Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8xn7_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 4.A N SER 75.A O no hydrogen 2.666 N/A ARG 9.A N ASP 7.A OD1 no hydrogen 2.991 N/A ASP 10.A N ASP 7.A O no hydrogen 3.075 N/A HIS 11.A N PRO 8.A O no hydrogen 3.038 N/A HIS 11.A ND1 TYR 76.A OH no hydrogen 3.045 N/A ASP 13.A N ARG 30.A O no hydrogen 3.006 N/A LEU 15.A N LYS 28.A O no hydrogen 2.555 N/A GLN 16.A N LYS 28.A O no hydrogen 3.384 N/A ARG 17.A NE GLU 25.A OE1 no hydrogen 2.957 N/A LEU 18.A N VAL 26.A O no hydrogen 2.710 N/A GLU 25.A N MET 42.A O no hydrogen 3.316 N/A VAL 26.A N GLY 19.A O no hydrogen 3.053 N/A PHE 27.A N LEU 40.A O no hydrogen 2.920 N/A LYS 28.A N GLN 16.A O no hydrogen 2.849 N/A LYS 28.A NZ GLN 16.A OE1 no hydrogen 3.339 N/A ALA 29.A N VAL 38.A O no hydrogen 2.784 N/A ARG 30.A N ASP 13.A O no hydrogen 3.102 N/A ASP 31.A N ASP 36.A O no hydrogen 2.900 N/A LYS 32.A N HIS 11.A O no hydrogen 3.024 N/A VAL 33.A N ASP 31.A OD1 no hydrogen 3.000 N/A SER 34.A N ASP 31.A OD1 no hydrogen 3.349 N/A SER 34.A OG ASP 36.A OD2 no hydrogen 2.578 N/A GLY 35.A N ASP 31.A O no hydrogen 2.932 N/A ASP 36.A N SER 34.A OG no hydrogen 3.140 N/A VAL 38.A N ALA 29.A O no hydrogen 2.732 N/A ALA 39.A N MET 86.A O no hydrogen 3.192 N/A LEU 40.A N PHE 27.A O no hydrogen 2.837 N/A LYS 41.A N ILE 84.A O no hydrogen 3.068 N/A LYS 41.A NZ ASP 150.A O no hydrogen 3.218 N/A MET 42.A N GLU 25.A O no hydrogen 2.778 N/A VAL 43.A N LEU 82.A O no hydrogen 2.719 N/A LYS 44.A N TYR 23.A O no hydrogen 3.238 N/A MET 45.A N GLN 80.A O no hydrogen 3.256 N/A ASP 49.A N GLU 46.A O no hydrogen 3.251 N/A SER 52.A N ASP 50.A OD1 no hydrogen 2.715 N/A THR 53.A OG1 ASP 50.A O no hydrogen 2.574 N/A GLN 55.A N VAL 51.A O no hydrogen 3.497 N/A LYS 56.A N SER 52.A O no hydrogen 3.223 N/A GLU 57.A N THR 53.A O no hydrogen 2.993 N/A ILE 58.A N LEU 54.A O no hydrogen 2.605 N/A LEU 59.A N GLN 55.A O no hydrogen 2.737 N/A ILE 60.A N LYS 56.A O no hydrogen 3.231 N/A LEU 61.A N GLU 57.A O no hydrogen 3.136 N/A LYS 62.A N ILE 58.A O no hydrogen 2.845 N/A THR 63.A N LEU 59.A O no hydrogen 2.858 N/A THR 63.A OG1 LEU 59.A O no hydrogen 2.738 N/A THR 63.A OG1 ILE 60.A O no hydrogen 3.172 N/A CYS 64.A N ILE 60.A O no hydrogen 3.188 N/A ARG 65.A N TYR 122.A OH no hydrogen 2.955 N/A ASN 68.A N HIS 66.A ND1 no hydrogen 2.973 N/A ASN 68.A ND2 GLU 115.A OE1 no hydrogen 2.959 N/A ASN 68.A ND2 VAL 146.A O no hydrogen 3.126 N/A ILE 69.A N HIS 66.A O no hydrogen 3.040 N/A VAL 70.A N LEU 148.A O no hydrogen 3.263 N/A ALA 71.A N GLU 87.A OE1 no hydrogen 3.146 N/A TYR 72.A OH SER 75.A OG no hydrogen 2.207 N/A HIS 73.A N CYS 85.A O no hydrogen 2.817 N/A SER 75.A OG TYR 72.A OH no hydrogen 2.207 N/A TYR 76.A N TRP 83.A O no hydrogen 2.948 N/A TYR 76.A OH HIS 11.A ND1 no hydrogen 3.045 N/A LEU 77.A N PHE 4.A O no hydrogen 