Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3f6d_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 2.A N VAL 56.A O no hydrogen 2.955 N/A PHE 3.A N ASN 27.A O no hydrogen 2.867 N/A TYR 4.A N THR 54.A O no hydrogen 2.843 N/A TYR 5.A N LYS 29.A O no hydrogen 3.086 N/A SER 9.A N LEU 6.A O no hydrogen 3.123 N/A CYS 12.A SG SER 9.A OG no hydrogen 3.418 N/A ARG 13.A N SER 9.A O no hydrogen 2.988 N/A ARG 13.A NE PRO 7.A O no hydrogen 3.074 N/A ARG 13.A NH1 ALA 170.A O no hydrogen 2.946 N/A ARG 13.A NH1 ASN 205.A OD1 no hydrogen 2.945 N/A ARG 13.A NH2 GLY 8.A O no hydrogen 2.883 N/A ARG 13.A NH2 THR 174.A OG1 no hydrogen 2.909 N/A ALA 14.A N ALA 10.A O no hydrogen 2.990 N/A VAL 15.A N PRO 11.A O no hydrogen 3.276 N/A GLN 16.A N CYS 12.A O no hydrogen 2.969 N/A MET 17.A N ARG 13.A O no hydrogen 2.929 N/A THR 18.A N ALA 14.A O no hydrogen 3.071 N/A THR 18.A OG1 ALA 14.A O no hydrogen 2.883 N/A ALA 19.A N VAL 15.A O no hydrogen 2.801 N/A ALA 20.A N GLN 16.A O no hydrogen 3.021 N/A ALA 21.A N MET 17.A O no hydrogen 2.959 N/A VAL 22.A N THR 18.A O no hydrogen 3.073 N/A GLY 23.A N ALA 20.A O no hydrogen 3.219 N/A VAL 24.A N ALA 19.A O no hydrogen 2.939 N/A ASN 27.A N MET 1.A O no hydrogen 2.891 N/A ASN 27.A ND2 ASP 2.A OD1 no hydrogen 2.830 N/A LYS 29.A N PHE 3.A O no hydrogen 2.890 N/A THR 31.A N TYR 5.A O no hydrogen 2.980 N/A THR 31.A OG1 LYS 29.A O no hydrogen 3.025 N/A ASN 32.A N GLU 37.A OE1 no hydrogen 2.791 N/A ALA 35.A N ASN 32.A OD1 no hydrogen 2.869 N/A GLY 36.A N LEU 33.A O no hydrogen 2.921 N/A GLU 37.A N ASN 32.A O no hydrogen 2.963 N/A HIS 38.A N HIS 38.A ND1 no hydrogen 2.834 N/A MET 39.A N GLY 36.A O no hydrogen 2.957 N/A GLU 42.A N GLU 42.A OE1 no hydrogen 2.734 N/A LEU 44.A N LYS 40.A O no hydrogen 2.944 N/A LYS 45.A N PRO 41.A O no hydrogen 3.010 N/A LEU 46.A N PHE 43.A O no hydrogen 2.951 N/A ASN 47.A N PHE 43.A O no hydrogen 2.809 N/A ASN 47.A ND2 THR 54.A OG1 no hydrogen 2.936 N/A GLN 49.A N ASN 47.A OD1 no hydrogen 2.870 N/A HIS 50.A N ASN 47.A O no hydrogen 2.943 N/A HIS 50.A ND1 HIS 50.A O no hydrogen 2.779 N/A THR 54.A N TYR 4.A O no hydrogen 3.197 N/A THR 54.A OG1 CYS 51.A O no hydrogen 2.709 N/A LEU 55.A N LEU 63.A O no hydrogen 2.804 N/A VAL 56.A N ASP 2.A O no hydrogen 2.865 N/A ASP 57.A N PHE 61.A O no hydrogen 2.855 N/A GLU 58.A N GLU 58.A OE1 no hydrogen 2.753 N/A ASP 59.A N ASP 57.A OD1 no hydrogen 2.782 N/A GLY 60.A N ASP 57.A O no hydrogen 3.070 N/A PHE 61.A N ASP 57.A OD1 no hydrogen 2.897 N/A LEU 63.A N LEU 55.A O no hydrogen 2.881 N/A TRP 64.A NE1 GLN 49.A OE1 no hydrogen 2.856 N/A SER 66.A OG GLU 65.A OE1 no hydrogen 3.453 N/A ARG 67.A N GLU 65.A OE1 no