Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4htc_H.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 1.A N ASN 143.A O no hydrogen 2.916 N/A ILE 1.A N ASP 204.A OD1 no hydrogen 3.423 N/A ILE 1.A N ASP 204.A OD2 no hydrogen 2.713 N/A VAL 2.A N ASP 199.A O no hydrogen 2.832 N/A SER 5.A N VAL 162.A O no hydrogen 3.044 N/A ALA 7.A N LEU 160.A O no hydrogen 2.789 N/A MET 11.A N GLU 8.A O no hydrogen 3.148 N/A SER 12.A OG THR 139.A OG1 no hydrogen 3.408 N/A GLN 15.A N SER 12.A O no hydrogen 2.984 N/A GLN 15.A NE2 VAL 16.A O no hydrogen 3.426 N/A VAL 16.A N ALA 30.A O no hydrogen 2.731 N/A MET 17.A N ARG 62.A O no hydrogen 2.806 N/A LEU 18.A N CYS 28.A O no hydrogen 2.803 N/A PHE 19.A N LEU 60.A O no hydrogen 2.907 N/A ARG 20.A N GLU 25.A O no hydrogen 2.692 N/A ARG 20.A NE SER 22A.A O no hydrogen 3.019 N/A LYS 21.A N ASP 58.A O no hydrogen 3.180 N/A LYS 21.A NZ ASN 57.A O no hydrogen 3.182 N/A GLU 25.A N ARG 20.A O no hydrogen 3.244 N/A LEU 27.A N LEU 18.A O no hydrogen 2.627 N/A CYS 28.A SG LEU 27.A O no hydrogen 3.076 N/A GLY 29.A N SER 205.A O no hydrogen 2.834 N/A SER 31.A N LEU 39.A O no hydrogen 3.201 N/A SER 31.A OG GLN 221.A OE1 no hydrogen 2.449 N/A LEU 32.A N TRP 14.A O no hydrogen 2.980 N/A ILE 33.A N TRP 37.A O no hydrogen 2.899 N/A ARG 36.A N SER 34.A OG no hydrogen 3.338 N/A VAL 38.A N MET 103.A O no hydrogen 3.093 N/A LEU 39.A N SER 31.A O no hydrogen 2.694 N/A THR 40.A N ALA 101.A O no hydrogen 3.009 N/A THR 40.A OG1 GLY 29.A O no hydrogen 3.064 N/A ALA 41.A N THR 40.A OG1 no hydrogen 2.770 N/A HIS 43.A N ASP 99.A OD1 no hydrogen 2.743 N/A HIS 43.A ND1 ASP 99.A OD2 no hydrogen 2.672 N/A HIS 43.A NE2 SER 205.A OG no hydrogen 2.992 N/A CYS 44.A N ALA 41.A O no hydrogen 3.351 N/A CYS 44.A SG HIS 43.A NE2 no hydrogen 3.655 N/A CYS 44.A SG SER 205.A O no hydrogen 3.565 N/A LEU 45.A N ALA 42.A O no hydrogen 3.062 N/A LEU 46.A N ALA 42.A O no hydrogen 3.237 N/A ASP 58.A N THR 55I.A O no hydrogen 2.668 N/A LEU 60.A N PHE 19.A O no hydrogen 2.845 N/A VAL 61.A N SER 79.A O no hydrogen 3.053 N/A ARG 62.A N MET 17.A O no hydrogen 3.064 N/A ARG 62.A NE GLU 76.A OE1 no hydrogen 3.008 N/A ARG 62.A NH2 GLU 76.A OE1 no hydrogen 3.365 N/A ARG 62.A NH2 GLU 76.A OE2 no hydrogen 2.973 N/A ILE 63.A N LYS 77.A O no hydrogen 2.480 N/A LYS 65.A NZ ARG 70.A O no hydrogen 2.468 N/A LYS 65.A NZ GLU 72.A OE1 no hydrogen 2.810 N/A LYS 65.A NZ GLU 76.A OE2 no hydrogen 3.031 N/A HIS 66.A