Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6aug_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ASP 4.A N GLU 1.A O no hydrogen 3.253 N/A ARG 6.A N SER 2.A O no hydrogen 2.895 N/A ARG 6.A NH2 GLN 204.A OE1 no hydrogen 2.418 N/A ALA 7.A N ALA 3.A O no hydrogen 3.004 N/A LEU 8.A N ASP 4.A O no hydrogen 3.156 N/A ALA 9.A N LEU 5.A O no hydrogen 2.820 N/A LYS 10.A N ARG 6.A O no hydrogen 3.210 N/A LYS 10.A NZ GLN 204.A OE1 no hydrogen 3.464 N/A HIS 11.A N ALA 7.A O no hydrogen 3.042 N/A HIS 11.A NE2 SER 86.A O no hydrogen 2.831 N/A LEU 12.A N LEU 8.A O no hydrogen 3.086 N/A TYR 13.A N ALA 9.A O no hydrogen 3.065 N/A ASP 14.A N LYS 10.A O no hydrogen 2.922 N/A SER 15.A N HIS 11.A O no hydrogen 3.299 N/A SER 15.A OG HIS 11.A O no hydrogen 2.938 N/A SER 15.A OG SER 86.A OG no hydrogen 3.311 N/A TYR 16.A N LEU 12.A O no hydrogen 2.972 N/A TYR 16.A OH ASP 165.A OD1 no hydrogen 2.715 N/A ILE 17.A N TYR 13.A O no hydrogen 3.110 N/A LYS 18.A N ASP 14.A O no hydrogen 3.050 N/A LYS 18.A NZ ASP 14.A OD2 no hydrogen 2.587 N/A SER 19.A N TYR 16.A O no hydrogen 3.204 N/A SER 19.A OG SER 15.A O no hydrogen 3.195 N/A PHE 20.A N TYR 16.A O no hydrogen 3.014 N/A LYS 24.A N ASP 165.A OD1 no hydrogen 2.945 N/A LYS 24.A NZ GLU 162.A OE2 no hydrogen 3.440 N/A LYS 24.A NZ LEU 163.A O no hydrogen 2.958 N/A ALA 25.A N ASP 165.A OD2 no hydrogen 2.790 N/A LYS 26.A N THR 23.A OG1 no hydrogen 2.898 N/A ALA 27.A N THR 23.A O no hydrogen 2.901 N/A ARG 28.A N LYS 24.A O no hydrogen 2.798 N/A ALA 29.A N ALA 25.A O no hydrogen 3.031 N/A ILE 30.A N LYS 26.A O no hydrogen 2.984 N/A LEU 31.A N ALA 27.A O no hydrogen 2.836 N/A THR 32.A N ARG 28.A O no hydrogen 3.275 N/A THR 32.A OG1 ARG 28.A O no hydrogen 2.378 N/A THR 35.A N THR 32.A O no hydrogen 3.183 N/A THR 35.A OG1 ASP 37.A OD1 no hydrogen 3.136 N/A THR 36.A N LYS 34.A O no hydrogen 2.834 N/A THR 36.A OG1 THR 36.A O no hydrogen 2.369 N/A ASP 37.A N THR 35.A O no hydrogen 2.348 N/A PHE 41.A N GLN 129.A O no hydrogen 3.115 N/A ILE 43.A N PHE 131.A O no hydrogen 2.855 N/A TYR 44.A N SER 48.A OG no hydrogen 3.361 N/A ASP 45.A N SER 48.A OG no hydrogen 2.983 N/A SER 48.A N ASP 45.A O no hydrogen 3.104 N/A SER 48.A OG ASP 45.A O no hydrogen 2.846 N/A SER 48.A OG ASP 45.A OD2 no hydrogen 2.575 N/A LEU 49.A N ASP 45.A O no hydrogen 3.344 N/A LEU 49.A N MET 46.A O no hydrogen 3.151 N/A GLY 52.A N SER 48.A O no hydrogen 3.285 N/A GLU 53.A N MET 50.A O no hydrogen 2.707 N/A ASP 54.A N MET 50.A O no hydrogen 2.961 N/A LYS 55.A N MET 51.A O no hydrogen 3.106 N/A ARG 64.A N GLU 60.A O no hydrogen 2.891 N/A ILE 65.A N VAL 61.A O no hydrogen 2.787 N/A PHE 66.A N ALA 62.A O no hydrogen 3.232 N/A GLN 67.A N ILE 63.A O no hydrogen 2.752 N/A GLY 68.A N ARG 64.A O no hydrogen 3.006 N/A CYS 69.A N