hydrogen 2.927 N/A ARG 67.A NE ASP 106.A OD2 no hydrogen 3.276 N/A ARG 67.A NH1 GLU 65.A OE1 no hydrogen 2.837 N/A ARG 67.A NH2 ASP 106.A OD2 no hydrogen 2.789 N/A ILE 69.A N GLU 65.A O no hydrogen 3.030 N/A GLN 70.A N SER 66.A O no hydrogen 2.793 N/A GLN 70.A NE2 THR 18.A OG1 no hydrogen 2.946 N/A GLN 70.A NE2 ILE 163.A O no hydrogen 3.061 N/A ILE 71.A N ARG 67.A O no hydrogen 3.194 N/A TYR 72.A N ALA 68.A O no hydrogen 3.002 N/A TYR 72.A OH ASP 57.A OD2 no hydrogen 2.617 N/A LEU 73.A N ILE 69.A O no hydrogen 2.831 N/A VAL 74.A N GLN 70.A O no hydrogen 3.082 N/A GLU 75.A N ILE 71.A O no hydrogen 2.864 N/A LYS 76.A N TYR 72.A O no hydrogen 2.907 N/A LYS 76.A NZ ASP 57.A OD2 no hydrogen 3.485 N/A LYS 76.A NZ GLU 58.A OE2 no hydrogen 2.753 N/A LYS 76.A NZ TYR 72.A OH no hydrogen 2.999 N/A LYS 76.A NZ TYR 77.A OH no hydrogen 3.153 N/A TYR 77.A N LEU 73.A O no hydrogen 2.924 N/A TYR 77.A OH GLU 58.A OE1 no hydrogen 2.604 N/A GLY 78.A N VAL 74.A O no hydrogen 3.076 N/A ASP 81.A N GLY 78.A O no hydrogen 3.038 N/A LEU 84.A N ASP 81.A OD2 no hydrogen 3.237 N/A ALA 85.A N ASP 81.A O no hydrogen 3.026 N/A GLU 86.A N ALA 82.A O no hydrogen 3.011 N/A ARG 87.A N ASP 83.A O no hydrogen 2.952 N/A LEU 88.A N LEU 84.A O no hydrogen 2.964 N/A TYR 89.A N ALA 85.A O no hydrogen 2.814 N/A TYR 89.A OH HIS 100.A NE2 no hydrogen 2.698 N/A SER 91.A N GLU 86.A OE2 no hydrogen 3.142 N/A SER 91.A OG GLU 86.A OE2 no hydrogen 3.151 N/A ARG 94.A N ASP 92.A OD2 no hydrogen 2.943 N/A ARG 94.A NE ASP 92.A OD2 no hydrogen 2.983 N/A ARG 94.A NH2 ASP 92.A OD1 no hydrogen 3.199 N/A ARG 95.A N ASP 92.A OD2 no hydrogen 3.236 N/A ARG 96.A N ASP 92.A O no hydrogen 2.721 N/A ARG 96.A NE PRO 90.A O no hydrogen 2.815 N/A ARG 96.A NH2 TYR 89.A O no hydrogen 3.096 N/A ARG 96.A NH2 PRO 90.A O no hydrogen 3.482 N/A ALA 97.A N PRO 93.A O no hydrogen 2.887 N/A VAL 98.A N ARG 94.A O no hydrogen 3.144 N/A VAL 99.A N ARG 95.A O no hydrogen 3.127 N/A HIS 100.A N ARG 96.A O no hydrogen 2.882 N/A HIS 100.A NE2 TYR 89.A OH no hydrogen 2.698 N/A GLN 101.A N ALA 97.A O no hydrogen 2.846 N/A ARG 102.A N VAL 98.A O no hydrogen 2.944 N/A ARG 102.A NE VAL 155.A O no hydrogen 2.670 N/A ARG 102.A NH1 GLN 101.A OE1 no hydrogen 2.671 N/A ARG 102.A NH2 VAL 155.A O no hydrogen 3.478 N/A LEU 103.A N VAL 99.A O no hydrogen 2.974 N/A PHE 104.A N HIS 100.A O no hydrogen 2.908 N/A PHE 105.A N GLN 101.A O no hydrogen 2.748 N/A ASP 106.A N ARG 102.A O no hydrogen 2.852 N/A VAL 107.A N LEU 103.A O no hydrogen 3.066 N/A ALA 108.A N PHE 104.A O no hydrogen 2.897 N/A VAL 109.A N PHE 105.A O no hydrogen 2.867 N/A LEU 110.A N PHE 105.A O no hydrogen 2.925 N/A TYR 111.A N