Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4clr_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 4.A N ASP 87.A OD2 no hydrogen 2.889 N/A ALA 5.A N ARG 28.A O no hydrogen 2.821 N/A VAL 6.A N VAL 88.A O no hydrogen 2.892 N/A VAL 7.A N VAL 30.A O no hydrogen 3.107 N/A THR 8.A N VAL 90.A O no hydrogen 3.061 N/A THR 8.A OG1 VAL 90.A O no hydrogen 3.427 N/A GLY 9.A N HIS 32.A ND1 no hydrogen 2.931 N/A ALA 10.A N HIS 32.A O no hydrogen 2.851 N/A ARG 13.A NH1 LEU 190.A O no hydrogen 2.822 N/A ARG 13.A NH2 LEU 189.A O no hydrogen 2.877 N/A ARG 16.A N LYS 12.A O no hydrogen 3.150 N/A ARG 16.A NH2 GLU 46.A OE1 no hydrogen 3.013 N/A ALA 17.A N ARG 13.A O no hydrogen 3.188 N/A ILE 18.A N ILE 14.A O no hydrogen 2.915 N/A ALA 19.A N GLY 15.A O no hydrogen 2.949 N/A VAL 20.A N ARG 16.A O no hydrogen 2.919 N/A LYS 21.A N ALA 17.A O no hydrogen 2.973 N/A LEU 22.A N ILE 18.A O no hydrogen 2.868 N/A HIS 23.A N ALA 19.A O no hydrogen 2.925 N/A HIS 23.A NE2 THR 54.A OG1 no hydrogen 2.624 N/A GLN 24.A N VAL 20.A O no hydrogen 2.819 N/A THR 25.A N LYS 21.A O no hydrogen 3.006 N/A THR 25.A OG1 LYS 21.A O no hydrogen 2.799 N/A GLY 26.A N HIS 23.A O no hydrogen 3.000 N/A TYR 27.A N LEU 22.A O no hydrogen 3.004 N/A ARG 28.A N PRO 3.A O no hydrogen 2.839 N/A ARG 28.A NE ALA 2.A O no hydrogen 3.217 N/A ARG 28.A NH2 ALA 2.A O no hydrogen 2.813 N/A ARG 28.A NH2 PHE 83.A O no hydrogen 3.185 N/A VAL 29.A N THR 54.A O no hydrogen 2.904 N/A VAL 30.A N ALA 5.A O no hydrogen 2.811 N/A ILE 31.A N VAL 56.A O no hydrogen 2.781 N/A HIS 32.A N VAL 7.A O no hydrogen 3.112 N/A HIS 32.A NE2 ALA 60.A O no hydrogen 2.837 N/A TYR 33.A N CYS 58.A O no hydrogen 3.100 N/A ALA 37.A N ASN 35.A O no hydrogen 2.979 N/A ALA 40.A N SER 36.A O no hydrogen 2.956 N/A VAL 41.A N ALA 37.A O no hydrogen 2.982 N/A SER 42.A N GLU 38.A O no hydrogen 2.925 N/A LEU 43.A N ALA 39.A O no hydrogen 2.964 N/A ALA 44.A N ALA 40.A O no hydrogen 3.017 N/A ASP 45.A N VAL 41.A O no hydrogen 2.930 N/A GLU 46.A N SER 42.A O no hydrogen 2.983 N/A LEU 47.A N LEU 43.A O no hydrogen 2.926 N/A ASN 48.A N ALA 44.A O no hydrogen 2.892 N/A ASN 48.A ND2 ALA 55.A O no hydrogen 2.945 N/A LYS 49.A N ASP 45.A O no hydrogen 2.916 N/A GLU 50.A N GLU 46.A O no hydrogen 3.221 N/A ARG 51.A N LEU 47.A O no hydrogen 3.009 N/A ARG 51.A NH1 HIS 23.A O no hydrogen 2.974 N/A ARG 51.A NH2 HIS 23.A O no hydrogen 2.932 N/A THR 54.A N ASN 48.A OD1 no hydrogen 2.856 N/A THR 54.A OG1 HIS 23.A NE2 no hydrogen 2.624 N/A THR 54.A OG1 ARG 51.A O no hydrogen 2.661 N/A ALA 55.A N ASN 48.A OD1 no hydrogen 2.947 N/A VAL 56.A N VAL 29.A O no hydrogen 2.966 N/A CYS 58.A N ILE 31.A O no hydrogen 2.893 N/A GLN 59.A NE2 HIS 34.A O no hydrogen 3.050 N/A ALA 60.A N TYR 33.A O no hydrogen 2.954 N/A THR 63.A N ASP 61.A OD1 no hydrogen 3.079 N/A THR 63.A OG1 ASP 61.A OD1 no hydrogen 2.621 N/A