Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 5d1j_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N MET 1.A O no hydrogen 3.129 N/A GLN 5.A N ARG 20.A O no hydrogen 2.908 N/A VAL 7.A N LYS 18.A O no hydrogen 2.771 N/A GLU 8.A N LYS 18.A O no hydrogen 3.406 N/A ILE 10.A N VAL 16.A O no hydrogen 2.783 N/A VAL 15.A N LYS 32.A O no hydrogen 3.110 N/A VAL 16.A N GLY 11.A O no hydrogen 2.780 N/A TYR 17.A N LEU 30.A O no hydrogen 2.859 N/A LYS 18.A N GLU 8.A O no hydrogen 2.780 N/A ALA 19.A N VAL 28.A O no hydrogen 2.922 N/A ARG 20.A N GLN 5.A O no hydrogen 2.872 N/A ARG 20.A NH1 GLY 25.A O no hydrogen 2.906 N/A ASN 21.A N GLU 26.A O no hydrogen 2.769 N/A LYS 22.A N ASN 3.A O no hydrogen 2.915 N/A LYS 22.A NZ GLU 2.A O no hydrogen 3.180 N/A LEU 23.A N ASN 21.A OD1 no hydrogen 3.153 N/A THR 24.A N ASN 21.A OD1 no hydrogen 3.184 N/A GLY 25.A N ASN 21.A O no hydrogen 2.769 N/A GLU 26.A N THR 24.A OG1 no hydrogen 3.362 N/A VAL 27.A N GLU 26.A OE1 no hydrogen 2.791 N/A VAL 28.A N ALA 19.A O no hydrogen 2.902 N/A ALA 29.A N PHE 64.A O no hydrogen 2.924 N/A LEU 30.A N TYR 17.A O no hydrogen 2.790 N/A LYS 31.A N LEU 62.A O no hydrogen 2.845 N/A LYS 31.A NZ GLU 12.A OE1 no hydrogen 3.340 N/A LYS 31.A NZ ASP 129.A OD1 no hydrogen 3.181 N/A LYS 32.A N VAL 15.A O no hydrogen 2.806 N/A LYS 32.A NZ TYR 61.A OH no hydrogen 3.541 N/A ILE 33.A N LEU 60.A O no hydrogen 2.844 N/A LEU 38.A N ARG 34.A O no hydrogen 3.043 N/A LEU 39.A N GLU 35.A O no hydrogen 3.326 N/A LYS 40.A N ILE 36.A O no hydrogen 3.272 N/A GLU 41.A N LEU 38.A O no hydrogen 3.220 N/A LEU 42.A N LEU 39.A O no hydrogen 3.140 N/A ASN 43.A N GLU 41.A O no hydrogen 2.978 N/A ASN 43.A ND2 LYS 40.A O no hydrogen 3.360 N/A ASN 46.A N HIS 44.A ND1 no hydrogen 2.994 N/A ASN 46.A ND2 GLN 94.A OE1 no hydrogen 3.087 N/A ASN 46.A ND2 ILE 125.A O no hydrogen 2.928 N/A ILE 47.A N HIS 44.A O no hydrogen 3.069 N/A VAL 48.A N LEU 127.A O no hydrogen 2.948 N/A LYS 49.A N GLU 65.A OE2 no hydrogen 2.956 N/A LEU 51.A N VAL 63.A O no hydrogen 2.729 N/A ASP 52.A N VAL 63.A O no hydrogen 3.263 N/A ILE 54.A N TYR 61.A O no hydrogen 2.864 N/A LYS 59.A N GLU 57.A O no hydrogen 2.770 N/A TYR 61.A N ILE 54.A O no hydrogen 2.947 N/A LEU 62.A N LYS 31.A O no hydrogen 2.871 N/A VAL 63.A N ASP 52.A O no hydrogen 2.853 N/A PHE 64.A N ALA 29.A O no hydrogen 2.814 N/A GLU 65.A N LYS 49.A O no hydrogen 2.980 N/A ASP 70.A N GLN 69.A OE1 no hydrogen 3.111 N/A LEU 71.A N LEU 117.A O no hydrogen 2.771 N/A LYS 72.A N PRO 114.A O no hydrogen 3.294 N/A LYS 73.A N ASP 70.A OD1 no hydrogen 2.855 N/A PHE 74.A N ASP 70.A O no hydrogen 3.172 N/A MET 75.A N LEU 71.A O no