Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1xmj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 2.A N ILE 23.A O no hydrogen 3.123 N/A VAL 3.A N LYS 58.A O no hydrogen 3.431 N/A MET 4.A N PHE 21.A O no hydrogen 2.800 N/A ASN 6.A N ASN 20.A OD1 no hydrogen 2.632 N/A ASN 6.A ND2 ASP 18.A OD2 no hydrogen 2.723 N/A VAL 7.A N ILE 19.A O no hydrogen 3.017 N/A THR 8.A N GLU 54.A O no hydrogen 2.901 N/A ALA 9.A N LEU 16.A O no hydrogen 2.942 N/A TRP 11.A NE1 SER 41.A OG no hydrogen 2.847 N/A LEU 16.A N ALA 9.A O no hydrogen 3.183 N/A LYS 17.A N GLY 196.A O no hydrogen 2.936 N/A ASP 18.A N THR 8.A OG1 no hydrogen 3.076 N/A ILE 19.A N VAL 7.A O no hydrogen 2.814 N/A ASN 20.A ND2 ASP 18.A O no hydrogen 3.029 N/A PHE 21.A N MET 4.A O no hydrogen 2.943 N/A LYS 22.A N TYR 201.A OH no hydrogen 3.190 N/A ILE 23.A N VAL 2.A O no hydrogen 2.879 N/A GLU 24.A N GLN 27.A OE1 no hydrogen 2.901 N/A GLN 27.A N GLU 24.A O no hydrogen 3.268 N/A LEU 28.A N ASP 188.A OD2 no hydrogen 2.789 N/A LEU 29.A N ARG 174.A O no hydrogen 3.074 N/A ALA 30.A N LYS 189.A O no hydrogen 3.090 N/A VAL 31.A N LEU 176.A O no hydrogen 2.720 N/A ALA 32.A N LEU 191.A O no hydrogen 2.950 N/A SER 34.A N LEU 193.A O no hydrogen 3.300 N/A SER 34.A OG HIS 194.A ND1 no hydrogen 2.713 N/A THR 35.A N THR 234.A OG1 no hydrogen 3.250 N/A ALA 37.A N SER 34.A O no hydrogen 3.071 N/A LYS 39.A NZ GLY 33.A O no hydrogen 3.101 N/A LYS 39.A NZ SER 34.A O no hydrogen 3.088 N/A THR 40.A OG1 ASP 146.A OD2 no hydrogen 2.562 N/A LEU 42.A N GLY 38.A O no hydrogen 2.783 N/A LEU 43.A N LYS 39.A O no hydrogen 3.389 N/A MET 44.A N THR 40.A O no hydrogen 2.818 N/A MET 45.A N SER 41.A O no hydrogen 2.888 N/A MET 45.A N LEU 42.A O no hydrogen 3.217 N/A ILE 46.A N LEU 42.A O no hydrogen 3.187 N/A MET 47.A N LEU 43.A O no hydrogen 2.969 N/A GLY 48.A N MET 45.A O no hydrogen 3.034 N/A GLU 49.A N MET 44.A O no hydrogen 2.952 N/A SER 53.A N THR 8.A O no hydrogen 2.814 N/A GLU 54.A N THR 8.A O no hydrogen 3.306 N/A LYS 56.A N GLU 5.A O no hydrogen 3.371 N/A LYS 58.A N VAL 3.A O no hydrogen 3.095 N/A HIS 59.A N ILE 57.A O no hydrogen 3.067 N/A ARG 62.A N ASP 141.A OD2 no hydrogen 2.919 N/A ARG 62.A NH1 ASP 139.A O no hydrogen 3.129 N/A SER 64.A N LEU 142.A O no hydrogen 2.781 N/A SER 64.A OG ALA 135.A O no hydrogen 2.754 N/A CYS 66.A N LEU 144.A O no hydrogen 2.900 N/A CYS 66.A SG SER 67.A O no hydrogen 3.702 N/A PHE 69.A N SER 67.A OG no hydrogen 3.319 N/A TRP 71.A N SER 131.A OG no hydrogen 3.272 N/A MET 73.A N ASN 80.A OD1 no hydrogen 2.564 N/A GLY 75.A N LEU 115.A O no hydrogen 3.141 N/A THR 76.A N GLU 79.A OE2 no hydrogen 2.984 N/A LYS 78.A N ASP 111.A O no hydrogen 3.051 N/A