2.884 N/A TRP 78.A N LYS 81.A O no hydrogen 3.020 N/A LYS 81.A N TRP 78.A O no hydrogen 2.962 N/A LEU 82.A N VAL 43.A O no hydrogen 2.981 N/A TRP 83.A N TYR 76.A O no hydrogen 2.955 N/A ILE 84.A N LYS 41.A O no hydrogen 2.943 N/A CYS 85.A N GLY 74.A O no hydrogen 2.909 N/A CYS 85.A SG TYR 12.A OH no hydrogen 3.311 N/A MET 86.A N ALA 39.A O no hydrogen 2.978 N/A GLU 87.A N ALA 71.A O no hydrogen 2.781 N/A ALA 91.A N ILE 140.A O no hydrogen 2.977 N/A GLY 92.A N CYS 89.A O no hydrogen 3.386 N/A SER 93.A N ASP 96.A OD2 no hydrogen 2.898 N/A SER 93.A OG ASP 96.A OD2 no hydrogen 3.023 N/A LEU 94.A N ILE 138.A O no hydrogen 2.995 N/A GLN 95.A N GLY 135.A O no hydrogen 3.374 N/A ASP 96.A N SER 93.A OG no hydrogen 2.990 N/A ILE 97.A N SER 93.A O no hydrogen 3.107 N/A ILE 97.A N LEU 94.A O no hydrogen 3.079 N/A TYR 98.A N LEU 94.A O no hydrogen 2.761 N/A TYR 98.A OH GLU 202.A OE2 no hydrogen 2.532 N/A GLN 99.A N GLN 95.A O no hydrogen 3.213 N/A VAL 100.A N ILE 97.A O no hydrogen 2.912 N/A THR 101.A N ILE 97.A O no hydrogen 2.856 N/A THR 101.A OG1 ILE 97.A O no hydrogen 3.249 N/A THR 101.A OG1 GLY 102.A O no hydrogen 3.197 N/A GLY 102.A N TYR 98.A O no hydrogen 2.886 N/A LEU 104.A N LEU 203.A O no hydrogen 3.114 N/A SER 105.A N GLN 108.A OE1 no hydrogen 3.119 N/A GLN 108.A N SER 105.A OG no hydrogen 2.948 N/A GLN 108.A NE2 LEU 278.A O no hydrogen 3.040 N/A ILE 109.A N SER 105.A O no hydrogen 2.828 N/A SER 110.A N GLU 106.A O no hydrogen 2.875 N/A SER 110.A OG GLU 106.A O no hydrogen 2.581 N/A TYR 111.A N LEU 107.A O no hydrogen 3.004 N/A TYR 111.A OH GLY 144.A O no hydrogen 3.034 N/A VAL 112.A N GLN 108.A O no hydrogen 3.012 N/A CYS 113.A N ILE 109.A O no hydrogen 2.804 N/A CYS 113.A SG ILE 109.A O no hydrogen 3.307 N/A ARG 114.A N SER 110.A O no hydrogen 2.861 N/A ARG 114.A NE GLU 115.A OE2 no hydrogen 3.014 N/A ARG 114.A NH1 LEU 274.A O no hydrogen 2.965 N/A ARG 114.A NH2 GLU 115.A OE2 no hydrogen 2.649 N/A GLU 115.A N TYR 111.A O no hydrogen 3.034 N/A VAL 116.A N VAL 112.A O no hydrogen 2.921 N/A LEU 117.A N CYS 113.A O no hydrogen 2.999 N/A GLN 118.A N ARG 114.A O no hydrogen 3.090 N/A GLY 119.A N GLU 115.A O no hydrogen 3.250 N/A LEU 120.A N VAL 116.A O no hydrogen 2.693 N/A ALA 121.A N LEU 117.A O no hydrogen 2.733 N/A TYR 122.A N GLN 118.A O no hydrogen 3.286 N/A LEU 123.A N GLY 119.A O no hydrogen 2.930 N/A HIS 124.A N LEU 120.A O no hydrogen 2.954 N/A HIS 124.A NE2 ASP 192.A OD2 no hydrogen 2.951 N/A SER 125.A N ALA 121.A O no hydrogen 3.059 N/A SER 125.A OG TYR 122.A O no hydrogen 2.401 N/A GLN 126.A N TYR 122.A O no hydrogen 3.216 N/A GLN 126.A NE2 SER 125.A OG no hydrogen 3.257 N/A LYS 127.A N HIS 124.A O no hydrogen 3.028 N/A LYS 128.A N LEU 123.A O no hydrogen 2.890 N/A HIS 130.A N ASP 192.A OD2 no hydrogen 3.051 N/A HIS 130.A NE2 ALA 149.A O no hydrogen 2.515 N/A ARG 131.A