Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1yfj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): MET 1.A N GLN 12.A O no hydrogen 3.169 N/A GLY 3.A N GLN 12.A OE1 no hydrogen 3.165 N/A ALA 4.A N GLY 35.A O no hydrogen 2.898 N/A ASN 10.A N TYR 7.A O no hydrogen 2.964 N/A ASN 10.A ND2 TYR 7.A O no hydrogen 2.870 N/A LYS 11.A N SER 37.A OG no hydrogen 3.016 N/A LYS 11.A NZ GLY 9.A O no hydrogen 2.909 N/A LYS 11.A NZ ASP 171.A OD1 no hydrogen 3.009 N/A LYS 11.A NZ ASP 171.A OD2 no hydrogen 2.713 N/A LYS 11.A NZ TYR 174.A OH no hydrogen 2.845 N/A GLN 12.A N ASN 10.A OD1 no hydrogen 2.927 N/A LEU 15.A N LYS 11.A O no hydrogen 2.915 N/A LEU 18.A N LEU 14.A O no hydrogen 3.048 N/A LYS 19.A N LEU 15.A O no hydrogen 2.789 N/A LYS 19.A NZ ASN 41.A O no hydrogen 2.856 N/A SER 20.A N PRO 16.A O no hydrogen 3.195 N/A SER 20.A N GLU 17.A O no hydrogen 3.092 N/A HIS 21.A N LEU 18.A O no hydrogen 2.846 N/A HIS 21.A NE2 GLU 17.A OE2 no hydrogen 3.060 N/A PHE 22.A N LYS 19.A O no hydrogen 3.415 N/A TYR 25.A OH ASN 43.A O no hydrogen 2.693 N/A ASN 26.A N GLY 165.A O no hydrogen 2.771 N/A ARG 27.A NE ASP 166.A OD1 no hydrogen 2.725 N/A ARG 27.A NH2 LYS 161.A O no hydrogen 3.119 N/A ARG 27.A NH2 ASP 166.A OD1 no hydrogen 3.504 N/A ARG 27.A NH2 ASP 166.A OD2 no hydrogen 2.698 N/A PHE 28.A N PRO 45.A O no hydrogen 2.872 N/A VAL 29.A N PHE 167.A O no hydrogen 3.339 N/A ASP 30.A N LEU 47.A O no hydrogen 2.948 N/A LEU 31.A N TYR 169.A O no hydrogen 3.220 N/A CYS 33.A N ASN 49.A O no hydrogen 2.781 N/A CYS 33.A SG ASN 49.A O no hydrogen 3.140 N/A GLY 34.A N ASP 50.A OD2 no hydrogen 2.781 N/A LEU 36.A N CYS 33.A O no hydrogen 2.943 N/A SER 39.A OG ASP 30.A OD2 no hydrogen 2.503 N/A LEU 40.A N LEU 36.A O no hydrogen 3.270 N/A ASN 41.A N VAL 38.A O no hydrogen 2.960 N/A ASN 41.A ND2 LEU 2.A O no hydrogen 3.070 N/A ASN 41.A ND2 SER 37.A O no hydrogen 2.913 N/A VAL 46.A N LYS 149.A O no hydrogen 2.881 N/A LEU 47.A N PHE 28.A O no hydrogen 2.829 N/A ALA 48.A N ILE 151.A O no hydrogen 2.874 N/A ASN 49.A N ASP 30.A O no hydrogen 2.931 N/A ASN 49.A ND2 LEU 31.A O no hydrogen 3.290 N/A ASN 49.A ND2 LEU 155.A O no hydrogen 2.755 N/A ASP 50.A N SER 153.A O no hydrogen 3.025 N/A GLN 52.A N ASP 50.A OD1 no hydrogen 3.189 N/A GLU 53.A N ILE 51.A O no hydrogen 3.091 N/A ILE 55.A N GLN 52.A O no hydrogen 2.894 N/A ILE 56.A