Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4pnf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): THR 4.A N GLU 58.A O no hydrogen 2.879 N/A LEU 5.A N GLU 29.A O no hydrogen 2.770 N/A TYR 6.A N THR 56.A O no hydrogen 2.859 N/A TYR 6.A OH GLU 58.A OE2 no hydrogen 3.134 N/A GLY 7.A N VAL 31.A O no hydrogen 3.148 N/A SER 11.A N LEU 8.A O no hydrogen 3.234 N/A ARG 15.A N SER 11.A O no hydrogen 3.112 N/A ARG 15.A NE ASP 9.A O no hydrogen 2.864 N/A ARG 15.A NH1 SER 165.A O no hydrogen 2.840 N/A ARG 15.A NH1 ASN 201.A OD1 no hydrogen 2.593 N/A ARG 15.A NH2 PRO 10.A O no hydrogen 3.019 N/A ARG 15.A NH2 SER 169.A OG no hydrogen 3.086 N/A ALA 16.A N PRO 12.A O no hydrogen 3.044 N/A VAL 17.A N PRO 13.A O no hydrogen 3.394 N/A LYS 18.A N VAL 14.A O no hydrogen 3.036 N/A LYS 18.A NZ ASP 9.A OD2 no hydrogen 2.852 N/A LEU 19.A N ARG 15.A O no hydrogen 3.160 N/A THR 20.A N ALA 16.A O no hydrogen 3.343 N/A THR 20.A OG1 ALA 16.A O no hydrogen 2.909 N/A LEU 21.A N VAL 17.A O no hydrogen 2.867 N/A ALA 22.A N LYS 18.A O no hydrogen 2.989 N/A ALA 23.A N LEU 19.A O no hydrogen 2.841 N/A LEU 24.A N THR 20.A O no hydrogen 3.035 N/A LEU 24.A N LEU 21.A O no hydrogen 3.017 N/A ASN 25.A N ALA 22.A O no hydrogen 3.085 N/A LEU 26.A N LEU 21.A O no hydrogen 3.293 N/A GLU 29.A N LEU 3.A O no hydrogen 2.922 N/A TYR 30.A OH ASP 9.A OD2 no hydrogen 2.769 N/A VAL 31.A N LEU 5.A O no hydrogen 2.886 N/A VAL 33.A N GLY 7.A O no hydrogen 3.126 N/A ARG 38.A N ILE 35.A O no hydrogen 2.772 N/A ALA 39.A N ASP 34.A O no hydrogen 2.928 N/A GLN 40.A N GLN 40.A OE1 no hydrogen 2.498 N/A LEU 41.A N ARG 38.A O no hydrogen 3.027 N/A SER 42.A N ALA 39.A O no hydrogen 3.460 N/A SER 42.A OG ALA 39.A O no hydrogen 3.534 N/A SER 42.A OG GLU 44.A OE2 no hydrogen 3.471 N/A TYR 45.A N SER 42.A OG no hydrogen 3.009 N/A TYR 45.A OH THR 53.A O no hydrogen 2.749 N/A LEU 46.A N SER 42.A O no hydrogen 2.816 N/A GLU 47.A N PRO 43.A O no hydrogen 3.054 N/A LYS 48.A NZ TYR 6.A OH no hydrogen 2.954 N/A LYS 48.A NZ TYR 63.A OH no hydrogen 3.558 N/A ASN 49.A N TYR 45.A O no hydrogen 2.692 N/A ASN 49.A ND2 THR 53.A O no hydrogen 2.930 N/A ASN 49.A ND2 THR 53.A OG1 no hydrogen 3.081 N/A ASN 49.A ND2 THR 56.A OG1 no hydrogen 3.231 N/A GLN 51.A N ASN 49.A OD1 no hydrogen 3.097 N/A HIS 52.A N ASN 49.A O no hydrogen 2.608 N/A THR 56.A N TYR 6.A O no hydrogen 3.259 N/A THR 56.A OG1 TYR 45.A OH no hydrogen 2.834 N/A THR 56.A OG1 THR 53.A O no hydrogen 3.377 N/A LEU 57.A N ILE 64.A O no