hydrogen 2.813 N/A ASP 76.A N LYS 72.A O no hydrogen 2.948 N/A ALA 77.A N LYS 73.A O no hydrogen 2.889 N/A SER 78.A N PHE 74.A O no hydrogen 2.890 N/A SER 78.A N MET 75.A O no hydrogen 3.243 N/A SER 78.A OG PHE 74.A O no hydrogen 2.876 N/A ALA 79.A N ASP 76.A O no hydrogen 3.490 N/A GLY 82.A N SER 78.A O no hydrogen 2.639 N/A LEU 87.A N PRO 84.A O no hydrogen 2.932 N/A ILE 88.A N PRO 84.A O no hydrogen 3.055 N/A LYS 89.A N LEU 85.A O no hydrogen 2.948 N/A LYS 89.A NZ PHE 252.A O no hydrogen 3.101 N/A LYS 89.A NZ ASP 255.A OD1 no hydrogen 2.726 N/A SER 90.A N PRO 86.A O no hydrogen 2.994 N/A SER 90.A OG THR 257.A O no hydrogen 3.470 N/A TYR 91.A N LEU 87.A O no hydrogen 2.944 N/A LEU 92.A N ILE 88.A O no hydrogen 2.866 N/A PHE 93.A N LYS 89.A O no hydrogen 2.959 N/A GLN 94.A N SER 90.A O no hydrogen 2.976 N/A GLN 94.A NE2 SER 90.A O no hydrogen 3.385 N/A GLN 94.A NE2 SER 90.A OG no hydrogen 2.959 N/A GLN 94.A NE2 GLY 123.A O no hydrogen 2.915 N/A LEU 95.A N TYR 91.A O no hydrogen 3.008 N/A LEU 96.A N LEU 92.A O no hydrogen 2.924 N/A GLN 97.A N PHE 93.A O no hydrogen 2.987 N/A GLY 98.A N GLN 94.A O no hydrogen 2.955 N/A LEU 99.A N LEU 95.A O no hydrogen 2.837 N/A ALA 100.A N LEU 96.A O no hydrogen 2.783 N/A PHE 101.A N GLN 97.A O no hydrogen 3.076 N/A CYS 102.A N GLY 98.A O no hydrogen 2.987 N/A CYS 102.A SG GLY 98.A O no hydrogen 3.359 N/A HIS 103.A N LEU 99.A O no hydrogen 2.792 N/A HIS 103.A NE2 ASP 152.A OD2 no hydrogen 2.826 N/A SER 104.A N ALA 100.A O no hydrogen 3.021 N/A SER 104.A OG ALA 100.A O no hydrogen 3.501 N/A SER 104.A OG PHE 101.A O no hydrogen 2.767 N/A SER 104.A OG HIS 105.A ND1 no hydrogen 3.378 N/A HIS 105.A N CYS 102.A O no hydrogen 2.958 N/A HIS 105.A ND1 PHE 101.A O no hydrogen 3.003 N/A ARG 106.A N HIS 103.A O no hydrogen 3.126 N/A VAL 107.A N CYS 102.A O no hydrogen 3.022 N/A HIS 109.A N ASP 152.A OD2 no hydrogen 2.831 N/A HIS 109.A NE2 ALA 128.A O no hydrogen 2.653 N/A ARG 110.A N ASP 152.A OD1 no hydrogen 2.895 N/A ASP 111.A N HIS 109.A ND1 no hydrogen 3.061 N/A LYS 113.A N ASN 116.A OD1 no hydrogen 3.193 N/A LYS 113.A NZ ASP 111.A OD2 no hydrogen 2.961 N/A GLN 115.A N GLN 115.A OE1 no hydrogen 2.905 N/A ASN 116.A N LYS 113.A O no hydrogen 3.021 N/A ASN 116.A ND2 ASP 111.A O no hydrogen 2.890 N/A LEU 117.A N PRO 114.A O no hydrogen 3.270 N/A LEU 118.A N LYS 126.A O no hydrogen 3.019 N/A ILE 119.A N GLN 69.A O no hydrogen 2.854 N/A ASN 120.A N ALA 124.A O no hydrogen 3.259 N/A GLU 122.A N ASN 120.A OD1 no hydrogen 3.019 N/A GLY 123.A N ASN 120.A O no hydrogen 3.505 N/A ALA 124.A N ASN 120.A OD1 no hydrogen 3.065 N/A ILE 125.A N GLN 94.A OE1 no hydrogen 