THR 63.A OG1 ASP 61.A OD2 no hydrogen 3.536 N/A ASN 64.A N ALA 112.A O no hydrogen 2.962 N/A VAL 67.A N SER 65.A OG no hydrogen 3.106 N/A LEU 68.A N SER 65.A O no hydrogen 3.296 N/A SER 71.A N VAL 67.A O no hydrogen 2.968 N/A SER 71.A OG VAL 67.A O no hydrogen 3.189 N/A CYS 72.A N LEU 68.A O no hydrogen 2.857 N/A CYS 72.A SG LEU 68.A O no hydrogen 3.443 N/A CYS 72.A SG ALA 121.A O no hydrogen 3.979 N/A GLU 73.A N PRO 69.A O no hydrogen 2.924 N/A GLU 74.A N ALA 70.A O no hydrogen 2.933 N/A ILE 75.A N SER 71.A O no hydrogen 3.055 N/A ILE 76.A N CYS 72.A O no hydrogen 3.232 N/A ASN 77.A N GLU 73.A O no hydrogen 2.877 N/A ASN 77.A ND2.A GLU 74.A OE1 no hydrogen 3.462 N/A ASN 77.A ND2.B GLU 74.A OE1 no hydrogen 2.887 N/A SER 78.A N GLU 74.A O no hydrogen 2.875 N/A SER 78.A OG ILE 75.A O no hydrogen 2.644 N/A CYS 79.A N ILE 76.A O no hydrogen 3.003 N/A CYS 79.A SG ARG 85.A O no hydrogen 3.311 N/A PHE 80.A N ILE 76.A O no hydrogen 3.320 N/A ARG 81.A N ASN 77.A O no hydrogen 2.858 N/A ARG 81.A NH1.A ASN 77.A OD1.A no hydrogen 2.782 N/A ALA 82.A N SER 78.A O no hydrogen 3.128 N/A PHE 83.A N CYS 79.A O no hydrogen 2.897 N/A GLY 84.A N PHE 80.A O no hydrogen 2.844 N/A ARG 85.A NE ASP 87.A OD2 no hydrogen 2.870 N/A ARG 85.A NH2 ASP 87.A OD1 no hydrogen 2.913 N/A CYS 86.A SG VAL 88.A O no hydrogen 3.962 N/A ASP 87.A N ALA 4.A O no hydrogen 2.762 N/A VAL 88.A N ALA 4.A O no hydrogen 3.182 N/A LEU 89.A N SER 137.A O no hydrogen 3.153 N/A VAL 90.A N VAL 6.A O no hydrogen 2.734 N/A ASN 91.A N VAL 139.A O no hydrogen 2.908 N/A ASN 91.A ND2 ASN 140.A OD1 no hydrogen 2.895 N/A ASN 92.A N THR 8.A OG1 no hydrogen 2.876 N/A ASN 92.A ND2 THR 8.A O no hydrogen 3.039 N/A ALA 93.A N THR 8.A OG1 no hydrogen 2.965 N/A SER 94.A OG ALA 95.A O no hydrogen 3.295 N/A SER 94.A OG ASN 118.A OD1 no hydrogen 2.687 N/A ALA 95.A N THR 117.A OG1 no hydrogen 3.000 N/A TYR 97.A OH GLU 113.A OE1 no hydrogen 2.612 N/A THR 99.A N ALA 151.A O no hydrogen 2.782 N/A THR 99.A OG1 THR 99.A O no hydrogen 2.590 N/A LYS 105.A NZ GLU 113.A OE1 no hydrogen 2.701 N/A LYS 105.A NZ GLU 113.A OE2 no hydrogen 3.541 N/A THR 106.A OG1 THR 109.A OG1 no hydrogen 3.110 N/A GLU 108.A N GLU 108.A OE1 no hydrogen 2.800 N/A THR 109.A N THR 106.A OG1 no hydrogen 3.353 N/A THR 109.A OG1 THR 106.A OG1 no hydrogen 3.110 N/A GLN 110.A N THR 106.A O no hydrogen 3.121 N/A VAL 111.A N VAL 107.A O no hydrogen 2.964 N/A ALA 112.A N GLU 108.A O no hydrogen 2.964 N/A GLU 113.A N THR 109.A O no hydrogen 2.917 N/A LEU 114.A N GLN 110.A O no hydrogen 2.902 N/A ILE 115.A N VAL 111.A O no hydrogen 2.883 N/A GLY 116.A N ALA 112.A O no hydrogen 2.855 N/A THR 117.A N GLU 113.A O no hydrogen 3.038 N/A THR 117.A OG1 GLU 113.A O no hydrogen 2.790 N/A ASN 118.A N LEU 114.A O no hydrogen 3.321 N/A ASN 118.A ND2 ALA 95.A O no hydrogen 3.079 N/A ASN 118.A ND2 LEU 114.A O no