N GLN 52.A O no hydrogen 3.239 N/A GLU 57.A N GLU 53.A O no hydrogen 2.764 N/A MET 58.A N PRO 54.A O no hydrogen 3.066 N/A TYR 59.A N ILE 55.A O no hydrogen 3.018 N/A TYR 59.A OH GLY 34.A O no hydrogen 2.618 N/A LYS 60.A N ILE 56.A O no hydrogen 3.011 N/A ARG 61.A N GLU 57.A O no hydrogen 3.027 N/A LEU 62.A N MET 58.A O no hydrogen 2.938 N/A ILE 63.A N TYR 59.A O no hydrogen 3.379 N/A ASN 64.A N ARG 61.A O no hydrogen 3.025 N/A VAL 65.A N LEU 62.A O no hydrogen 3.079 N/A SER 66.A OG ASP 69.A OD1 no hydrogen 3.161 N/A ASP 69.A N SER 66.A O no hydrogen 2.713 N/A VAL 70.A N SER 66.A O no hydrogen 3.333 N/A LEU 71.A N TRP 67.A O no hydrogen 2.982 N/A LYS 72.A N ASP 68.A O no hydrogen 2.953 N/A VAL 73.A N ASP 69.A O no hydrogen 3.246 N/A ILE 74.A N VAL 70.A O no hydrogen 2.968 N/A LYS 75.A N LEU 71.A O no hydrogen 2.676 N/A GLN 76.A N LYS 72.A O no hydrogen 2.826 N/A TYR 77.A N VAL 73.A O no hydrogen 3.062 N/A TYR 77.A OH ASP 93.A OD2 no hydrogen 2.501 N/A LYS 78.A N LYS 75.A O no hydrogen 2.955 N/A LEU 79.A N ILE 74.A O no hydrogen 3.243 N/A SER 80.A N SER 83.A OG no hydrogen 2.572 N/A THR 82.A N SER 80.A OG no hydrogen 3.231 N/A SER 83.A N SER 80.A O no hydrogen 3.533 N/A SER 83.A OG SER 80.A O no hydrogen 3.265 N/A GLU 86.A N GLU 86.A OE1 no hydrogen 2.467 N/A PHE 87.A N SER 83.A O no hydrogen 2.805 N/A LEU 88.A N LYS 84.A O no hydrogen 3.070 N/A LYS 89.A N GLU 85.A O no hydrogen 3.221 N/A LEU 90.A N GLU 86.A O no hydrogen 3.070 N/A ARG 91.A N PHE 87.A O no hydrogen 2.951 N/A ARG 91.A NH1 THR 125.A O no hydrogen 3.116 N/A GLU 92.A N LEU 88.A O no hydrogen 3.005 N/A ASP 93.A N LYS 89.A O no hydrogen 2.941 N/A TYR 94.A N LEU 90.A O no hydrogen 2.739 N/A ASN 95.A N ARG 91.A O no hydrogen 2.893 N/A ASN 95.A ND2 PHE 123.A O no hydrogen 3.334 N/A LYS 96.A N GLU 92.A O no hydrogen 3.044 N/A LYS 96.A N ASP 93.A O no hydrogen 3.278 N/A THR 97.A N ASP 93.A O no hydrogen 2.960 N/A THR 97.A OG1 ASP 93.A O no hydrogen 2.898 N/A ARG 98.A N TYR 94.A O no hydrogen 2.714 N/A ARG 98.A NE ASN 95.A O no hydrogen 2.877 N/A ARG 98.A NH2 LYS 120.A O no hydrogen 2.882 N/A ARG 98.A NH2 ASN 122.A OD1 no hydrogen 2.990 N/A ASP 99.A N THR 97.A OG1 no hydrogen 3.312 N/A LEU 101.A N ASP 99.A OD1 no hydrogen 3.046 N/A LEU 102.A N ASP 99.A O no hydrogen 2.991 N/A LEU 103.A N ASP 99.A O no hydrogen 3.385 N/A TYR 104.A N PRO 100.A