hydrogen 2.776 N/A GLU 58.A N THR 4.A O no hydrogen 2.926 N/A ASP 59.A N HIS 62.A O no hydrogen 2.803 N/A ASP 60.A N LYS 2.A O no hydrogen 3.137 N/A HIS 62.A N ASP 59.A O no hydrogen 2.868 N/A ILE 64.A N LEU 57.A O no hydrogen 2.648 N/A TRP 65.A NE1 GLN 51.A OE1 no hydrogen 2.758 N/A HIS 68.A N ASP 66.A OD1 no hydrogen 2.994 N/A HIS 68.A ND1 ASP 66.A OD1 no hydrogen 2.712 N/A HIS 68.A NE2 GLU 102.A OE1 no hydrogen 2.535 N/A ILE 70.A N ASP 66.A O no hydrogen 2.772 N/A ILE 71.A N SER 67.A O no hydrogen 2.935 N/A ALA 72.A N HIS 68.A O no hydrogen 3.151 N/A TYR 73.A N ALA 69.A O no hydrogen 2.897 N/A TYR 73.A OH ASP 59.A OD1 no hydrogen 2.716 N/A LEU 74.A N ILE 70.A O no hydrogen 2.924 N/A VAL 75.A N ILE 71.A O no hydrogen 3.221 N/A SER 76.A N ALA 72.A O no hydrogen 3.012 N/A SER 76.A OG ALA 72.A O no hydrogen 3.072 N/A SER 76.A OG TYR 73.A O no hydrogen 3.105 N/A LYS 77.A N TYR 73.A O no hydrogen 2.910 N/A TYR 78.A N LEU 74.A O no hydrogen 2.659 N/A TYR 78.A OH ASP 59.A OD1 no hydrogen 2.495 N/A TYR 78.A OH ASP 59.A OD2 no hydrogen 3.407 N/A ALA 79.A N VAL 75.A O no hydrogen 2.902 N/A ALA 83.A N SER 81.A OG no hydrogen 3.225 N/A TYR 85.A N ASP 82.A O no hydrogen 2.907 N/A TYR 85.A OH ASP 96.A OD1 no hydrogen 2.726 N/A LYS 87.A N ASP 82.A OD2 no hydrogen 2.849 N/A LYS 91.A N ASP 88.A OD2 no hydrogen 3.042 N/A LYS 91.A NZ GLN 155.A OE1 no hydrogen 2.991 N/A ARG 92.A N ASP 88.A O no hydrogen 2.735 N/A ARG 92.A NE PRO 86.A O no hydrogen 3.009 N/A ARG 92.A NH1 TYR 85.A O no hydrogen 3.213 N/A ARG 92.A NH1 PRO 86.A O no hydrogen 3.322 N/A ALA 93.A N PRO 89.A O no hydrogen 2.852 N/A VAL 94.A N LEU 90.A O no hydrogen 3.181 N/A VAL 95.A N LYS 91.A O no hydrogen 3.163 N/A ASP 96.A N ARG 92.A O no hydrogen 2.730 N/A GLN 97.A N ALA 93.A O no hydrogen 3.049 N/A ARG 98.A N VAL 94.A O no hydrogen 3.122 N/A ARG 98.A NE ILE 151.A O no hydrogen 2.716 N/A ARG 98.A NH1 GLN 97.A OE1 no hydrogen 2.854 N/A ARG 98.A NH2 ILE 151.A O no hydrogen 2.932 N/A LEU 99.A N VAL 95.A O no hydrogen 2.931 N/A HIS 100.A N ASP 96.A O no hydrogen 2.982 N/A PHE 101.A N GLN 97.A O no hydrogen 2.855 N/A GLU 102.A N ARG 98.A O no hydrogen 3.034 N/A SER 103.A N LEU 99.A O no hydrogen 3.107 N/A SER 103.A OG LEU 99.A O no hydrogen 3.393 N/A GLY 104.A N HIS 100.A O no hydrogen 3.128 N/A VAL 105.A N PHE 101.A O no hydrogen 3.010 N/A VAL 106.A N PHE 101.A O no hydrogen 3.115 N/A PHE 107.A N GLU 102.A O no hydrogen 2.557 N/A ALA 108.A N SER 103.A O no hydrogen 3.153 N/A ASN 109.A