3.233 N/A LYS 126.A N LEU 118.A O no hydrogen 2.773 N/A LYS 126.A NZ GLU 65.A OE1 no hydrogen 3.529 N/A LYS 126.A NZ GLU 65.A OE2 no hydrogen 3.015 N/A LEU 127.A N ASN 46.A O no hydrogen 2.795 N/A ALA 128.A N ASN 116.A O no hydrogen 3.219 N/A TYR 135.A OH GLU 162.A OE2 no hydrogen 2.673 N/A ARG 136.A N LEU 133.A O no hydrogen 3.086 N/A ARG 136.A NH2 ASP 111.A OD1 no hydrogen 2.830 N/A GLU 139.A N GLU 139.A OE1 no hydrogen 2.758 N/A ILE 140.A N ALA 137.A O no hydrogen 3.161 N/A LEU 141.A N ALA 137.A O no hydrogen 3.340 N/A LEU 142.A N PRO 138.A O no hydrogen 2.908 N/A GLY 143.A N ILE 140.A O no hydrogen 3.071 N/A CYS 144.A N GLU 139.A O no hydrogen 2.963 N/A ALA 150.A N SER 148.A OG no hydrogen 3.140 N/A VAL 151.A N SER 148.A O no hydrogen 3.032 N/A ASP 152.A N THR 149.A O no hydrogen 3.052 N/A TRP 154.A N ALA 150.A O no hydrogen 3.140 N/A SER 155.A N VAL 151.A O no hydrogen 3.208 N/A SER 155.A OG TYR 135.A O no hydrogen 2.699 N/A SER 155.A OG VAL 151.A O no hydrogen 3.128 N/A LEU 156.A N ASP 152.A O no hydrogen 2.906 N/A GLY 157.A N ILE 153.A O no hydrogen 2.845 N/A CYS 158.A N TRP 154.A O no hydrogen 2.984 N/A CYS 158.A SG TRP 154.A O no hydrogen 3.507 N/A ILE 159.A N SER 155.A O no hydrogen 3.045 N/A PHE 160.A N LEU 156.A O no hydrogen 2.875 N/A ALA 161.A N GLY 157.A O no hydrogen 3.056 N/A GLU 162.A N CYS 158.A O no hydrogen 3.137 N/A MET 163.A N ILE 159.A O no hydrogen 2.913 N/A VAL 164.A N PHE 160.A O no hydrogen 3.180 N/A THR 165.A N ALA 161.A O no hydrogen 2.991 N/A THR 165.A OG1 ALA 161.A O no hydrogen 3.019 N/A ARG 166.A N GLU 162.A O no hydrogen 2.921 N/A ARG 166.A NE ALA 79.A O no hydrogen 3.179 N/A ARG 166.A NH2 ALA 79.A O no hydrogen 2.992 N/A ARG 167.A N THR 165.A OG1 no hydrogen 3.423 N/A GLY 172.A N PHE 170.A O no hydrogen 2.994 N/A GLY 172.A N GLN 178.A OE1 no hydrogen 2.894 N/A ASP 173.A N ASP 177.A OD2 no hydrogen 3.072 N/A ASP 177.A N SER 174.A OG no hydrogen 3.000 N/A GLN 178.A N SER 174.A O no hydrogen 2.839 N/A GLN 178.A NE2 TRP 134.A O no hydrogen 3.258 N/A GLN 178.A NE2 PHE 170.A O no hydrogen 2.941 N/A LEU 179.A N GLU 175.A O no hydrogen 2.991 N/A PHE 180.A N ILE 176.A O no hydrogen 2.816 N/A ARG 181.A N ASP 177.A O no hydrogen 2.876 N/A ARG 181.A NE ASP 177.A OD2 no hydrogen 2.914 N/A ILE 182.A N GLN 178.A O no hydrogen 3.090 N/A PHE 183.A N LEU 179.A O no hydrogen 2.966 N/A ARG 184.A N PHE 180.A O no hydrogen 2.860 N/A THR 185.A N ILE 182.A O no hydrogen 3.192 N/A THR 185.A OG1 ARG 181.A O no hydrogen 3.419 N/A LEU 186.A N ILE 182.A O no hydrogen 2.813 N/A GLY 187.A N PHE 183.A O no hydrogen 2.763 N/A THR 188.A N TRP 210.A O no hydrogen 2.945 N/A THR 