ILE 65.A O no hydrogen 2.803 N/A GLN 70.A N PHE 66.A O no hydrogen 2.828 N/A GLN 70.A NE2 GLN 67.A OE1 no hydrogen 3.678 N/A PHE 71.A N GLN 67.A O no hydrogen 2.911 N/A ARG 72.A N GLY 68.A O no hydrogen 3.259 N/A ARG 72.A NH1 GLU 79.A OE1 no hydrogen 3.566 N/A SER 73.A N CYS 69.A O no hydrogen 3.249 N/A SER 73.A N GLN 70.A O no hydrogen 3.178 N/A VAL 74.A N GLN 70.A O no hydrogen 3.385 N/A GLU 75.A N PHE 71.A O no hydrogen 3.198 N/A ALA 76.A N ARG 72.A O no hydrogen 2.916 N/A VAL 77.A N SER 73.A O no hydrogen 2.808 N/A GLN 78.A N VAL 74.A O no hydrogen 2.971 N/A GLU 79.A N GLU 75.A O no hydrogen 3.177 N/A ILE 80.A N ALA 76.A O no hydrogen 2.917 N/A THR 81.A N VAL 77.A O no hydrogen 2.672 N/A THR 81.A OG1 VAL 77.A O no hydrogen 3.053 N/A GLU 82.A N GLN 78.A O no hydrogen 2.957 N/A TYR 83.A N GLU 79.A O no hydrogen 2.884 N/A TYR 83.A OH ALA 169.A O no hydrogen 2.712 N/A ALA 84.A N ILE 80.A O no hydrogen 2.964 N/A LYS 85.A N THR 81.A O no hydrogen 3.424 N/A SER 86.A N TYR 83.A O no hydrogen 3.098 N/A SER 86.A OG TYR 83.A O no hydrogen 2.802 N/A ILE 87.A N ALA 84.A O no hydrogen 2.506 N/A PHE 90.A N ILE 87.A O no hydrogen 2.924 N/A ASN 92.A N GLY 89.A O no hydrogen 2.781 N/A LEU 93.A N PHE 90.A O no hydrogen 2.991 N/A ASN 96.A N ASP 94.A OD1 no hydrogen 2.695 N/A GLN 98.A N ASP 94.A O no hydrogen 2.968 N/A GLN 98.A NE2 VAL 91.A O no hydrogen 2.744 N/A GLN 98.A NE2 LEU 93.A O no hydrogen 3.297 N/A VAL 99.A N LEU 95.A O no hydrogen 3.060 N/A THR 100.A N ASN 96.A O no hydrogen 3.179 N/A THR 100.A OG1 ASN 96.A O no hydrogen 3.188 N/A THR 100.A OG1 ASP 97.A O no hydrogen 3.028 N/A LEU 101.A N ASP 97.A O no hydrogen 2.831 N/A LEU 102.A N GLN 98.A O no hydrogen 3.086 N/A LYS 103.A N VAL 99.A O no hydrogen 2.529 N/A LYS 103.A NZ ILE 256.A O no hydrogen 3.433 N/A TYR 104.A N THR 100.A O no hydrogen 2.970 N/A GLY 105.A N LEU 101.A O no hydrogen 2.839 N/A VAL 106.A N LEU 102.A O no hydrogen 3.162 N/A HIS 107.A NE2 TYR 257.A OH no hydrogen 2.491 N/A ILE 109.A N GLY 105.A O no hydrogen 3.256 N/A ILE 110.A N VAL 106.A O no hydrogen 2.682 N/A TYR 111.A N HIS 107.A O no hydrogen 3.163 N/A THR 112.A N GLU 108.A O no hydrogen 3.164 N/A THR 112.A OG1 GLU 108.A O no hydrogen 3.053 N/A MET 113.A N ILE 109.A O no hydrogen 3.029 N/A LEU 114.A N ILE 110.A O no hydrogen 2.858 N/A ALA 115.A N TYR 111.A O no hydrogen 3.220 N/A SER 116.A N MET 113.A O no hydrogen 2.662 N/A SER 116.A OG MET 113.A O no hydrogen 2.996 N/A LEU 117.A N LEU 114.A O no hydrogen 2.828 N/A MET 118.A N ALA 115.A O no hydrogen 3.197 N/A ASN 119.A N GLY 122.A O no hydrogen 2.998 N/A ASP 121.A N ASN 119.A OD1 no hydrogen 2.671 N/A VAL 123.A N MET 132.A O no hydrogen 3.032 N/A LEU 124.A N LEU 117.A O no hydrogen 2.918 N/A ILE 125.A N GLY 130.A O no hydrogen 3.261 N/A