LYS 78.A NZ TYR 86.A OH no hydrogen 2.993 N/A GLU 79.A N THR 76.A OG1 no hydrogen 2.955 N/A ASN 80.A N THR 76.A O no hydrogen 3.084 N/A ASN 80.A ND2 MET 73.A O no hydrogen 2.659 N/A ASN 80.A ND2 THR 76.A O no hydrogen 2.989 N/A ILE 81.A N LYS 78.A O no hydrogen 3.068 N/A ILE 82.A N LYS 78.A O no hydrogen 2.874 N/A GLY 83.A N GLU 79.A O no hydrogen 2.913 N/A ASP 87.A N TYR 137.A OH no hydrogen 2.594 N/A ARG 90.A N ASP 87.A OD2 no hydrogen 2.924 N/A ARG 90.A NE TYR 137.A O no hydrogen 2.763 N/A ARG 90.A NH2 VAL 136.A O no hydrogen 3.369 N/A ARG 90.A NH2 TYR 137.A O no hydrogen 3.212 N/A ARG 90.A NH2 LYS 138.A O no hydrogen 3.505 N/A TYR 91.A N ASP 87.A O no hydrogen 2.925 N/A TYR 91.A OH ASP 111.A OD1 no hydrogen 2.798 N/A ARG 92.A N GLU 88.A O no hydrogen 3.125 N/A ARG 92.A NH1 GLU 101.A OE2 no hydrogen 2.859 N/A SER 93.A N TYR 89.A O no hydrogen 3.173 N/A SER 93.A OG ARG 90.A O no hydrogen 2.848 N/A VAL 94.A N ARG 90.A O no hydrogen 2.990 N/A ILE 95.A N TYR 91.A O no hydrogen 2.951 N/A LYS 96.A N ARG 92.A O no hydrogen 2.951 N/A LYS 96.A NZ GLU 101.A OE1 no hydrogen 2.714 N/A LYS 96.A NZ GLU 101.A OE2 no hydrogen 3.511 N/A ALA 97.A N SER 93.A O no hydrogen 2.978 N/A CYS 98.A N VAL 94.A O no hydrogen 3.018 N/A CYS 98.A SG VAL 94.A O no hydrogen 3.465 N/A GLN 99.A N LYS 96.A O no hydrogen 3.043 N/A LEU 100.A N ILE 95.A O no hydrogen 2.924 N/A ILE 104.A N LEU 100.A O no hydrogen 2.823 N/A SER 105.A N GLU 101.A O no hydrogen 2.963 N/A SER 105.A OG GLU 101.A O no hydrogen 3.488 N/A SER 105.A OG GLU 102.A O no hydrogen 2.899 N/A LYS 106.A N GLU 102.A O no hydrogen 3.229 N/A LYS 106.A N ASP 103.A O no hydrogen 3.328 N/A LYS 106.A NZ GLU 102.A O no hydrogen 3.142 N/A LYS 106.A NZ SER 105.A OG no hydrogen 2.751 N/A PHE 107.A N ILE 104.A O no hydrogen 3.236 N/A LYS 110.A N PHE 107.A O no hydrogen 2.899 N/A ASN 112.A N GLU 109.A O no hydrogen 2.817 N/A ILE 113.A N LYS 110.A O no hydrogen 3.410 N/A LEU 115.A N GLY 75.A O no hydrogen 2.804 N/A SER 123.A N GLN 126.A OE1 no hydrogen 2.940 N/A GLN 126.A N SER 123.A OG no hydrogen 2.992 N/A GLN 126.A NE2 ASP 103.A OD1 no hydrogen 2.820 N/A GLN 127.A N SER 123.A O no hydrogen 3.112 N/A ALA 128.A N GLU 124.A O no hydrogen 3.029 N/A LYS 129.A N GLY 125.A O no hydrogen 3.033 N/A LYS 129.A NZ GLN 99.A O no hydrogen 2.657 N/A LYS 129.A NZ ASP 103.A OD2 no hydrogen 2.989 N/A ILE 130.A N GLN 126.A O no hydrogen 2.982 N/A SER 131.A N GLN 127.A O no hydrogen 2.880 N/A SER 131.A OG TRP 71.A O no hydrogen 3.168 N/A SER 131.A OG GLN 127.A O no hydrogen 3.010 N/A LEU 132.A N ALA 128.A O no hydrogen 3.011 N/A ALA 133.A N LYS 129.A O no hydrogen 2.777 N/A ARG 134.A N ILE 130.A O no hydrogen 