N ASP 192.A OD1 no hydrogen 3.146 N/A ARG 131.A NH2 LYS 184.A O no hydrogen 3.523 N/A ASP 132.A N HIS 130.A ND1 no hydrogen 3.272 N/A GLY 135.A N GLU 202.A OE1 no hydrogen 3.061 N/A ASN 137.A N LYS 134.A O no hydrogen 3.176 N/A ASN 137.A ND2 ASP 132.A O no hydrogen 2.752 N/A ILE 138.A N GLY 135.A O no hydrogen 3.376 N/A LEU 139.A N ARG 147.A O no hydrogen 2.807 N/A ILE 140.A N GLY 92.A O no hydrogen 2.880 N/A ASN 141.A N GLU 145.A O no hydrogen 3.297 N/A ASN 141.A ND2 GLU 145.A OE1 no hydrogen 3.097 N/A GLY 144.A N ASN 141.A O no hydrogen 3.003 N/A GLU 145.A N ASN 141.A OD1 no hydrogen 2.750 N/A ARG 147.A N LEU 139.A O no hydrogen 3.041 N/A ARG 147.A NE GLU 87.A OE1 no hydrogen 3.324 N/A ARG 147.A NE GLU 87.A OE2 no hydrogen 2.804 N/A ARG 147.A NH1 VAL 146.A O no hydrogen 3.047 N/A ARG 147.A NH2 GLU 145.A OE1 no hydrogen 3.071 N/A LEU 148.A N ASN 68.A O no hydrogen 2.654 N/A ALA 149.A N ASN 137.A O no hydrogen 3.092 N/A GLY 152.A N ASP 150.A OD1 no hydrogen 2.986 N/A SER 154.A OG PHE 151.A O no hydrogen 2.963 N/A SER 154.A OG GLU 160.A OE1 no hydrogen 2.377 N/A ALA 155.A N GLY 152.A O no hydrogen 2.890 N/A GLN 156.A N ILE 153.A O no hydrogen 3.276 N/A GLY 158.A N ASP 49.A OD2 no hydrogen 2.615 N/A ALA 162.A N GLY 158.A O no hydrogen 3.239 N/A ARG 163.A N ALA 159.A O no hydrogen 2.869 N/A ARG 164.A N GLU 160.A O no hydrogen 3.056 N/A LEU 165.A N LEU 161.A O no hydrogen 3.252 N/A GLU 166.A N ALA 162.A O no hydrogen 2.712 N/A PHE 167.A N ARG 163.A O no hydrogen 3.096 N/A PHE 167.A N ARG 164.A O no hydrogen 2.880 N/A ILE 168.A N ARG 164.A O no hydrogen 3.031 N/A GLY 169.A N LEU 165.A O no hydrogen 3.163 N/A MET 174.A N PRO 171.A O no hydrogen 3.169 N/A GLU 177.A N GLU 177.A OE1 no hydrogen 2.965 N/A ALA 179.A N ALA 175.A O no hydrogen 3.024 N/A ALA 180.A N PRO 176.A O no hydrogen 3.129 N/A ALA 182.A N ALA 179.A O no hydrogen 3.066 N/A LEU 183.A N ALA 180.A O no hydrogen 3.188 N/A GLY 185.A N ALA 180.A O no hydrogen 3.043 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.626 N/A LEU 190.A N ASN 188.A OD1 no hydrogen 3.290 N/A CYS 191.A N ASN 188.A O no hydrogen 3.374 N/A CYS 191.A SG ASN 188.A O no hydrogen 3.193 N/A ASP 192.A N GLU 189.A O no hydrogen 3.102 N/A ILE 193.A N LEU 190.A O no hydrogen 3.137 N/A SER 195.A N CYS 191.A O no hydrogen 3.050 N/A SER 195.A OG CYS 191.A O no hydrogen 3.108 N/A LEU 196.A N ASP 192.A O no hydrogen 3.107 N/A GLY 197.A N ILE 193.A O no hydrogen 3.226 N/A ILE 198.A N TRP 194.A O no hydrogen 3.184 N/A THR 199.A N SER 195.A O no hydrogen 3.022 N/A THR 199.A OG1 SER 195.A O no hydrogen 2.405 N/A ALA 200.A N LEU 196.A O no hydrogen 2.896 N/A ILE 201.A N GLY 197.A O no hydrogen 3.142 N/A GLU 202.A N ILE 198.A O no hydrogen 2.600 N/A LEU 203.A N THR 199.A O no hydrogen 2.709 N/A ALA 204.A N ALA 200.A O no hydrogen 3.040 N/A ALA 204.A N ILE 201.A O