ASP 106.A O no hydrogen 2.761 N/A TYR 111.A OH TYR 119.A OH no hydrogen 2.661 N/A GLN 112.A NE2 GLU 116.A OE2 no hydrogen 2.858 N/A ARG 113.A N VAL 109.A O no hydrogen 2.954 N/A ARG 113.A NH1 SER 137.A O no hydrogen 3.061 N/A ARG 113.A NH1 GLN 140.A OE1 no hydrogen 2.858 N/A PHE 114.A N LEU 110.A O no hydrogen 3.322 N/A ALA 115.A N TYR 111.A O no hydrogen 2.935 N/A GLU 116.A N GLN 112.A O no hydrogen 2.932 N/A TYR 117.A N ARG 113.A O no hydrogen 3.032 N/A TYR 118.A N PHE 114.A O no hydrogen 2.852 N/A TYR 119.A N ALA 115.A O no hydrogen 2.900 N/A TYR 119.A OH TYR 111.A OH no hydrogen 2.661 N/A GLN 121.A N TYR 118.A O no hydrogen 2.853 N/A ILE 122.A N TYR 118.A O no hydrogen 3.047 N/A ILE 122.A N TYR 119.A O no hydrogen 3.293 N/A ALA 123.A N TYR 119.A O no hydrogen 2.960 N/A LYS 126.A N ALA 123.A O no hydrogen 2.976 N/A VAL 127.A N PRO 120.A O no hydrogen 2.794 N/A ARG 134.A N ASP 131.A OD2 no hydrogen 2.949 N/A LEU 135.A N ASP 131.A O no hydrogen 2.833 N/A ARG 136.A N PRO 132.A O no hydrogen 2.943 N/A SER 137.A N GLY 133.A O no hydrogen 2.973 N/A MET 138.A N ARG 134.A O no hydrogen 2.954 N/A GLU 139.A N LEU 135.A O no hydrogen 2.827 N/A GLN 140.A N ARG 136.A O no hydrogen 2.881 N/A ALA 141.A N SER 137.A O no hydrogen 3.144 N/A LEU 142.A N MET 138.A O no hydrogen 3.115 N/A GLU 143.A N GLU 139.A O no hydrogen 2.861 N/A PHE 144.A N GLN 140.A O no hydrogen 2.918 N/A LEU 145.A N ALA 141.A O no hydrogen 3.024 N/A ASN 146.A N LEU 142.A O no hydrogen 2.834 N/A ASN 146.A ND2 GLU 186.A OE2 no hydrogen 2.926 N/A THR 147.A N GLU 143.A O no hydrogen 2.949 N/A THR 147.A OG1 GLU 143.A O no hydrogen 3.121 N/A PHE 148.A N PHE 144.A O no hydrogen 2.903 N/A LEU 149.A N LEU 145.A O no hydrogen 3.037 N/A GLU 150.A N THR 147.A O no hydrogen 3.036 N/A GLU 152.A N LEU 149.A O no hydrogen 3.014 N/A VAL 155.A N ASP 165.A OD1 no hydrogen 2.905 N/A GLY 157.A N TYR 154.A O no hydrogen 3.095 N/A THR 162.A N ASP 165.A OD2 no hydrogen 2.834 N/A THR 162.A OG1 ASP 165.A OD2 no hydrogen 3.301 N/A ILE 163.A N LEU 88.A O no hydrogen 2.833 N/A ALA 164.A N THR 162.A OG1 no hydrogen 3.142 N/A LEU 166.A N THR 162.A O no hydrogen 3.238 N/A SER 167.A N ILE 163.A O no hydrogen 2.979 N/A SER 167.A OG ASP 106.A OD2 no hydrogen 2.617 N/A ILE 168.A N ALA 164.A O no hydrogen 3.011 N/A LEU 169.A N ASP 165.A O no hydrogen 2.781 N/A ALA 170.A N LEU 166.A O no hydrogen 3.180 N/A THR 171.A N SER 167.A O no hydrogen 3.149 N/A THR 171.A OG1 ASP 106.A OD1 no hydrogen 2.780 N/A THR 171.A OG1 ASP 106.A OD2 no hydrogen 3.193 N/A THR 171.A OG1 SER 167.A O no hydrogen 3.463 N/A ILE 172.A N ILE 168.A O no hydrogen 2.699 N/A ALA 173.A N LEU 169.A O no hydrogen 