Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4o91_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 5.A N ALA 69.A O no hydrogen 2.824 N/A TYR 7.A OH GLN 38.A OE1 no hydrogen 2.809 N/A LYS 8.A NZ ASP 6.A OD2 no hydrogen 2.798 N/A GLU 9.A N ASP 6.A O no hydrogen 2.950 N/A ILE 10.A N TYR 7.A O no hydrogen 3.229 N/A GLU 11.A N LYS 28.A O no hydrogen 2.883 N/A GLU 13.A N LYS 26.A O no hydrogen 2.991 N/A GLU 14.A N LYS 26.A O no hydrogen 3.355 N/A VAL 16.A N VAL 24.A O no hydrogen 2.702 N/A GLY 17.A N VAL 24.A O no hydrogen 3.321 N/A ARG 18.A NE GLU 40.A OE2 no hydrogen 2.828 N/A ARG 18.A NH2 GLU 40.A OE2 no hydrogen 3.391 N/A ALA 20.A N PHE 150.A O no hydrogen 3.229 N/A GLY 22.A N GLU 44.A OE1 no hydrogen 3.095 N/A VAL 23.A N GLN 38.A O no hydrogen 3.051 N/A VAL 24.A N GLY 17.A O no hydrogen 2.927 N/A CYS 25.A N ILE 36.A O no hydrogen 2.703 N/A LYS 26.A N GLU 14.A O no hydrogen 2.667 N/A LYS 26.A NZ GLU 13.A OE1 no hydrogen 2.996 N/A LYS 26.A NZ ASP 33.A OD1 no hydrogen 3.074 N/A ALA 27.A N VAL 34.A O no hydrogen 2.751 N/A LYS 28.A N GLU 11.A O no hydrogen 2.973 N/A TRP 29.A N LYS 32.A O no hydrogen 3.053 N/A LYS 32.A N TRP 29.A O no hydrogen 3.144 N/A VAL 34.A N ALA 27.A O no hydrogen 2.965 N/A ALA 35.A N MET 78.A O no hydrogen 3.090 N/A ILE 36.A N CYS 25.A O no hydrogen 2.754 N/A LYS 37.A N LEU 76.A O no hydrogen 2.954 N/A LYS 37.A NZ GLU 51.A OE1 no hydrogen 2.953 N/A LYS 37.A NZ GLU 51.A OE2 no hydrogen 3.519 N/A GLN 38.A N VAL 23.A O no hydrogen 2.919 N/A ILE 39.A N VAL 74.A O no hydrogen 3.261 N/A GLU 40.A N GLU 44.A OE2 no hydrogen 3.092 N/A GLU 44.A N SER 41.A O no hydrogen 3.068 N/A ARG 45.A N GLU 42.A O no hydrogen 3.310 N/A ARG 45.A NH1 GLU 42.A OE1 no hydrogen 2.983 N/A PHE 48.A N GLU 44.A O no hydrogen 3.185 N/A ILE 49.A N ARG 45.A O no hydrogen 3.380 N/A VAL 50.A N LYS 46.A O no hydrogen 3.108 N/A GLU 51.A N ALA 47.A O no hydrogen 3.136 N/A LEU 52.A N PHE 48.A O no hydrogen 2.655 N/A ARG 53.A N ILE 49.A O no hydrogen 2.832 N/A GLN 54.A N VAL 50.A O no hydrogen 2.926 N/A LEU 55.A N GLU 51.A O no hydrogen 2.901 N/A SER 56.A N LEU 52.A O no hydrogen 3.159 N/A SER 56.A OG LEU 52.A O no hydrogen 3.218 N/A SER 56.A OG ARG 53.A O no hydrogen 2.557 N/A ARG 57.A N GLN 54.A O no hydrogen 3.141 N/A ARG 57.A NH2 GLN 122.A O no hydrogen 3.436 N/A ARG 57.A NH2 LYS 124.A O no hydrogen 3.208 N/A VAL 58.A N LEU 55.A O no hydrogen 3.348 N/A ASN 59.A N TYR 117.A OH no hydrogen 3.001 N/A ASN 62.A N HIS 60.A ND1 no hydrogen 2.876 N/A ASN 62.A ND2 GLN 110.A OE1 no