no hydrogen 3.046 N/A GLU 205.A N ILE 201.A O no hydrogen 2.823 N/A PHE 211.A N PRO 208.A O no hydrogen 3.320 N/A ASP 212.A N ASP 212.A OD1 no hydrogen 2.575 N/A VAL 213.A N LEU 210.A O no hydrogen 3.074 N/A LEU 216.A N HIS 214.A ND1 no hydrogen 2.976 N/A VAL 218.A N HIS 214.A O no hydrogen 3.073 N/A LEU 219.A N PRO 215.A O no hydrogen 3.017 N/A PHE 220.A N LEU 216.A O no hydrogen 2.967 N/A LEU 221.A N ARG 217.A O no hydrogen 3.031 N/A MET 222.A N VAL 218.A O no hydrogen 3.312 N/A THR 223.A N PHE 220.A O no hydrogen 3.064 N/A THR 223.A OG1 PHE 220.A O no hydrogen 2.774 N/A TYR 227.A N LYS 224.A O no hydrogen 3.096 N/A LYS 233.A N GLU 205.A OE2 no hydrogen 2.717 N/A TRP 238.A N LYS 235.A O no hydrogen 3.344 N/A SER 239.A N GLU 106.A OE1 no hydrogen 3.048 N/A SER 239.A OG GLU 106.A OE2 no hydrogen 2.526 N/A PHE 242.A N SER 239.A OG no hydrogen 3.335 N/A HIS 243.A N SER 239.A O no hydrogen 3.076 N/A HIS 243.A NE2 LYS 235.A O no hydrogen 2.786 N/A ASN 244.A N ALA 240.A O no hydrogen 2.820 N/A PHE 245.A N ALA 241.A O no hydrogen 2.765 N/A ILE 246.A N PHE 242.A O no hydrogen 2.937 N/A LYS 247.A N HIS 243.A O no hydrogen 2.936 N/A VAL 248.A N ASN 244.A O no hydrogen 2.878 N/A THR 249.A N PHE 245.A O no hydrogen 3.128 N/A THR 249.A OG1 PHE 245.A O no hydrogen 2.646 N/A THR 249.A OG1 ILE 246.A O no hydrogen 3.094 N/A LEU 250.A N ILE 246.A O no hydrogen 2.974 N/A THR 251.A OG1 VAL 248.A O no hydrogen 2.787 N/A LYS 252.A NZ SER 225.A O no hydrogen 3.371 N/A LYS 252.A NZ TYR 227.A O no hydrogen 2.335 N/A LYS 256.A N SER 253.A O no hydrogen 3.166 N/A ARG 257.A NE THR 251.A O no hydrogen 2.875 N/A ARG 257.A NH1 LEU 190.A O no hydrogen 3.007 N/A ARG 257.A NH2 THR 251.A O no hydrogen 2.808 N/A ARG 257.A NH2 LYS 252.A O no hydrogen 3.090 N/A LYS 262.A N SER 259.A OG no hydrogen 3.073 N/A MET 263.A N SER 259.A O no hydrogen 2.755 N/A LEU 264.A N ALA 260.A O no hydrogen 2.907 N/A SER 265.A N LYS 262.A O no hydrogen 3.192 N/A HIS 266.A N MET 263.A O no hydrogen 2.975 N/A HIS 266.A NE2 ASN 244.A OD1 no hydrogen 2.935 N/A LEU 268.A N HIS 266.A ND1 no hydrogen 3.046 N/A SER 270.A N HIS 266.A O no hydrogen 3.033 N/A SER 270.A OG HIS 266.A O no hydrogen 2.634 N/A GLN 271.A NE2 LEU 268.A O no hydrogen 2.920 N/A ARG 276.A NE ALA 143.A O no hydrogen 2.864 N/A GLY 277.A N ASN 275.A OD1 no hydrogen 2.787 N/A LEU 278.A N ASN 275.A O no hydrogen 3.086 N/A ILE 279.A N ARG 276.A O no hydrogen 3.017 N/A LEU 280.A N ARG 276.A O no hydrogen 3.052 N/A ASP 281.A N GLY 277.A O no hydrogen 3.049 N/A LEU 282.A N LEU 278.A O no hydrogen 3.397 N/A LEU 283.A N ILE 279.A O no hydrogen 2.690 N/A ASP 284.A N LEU 280.A O no hydrogen 3.100 N/A LYS 285.A N ASP 281.A O no hydrogen 3.121 N/A LYS 285.A NZ THR 101.A O no hydrogen 2.594 N/A LEU 286.A N LEU 282.A O no hydrogen 3.189 N/A LYS 287.A N ASP 284.A O no hydrogen 2.980 N/A