O no hydrogen 2.900 N/A VAL 105.A N LEU 101.A O no hydrogen 2.935 N/A LEU 106.A N LEU 102.A O no hydrogen 2.725 N/A HIS 107.A N LEU 103.A O no hydrogen 3.111 N/A HIS 107.A ND1 TYR 104.A O no hydrogen 2.847 N/A HIS 109.A N LEU 106.A O no hydrogen 2.750 N/A HIS 109.A ND1 VAL 105.A O no hydrogen 2.859 N/A HIS 109.A NE2 THR 131.A OG1 no hydrogen 2.719 N/A GLY 110.A N HIS 107.A O no hydrogen 3.477 N/A PHE 111.A N PRO 126.A O no hydrogen 2.766 N/A ASN 113.A N GLY 110.A O no hydrogen 2.740 N/A MET 114.A N PHE 111.A O no hydrogen 2.943 N/A ARG 116.A N THR 125.A OG1 no hydrogen 2.959 N/A ARG 116.A NE THR 124.A OG1 no hydrogen 3.171 N/A ARG 116.A NH2 THR 124.A O no hydrogen 3.242 N/A ASN 118.A N ASN 122.A O no hydrogen 2.764 N/A GLY 121.A N ASN 118.A O no hydrogen 2.765 N/A ASN 122.A N ASN 118.A OD1 no hydrogen 2.951 N/A PHE 123.A N ASN 95.A OD1 no hydrogen 2.749 N/A THR 124.A N ARG 116.A O no hydrogen 2.920 N/A THR 125.A OG1 MET 114.A O no hydrogen 2.974 N/A GLY 128.A N HIS 109.A O no hydrogen 2.888 N/A ARG 130.A NE GLY 128.A O no hydrogen 2.920 N/A THR 131.A OG1 HIS 109.A NE2 no hydrogen 2.719 N/A ILE 132.A N THR 131.A OG1 no hydrogen 2.793 N/A ASN 133.A N SER 136.A OG no hydrogen 2.834 N/A SER 136.A N ASN 133.A O no hydrogen 2.968 N/A SER 136.A OG ASN 133.A O no hydrogen 3.414 N/A ARG 139.A N ASN 135.A O no hydrogen 2.799 N/A ARG 139.A NH1 GLY 3.A O no hydrogen 3.388 N/A ARG 139.A NH1 GLN 12.A OE1 no hydrogen 2.921 N/A PHE 140.A N SER 136.A O no hydrogen 2.883 N/A ASN 141.A N GLU 137.A O no hydrogen 2.597 N/A HIS 142.A N LYS 138.A O no hydrogen 2.714 N/A HIS 142.A NE2 ASN 41.A OD1 no hydrogen 2.682 N/A PHE 143.A N ARG 139.A O no hydrogen 2.862 N/A PHE 143.A N PHE 140.A O no hydrogen 3.059 N/A LYS 144.A N PHE 140.A O no hydrogen 3.047 N/A LYS 144.A NZ LEU 62.A O no hydrogen 3.315 N/A LYS 144.A NZ ILE 63.A O no hydrogen 2.811 N/A LYS 144.A NZ VAL 65.A O no hydrogen 2.838 N/A GLN 145.A N ASN 141.A O no hydrogen 2.922 N/A ASN 146.A N PHE 143.A O no hydrogen 3.284 N/A CYS 147.A SG LYS 144.A O no hydrogen 3.798 N/A LYS 149.A NZ LEU 40.A O no hydrogen 2.873 N/A LYS 149.A NZ VAL 42.A O no hydrogen 2.745 N/A ILE 150.A N CYS 147.A O no hydrogen 2.983 N/A ILE 151.A N VAL 46.A O no hydrogen 2.865 N/A SER 153.A N ALA 48.A O no hydrogen 2.904 N/A SER 153.A OG ASN 49.A OD1 no hydrogen 2.611 N/A SER 154.A OG SER 154.A