SER 126.A OG SER 126.A O no hydrogen 2.240 N/A GLY 128.A N ILE 125.A O no hydrogen 3.190 N/A GLN 129.A N SER 126.A O no hydrogen 2.814 N/A GLN 129.A NE2 SER 126.A O no hydrogen 3.542 N/A GLY 130.A N ILE 125.A O no hydrogen 3.004 N/A PHE 131.A N PHE 41.A O no hydrogen 2.847 N/A MET 132.A N VAL 123.A O no hydrogen 2.887 N/A THR 133.A N ILE 43.A O no hydrogen 3.072 N/A ARG 134.A N ASP 121.A O no hydrogen 2.971 N/A ARG 134.A NE GLU 149.A OE1 no hydrogen 2.685 N/A ARG 134.A NE GLU 149.A OE2 no hydrogen 3.007 N/A ARG 134.A NH1 LYS 120.A O no hydrogen 3.114 N/A ARG 134.A NH2 GLU 149.A OE1 no hydrogen 2.503 N/A PHE 136.A N THR 133.A OG1 no hydrogen 3.119 N/A LEU 137.A N THR 133.A O no hydrogen 3.197 N/A LYS 138.A N ARG 134.A O no hydrogen 2.819 N/A SER 139.A N GLU 135.A O no hydrogen 2.909 N/A SER 139.A OG PHE 136.A O no hydrogen 2.611 N/A LEU 140.A N LEU 137.A O no hydrogen 3.097 N/A ARG 141.A NE GLU 60.A OE1 no hydrogen 2.963 N/A ARG 141.A NE GLU 60.A OE2 no hydrogen 2.994 N/A ARG 141.A NH2 GLU 60.A OE2 no hydrogen 3.089 N/A ARG 141.A NH2 GLU 244.A OE1 no hydrogen 2.883 N/A PHE 144.A N ARG 141.A O no hydrogen 2.680 N/A PHE 147.A N PHE 144.A O no hydrogen 3.231 N/A LYS 151.A N MET 148.A O no hydrogen 2.910 N/A LYS 151.A NZ PHE 147.A O no hydrogen 3.444 N/A GLU 153.A N GLU 149.A O no hydrogen 3.183 N/A PHE 154.A N PRO 150.A O no hydrogen 3.173 N/A ALA 155.A N LYS 151.A O no hydrogen 2.782 N/A VAL 156.A N PHE 152.A O no hydrogen 2.984 N/A LYS 157.A N GLU 153.A O no hydrogen 3.447 N/A PHE 158.A N PHE 154.A O no hydrogen 2.794 N/A ASN 159.A N ALA 155.A O no hydrogen 2.559 N/A ASN 159.A ND2 ALA 115.A O no hydrogen 3.042 N/A ASN 159.A ND2 MET 118.A O no hydrogen 3.185 N/A ALA 160.A N LYS 157.A O no hydrogen 3.097 N/A LEU 161.A N PHE 158.A O no hydrogen 3.202 N/A GLU 162.A N ASN 159.A O no hydrogen 2.885 N/A ASP 164.A N ASP 167.A OD2 no hydrogen 2.648 N/A LEU 168.A N ASP 164.A O no hydrogen 3.038 N/A ALA 169.A N ASP 165.A O no hydrogen 3.063 N/A PHE 171.A N ASP 167.A O no hydrogen 3.031 N/A ILE 172.A N LEU 168.A O no hydrogen 2.723 N/A ALA 173.A N ALA 169.A O no hydrogen 3.314 N/A VAL 174.A N ILE 170.A O no hydrogen 3.028 N/A ILE 175.A N PHE 171.A O no hydrogen 3.112 N/A ILE 176.A N ILE 172.A O no hydrogen 3.174 N/A LEU 177.A N ALA 173.A O no hydrogen 3.431 N/A SER 178.A N ILE 176.A O no hydrogen 3.081 N/A SER 178.A OG ILE 175.A O no hydrogen 2.981 N/A ARG 181.A NH1 GLU 108.A OE1 no hydrogen 3.201 N/A ARG 181.A NH1 GLU 108.A OE2 no hydrogen 3.401 N/A ARG 181.A NH2 GLU 108.A OE1 no hydrogen 3.397 N/A LEU 185.A N ASP 97.A OD1 no hydrogen 2.912 N/A LYS 188.A NZ ASP 192.A OD2 no hydrogen 3.417 N/A GLU 191.A N VAL 187.A O no hydrogen 2.811 N/A ASP 192.A N LYS 188.A O no hydrogen 2.647 N/A ILE 193.A N PRO 189.A O no hydrogen 