hydrogen 3.240 N/A ASN 62.A ND2 LEU 145.A O no hydrogen 2.963 N/A ILE 63.A N HIS 60.A O no hydrogen 3.193 N/A VAL 64.A N ILE 147.A O no hydrogen 2.989 N/A LYS 65.A NZ TYR 67.A OH no hydrogen 3.511 N/A LYS 65.A NZ GLU 79.A OE2 no hydrogen 2.812 N/A TYR 67.A N VAL 77.A O no hydrogen 2.799 N/A GLY 68.A N VAL 77.A O no hydrogen 3.246 N/A CYS 70.A N CYS 75.A O no hydrogen 3.193 N/A CYS 70.A SG PRO 73.A O no hydrogen 3.192 N/A CYS 70.A SG CYS 75.A O no hydrogen 3.835 N/A CYS 75.A N CYS 70.A O no hydrogen 3.053 N/A CYS 75.A SG LYS 37.A O no hydrogen 3.662 N/A CYS 75.A SG LEU 76.A O no hydrogen 4.004 N/A LEU 76.A N LYS 37.A O no hydrogen 2.898 N/A VAL 77.A N GLY 68.A O no hydrogen 2.853 N/A MET 78.A N ALA 35.A O no hydrogen 2.806 N/A GLU 79.A N LYS 65.A O no hydrogen 2.933 N/A TYR 80.A N ASP 33.A O no hydrogen 3.428 N/A GLU 82.A N GLU 82.A OE1 no hydrogen 2.516 N/A LEU 86.A N LEU 136.A O no hydrogen 2.609 N/A TYR 87.A N PRO 133.A O no hydrogen 3.280 N/A ASN 88.A N SER 85.A OG no hydrogen 2.954 N/A VAL 89.A N SER 85.A O no hydrogen 3.199 N/A LEU 90.A N LEU 86.A O no hydrogen 2.879 N/A HIS 91.A N TYR 87.A O no hydrogen 2.766 N/A HIS 91.A NE2 GLU 182.A OE2 no hydrogen 2.789 N/A GLY 92.A N ASN 88.A O no hydrogen 2.782 N/A TYR 98.A N TYR 261.A O no hydrogen 2.787 N/A TYR 99.A N TYR 278.A OH no hydrogen 3.237 N/A TYR 99.A OH VAL 183.A O no hydrogen 2.540 N/A THR 100.A N HIS 103.A ND1 no hydrogen 2.964 N/A THR 100.A OG1 HIS 103.A ND1 no hydrogen 3.006 N/A HIS 103.A N THR 100.A OG1 no hydrogen 3.311 N/A HIS 103.A NE2 GLU 257.A O no hydrogen 2.663 N/A ALA 104.A N THR 100.A O no hydrogen 3.123 N/A MET 105.A N ALA 101.A O no hydrogen 3.051 N/A SER 106.A N ALA 102.A O no hydrogen 2.913 N/A TRP 107.A N HIS 103.A O no hydrogen 2.817 N/A TRP 107.A NE1 GLY 142.A O no hydrogen 2.934 N/A CYS 108.A N ALA 104.A O no hydrogen 3.156 N/A CYS 108.A SG ALA 104.A O no hydrogen 3.521 N/A LEU 109.A N MET 105.A O no hydrogen 2.885 N/A GLN 110.A N SER 106.A O no hydrogen 2.928 N/A GLN 110.A NE2 SER 106.A O no hydrogen 3.180 N/A GLN 110.A NE2 SER 106.A OG no hydrogen 2.819 N/A GLN 110.A NE2 THR 143.A O no hydrogen 2.945 N/A CYS 111.A N TRP 107.A O no hydrogen 2.947 N/A SER 112.A N CYS 108.A O no hydrogen 3.017 N/A SER 112.A OG CYS 108.A O no hydrogen 3.432 N/A SER 112.A OG LEU 109.A O no hydrogen 2.699 N/A GLN 113.A N LEU 109.A O no hydrogen 2.890 N/A GLY 114.A N GLN 110.A O no hydrogen 3.268 N/A VAL 115.A N CYS 111.A O no hydrogen 3.003 N/A ALA 116.A N SER 112.A O no hydrogen 2.832 N/A TYR 117.A N GLN 113.A