O no hydrogen 2.443 N/A LEU 155.A N ASN 49.A OD1 no hydrogen 2.862 N/A HIS 156.A NE2 GLU 189.A OE1 no hydrogen 2.721 N/A LYS 158.A N HIS 156.A ND1 no hydrogen 3.059 N/A ASP 159.A N HIS 156.A O no hydrogen 2.829 N/A VAL 160.A N PHE 157.A O no hydrogen 3.470 N/A LEU 163.A N ASP 166.A OD2 no hydrogen 2.658 N/A ASP 166.A N LEU 163.A O no hydrogen 3.009 N/A PHE 167.A N ARG 27.A O no hydrogen 3.022 N/A VAL 168.A N LYS 206.A O no hydrogen 3.091 N/A TYR 169.A N VAL 29.A O no hydrogen 2.899 N/A TYR 169.A OH SER 210.A OG no hydrogen 2.713 N/A VAL 170.A N GLY 208.A O no hydrogen 2.723 N/A TYR 174.A OH ASP 171.A OD1 no hydrogen 2.687 N/A THR 177.A N TYR 174.A O no hydrogen 3.210 N/A TYR 181.A OH THR 8.A O no hydrogen 2.604 N/A ASN 182.A N ALA 179.A O no hydrogen 2.944 N/A ASN 182.A ND2 TYR 174.A O no hydrogen 3.231 N/A LYS 183.A N ASP 180.A O no hydrogen 3.094 N/A LYS 183.A NZ ILE 117.A O no hydrogen 3.419 N/A LYS 183.A NZ ASP 180.A OD2 no hydrogen 2.969 N/A PHE 184.A N TYR 181.A O no hydrogen 3.066 N/A TRP 185.A N ASN 182.A O no hydrogen 2.908 N/A TRP 185.A NE1 GLU 190.A OE1 no hydrogen 3.218 N/A GLU 189.A N SER 186.A OG no hydrogen 3.109 N/A GLU 190.A N SER 186.A O no hydrogen 3.031 N/A LYS 191.A N GLU 187.A O no hydrogen 2.984 N/A ASP 192.A N ASP 188.A O no hydrogen 3.088 N/A LEU 193.A N GLU 189.A O no hydrogen 2.965 N/A LEU 194.A N GLU 190.A O no hydrogen 2.956 N/A ASN 195.A N LYS 191.A O no hydrogen 2.939 N/A LEU 196.A N ASP 192.A O no hydrogen 2.933 N/A LEU 197.A N LEU 193.A O no hydrogen 2.836 N/A ASP 198.A N LEU 194.A O no hydrogen 2.981 N/A SER 199.A N ASN 195.A O no hydrogen 2.934 N/A SER 199.A OG ASN 195.A O no hydrogen 3.214 N/A LEU 200.A N LEU 196.A O no hydrogen 2.983 N/A ASN 201.A N LEU 197.A O no hydrogen 2.967 N/A ASP 202.A N ASP 198.A O no hydrogen 2.825 N/A ARG 203.A N SER 199.A O no hydrogen 2.757 N/A ARG 203.A NH2 ILE 162.A O no hydrogen 2.629 N/A GLY 204.A N ASN 201.A O no hydrogen 2.665 N/A ILE 205.A N LEU 200.A O no hydrogen 2.724 N/A LYS 206.A NZ ASN 259.A O no hydrogen 3.243 N/A LYS 206.A NZ ASN 259.A OXT no hydrogen 2.807 N/A PHE 207.A N ASN 259.A OD1 no hydrogen 2.641 N/A GLY 208.A N VAL 168.A O no hydrogen 2.891 N/A LEU 209.A N ILE 257.A O no hydrogen 2.709 N/A SER 210.A N VAL 170.A O no hydrogen 2.725 N/A SER 210.A OG TYR 169.A OH no hydrogen 2.713 N/A ASN 211.A N VAL 255.A O