Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8ban_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): CYS 6.A N ASP 3.A O no hydrogen 3.116 N/A CYS 6.A N ASP 3.A OD2 no hydrogen 3.109 N/A PHE 7.A N ASP 3.A O no hydrogen 3.080 N/A TRP 8.A N ALA 4.A O no hydrogen 2.847 N/A GLN 9.A N ALA 5.A O no hydrogen 3.168 N/A ILE 10.A N CYS 6.A O no hydrogen 3.401 N/A TRP 11.A N PHE 7.A O no hydrogen 3.080 N/A TRP 11.A NE1 ASP 15.A OD2 no hydrogen 2.949 N/A GLN 12.A N TRP 8.A O no hydrogen 2.868 N/A ARG 13.A N ILE 10.A O no hydrogen 3.268 N/A PHE 14.A N TRP 11.A O no hydrogen 3.141 N/A ASP 15.A N TRP 11.A O no hydrogen 2.948 N/A LYS 19.A N ASP 15.A OD1 no hydrogen 2.889 N/A GLY 20.A N ASP 15.A OD2 no hydrogen 3.055 N/A ILE 22.A N ILE 54.A O no hydrogen 3.096 N/A ARG 23.A N GLU 26.A OE2 no hydrogen 3.015 N/A LEU 27.A N GLU 24.A O no hydrogen 3.009 N/A PHE 30.A N GLU 26.A O no hydrogen 3.026 N/A PHE 31.A N LEU 27.A O no hydrogen 3.183 N/A ASP 32.A N ASP 28.A O no hydrogen 3.060 N/A HIS 33.A N ALA 29.A O no hydrogen 2.993 N/A HIS 33.A ND1 ALA 29.A O no hydrogen 3.268 N/A LEU 34.A N PHE 30.A O no hydrogen 2.946 N/A LEU 35.A N PHE 31.A O no hydrogen 2.875 N/A ALA 36.A N ASP 32.A O no hydrogen 2.998 N/A GLU 42.A N THR 38.A O no hydrogen 3.080 N/A ASN 43.A N LEU 39.A O no hydrogen 3.247 N/A VAL 44.A N MET 40.A O no hydrogen 3.273 N/A VAL 44.A N GLU 41.A O no hydrogen 3.053 N/A GLN 45.A N GLU 41.A O no hydrogen 3.308 N/A LYS 46.A N GLU 42.A O no hydrogen 3.078 N/A VAL 47.A N ASN 43.A O no hydrogen 2.872 N/A LYS 48.A N VAL 44.A O no hydrogen 2.448 N/A LYS 48.A NZ GLN 45.A OE1 no hydrogen 3.357 N/A GLU 49.A N GLN 45.A O no hydrogen 2.469 N/A GLN 50.A N VAL 47.A O no hydrogen 2.986 N/A ILE 54.A N ILE 22.A O no hydrogen 3.362 N/A LEU 55.A N GLU 58.A OE1 no hydrogen 2.967 N/A MET 56.A N GLY 20.A O no hydrogen 3.222 N/A LYS 57.A NZ ASN 69.A OD1 no hydrogen 3.393 N/A GLU 58.A N LEU 55.A O no hydrogen 2.841 N/A LEU 59.A N MET 56.A O no hydrogen 2.763 N/A ALA 60.A N MET 56.A O no hydrogen 2.981 N/A SER 61.A N LYS 57.A O no hydrogen 3.176 N/A SER 61.A OG LYS 57.A O no hydrogen 3.249 N/A MET 62.A N LEU 59.A O no hydrogen 2.859 N/A PHE 63.A N LEU 59.A O no hydrogen 3.238 N/A LEU 64.A N ALA 60.A O no hydrogen 2.973 N/A SER 65.A N GLU 68.A OE1 no hydrogen 3.143 N/A GLU 68.A N SER 65.A OG no hydrogen 3.139 N/A ASN 69.A N SER 65.A O no hydrogen 3.037 N/A ASN 69.A ND2 ALA 60.A O no hydrogen 3.594 N/A ASN 69.A ND2 SER 65.A O no hydrogen 2.659 N/A PHE 70.A N GLU 66.A O no hydrogen 3.133 N/A LEU 71.A N ASP 67.A O no hydrogen 2.979 N/A LEU 72.A N GLU 68.A O no hydrogen 2.893 N/A PHE 73.A N ASN 69.A O no hydrogen 2.738 N/A PHE 74.A N PHE 70.A O no hydrogen 2.975 N/A ARG 75.A NH2 LEU 71.A O no hydrogen 2.842 N/A LEU 76.A N PHE 73.A O no hydrogen 2.698 N/A GLU 77.A N PHE 74.A O no hydrogen 2.910 N/A THR 78.A OG1 GLU 77.A O no hydrogen 