2.824 N/A ARG 134.A NE ASN 80.A O no hydrogen 2.719 N/A ARG 134.A NH1 TRP 71.A O no hydrogen 2.990 N/A ARG 134.A NH1 ASN 80.A OD1 no hydrogen 3.041 N/A ARG 134.A NH2 TRP 71.A O no hydrogen 3.476 N/A ALA 135.A N SER 131.A O no hydrogen 3.209 N/A VAL 136.A N LEU 132.A O no hydrogen 2.818 N/A TYR 137.A N ALA 133.A O no hydrogen 2.772 N/A TYR 137.A OH SER 85.A O no hydrogen 2.893 N/A LYS 138.A N ARG 134.A O no hydrogen 3.190 N/A LYS 138.A NZ ILE 63.A O no hydrogen 3.381 N/A ASP 141.A N ARG 62.A O no hydrogen 2.741 N/A LEU 142.A N ARG 62.A O no hydrogen 3.068 N/A TYR 143.A N THR 173.A O no hydrogen 2.901 N/A TYR 143.A OH LYS 138.A O no hydrogen 2.690 N/A LEU 144.A N SER 64.A O no hydrogen 2.815 N/A LEU 145.A N ILE 175.A O no hydrogen 2.797 N/A ASP 146.A N CYS 66.A O no hydrogen 2.946 N/A SER 147.A N VAL 177.A O no hydrogen 2.998 N/A SER 147.A OG ASP 146.A OD1 no hydrogen 3.188 N/A LEU 152.A N PHE 149.A O no hydrogen 3.112 N/A THR 156.A N ASP 153.A OD2 no hydrogen 3.204 N/A THR 156.A OG1 ASP 153.A OD2 no hydrogen 2.938 N/A GLU 157.A N ASP 153.A O no hydrogen 2.952 N/A LYS 158.A N VAL 154.A O no hydrogen 2.990 N/A GLU 159.A N LEU 155.A O no hydrogen 2.799 N/A ILE 160.A N THR 156.A O no hydrogen 2.966 N/A PHE 161.A N GLU 157.A O no hydrogen 2.906 N/A GLU 162.A N LYS 158.A O no hydrogen 2.998 N/A SER 163.A N GLU 159.A O no hydrogen 2.993 N/A SER 163.A OG GLU 159.A O no hydrogen 2.915 N/A CYS 164.A N ILE 160.A O no hydrogen 2.841 N/A VAL 165.A N ILE 160.A O no hydrogen 3.262 N/A CYS 166.A N PHE 161.A O no hydrogen 2.914 N/A CYS 166.A SG PHE 161.A O no hydrogen 3.335 N/A LYS 167.A N GLU 162.A O no hydrogen 2.887 N/A LEU 168.A N SER 163.A O no hydrogen 2.742 N/A MET 169.A N CYS 164.A O no hydrogen 2.891 N/A ALA 170.A N LYS 167.A O no hydrogen 3.086 N/A LYS 172.A N MET 169.A O no hydrogen 2.985 N/A ARG 174.A N GLN 27.A O no hydrogen 3.195 N/A ARG 174.A NE VAL 165.A O no hydrogen 2.875 N/A ARG 174.A NH1 GLY 26.A O no hydrogen 3.240 N/A ARG 174.A NH1 LYS 172.A O no hydrogen 2.780 N/A ARG 174.A NH2 VAL 165.A O no hydrogen 3.044 N/A ILE 175.A N TYR 143.A O no hydrogen 2.780 N/A LEU 176.A N LEU 29.A O no hydrogen 2.830 N/A VAL 177.A N LEU 145.A O no hydrogen 2.858 N/A THR 178.A N VAL 31.A O no hydrogen 2.961 N/A THR 178.A OG1 HIS 183.A ND1 no hydrogen 2.834 N/A LYS 180.A N THR 178.A OG1 no hydrogen 3.110 N/A LYS 180.A NZ GLU 157.A OE2 no hydrogen 3.030 N/A LYS 180.A NZ ASP 222.A O no hydrogen 3.244 N/A MET 181.A N ASP 222.A OD1 no hydrogen 2.703 N/A GLU 182.A N ASP 222.A OD2 no hydrogen 2.806 N/A HIS 183.A N LYS 180.A O no hydrogen 3.129 N/A HIS 183.A ND1 THR 178.A OG1 no hydrogen 2.834 N/A LEU 184.A N LYS 180.A O no hydrogen 