N GLU 72.A OE1 no hydrogen 2.796 N/A HIS 66.A N GLU 72.A OE2 no hydrogen 3.055 N/A SER 67.A N GLU 72.A OE2 no hydrogen 2.562 N/A ARG 68.A N SER 158.A O no hydrogen 2.989 N/A ARG 68.A NH1 PRO 157.A O no hydrogen 3.558 N/A ARG 70.A N SER 67.A OG no hydrogen 3.043 N/A GLU 72.A N GLU 76.A OE2 no hydrogen 2.866 N/A ILE 75.A N GLU 72.A O no hydrogen 2.870 N/A GLU 76.A N GLU 72.A O no hydrogen 2.631 N/A LYS 77.A N ILE 63.A O no hydrogen 2.718 N/A LYS 77.A NZ ALA 110.A O no hydrogen 2.734 N/A SER 79.A N VAL 61.A O no hydrogen 2.765 N/A GLU 82.A N LYS 104.A O no hydrogen 2.645 N/A TYR 85.A N LEU 102.A O no hydrogen 2.696 N/A HIS 87.A N ILE 100.A O no hydrogen 3.367 N/A ARG 89.A N HIS 87.A ND1 no hydrogen 2.798 N/A TYR 90.A N HIS 87.A O no hydrogen 3.255 N/A TYR 90.A OH LEU 46.A O no hydrogen 2.630 N/A ASN 91.A N ASP 97.A O no hydrogen 2.764 N/A ASN 91.A ND2 ARG 93.A O no hydrogen 2.726 N/A ASN 95.A ND2 ARG 180.A O no hydrogen 2.585 N/A LEU 96.A N ASN 91.A O no hydrogen 2.770 N/A ALA 101.A N THR 40.A O no hydrogen 2.959 N/A LEU 102.A N TYR 85.A O no hydrogen 2.841 N/A MET 103.A N VAL 38.A O no hydrogen 3.152 N/A LYS 104.A N LYS 83.A O no hydrogen 2.961 N/A LYS 104.A NZ GLU 82.A OE1 no hydrogen 3.168 N/A LEU 105.A N ARG 36.A O no hydrogen 2.925 N/A LYS 106.A N MET 80.A O no hydrogen 3.026 N/A VAL 109.A N ASP 35.A O no hydrogen 2.809 N/A SER 112.A N ILE 115.A O no hydrogen 2.716 N/A TYR 114.A N SER 112.A OG no hydrogen 3.095 N/A ILE 115.A N SER 112.A O no hydrogen 3.389 N/A HIS 116.A N PRO 13.A O no hydrogen 3.186 N/A VAL 118.A N LEU 32.A O no hydrogen 3.182 N/A CYS 119.A N TRP 219.A O no hydrogen 2.949 N/A THR 125.A N ASP 122.A OD2 no hydrogen 3.134 N/A THR 125.A OG1 ASP 122.A OD1 no hydrogen 2.713 N/A THR 125.A OG1 ASP 122.A OD2 no hydrogen 2.972 N/A ALA 126.A N ASP 122.A O no hydrogen 2.978 N/A LEU 130.A N ALA 126.A O no hydrogen 3.116 N/A GLN 131.A N LEU 129C.A O no hydrogen 2.839 N/A GLN 131.A NE2 SER 128B.A O no hydrogen 2.657 N/A GLY 133.A N ILE 167.A O no hydrogen 2.732 N/A TYR 134.A N GLN 131.A O no hydrogen 2.823 N/A LYS 135.A NZ TYR 190A.A OH no hydrogen 3.160 N/A GLY 136.A N LEU 165.A O no hydrogen 2.523 N/A ARG 137.A N VAL 210.A O no hydrogen 2.842 N/A ARG 137.A NE ASN 164.A OD1 no hydrogen 3.018 N/A VAL 138.A N VAL 163.A O no hydrogen 2.851 N/A THR 139.A OG1 SER 12.A OG no hydrogen 3.408 N/A THR 139.A OG1 GLN 15.A OE1 no hydrogen 2.913 N/A GLY 140.A N GLN 161.A O no hydrogen 