O no hydrogen 3.224 N/A LEU 118.A N GLY 114.A O no hydrogen 3.114 N/A HIS 119.A N VAL 115.A O no hydrogen 2.812 N/A HIS 119.A NE2 ASP 172.A OD2 no hydrogen 2.927 N/A SER 120.A N TYR 117.A O no hydrogen 3.127 N/A SER 120.A OG ALA 116.A O no hydrogen 3.190 N/A SER 120.A OG TYR 117.A O no hydrogen 2.808 N/A GLN 122.A NE2 SER 120.A O no hydrogen 3.565 N/A LEU 126.A N LEU 118.A O no hydrogen 2.876 N/A HIS 128.A N ASP 172.A OD2 no hydrogen 2.889 N/A HIS 128.A NE2 CYS 148.A O no hydrogen 2.887 N/A ARG 129.A N ASP 172.A OD1 no hydrogen 2.859 N/A ARG 129.A NE ARG 129.A O no hydrogen 3.135 N/A ASP 130.A N HIS 128.A ND1 no hydrogen 3.086 N/A LYS 132.A NZ SER 153.A OG no hydrogen 2.662 N/A ASN 135.A N LYS 132.A O no hydrogen 2.908 N/A ASN 135.A ND2 ASP 130.A O no hydrogen 2.831 N/A ASN 135.A ND2 ASP 130.A OD2 no hydrogen 3.241 N/A LEU 136.A N PRO 133.A O no hydrogen 3.001 N/A LEU 137.A N LYS 146.A O no hydrogen 2.701 N/A LEU 138.A N GLY 84.A O no hydrogen 2.898 N/A VAL 139.A N VAL 144.A O no hydrogen 2.722 N/A ALA 140.A N GLU 82.A OE2 no hydrogen 3.209 N/A THR 143.A N VAL 139.A O no hydrogen 3.097 N/A THR 143.A N ALA 140.A O no hydrogen 3.241 N/A THR 143.A OG1 ALA 140.A O no hydrogen 2.639 N/A VAL 144.A N VAL 139.A O no hydrogen 3.011 N/A LEU 145.A N GLN 110.A OE1 no hydrogen 2.803 N/A LYS 146.A N LEU 137.A O no hydrogen 2.571 N/A LYS 146.A NZ PRO 61.A O no hydrogen 2.814 N/A ILE 147.A N ASN 62.A O no hydrogen 2.824 N/A CYS 148.A N ASN 135.A O no hydrogen 3.074 N/A CYS 148.A SG ASN 135.A O no hydrogen 3.157 N/A PHE 150.A N ASN 135.A OD1 no hydrogen 3.394 N/A GLY 151.A N ASP 149.A OD1 no hydrogen 2.900 N/A SER 153.A OG ASP 130.A OD1 no hydrogen 2.617 N/A TRP 156.A N SER 153.A O no hydrogen 3.156 N/A TRP 156.A NE1 GLU 182.A OE1 no hydrogen 2.780 N/A MET 157.A N ALA 154.A O no hydrogen 3.226 N/A GLU 160.A N GLU 160.A OE1 no hydrogen 2.804 N/A VAL 161.A N ALA 158.A O no hydrogen 2.886 N/A GLY 164.A N VAL 161.A O no hydrogen 3.016 N/A SER 165.A N GLU 160.A O no hydrogen 3.055 N/A SER 165.A OG GLU 163.A OE2 no hydrogen 2.834 N/A LYS 170.A N SER 168.A OG no hydrogen 3.318 N/A LYS 170.A NZ PRO 232.A O no hydrogen 3.469 N/A LYS 170.A NZ ARG 235.A O no hydrogen 2.731 N/A CYS 171.A N SER 168.A O no hydrogen 3.153 N/A CYS 171.A SG SER 168.A O no hydrogen 3.189 N/A ASP 172.A N GLU 169.A O no hydrogen 3.164 N/A PHE 174.A N LYS 170.A O no hydrogen 3.344 N/A SER 175.A N CYS 171.A O no hydrogen 3.233 N/A SER 175.A OG TRP 156.A O no hydrogen 2.686 N/A SER 175.A OG CYS 171.A O no hydrogen 3.345 