3.223 N/A GLN 194.A N ILE 190.A O no hydrogen 3.087 N/A ASP 195.A N GLU 191.A O no hydrogen 2.969 N/A ASN 196.A N ASP 192.A O no hydrogen 3.297 N/A LEU 197.A N ILE 193.A O no hydrogen 2.812 N/A LEU 198.A N GLN 194.A O no hydrogen 2.635 N/A GLN 199.A N ASP 195.A O no hydrogen 3.111 N/A ALA 200.A N ASN 196.A O no hydrogen 2.975 N/A LEU 201.A N LEU 197.A O no hydrogen 2.718 N/A GLU 202.A N LEU 198.A O no hydrogen 2.839 N/A LEU 203.A N GLN 199.A O no hydrogen 3.024 N/A GLN 204.A N ALA 200.A O no hydrogen 2.902 N/A GLN 204.A NE2 ASP 167.A OD1 no hydrogen 2.690 N/A LEU 205.A N LEU 201.A O no hydrogen 2.856 N/A LYS 206.A N GLU 202.A O no hydrogen 3.124 N/A LEU 207.A N LEU 203.A O no hydrogen 3.012 N/A ASN 208.A N GLN 204.A O no hydrogen 2.807 N/A ASN 208.A ND2 ASP 164.A OD2 no hydrogen 2.950 N/A ASN 208.A ND2 ASP 167.A OD1 no hydrogen 2.867 N/A ASN 208.A ND2 ASP 167.A OD2 no hydrogen 3.284 N/A HIS 209.A N LEU 205.A O no hydrogen 3.002 N/A HIS 209.A NE2 ASP 167.A OD2 no hydrogen 2.732 N/A SER 212.A N HIS 209.A O no hydrogen 3.159 N/A LYS 218.A N GLN 214.A O no hydrogen 3.086 N/A LEU 219.A N LEU 215.A O no hydrogen 2.584 N/A LEU 220.A N PHE 216.A O no hydrogen 3.072 N/A GLN 221.A N ALA 217.A O no hydrogen 3.112 N/A LYS 222.A N LEU 219.A O no hydrogen 2.660 N/A MET 223.A N LEU 220.A O no hydrogen 3.215 N/A THR 224.A N GLN 221.A O no hydrogen 3.012 N/A THR 224.A OG1 GLN 221.A O no hydrogen 2.830 N/A LEU 226.A N LYS 222.A O no hydrogen 3.203 N/A ARG 227.A N MET 223.A O no hydrogen 3.158 N/A GLN 228.A N THR 224.A O no hydrogen 3.278 N/A ILE 229.A N ASP 225.A O no hydrogen 3.077 N/A VAL 230.A N LEU 226.A O no hydrogen 3.090 N/A THR 231.A N ARG 227.A O no hydrogen 3.140 N/A THR 231.A OG1 GLN 228.A O no hydrogen 2.698 N/A GLU 232.A N GLN 228.A O no hydrogen 3.314 N/A HIS 233.A N ILE 229.A O no hydrogen 3.123 N/A VAL 234.A N VAL 230.A O no hydrogen 3.167 N/A GLN 235.A N THR 231.A O no hydrogen 3.243 N/A LEU 236.A N GLU 232.A O no hydrogen 3.063 N/A LEU 237.A N HIS 233.A O no hydrogen 2.761 N/A GLN 238.A N VAL 234.A O no hydrogen 2.970 N/A GLN 238.A NE2 VAL 234.A O no hydrogen 3.356 N/A VAL 239.A N GLN 235.A O no hydrogen 3.351 N/A LYS 241.A N LEU 237.A O no hydrogen 3.136 N/A LYS 242.A N VAL 239.A O no hydrogen 3.107 N/A THR 243.A N VAL 239.A O no hydrogen 3.011 N/A THR 243.A OG1 VAL 239.A O no hydrogen 3.373 N/A GLU 244.A N ILE 240.A O no hydrogen 3.117 N/A MET 247.A N GLU 244.A O no hydrogen 2.959 N/A HIS 250.A N GLN 70.A OE1 no hydrogen 2.979 N/A LEU 252.A N HIS 250.A ND1 no hydrogen 3.244 N/A GLN 254.A N HIS 250.A O no hydrogen 3.212 N/A GLN 254.A N PRO 251.A O no hydrogen 2.730 N/A GLU 255.A N PRO 251.A O no hydrogen 3.365 N/A TYR 257.A N GLN 254.A O no hydrogen 3.095 N/A TYR 257.A OH HIS 107.A NE2 no hydrogen 2.491 N/A