2.119 N/A LEU 80.A N ALA 155.A O no hydrogen 3.238 N/A SER 83.A OG GLY 200.A O no hydrogen 3.442 N/A SER 83.A OG ASP 204.A OD2 no hydrogen 2.667 N/A VAL 84.A N ASN 82.A OD1 no hydrogen 2.911 N/A GLU 85.A N ASN 82.A OD1 no hydrogen 2.933 N/A PHE 86.A N ASN 82.A O no hydrogen 3.349 N/A MET 87.A N SER 83.A O no hydrogen 3.151 N/A GLN 88.A N VAL 84.A O no hydrogen 3.061 N/A ILE 89.A N GLU 85.A O no hydrogen 3.060 N/A TRP 90.A N PHE 86.A O no hydrogen 2.964 N/A ARG 91.A N MET 87.A O no hydrogen 2.749 N/A ARG 91.A NE ASP 199.A OD2 no hydrogen 2.778 N/A ARG 91.A NH2 ASP 199.A OD1 no hydrogen 3.467 N/A ARG 91.A NH2 ASP 219.A OD1 no hydrogen 2.809 N/A LYS 92.A N GLN 88.A O no hydrogen 3.052 N/A TYR 93.A N ILE 89.A O no hydrogen 3.204 N/A TYR 93.A OH ASP 112.A OD2 no hydrogen 2.846 N/A ASP 94.A N TRP 90.A O no hydrogen 2.908 N/A ALA 95.A N GLU 105.A OE2 no hydrogen 3.179 N/A SER 97.A N ASP 94.A O no hydrogen 2.983 N/A SER 98.A N ASP 94.A OD1 no hydrogen 2.904 N/A SER 98.A N ASP 96.A OD1 no hydrogen 2.966 N/A SER 98.A OG ASP 94.A OD1 no hydrogen 3.170 N/A SER 98.A OG ASP 96.A OD1 no hydrogen 3.547 N/A GLY 99.A N ASP 94.A OD2 no hydrogen 2.796 N/A PHE 100.A N SER 98.A OG no hydrogen 2.827 N/A ILE 101.A N LEU 145.A O no hydrogen 2.894 N/A SER 102.A N GLU 105.A OE1 no hydrogen 2.823 N/A LEU 106.A N SER 102.A O no hydrogen 2.788 N/A CYS 107.A N ALA 103.A O no hydrogen 2.845 N/A CYS 107.A SG GLU 127.A OE2 no hydrogen 3.563 N/A ASN 108.A N ALA 104.A O no hydrogen 3.166 N/A PHE 109.A N GLU 105.A O no hydrogen 3.054 N/A LEU 110.A N LEU 106.A O no hydrogen 2.889 N/A ARG 111.A N CYS 107.A O no hydrogen 2.820 N/A ARG 111.A NH1 ASN 108.A OD1 no hydrogen 2.793 N/A ARG 111.A NH2 GLU 123.A OE2 no hydrogen 2.860 N/A ASP 112.A N ASN 108.A O no hydrogen 3.087 N/A LEU 113.A N PHE 109.A O no hydrogen 2.897 N/A PHE 114.A N LEU 110.A O no hydrogen 2.945 N/A LEU 115.A N ARG 111.A O no hydrogen 3.167 N/A HIS 116.A N ASP 112.A O no hydrogen 2.975 N/A HIS 117.A N LEU 113.A O no hydrogen 3.311 N/A HIS 117.A N PHE 114.A O no hydrogen 3.070 N/A HIS 117.A ND1 LEU 113.A O no hydrogen 3.261 N/A LYS 118.A N LEU 115.A O no hydrogen 2.821 N/A LYS 119.A N PHE 114.A O no hydrogen 2.979 N/A SER 122.A N GLU 125.A OE1 no hydrogen 3.113 N/A GLU 125.A N SER 122.A OG no hydrogen 3.312 N/A LEU 126.A N SER 122.A O no hydrogen 2.847 N/A GLU 127.A N GLU 123.A O no hydrogen 3.101 N/A GLU 128.A N ALA 124.A O no hydrogen 3.174 N/A TYR 129.A N GLU 125.A O no hydrogen 3.052 N/A TYR 129.A OH ASP 67.A OD2 no hydrogen 2.460 N/A THR 130.A N LEU 126.A O no hydrogen 3.076 N/A THR 130.A OG1 LEU 126.A O no hydrogen 2.972 N/A SER 131.A N GLU 127.A O no hydrogen 3.079 N/A THR 132.A N GLU 128.A O no hydrogen 2.799 N/A THR 132.A OG1 GLU 128.A O no hydrogen 3.193 N/A MET 133.A N TYR 129.A O no hydrogen 2.837 N/A MET 134.A N THR 130.A O no hydrogen 2.943 N/A LYS 135.A N SER 