N/A TRP 176.A N ASP 172.A O no hydrogen 2.979 N/A TRP 176.A NE1 CYS 108.A O no hydrogen 2.794 N/A GLY 177.A N VAL 173.A O no hydrogen 3.075 N/A ILE 178.A N PHE 174.A O no hydrogen 3.217 N/A ILE 179.A N SER 175.A O no hydrogen 2.897 N/A LEU 180.A N TRP 176.A O no hydrogen 2.875 N/A TRP 181.A N GLY 177.A O no hydrogen 3.162 N/A TRP 181.A NE1 PRO 211.A O no hydrogen 2.801 N/A GLU 182.A N ILE 178.A O no hydrogen 2.942 N/A VAL 183.A N ILE 179.A O no hydrogen 2.941 N/A ILE 184.A N LEU 180.A O no hydrogen 3.284 N/A THR 185.A N TRP 181.A O no hydrogen 2.994 N/A THR 185.A OG1 TRP 181.A O no hydrogen 2.948 N/A THR 185.A OG1 GLU 182.A O no hydrogen 3.503 N/A ARG 186.A N GLU 182.A O no hydrogen 2.724 N/A ARG 186.A NE LEU 90.A O no hydrogen 3.097 N/A ARG 186.A NH1 PRO 97.A O no hydrogen 2.912 N/A ARG 186.A NH2 VAL 89.A O no hydrogen 2.852 N/A ARG 186.A NH2 PRO 97.A O no hydrogen 2.653 N/A ARG 187.A N THR 185.A OG1 no hydrogen 3.222 N/A ASP 191.A N LYS 188.A O no hydrogen 3.282 N/A ARG 199.A N PRO 196.A O no hydrogen 3.117 N/A ARG 199.A NH1 ILE 193.A O no hydrogen 2.757 N/A ARG 199.A NH1 GLY 194.A O no hydrogen 3.308 N/A MET 201.A N ALA 197.A O no hydrogen 2.929 N/A TRP 202.A N PHE 198.A O no hydrogen 2.866 N/A ALA 203.A N ARG 199.A O no hydrogen 3.203 N/A VAL 204.A N ILE 200.A O no hydrogen 2.907 N/A HIS 205.A N MET 201.A O no hydrogen 2.872 N/A ASN 206.A N TRP 202.A O no hydrogen 3.027 N/A GLY 207.A N VAL 204.A O no hydrogen 2.931 N/A THR 208.A N ALA 203.A O no hydrogen 2.977 N/A THR 208.A OG1 ALA 203.A O no hydrogen 3.227 N/A ARG 209.A NE TRP 228.A O no hydrogen 2.757 N/A ARG 209.A NH1 VAL 204.A O no hydrogen 3.052 N/A ARG 209.A NH1 THR 208.A O no hydrogen 2.766 N/A ARG 209.A NH2 TRP 228.A O no hydrogen 2.798 N/A LYS 214.A N VAL 275.A O no hydrogen 2.820 N/A LYS 214.A NZ ARG 274.A O no hydrogen 3.401 N/A LEU 216.A N ILE 213.A O no hydrogen 3.342 N/A ILE 220.A N PRO 217.A O no hydrogen 2.787 N/A GLU 221.A N PRO 217.A O no hydrogen 2.880 N/A SER 222.A N LYS 218.A O no hydrogen 2.887 N/A LEU 223.A N PRO 219.A O no hydrogen 3.373 N/A MET 224.A N ILE 220.A O no hydrogen 2.916 N/A THR 225.A N GLU 221.A O no hydrogen 2.981 N/A THR 225.A OG1 GLU 221.A O no hydrogen 2.911 N/A THR 225.A OG1 SER 222.A O no hydrogen 3.198 N/A ARG 226.A N SER 222.A O no hydrogen 3.170 N/A ARG 226.A NH1 GLU 240.A OE2 no hydrogen 3.109 N/A ARG 226.A NH2 GLU 240.A OE2 no hydrogen 2.725 N/A CYS 227.A N LEU 223.A O no hydrogen 3.147 N/A CYS 227.A SG LEU 223.A O no hydrogen 3.429 N/A TRP 228.A N MET 224.A O no