N/A ARG 216.A NH2 THR 213.A OG1 no hydrogen 3.047 N/A VAL 217.A N THR 213.A O no hydrogen 2.907 N/A LEU 218.A N VAL 214.A O no hydrogen 2.907 N/A ARG 219.A N ARG 215.A O no hydrogen 2.783 N/A