hydrogen 2.951 N/A ALA 119.A N ILE 115.A O no hydrogen 2.999 N/A ILE 120.A N ILE 115.A O no hydrogen 2.929 N/A ALA 121.A N GLY 116.A O no hydrogen 2.787 N/A PHE 123.A N ALA 119.A O no hydrogen 3.021 N/A LEU 124.A N ILE 120.A O no hydrogen 2.935 N/A LEU 125.A N ALA 121.A O no hydrogen 2.736 N/A THR 126.A N PRO 122.A O no hydrogen 2.923 N/A THR 126.A OG1 PRO 122.A O no hydrogen 2.691 N/A MET 127.A N PHE 123.A O no hydrogen 2.859 N/A SER 128.A N LEU 124.A O no hydrogen 3.024 N/A SER 128.A OG LEU 124.A O no hydrogen 3.371 N/A PHE 129.A N LEU 125.A O no hydrogen 2.716 N/A ALA 130.A N THR 126.A O no hydrogen 2.913 N/A GLN 131.A N MET 127.A O no hydrogen 2.880 N/A ARG 132.A N SER 128.A O no hydrogen 3.195 N/A ARG 132.A NH1 ASN 77.A OD1.A no hydrogen 2.842 N/A GLN 133.A N ALA 130.A O no hydrogen 3.068 N/A GLN 133.A NE2 CYS 86.A O no hydrogen 2.773 N/A GLN 133.A NE2 PHE 129.A O no hydrogen 3.190 N/A ASN 135.A ND2 VAL 226.A O no hydrogen 2.672 N/A SER 137.A N ASP 87.A O no hydrogen 3.087 N/A ILE 138.A N ARG 179.A O no hydrogen 2.804 N/A VAL 139.A N LEU 89.A O no hydrogen 2.863 N/A ASN 140.A N ASN 181.A O no hydrogen 2.812 N/A ASN 140.A ND2 THR 166.A OG1 no hydrogen 2.956 N/A LEU 141.A N ASN 91.A O no hydrogen 2.947 N/A CYS 142.A N VAL 183.A O no hydrogen 2.752 N/A CYS 142.A SG ASN 140.A O no hydrogen 3.549 N/A ALA 144.A N PRO 185.A O no hydrogen 2.875 N/A MET 145.A N ASP 143.A OD1 no hydrogen 2.904 N/A VAL 146.A N ASP 143.A O no hydrogen 3.255 N/A GLN 148.A N MET 145.A O no hydrogen 2.909 N/A GLN 148.A NE2 SER 245.A O no hydrogen 2.868 N/A LEU 154.A N THR 99.A OG1 no hydrogen 3.387 N/A TYR 155.A OH ASP 143.A OD2 no hydrogen 2.507 N/A ASN 156.A N PHE 152.A O no hydrogen 2.843 N/A MET 157.A N SER 153.A O no hydrogen 2.844 N/A GLY 158.A N LEU 154.A O no hydrogen 2.901 N/A LYS 159.A N TYR 155.A O no hydrogen 3.007 N/A LYS 159.A NZ ASN 118.A OD1 no hydrogen 3.015 N/A LYS 159.A NZ LEU 141.A O no hydrogen 2.827 N/A HIS 160.A N ASN 156.A O no hydrogen 2.890 N/A ALA 161.A N MET 157.A O no hydrogen 2.866 N/A LEU 162.A N GLY 158.A O no hydrogen 2.955 N/A VAL 163.A N LYS 159.A O no hydrogen 3.128 N/A GLY 164.A N HIS 160.A O no hydrogen 3.166 N/A LEU 165.A N ALA 161.A O no hydrogen 2.822 N/A THR 166.A N LEU 162.A O no hydrogen 2.871 N/A THR 166.A OG1 LEU 162.A O no hydrogen 2.782 N/A GLN 167.A N VAL 163.A O no hydrogen 3.030 N/A SER 168.A N GLY 164.A O no hydrogen 2.875 N/A SER 168.A OG GLY 164.A O no hydrogen 3.281 N/A ALA 169.A N LEU 165.A O no hydrogen 2.747 N/A ALA 170.A N THR 166.A O no hydrogen 2.993 N/A LEU 171.A N GLN 167.A O no hydrogen 3.111 N/A GLU 172.A N SER 168.A O no hydrogen 3.015 N/A LEU 173.A N ALA 169.A O no hydrogen 2.832 N/A TYR 176.A N LEU 173.A O no hydrogen 2.915 N/A GLY 177.A N ALA 174.A O no hydrogen 2.830 N/A ILE 178.A N LEU 173.A O no hydrogen 3.267 N/A ARG 179.A N LEU 136.A O no