N GLY 104.A O no hydrogen 3.062 N/A GLY 110.A N VAL 106.A O no hydrogen 2.935 N/A ILE 111.A N PHE 107.A O no hydrogen 3.099 N/A ARG 112.A N PHE 107.A O no hydrogen 2.921 N/A SER 113.A N ALA 108.A O no hydrogen 3.107 N/A SER 113.A OG ASN 109.A O no hydrogen 2.655 N/A SER 115.A N ILE 111.A O no hydrogen 2.767 N/A LYS 116.A N ARG 112.A O no hydrogen 2.969 N/A SER 117.A OG SER 113.A O no hydrogen 3.403 N/A VAL 118.A N ILE 114.A O no hydrogen 3.164 N/A LEU 119.A N SER 115.A O no hydrogen 3.008 N/A PHE 120.A N LYS 116.A O no hydrogen 3.186 N/A GLN 121.A N SER 117.A O no hydrogen 3.233 N/A GLN 123.A NE2 GLN 121.A OE1 no hydrogen 3.179 N/A VAL 126.A N THR 218.A O no hydrogen 2.679 N/A LYS 128.A NZ ASP 132.A OD1 no hydrogen 3.356 N/A ARG 130.A N PRO 127.A O no hydrogen 3.056 N/A ARG 130.A NE SER 113.A OG no hydrogen 3.323 N/A ARG 130.A NH1 ASN 109.A O no hydrogen 2.939 N/A ASP 132.A N LYS 128.A O no hydrogen 2.775 N/A ALA 133.A N GLU 129.A O no hydrogen 2.756 N/A ILE 135.A N TYR 131.A O no hydrogen 3.279 N/A GLU 136.A N ASP 132.A O no hydrogen 3.030 N/A ILE 137.A N ALA 133.A O no hydrogen 2.897 N/A TYR 138.A N ILE 134.A O no hydrogen 2.769 N/A TYR 138.A OH VAL 174.A O no hydrogen 2.640 N/A ASP 139.A N ILE 135.A O no hydrogen 2.966 N/A PHE 140.A N GLU 136.A O no hydrogen 2.933 N/A VAL 141.A N ILE 137.A O no hydrogen 2.971 N/A GLU 142.A N TYR 138.A O no hydrogen 2.721 N/A THR 143.A N ASP 139.A O no hydrogen 2.963 N/A THR 143.A OG1 ASP 139.A O no hydrogen 2.722 N/A PHE 144.A N PHE 140.A O no hydrogen 2.678 N/A LEU 145.A N VAL 141.A O no hydrogen 3.004 N/A LYS 146.A N THR 143.A O no hydrogen 3.149 N/A GLN 148.A N LEU 145.A O no hydrogen 3.180 N/A TYR 150.A N GLY 153.A O no hydrogen 3.346 N/A ILE 151.A N ASP 160.A OD1 no hydrogen 2.807 N/A GLN 155.A NE2 ALA 83.A O no hydrogen 2.745 N/A THR 157.A N ASP 160.A OD2 no hydrogen 2.935 N/A ILE 158.A N LEU 84.A O no hydrogen 2.918 N/A ASP 160.A N THR 157.A O no hydrogen 2.855 N/A PHE 161.A N THR 157.A O no hydrogen 3.438 N/A SER 162.A N ILE 158.A O no hydrogen 2.840 N/A SER 162.A OG HIS 68.A NE2 no hydrogen 3.199 N/A LEU 163.A N ALA 159.A O no hydrogen 3.016 N/A VAL 164.A N ASP 160.A O no hydrogen 2.844 N/A SER 165.A N PHE 161.A O no hydrogen 3.130 N/A SER 165.A OG PRO 12.A O no hydrogen 3.083 N/A SER 165.A OG SER 162.A O no hydrogen 2.736 N/A SER 166.A OG GLU 102.A OE2 no hydrogen 2.583 N/A SER 166.A OG SER 162.A O no hydrogen 3.356 N/A SER 166.A OG LEU 163.A O no hydrogen 3.496 N/A VAL 167.A N