131.A O no hydrogen 3.103 N/A ILE 136.A N THR 132.A O no hydrogen 3.112 N/A PHE 137.A N MET 133.A O no hydrogen 2.999 N/A ASP 138.A N MET 134.A O no hydrogen 2.985 N/A LYS 139.A NZ GLU 18.A OE1 no hydrogen 2.645 N/A LYS 141.A N ASP 138.A O no hydrogen 3.172 N/A LYS 141.A NZ LYS 135.A O no hydrogen 2.975 N/A LYS 141.A NZ ASP 138.A O no hydrogen 3.044 N/A ASP 142.A N ASP 138.A OD1 no hydrogen 3.266 N/A GLY 143.A N ASP 138.A OD2 no hydrogen 2.660 N/A ARG 144.A N ASP 142.A OD2 no hydrogen 2.942 N/A ARG 144.A NH1 GLY 143.A O no hydrogen 3.123 N/A LEU 145.A N ILE 101.A O no hydrogen 2.786 N/A ASP 146.A N ASP 149.A OD2 no hydrogen 2.715 N/A LEU 147.A N ASP 146.A OD1 no hydrogen 2.799 N/A LEU 150.A N ASP 146.A O no hydrogen 3.173 N/A ALA 151.A N LEU 147.A O no hydrogen 3.110 N/A ARG 152.A N ASN 148.A O no hydrogen 2.947 N/A ARG 152.A NE GLU 18.A OE2 no hydrogen 3.521 N/A ARG 152.A NH1 PHE 137.A O no hydrogen 2.958 N/A ILE 153.A N ASP 149.A O no hydrogen 3.066 N/A LEU 154.A N LEU 150.A O no hydrogen 3.076 N/A ALA 155.A N ARG 152.A O no hydrogen 3.213 N/A LEU 156.A N ALA 151.A O no hydrogen 3.007 N/A GLN 157.A N LEU 80.A O no hydrogen 2.760 N/A ASN 159.A ND2 ASP 204.A O no hydrogen 2.622 N/A LEU 161.A N ASN 159.A OD1 no hydrogen 3.094 N/A LEU 162.A N ASN 159.A O no hydrogen 3.181 N/A GLN 163.A NE2 PHE 160.A O no hydrogen 3.093 N/A PHE 164.A N LEU 161.A O no hydrogen 3.400 N/A ALA 168.A N LYS 165.A O no hydrogen 3.364 N/A SER 170.A N GLU 173.A OE1 no hydrogen 3.441 N/A SER 170.A OG GLU 173.A OE1 no hydrogen 2.685 N/A GLU 172.A N GLU 172.A OE1 no hydrogen 2.930 N/A GLU 173.A N SER 170.A OG no hydrogen 3.401 N/A ARG 174.A N SER 170.A O no hydrogen 2.791 N/A ARG 174.A NH2 LEU 246.A O no hydrogen 2.991 N/A ARG 174.A NH2 GLY 247.A O no hydrogen 2.777 N/A LYS 175.A N THR 171.A O no hydrogen 3.158 N/A ARG 176.A N GLU 172.A O no hydrogen 2.939 N/A ARG 176.A NE ASP 177.A OD1 no hydrogen 3.088 N/A ASP 177.A N GLU 173.A O no hydrogen 2.983 N/A PHE 178.A N ARG 174.A O no hydrogen 2.808 N/A GLU 179.A N LYS 175.A O no hydrogen 2.900 N/A LYS 180.A N ARG 176.A O no hydrogen 3.079 N/A LYS 180.A NZ GLN 163.A OE1 no hydrogen 3.158 N/A ILE 181.A N ASP 177.A O no hydrogen 2.884 N/A PHE 182.A N PHE 178.A O no hydrogen 2.827 N/A ALA 183.A N GLU 179.A O no hydrogen 2.946 N/A HIS 184.A N LYS 180.A O no hydrogen 3.211 N/A HIS 184.A N ILE 181.A O no hydrogen 3.183 N/A TYR 185.A N ILE 181.A O no hydrogen 3.304 N/A TYR 185.A OH ASP 204.A OD2 no hydrogen 2.813 N/A ASP 186.A N PHE 182.A O no hydrogen 2.928 N/A SER 188.A N GLU 197.A OE2 no hydrogen 2.947 N/A SER 188.A OG GLU 194.A OE2 no hydrogen 3.242 N/A SER 188.A OG GLU 197.A OE2 no hydrogen 2.738 N/A LYS 189.A N ASP 186.A O no hydrogen 2.825 N/A THR 190.A N ASP 186.A OD1 no hydrogen 3.051 N/A THR 190.A OG1 GLU 194.A OE1 no hydrogen 3.207 N/A THR 190.A OG1 GLU 194.A OE2 no hydrogen 3.021 