2.960 N/A THR 174.A N ALA 170.A O no hydrogen 3.370 N/A THR 174.A OG1 ALA 170.A O no hydrogen 2.730 N/A TYR 175.A N THR 171.A O no hydrogen 3.082 N/A TYR 175.A OH LEU 110.A O no hydrogen 2.646 N/A GLU 176.A N ILE 172.A O no hydrogen 2.977 N/A VAL 177.A N ALA 173.A O no hydrogen 3.162 N/A ALA 178.A N THR 174.A O no hydrogen 3.065 N/A GLY 179.A N GLU 176.A O no hydrogen 2.941 N/A TYR 180.A N TYR 175.A O no hydrogen 3.187 N/A TYR 180.A OH GLU 139.A OE2 no hydrogen 2.679 N/A ARG 183.A N ASP 181.A OD1 no hydrogen 3.220 N/A ARG 184.A N ASP 181.A O no hydrogen 3.259 N/A TYR 185.A N LEU 182.A O no hydrogen 2.819 N/A GLU 186.A N GLU 186.A OE1 no hydrogen 2.656 N/A ASN 187.A N ASN 146.A OD1 no hydrogen 2.914 N/A ASN 187.A ND2 ASN 146.A O no hydrogen 2.935 N/A ASN 187.A ND2 GLU 150.A OE2 no hydrogen 2.862 N/A VAL 188.A N ASN 146.A OD1 no hydrogen 3.246 N/A GLN 189.A N TYR 185.A O no hydrogen 2.935 N/A GLN 189.A NE2 GLU 193.A OE2 no hydrogen 2.924 N/A ARG 190.A N GLU 186.A O no hydrogen 2.967 N/A ARG 190.A NH1 GLU 152.A O no hydrogen 2.825 N/A ARG 190.A NH2 LEU 149.A O no hydrogen 2.869 N/A TRP 191.A N ASN 187.A O no hydrogen 2.973 N/A TRP 191.A NE1 ASP 165.A OD1 no hydrogen 2.873 N/A TYR 192.A N VAL 188.A O no hydrogen 2.804 N/A TYR 192.A OH GLU 176.A OE1 no hydrogen 2.605 N/A GLU 193.A N GLN 189.A O no hydrogen 3.023 N/A ARG 194.A N ARG 190.A O no hydrogen 3.074 N/A ARG 194.A NH1 TYR 154.A OH no hydrogen 2.263 N/A THR 195.A N TRP 191.A O no hydrogen 2.850 N/A THR 195.A OG1 TRP 191.A O no hydrogen 2.795 N/A SER 196.A N TYR 192.A O no hydrogen 3.008 N/A SER 196.A OG TYR 192.A O no hydrogen 2.758 N/A ALA 197.A N GLU 193.A O no hydrogen 3.150 N/A ALA 197.A N ARG 194.A O no hydrogen 3.140 N/A ILE 198.A N THR 195.A O no hydrogen 3.089 N/A VAL 199.A N THR 195.A O no hydrogen 3.100 N/A ALA 202.A N VAL 199.A O no hydrogen 3.406 N/A LYS 204.A N GLY 201.A O no hydrogen 3.004 N/A LYS 204.A NZ ASP 203.A OD1 no hydrogen 3.261 N/A ASN 205.A N GLY 201.A O no hydrogen 3.231 N/A ASN 205.A ND2 LEU 169.A O no hydrogen 3.308 N/A VAL 206.A N ALA 202.A O no hydrogen 2.784 N/A GLU 207.A N ASP 203.A O no hydrogen 2.994 N/A GLY 208.A N LYS 204.A O no hydrogen 2.993 N/A ALA 209.A N ASN 205.A O no hydrogen 2.882 N/A LYS 210.A N VAL 206.A O no hydrogen 3.064 N/A VAL 211.A N GLU 207.A O no hydrogen 3.133 N/A PHE 212.A N GLY 208.A O no hydrogen 3.082 N/A GLY 213.A N ALA 209.A O no hydrogen 3.125 N/A GLY 213.A N LYS 210.A O no hydrogen 3.030 N/A ARG 214.A N VAL 211.A O no hydrogen 2.911 N/A TYR 215.A N PHE 212.A O no hydrogen 3.109 N/A PHE 216.A N GLY 213.A O no hydrogen 2.897 N/A THR 217.A OG1 GLN 218.A OE1 no hydrogen 2.781 N/A