LEU 163.A O no hydrogen 2.696 N/A ALA 168.A N VAL 164.A O no hydrogen 3.114 N/A SER 169.A OG SER 165.A O no hydrogen 2.655 N/A LEU 170.A N VAL 167.A O no hydrogen 3.065 N/A ALA 172.A N SER 169.A O no hydrogen 2.906 N/A PHE 173.A N LEU 170.A O no hydrogen 2.822 N/A VAL 174.A N LEU 170.A O no hydrogen 2.823 N/A THR 179.A N ASP 177.A OD1 no hydrogen 2.851 N/A LYS 180.A N ASP 177.A OD1 no hydrogen 2.900 N/A LYS 180.A NZ ASP 139.A OD1 no hydrogen 3.406 N/A TYR 181.A N ASP 177.A O no hydrogen 2.876 N/A TYR 181.A OH ASP 139.A OD1 no hydrogen 2.892 N/A ARG 183.A N GLU 142.A OE2 no hydrogen 3.036 N/A ARG 183.A NH1 GLU 142.A O no hydrogen 2.885 N/A ILE 184.A N GLU 142.A OE1 no hydrogen 3.130 N/A GLY 185.A N TYR 181.A O no hydrogen 3.198 N/A ALA 186.A N PRO 182.A O no hydrogen 3.136 N/A TRP 187.A N ARG 183.A O no hydrogen 2.958 N/A TRP 187.A NE1 ASP 160.A OD1 no hydrogen 2.904 N/A ILE 188.A N ILE 184.A O no hydrogen 3.128 N/A LYS 189.A N GLY 185.A O no hydrogen 3.072 N/A LYS 190.A N ALA 186.A O no hydrogen 2.766 N/A LEU 191.A N TRP 187.A O no hydrogen 3.020 N/A GLU 192.A N ILE 188.A O no hydrogen 2.980 N/A GLN 193.A N LYS 190.A O no hydrogen 3.314 N/A GLN 193.A NE2 LYS 189.A O no hydrogen 2.351 N/A LEU 194.A N LEU 191.A O no hydrogen 2.961 N/A TYR 197.A N LEU 194.A O no hydrogen 3.086 N/A ALA 200.A N TYR 196.A O no hydrogen 3.062 N/A ASN 201.A N TYR 197.A O no hydrogen 2.609 N/A ASN 201.A ND2 VAL 164.A O no hydrogen 3.693 N/A ASN 201.A ND2 TYR 197.A OH no hydrogen 3.038 N/A GLY 202.A N TYR 197.A O no hydrogen 2.882 N/A LYS 203.A N GLU 198.A O no hydrogen 3.147 N/A LYS 203.A NZ GLU 198.A OE1 no hydrogen 2.785 N/A LYS 203.A NZ GLU 199.A OE2 no hydrogen 3.014 N/A VAL 205.A N ASN 201.A O no hydrogen 3.144 N/A ARG 206.A N GLY 202.A O no hydrogen 3.315 N/A ARG 206.A NH1 GLU 198.A OE1 no hydrogen 2.845 N/A ARG 206.A NH2 GLU 198.A OE2 no hydrogen 3.161 N/A GLN 207.A N LYS 203.A O no hydrogen 2.966 N/A LEU 208.A N GLY 204.A O no hydrogen 2.981 N/A VAL 209.A N VAL 205.A O no hydrogen 2.912 N/A ALA 210.A N ARG 206.A O no hydrogen 3.069 N/A ILE 211.A N GLN 207.A O no hydrogen 2.969 N/A PHE 212.A N LEU 208.A O no hydrogen 3.141 N/A LYS 213.A N VAL 209.A O no hydrogen 2.972 N/A LYS 214.A N ALA 210.A O no hydrogen 3.318 N/A THR 215.A N PHE 212.A O no hydrogen 2.984 N/A THR 215.A OG1 PHE 212.A O no hydrogen 2.531 N/A ASN 216.A N LYS 213.A O no hydrogen 3.436 N/A PHE 217.A N THR 215.A OG1 no hydrogen 3.388 N/A THR 218.A N THR 124.A O no hydrogen 3.167 N/A