hydrogen 3.304 N/A TRP 228.A N THR 225.A O no hydrogen 3.075 N/A SER 229.A N ARG 226.A O no hydrogen 3.294 N/A SER 229.A OG ARG 226.A O no hydrogen 2.709 N/A LYS 230.A NZ HIS 205.A O no hydrogen 2.956 N/A SER 233.A N ASP 231.A OD1 no hydrogen 3.492 N/A SER 233.A OG ASP 231.A OD1 no hydrogen 2.757 N/A SER 233.A OG ASP 231.A OD2 no hydrogen 2.702 N/A GLN 234.A N ASP 231.A O no hydrogen 2.865 N/A ARG 235.A N PRO 232.A O no hydrogen 3.096 N/A ARG 235.A NE SER 229.A O no hydrogen 2.951 N/A ARG 235.A NH1 GLU 160.A OE2 no hydrogen 2.723 N/A ARG 235.A NH1 LYS 170.A O no hydrogen 2.896 N/A ARG 235.A NH2 GLU 160.A OE1 no hydrogen 2.684 N/A ARG 235.A NH2 GLU 160.A OE2 no hydrogen 3.390 N/A ARG 235.A NH2 SER 229.A O no hydrogen 3.329 N/A GLU 240.A N SER 237.A OG no hydrogen 3.331 N/A ILE 241.A N SER 237.A O no hydrogen 3.131 N/A VAL 242.A N MET 238.A O no hydrogen 2.798 N/A LYS 243.A N GLU 239.A O no hydrogen 3.116 N/A ILE 244.A N GLU 240.A O no hydrogen 2.884 N/A MET 245.A N ILE 241.A O no hydrogen 2.803 N/A THR 246.A N VAL 242.A O no hydrogen 2.816 N/A THR 246.A OG1 VAL 242.A O no hydrogen 2.737 N/A HIS 247.A N LYS 243.A O no hydrogen 3.061 N/A LEU 248.A N ILE 244.A O no hydrogen 2.938 N/A MET 249.A N MET 245.A O no hydrogen 3.089 N/A ARG 250.A N HIS 247.A O no hydrogen 3.428 N/A ARG 250.A NE ASP 291.A OD2 no hydrogen 2.838 N/A ARG 250.A NH2 ASP 291.A OD1 no hydrogen 3.103 N/A ARG 250.A NH2 ASP 291.A OD2 no hydrogen 3.056 N/A TYR 251.A N LEU 248.A O no hydrogen 2.870 N/A TYR 251.A OH ASP 291.A OD2 no hydrogen 2.731 N/A PHE 252.A N MET 249.A O no hydrogen 2.839 N/A ASP 256.A N ASP 256.A OD1 no hydrogen 2.532 N/A GLU 257.A N GLY 254.A O no hydrogen 3.169 N/A LEU 259.A N GLY 141.A O no hydrogen 2.880 N/A CYS 263.A SG TYR 278.A OH no hydrogen 3.837 N/A VAL 275.A N LEU 212.A O no hydrogen 2.904 N/A TYR 278.A N ILE 184.A O no hydrogen 2.839 N/A VAL 279.A N ILE 184.A O no hydrogen 3.262 N/A ALA 282.A N ASP 280.A OD1 no hydrogen 3.340 N/A TYR 285.A N PHE 281.A O no hydrogen 3.066 N/A TYR 285.A OH ASN 215.A O no hydrogen 2.760 N/A ARG 286.A N ALA 282.A O no hydrogen 3.196 N/A ARG 286.A NE GLU 283.A OE1 no hydrogen 3.134 N/A LEU 287.A N GLU 283.A O no hydrogen 3.020 N/A TRP 288.A N PHE 284.A O no hydrogen 2.882 N/A SER 289.A N TYR 285.A O no hydrogen 3.025 N/A SER 289.A OG TYR 285.A O no hydrogen 3.053 N/A VAL 290.A N ARG 286.A O no hydrogen 3.164 N/A ASP 291.A N LEU 287.A O no hydrogen 3.415 N/A HIS 292.A N TRP 288.A O no hydrogen 2.949 N/A HIS 292.A ND1 TRP 288.A O no hydrogen 2.984 N/A