3.236 N/A TRP 141.A NE1 HIS 66.A O no hydrogen 3.125 N/A GLY 142.A N ASP 204.A OD1 no hydrogen 2.546 N/A ASN 143.A N GLU 202.A O no hydrogen 2.962 N/A LEU 144.A N GLY 155.A O no hydrogen 2.518 N/A GLN 156.A NE2 ASN 143.A OD1 no hydrogen 2.850 N/A LEU 160.A N HIS 66.A O no hydrogen 3.102 N/A GLN 161.A N GLY 140.A O no hydrogen 3.004 N/A GLN 161.A NE2 ASP 6.A OD1 no hydrogen 2.871 N/A GLN 161.A NE2 VAL 159.A O no hydrogen 2.934 N/A VAL 162.A N SER 5.A O no hydrogen 2.936 N/A VAL 163.A N VAL 138.A O no hydrogen 3.013 N/A LEU 165.A N GLY 136.A O no hydrogen 2.440 N/A ILE 167.A N TYR 134.A O no hydrogen 2.724 N/A VAL 168.A N CYS 187.A O no hydrogen 3.181 N/A ARG 170.A NH1 MET 185.A O no hydrogen 2.178 N/A ARG 170.A NH2 THR 182.A O no hydrogen 2.384 N/A CYS 173.A N GLU 169.A O no hydrogen 3.059 N/A CYS 173.A SG VAL 168.A O no hydrogen 3.521 N/A CYS 173.A SG GLU 169.A O no hydrogen 3.562 N/A LYS 174.A N ARG 170.A O no hydrogen 2.944 N/A ASP 175.A N PRO 171.A O no hydrogen 2.735 N/A SER 176.A N CYS 173.A O no hydrogen 3.158 N/A SER 176.A OG CYS 173.A O no hydrogen 2.685 N/A THR 177.A OG1 GLU 229.A OE1 no hydrogen 3.188 N/A ILE 179.A N THR 177.A OG1 no hydrogen 3.212 N/A THR 182.A OG1 ASP 97.A OD1 no hydrogen 2.695 N/A ASN 184.A N THR 182.A OG1 no hydrogen 2.871 N/A ASN 184.A ND2 ASP 97.A OD1 no hydrogen 2.802 N/A ASN 184.A ND2 ASP 97.A OD2 no hydrogen 3.522 N/A MET 185.A N THR 182.A O no hydrogen 3.160 N/A PHE 186.A N TYR 240.A O no hydrogen 2.907 N/A ALA 188.A N GLY 238.A O no hydrogen 2.828 N/A GLY 189.A N PRO 166.A O no hydrogen 2.940 N/A LYS 191.A N GLU 194B.A OE1 no hydrogen 2.638 N/A LYS 191.A NZ GLU 169.A OE2 no hydrogen 2.594 N/A ARG 197.A NE ASP 232.A OD2 no hydrogen 3.082 N/A ARG 197.A NH1 ASP 234.A OD1 no hydrogen 2.710 N/A ARG 197.A NH2 ASP 232.A O no hydrogen 2.861 N/A ARG 197.A NH2 ASP 234.A OD1 no hydrogen 2.385 N/A GLY 198.A N ASP 232.A OD1 no hydrogen 3.068 N/A ASP 199.A N VAL 2.A O no hydrogen 3.371 N/A ALA 200.A N ASP 199.A OD1 no hydrogen 2.864 N/A CYS 201.A N ASP 204.A OD2 no hydrogen 2.757 N/A CYS 201.A SG LYS 145.A O no hydrogen 3.805 N/A ASP 204.A N CYS 201.A O no hydrogen 2.763 N/A SER 205.A OG HIS 43.A NE2 no hydrogen 2.992 N/A SER 205.A OG SER 226.A O no hydrogen 3.516 N/A GLY 206.A N VAL 225.A O no hydrogen 2.861 N/A GLY 207.A N ASP 204.A O no hydrogen 3.197 N/A PHE 209.A N GLY 223.A O no hydrogen 2.922 N/A VAL 210.A N ARG 137.A O no hydrogen 2.810 N/A MET 211.A