no hydrogen 3.096 N/A ASN 211.A ND2 SER 210.A O no hydrogen 3.191 N/A VAL 212.A N ASN 211.A OD1 no hydrogen 2.931 N/A LEU 213.A N ASP 253.A O no hydrogen 2.949 N/A HIS 215.A N LYS 218.A O no hydrogen 2.894 N/A HIS 215.A ND1 THR 252.A OG1 no hydrogen 2.856 N/A LYS 218.A N HIS 215.A O no hydrogen 2.687 N/A ASN 220.A N LEU 213.A O no hydrogen 2.748 N/A ASN 220.A ND2 GLU 190.A OE2 no hydrogen 2.870 N/A LEU 223.A N ASN 220.A OD1 no hydrogen 3.251 N/A LYS 224.A N ASN 220.A O no hydrogen 2.975 N/A LYS 224.A NZ GLU 214.A OE2 no hydrogen 2.902 N/A LYS 224.A NZ GLU 219.A OE1 no hydrogen 2.492 N/A GLU 225.A N THR 221.A O no hydrogen 3.111 N/A TRP 226.A N LEU 222.A O no hydrogen 2.956 N/A TRP 226.A NE1 ASP 198.A OD2 no hydrogen 3.254 N/A SER 227.A N LEU 223.A O no hydrogen 2.779 N/A SER 227.A OG LEU 223.A O no hydrogen 3.496 N/A SER 227.A OG LYS 224.A O no hydrogen 2.633 N/A LYS 228.A N GLU 225.A O no hydrogen 3.183 N/A LYS 228.A NZ GLU 225.A OE2 no hydrogen 2.702 N/A LYS 229.A N TRP 226.A O no hydrogen 3.102 N/A LYS 229.A NZ ASP 198.A OD1 no hydrogen 3.348 N/A LYS 229.A NZ ASP 198.A OD2 no hydrogen 3.002 N/A TYR 230.A N SER 227.A O no hydrogen 3.117 N/A TYR 230.A OH ASP 198.A OD1 no hydrogen 2.565 N/A ASN 231.A N PHE 258.A O no hydrogen 2.845 N/A ASN 231.A ND2 PHE 258.A O no hydrogen 3.073 N/A LYS 233.A N TYR 256.A O no hydrogen 2.922 N/A HIS 234.A ND1 ASP 253.A OD1 no hydrogen 2.563 N/A LEU 235.A N GLU 254.A O no hydrogen 2.777 N/A ASN 236.A ND2 GLU 254.A OE2 no hydrogen 3.035 N/A TYR 239.A N ASN 236.A OD1 no hydrogen 2.718 N/A TYR 239.A OH GLU 214.A OE1 no hydrogen 3.064 N/A TYR 239.A OH GLU 214.A OE2 no hydrogen 3.280 N/A VAL 240.A N ASN 236.A O no hydrogen 3.021 N/A PHE 241.A N LYS 237.A O no hydrogen 2.826 N/A ASN 242.A N LYS 238.A O no hydrogen 2.947 N/A ILE 243.A N TYR 239.A O no hydrogen 3.121 N/A TYR 244.A N VAL 240.A O no hydrogen 3.140 N/A TYR 244.A N PHE 241.A O no hydrogen 2.747 N/A HIS 245.A N PHE 241.A O no hydrogen 2.902 N/A THR 252.A OG1 HIS 215.A ND1 no hydrogen 2.856 N/A ASP 253.A N GLU 214.A O no hydrogen 2.754 N/A GLU 254.A N THR 252.A O no hydrogen 3.173 N/A VAL 255.A N ASN 211.A O no hydrogen 2.778 N/A TYR 256.A N LYS 233.A O no hydrogen 2.859 N/A ILE 257.A N LEU 209.A O no hydrogen 2.778 N/A PHE 258.A N ASN 231.A O no hydrogen 3.003 N/A ASN 259.A ND2 ILE 205.A O no hydrogen 2.921 N/A