N/A GLY 191.A N ASP 186.A OD2 no hydrogen 2.791 N/A ALA 192.A N THR 190.A OG1 no hydrogen 3.278 N/A LEU 193.A N ILE 237.A O no hydrogen 2.786 N/A GLU 194.A N GLU 197.A OE1 no hydrogen 3.187 N/A GLU 197.A N GLU 194.A O no hydrogen 3.083 N/A ASP 199.A N GLY 195.A O no hydrogen 3.188 N/A GLY 200.A N PRO 196.A O no hydrogen 2.785 N/A PHE 201.A N GLU 197.A O no hydrogen 3.238 N/A VAL 202.A N VAL 198.A O no hydrogen 2.821 N/A LYS 203.A N ASP 199.A O no hydrogen 2.901 N/A LYS 203.A NZ GLU 207.A OE1 no hydrogen 2.710 N/A LYS 203.A NZ GLU 207.A OE2 no hydrogen 3.313 N/A ASP 204.A N GLY 200.A O no hydrogen 3.258 N/A MET 205.A N PHE 201.A O no hydrogen 3.008 N/A MET 206.A N VAL 202.A O no hydrogen 3.039 N/A GLU 207.A N LYS 203.A O no hydrogen 3.145 N/A LEU 208.A N MET 205.A O no hydrogen 3.227 N/A VAL 209.A N MET 206.A O no hydrogen 3.114 N/A GLN 210.A N MET 206.A O no hydrogen 3.077 N/A ILE 213.A N GLU 207.A OE2 no hydrogen 3.054 N/A GLY 215.A N ASP 146.A OD1 no hydrogen 3.225 N/A ASP 217.A N SER 214.A OG no hydrogen 3.297 N/A LEU 218.A N SER 214.A O no hydrogen 2.983 N/A ASP 219.A N GLY 215.A O no hydrogen 3.310 N/A LYS 220.A N VAL 216.A O no hydrogen 3.166 N/A PHE 221.A N ASP 217.A O no hydrogen 2.820 N/A ARG 222.A N LEU 218.A O no hydrogen 2.963 N/A ARG 222.A NE ASP 199.A OD1 no hydrogen 2.787 N/A ARG 222.A NH2 GLY 195.A O no hydrogen 3.144 N/A GLU 223.A N ASP 219.A O no hydrogen 3.147 N/A ILE 224.A N LYS 220.A O no hydrogen 3.073 N/A LEU 225.A N PHE 221.A O no hydrogen 3.014 N/A LEU 226.A N ARG 222.A O no hydrogen 3.153 N/A ARG 227.A N GLU 223.A O no hydrogen 2.791 N/A HIS 228.A N ILE 224.A O no hydrogen 2.850 N/A CYS 229.A N LEU 225.A O no hydrogen 2.898 N/A CYS 229.A SG LEU 225.A O no hydrogen 3.467 N/A ASP 230.A N LEU 226.A O no hydrogen 2.864 N/A VAL 231.A N CYS 229.A O no hydrogen 2.930 N/A ASN 232.A N GLU 241.A OE2 no hydrogen 3.238 N/A LYS 233.A N ASP 230.A O no hydrogen 3.043 N/A LYS 233.A NZ ASP 230.A O no hydrogen 3.337 N/A LYS 233.A NZ VAL 231.A O no hydrogen 3.389 N/A ASP 234.A N ASN 232.A OD1 no hydrogen 3.409 N/A GLY 235.A N ASP 230.A OD1 no hydrogen 2.883 N/A LYS 236.A N ASP 234.A OD2 no hydrogen 2.824 N/A ILE 237.A N LEU 193.A O no hydrogen 3.022 N/A GLN 238.A N GLU 241.A OE1 no hydrogen 3.070 N/A GLN 238.A NE2 ASP 234.A OD1 no hydrogen 2.824 N/A LYS 239.A N GLY 191.A O no hydrogen 3.054 N/A LYS 239.A NZ GLU 179.A OE2 no hydrogen 2.389 N/A LEU 242.A N GLN 238.A O no hydrogen 3.097 N/A ALA 243.A N LYS 239.A O no hydrogen 3.013 N/A LEU 244.A N SER 240.A O no hydrogen 3.198 N/A CYS 245.A N GLU 241.A O no hydrogen 3.224 N/A CYS 245.A SG GLU 241.A O no hydrogen 3.902 N/A CYS 245.A SG LEU 242.A O no hydrogen 3.870 N/A LEU 246.A N LEU 242.A O no hydrogen 2.992 N/A LEU 246.A N ALA 243.A O no hydrogen 3.211 N/A GLY 247.A N LEU 244.A O no hydrogen 3.095 N/A LEU 248.A N ALA 243.A O no hydrogen 2.757 N/A