N TYR 220.A O no hydrogen 2.867 N/A SER 213.A N ARG 218.A O no hydrogen 2.717 N/A TYR 220.A N MET 211.A O no hydrogen 2.896 N/A TYR 220.A OH ASN 216B.A OD1 no hydrogen 3.174 N/A GLN 221.A N CYS 119.A O no hydrogen 2.889 N/A GLN 221.A NE2 GLY 223.A O no hydrogen 2.845 N/A MET 222.A N PHE 209.A O no hydrogen 2.958 N/A GLY 223.A N PHE 209.A O no hydrogen 3.035 N/A VAL 225.A N GLY 207.A O no hydrogen 2.850 N/A SER 226.A N PHE 239.A O no hydrogen 3.060 N/A SER 226.A OG ASP 99.A OD2 no hydrogen 2.534 N/A TRP 227.A N PHE 239.A O no hydrogen 3.285 N/A CYS 231.A N GLU 146.A OE1 no hydrogen 3.112 N/A CYS 231.A SG ALA 200.A O no hydrogen 3.845 N/A ASP 232.A N ASP 199.A OD2 no hydrogen 2.868 N/A LYS 236.A N ARG 233A.A O no hydrogen 3.269 N/A LYS 236.A NZ SER 176.A O no hydrogen 2.761 N/A LYS 236.A NZ GLU 229.A OE1 no hydrogen 2.607 N/A GLY 238.A N ALA 188.A O no hydrogen 3.295 N/A PHE 239.A N TRP 227.A O no hydrogen 2.822 N/A TYR 240.A N PHE 186.A O no hydrogen 2.612 N/A THR 241.A N ILE 224.A O no hydrogen 2.792 N/A THR 241.A OG1 ASP 99.A O no hydrogen 2.808 N/A HIS 242.A N ASN 184.A O no hydrogen 2.715 N/A VAL 243.A N MET 222.A O no hydrogen 3.380 N/A ARG 245.A N HIS 242.A ND1 no hydrogen 3.220 N/A LEU 246.A N VAL 243.A O no hydrogen 3.024 N/A LYS 247.A N PHE 244.A O no hydrogen 3.024 N/A TRP 249.A N LEU 246.A O no hydrogen 3.194 N/A ILE 250.A N LEU 246.A O no hydrogen 3.295 N/A GLN 251.A N LYS 247.A O no hydrogen 2.751 N/A LYS 252.A N LYS 248.A O no hydrogen 3.094 N/A VAL 253.A N TRP 249.A O no hydrogen 2.837 N/A ILE 254.A N ILE 250.A O no hydrogen 2.995 N/A ASP 255.A N GLN 251.A O no hydrogen 3.029 N/A TYR 47A.A N LYS 52F.A O no hydrogen 2.720 N/A ARG 73A.A N TYR 71.A O no hydrogen 2.774 N/A ALA 127A.A N ARG 123.A O no hydrogen 2.766 N/A ARG 233A.A NE GLU 146.A OE1 no hydrogen 2.658 N/A ARG 233A.A NH2 GLU 146.A OE2 no hydrogen 3.308 N/A SER 128B.A N GLU 124.A O no hydrogen 2.881 N/A SER 128B.A OG GLU 124.A O no hydrogen 3.370 N/A GLU 194B.A N LYS 191.A O no hydrogen 2.702 N/A ASN 216B.A N SER 213.A OG no hydrogen 3.190 N/A LEU 129C.A N THR 125.A O no hydrogen 2.725 N/A VAL 152C.A N THR 149.A O no hydrogen 3.270 N/A TRP 50D.A N TYR 47A.A O no hydrogen 3.008 N/A ASP 51E.A N PRO 48B.A O no hydrogen 2.370 N/A LYS 52F.A N TYR 47A.A O no hydrogen 2.820 N/A PHE 54H.A N LEU 45.A O no hydrogen 3.091 N/A THR 55I.A N ASP 58.A OD2 no hydrogen 2.556 N/A THR 55I.A OG1 ASP 58.A OD2 no hydrogen 3.270 N/A