3.330 N/A LYS 185.A N MET 181.A O no hydrogen 2.778 N/A LYS 186.A N GLU 182.A O no hydrogen 3.136 N/A LYS 186.A N HIS 183.A O no hydrogen 3.302 N/A ALA 187.A N HIS 183.A O no hydrogen 3.085 N/A ALA 187.A N LEU 184.A O no hydrogen 3.247 N/A ASP 188.A N LEU 28.A O no hydrogen 3.034 N/A LYS 189.A N LEU 28.A O no hydrogen 3.327 N/A ILE 190.A N GLY 202.A O no hydrogen 2.757 N/A LEU 191.A N ALA 30.A O no hydrogen 2.966 N/A ILE 192.A N PHE 200.A O no hydrogen 2.870 N/A LEU 193.A N ALA 32.A O no hydrogen 2.913 N/A HIS 194.A N SER 197.A O no hydrogen 3.014 N/A HIS 194.A ND1 SER 34.A OG no hydrogen 2.713 N/A GLY 196.A N ALA 37.A O no hydrogen 3.009 N/A SER 197.A N HIS 194.A O no hydrogen 3.248 N/A SER 197.A OG HIS 194.A O no hydrogen 3.357 N/A TYR 199.A N ILE 192.A O no hydrogen 2.831 N/A GLY 202.A N ILE 190.A O no hydrogen 3.259 N/A THR 203.A N GLU 206.A OE1 no hydrogen 3.103 N/A GLU 206.A N THR 203.A OG1 no hydrogen 3.076 N/A LEU 207.A N THR 203.A O no hydrogen 2.759 N/A GLN 208.A N PHE 204.A O no hydrogen 3.089 N/A ASN 209.A N GLU 206.A O no hydrogen 3.181 N/A LEU 210.A N GLU 206.A O no hydrogen 3.058 N/A GLN 211.A N LEU 207.A O no hydrogen 2.832 N/A SER 215.A N GLN 211.A O no hydrogen 2.911 N/A SER 215.A OG LEU 207.A O no hydrogen 3.440 N/A SER 215.A OG GLN 211.A O no hydrogen 3.019 N/A SER 216.A N PRO 212.A O no hydrogen 2.867 N/A LYS 217.A N ASP 213.A O no hydrogen 3.230 N/A LEU 218.A N SER 215.A O no hydrogen 2.917 N/A GLN 223.A N SER 220.A O no hydrogen 2.983 N/A PHE 224.A N PHE 221.A O no hydrogen 3.020 N/A ARG 228.A N SER 225.A OG no hydrogen 3.235 N/A ARG 228.A NH2 GLU 235.A OE1 no hydrogen 3.464 N/A ARG 229.A N SER 225.A O no hydrogen 2.864 N/A ARG 229.A NE SER 179.A O no hydrogen 3.079 N/A ARG 229.A NE SER 179.A OG no hydrogen 3.180 N/A ARG 229.A NH1 SER 179.A OG no hydrogen 2.658 N/A ARG 229.A NH2 PHE 224.A O no hydrogen 3.082 N/A ASN 230.A N ALA 226.A O no hydrogen 3.031 N/A ASN 230.A ND2 ALA 226.A O no hydrogen 2.688 N/A SER 231.A N GLU 227.A O no hydrogen 2.980 N/A SER 231.A OG GLU 227.A O no hydrogen 3.299 N/A ILE 232.A N ARG 228.A O no hydrogen 2.808 N/A LEU 233.A N ARG 229.A O no hydrogen 2.833 N/A THR 234.A N ASN 230.A O no hydrogen 3.015 N/A THR 234.A OG1 ASN 230.A O no hydrogen 2.670 N/A GLU 235.A N SER 231.A O no hydrogen 3.046 N/A THR 236.A N ILE 232.A O no hydrogen 2.985 N/A THR 236.A OG1 ILE 232.A O no hydrogen 2.798 N/A LEU 237.A N LEU 233.A O no hydrogen 2.874 N/A ARG 238.A N THR 234.A O no hydrogen 2.859 N/A ARG 239.A N THR 236.A O no hydrogen 3.034 N/A PHE 240.A N LEU 237.A O no hydrogen 2.902 N/A SER 241.A N ARG 239.A O no hydrogen 2.925 N/A GLU 243.A N SER 241.A OG no hydrogen 2.903 N/A