188.A OG1 PRO 208.A O no hydrogen 2.756 N/A VAL 193.A N ASP 190.A OD1 no hydrogen 3.184 N/A TRP 194.A N ASP 190.A O no hydrogen 2.805 N/A GLY 196.A N GLU 191.A OE1 no hydrogen 2.843 N/A VAL 197.A N TRP 194.A O no hydrogen 3.033 N/A THR 198.A N GLU 191.A OE2 no hydrogen 3.110 N/A THR 198.A OG1 GLU 191.A OE2 no hydrogen 2.628 N/A SER 199.A N GLY 196.A O no hydrogen 3.094 N/A SER 199.A OG GLY 196.A O no hydrogen 2.947 N/A MET 200.A N VAL 197.A O no hydrogen 3.160 N/A ASP 202.A N LEU 142.A O no hydrogen 2.936 N/A TYR 203.A N MET 200.A O no hydrogen 3.088 N/A PHE 207.A N LYS 204.A O no hydrogen 2.868 N/A TRP 210.A N THR 188.A OG1 no hydrogen 2.987 N/A ARG 212.A NH2 LEU 186.A O no hydrogen 3.069 N/A GLN 213.A N THR 185.A O no hydrogen 2.999 N/A LYS 217.A N ASP 214.A O no hydrogen 3.178 N/A VAL 218.A N PHE 215.A O no hydrogen 3.044 N/A VAL 219.A N PHE 215.A O no hydrogen 3.016 N/A LEU 222.A N VAL 219.A O no hydrogen 2.923 N/A GLY 226.A N ASP 223.A OD1 no hydrogen 2.860 N/A ARG 227.A N ASP 223.A O no hydrogen 2.911 N/A SER 228.A N GLU 224.A O no hydrogen 2.929 N/A SER 228.A OG HIS 250.A NE2 no hydrogen 3.260 N/A LEU 229.A N ASP 225.A O no hydrogen 3.027 N/A LEU 230.A N GLY 226.A O no hydrogen 2.843 N/A SER 231.A N ARG 227.A O no hydrogen 2.907 N/A GLN 232.A N SER 228.A O no hydrogen 3.157 N/A MET 233.A N LEU 229.A O no hydrogen 3.042 N/A MET 233.A N LEU 230.A O no hydrogen 2.983 N/A LEU 234.A N SER 231.A O no hydrogen 3.260 N/A TYR 236.A OH GLY 187.A O no hydrogen 2.637 N/A ASN 239.A N ASP 237.A OD1 no hydrogen 3.041 N/A LYS 240.A N ASP 237.A O no hydrogen 2.858 N/A LYS 240.A NZ VAL 193.A O no hydrogen 3.068 N/A LYS 240.A NZ ASP 237.A OD2 no hydrogen 2.936 N/A ARG 241.A N ASP 237.A O no hydrogen 2.970 N/A ARG 241.A NE HIS 235.A O no hydrogen 2.807 N/A ARG 241.A NH1 GLU 139.A OE1 no hydrogen 2.879 N/A ARG 241.A NH1 HIS 235.A O no hydrogen 3.162 N/A ARG 241.A NH1 TYR 236.A O no hydrogen 2.935 N/A ARG 241.A NH2 GLU 139.A OE1 no hydrogen 3.363 N/A ARG 241.A NH2 GLU 139.A OE2 no hydrogen 2.787 N/A ARG 241.A NH2 ALA 150.A O no hydrogen 3.003 N/A ILE 242.A N GLN 232.A O no hydrogen 2.957 N/A ALA 246.A N SER 243.A OG no hydrogen 3.134 N/A ALA 247.A N SER 243.A O no hydrogen 2.925 N/A LEU 248.A N ALA 244.A O no hydrogen 3.169 N/A LEU 248.A N LYS 245.A O no hydrogen 3.266 N/A ALA 249.A N ALA 246.A O no hydrogen 3.149 N/A HIS 250.A N ALA 247.A O no hydrogen 3.030 N/A HIS 250.A NE2 SER 228.A OG no hydrogen 3.260 N/A PHE 252.A N HIS 250.A ND1 no hydrogen 3.005 N/A PHE 253.A N HIS 250.A O no hydrogen 2.982 N/A GLN 254.A N PRO 251.A O no hydrogen 3.011 N/A VAL 256.A N PHE 253.A O no hydrogen 3.078 N/A