hydrogen 3.099 N/A ARG 179.A NH1 LEU 225.A O no hydrogen 2.821 N/A ARG 179.A NH1 ILE 233.A O no hydrogen 3.134 N/A ARG 179.A NH2 ASN 135.A OD1 no hydrogen 3.131 N/A ARG 179.A NH2 LEU 225.A O no hydrogen 2.787 N/A VAL 180.A N THR 234.A OG1 no hydrogen 2.949 N/A ASN 181.A N ILE 138.A O no hydrogen 3.006 N/A ASN 181.A ND2 ILE 233.A O no hydrogen 2.944 N/A GLY 182.A N SER 236.A O no hydrogen 2.793 N/A VAL 183.A N ASN 140.A O no hydrogen 2.929 N/A ALA 184.A N ILE 238.A O no hydrogen 2.880 N/A SER 188.A OG ALA 213.A O no hydrogen 2.837 N/A MET 194.A N PRO 191.A O no hydrogen 3.030 N/A LYS 199.A N GLY 195.A O no hydrogen 2.878 N/A LYS 199.A NZ MET 194.A O no hydrogen 3.449 N/A ASP 200.A N GLU 196.A O no hydrogen 2.885 N/A LYS 201.A N GLU 197.A O no hydrogen 2.977 N/A TRP 202.A N GLU 198.A O no hydrogen 3.148 N/A ARG 203.A N LYS 199.A O no hydrogen 3.030 N/A ARG 203.A NE GLU 212.A OE1 no hydrogen 2.881 N/A ARG 203.A NE GLU 212.A OE2 no hydrogen 3.261 N/A ARG 203.A NH1 GLU 196.A OE2 no hydrogen 2.977 N/A ARG 203.A NH2 GLU 212.A OE2 no hydrogen 3.038 N/A ARG 204.A N ASP 200.A O no hydrogen 3.040 N/A LYS 205.A N TRP 202.A O no hydrogen 3.048 N/A VAL 206.A N ARG 203.A O no hydrogen 3.083 N/A LEU 208.A N GLY 242.A O no hydrogen 3.004 N/A GLY 209.A N PRO 207.A O no hydrogen 3.037 N/A ARG 210.A N VAL 206.A O no hydrogen 3.051 N/A ARG 210.A NH1 ARG 204.A O no hydrogen 2.713 N/A GLU 212.A N GLU 212.A OE1 no hydrogen 2.666 N/A ALA 213.A N VAL 187.A O no hydrogen 2.924 N/A SER 214.A N GLN 217.A OE1 no hydrogen 3.008 N/A GLU 216.A N GLU 216.A OE1 no hydrogen 2.776 N/A GLN 217.A N SER 214.A OG no hydrogen 2.969 N/A ILE 218.A N SER 214.A O no hydrogen 3.363 N/A ALA 219.A N ALA 215.A O no hydrogen 2.870 N/A ASP 220.A N GLU 216.A O no hydrogen 2.916 N/A ALA 221.A N ILE 218.A O no hydrogen 3.103 N/A VAL 222.A N ILE 218.A O no hydrogen 3.375 N/A ILE 223.A N ALA 219.A O no hydrogen 2.902 N/A PHE 224.A N ASP 220.A O no hydrogen 3.024 N/A LEU 225.A N ALA 221.A O no hydrogen 3.014 N/A VAL 226.A N VAL 222.A O no hydrogen 2.991 N/A SER 227.A N PHE 224.A O no hydrogen 3.093 N/A SER 227.A OG PHE 224.A O no hydrogen 2.677 N/A SER 229.A N SER 227.A OG no hydrogen 3.022 N/A ALA 230.A N SER 227.A O no hydrogen 3.197 N/A ILE 233.A N ALA 230.A O no hydrogen 2.916 N/A GLY 235.A N VAL 180.A O no hydrogen 2.709 N/A SER 236.A N ASN 181.A OD1 no hydrogen 2.918 N/A ILE 238.A N GLY 182.A O no hydrogen 2.857 N/A LYS 239.A NZ SER 245.A OG no hydrogen 3.243 N/A VAL 240.A N ALA 184.A O no hydrogen 2.884 N/A GLY 243.A N ASP 241.A OD1 no hydrogen 2.943 N/A LEU 244.A N ASP 241.A O no hydrogen 3.021 N/A SER 245.A N ASP 241.A OD2 no hydrogen 2.974 N/A SER 245.A OG ASP 241.A OD2 no hydrogen 2.743 N/A LEU 246.A N GLY 243.A O no hydrogen 2.949 N/A VAL 247.A N LEU 244.A O no hydrogen 3.168 N/A HIS 248.A ND1 ALA 249.A OXT no hydrogen 2.765 N/A