Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3cvl_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A OH GLU 38.A OE2 no hydrogen 2.908 N/A PHE 5.A N TYR 3.A O no hydrogen 2.846 N/A GLU 6.A N GLU 38.A OE1 no hydrogen 2.912 N/A ASN 8.A ND2.B THR 247.A O no hydrogen 3.342 N/A ASN 9.A ND2 LEU 35.A O no hydrogen 3.006 N/A TYR 11.A N ASN 9.A OD1 no hydrogen 3.180 N/A MET 12.A N ASN 9.A O no hydrogen 3.209 N/A TYR 13.A N PRO 10.A O no hydrogen 3.323 N/A HIS 14.A ND1 PRO 10.A O no hydrogen 2.602 N/A GLU 19.A N ASN 16.A OD1.B no hydrogen 3.446 N/A GLU 20.A N ASN 16.A O no hydrogen 3.300 N/A GLY 21.A N PRO 17.A O no hydrogen 2.827 N/A LEU 22.A N MET 18.A O no hydrogen 2.858 N/A SER 23.A N GLU 19.A O no hydrogen 3.049 N/A SER 23.A OG GLU 19.A O no hydrogen 3.406 N/A MET 24.A N GLU 20.A O no hydrogen 2.854 N/A LEU 25.A N GLY 21.A O no hydrogen 3.036 N/A LYS 26.A N SER 23.A O no hydrogen 3.162 N/A LEU 27.A N SER 23.A O no hydrogen 3.177 N/A ALA 28.A N MET 24.A O no hydrogen 3.365 N/A ASN 29.A ND2 ASN 209.A OD1 no hydrogen 3.493 N/A ALA 33.A N ASN 29.A O no hydrogen 2.959 N/A ALA 34.A N LEU 30.A O no hydrogen 2.735 N/A LEU 35.A N ALA 31.A O no hydrogen 3.267 N/A ALA 36.A N GLU 32.A O no hydrogen 3.191 N/A PHE 37.A N ALA 33.A O no hydrogen 3.120 N/A GLU 38.A N ALA 34.A O no hydrogen 2.724 N/A ALA 39.A N LEU 35.A O no hydrogen 2.877 N/A VAL 40.A N ALA 36.A O no hydrogen 3.103 N/A CYS 41.A N PHE 37.A O no hydrogen 2.943 N/A CYS 41.A SG PHE 37.A O no hydrogen 3.338 N/A GLN 42.A N GLU 38.A O no hydrogen 3.169 N/A GLN 42.A NE2 GLU 38.A O no hydrogen 2.730 N/A ALA 43.A N ALA 39.A O no hydrogen 3.189 N/A ALA 44.A N VAL 40.A O no hydrogen 2.766 N/A GLU 46.A N GLU 46.A OE1 no hydrogen 2.782 N/A ARG 47.A N ALA 44.A O no hydrogen 2.991 N/A ARG 47.A NE GLU 49.A OE2 no hydrogen 3.195 N/A ALA 50.A N ARG 47.A O no hydrogen 3.089 N/A TRP 51.A N ARG 47.A O no hydrogen 3.357 N/A TRP 51.A NE1 PRO 45.A O no hydrogen 2.645 N/A ARG 52.A N GLU 48.A O no hydrogen 2.889 N/A ARG 52.A NH1 ASP 81.A OD2 no hydrogen 2.726 N/A SER 53.A N GLU 49.A O no hydrogen 3.093 N/A SER 53.A OG GLU 49.A O no hydrogen 3.037 N/A LEU 54.A N ALA 50.A O no hydrogen 3.194 N/A GLY 55.A N TRP 51.A O no hydrogen 3.010 N/A LEU 56.A N ARG 52.A O no hydrogen 3.051 N/A THR 57.A N SER 53.A O no hydrogen 2.990 N/A THR 57.A OG1 SER 53.A O no hydrogen 2.650 N/A GLN 58.A N LEU 54.A O no hydrogen 2.912 N/A GLN 58.A NE2 TYR 3.A OH no hydrogen 2.800 N/A ALA 59.A N GLY 55.A O no hydrogen 3.046 N/A GLU 60.A N LEU 56.A O no hydrogen 3.016 N/A ASN 61.A N THR 57.A O no hydrogen 2.835 N/A ASN 61.A ND2 GLN 243.A O no hydrogen 3.523 N/A GLU 62.A N ALA 59.A O no hydrogen 2.873 N/A LYS 63.A N GLN 58.A O no hydrogen 2.877 N/A ALA 67.A N LYS 63.A O no hydrogen 3.038 N/A ILE 68.A N ASP 64.A O no hydrogen 2.791 N/A ILE 69.A N GLY 65.A O no hydrogen 3.170 N/A ALA 70.A N LEU 66.A O no hydrogen 2.960 N/A LEU 71.A N ALA 67.A O no hydrogen 2.761 N/A ASN 72.A N ILE 68.A O no hydrogen 2.949 N/A HIS 73.A N ALA 70.A O no hydrogen 3.140 N/A HIS 73.A NE2 ASP 2.A OD1 no hydrogen 2.654 N/A ALA 74.A N ALA 70.A O no hydrogen 3.366 N/A ARG 75.A N LEU 71.A O no hydrogen 2.871 N/A ARG 75.A NH1 ASN 72.A OD1 no hydrogen 3.173 N/A MET 76.A N ASN 72.A O no hydrogen 3.174 N/A LEU 77.A N HIS 73.A O no hydrogen 2.932 N/A ASP 78.A N ALA 74.A O no hydrogen 2.768 N/A LYS 80.A N ASP 78.A OD1 no hydrogen 3.119 N/A ASP 81.A N ASP 78.A O no hydrogen 3.066 N/A ALA 83.A N ASP 81.A OD1 no hydrogen 3.073 N/A VAL 84.A N ASP 81.A O no hydrogen 3.228 N/A VAL 84.A N ASP 81.A OD1 no hydrogen 3.416 N/A HIS 85.A N ASP 81.A O no hydrogen 3.511 N/A HIS 85.A NE2 PRO 79.A O no hydrogen 2.735 N/A ALA 86.A N ILE 82.A O no hydrogen 2.960 N/A ALA 87.A N ALA 83.A O no hydrogen 3.044 N/A LEU 88.A N VAL 84.A O no hydrogen 2.808 N/A ALA 89.A N HIS 85.A O no hydrogen 3.023 N/A VAL 90.A N ALA 86.A O no hydrogen 3.181 N/A SER 91.A N ALA 87.A O no hydrogen 3.027 N/A SER 91.A OG ASP 64.A OD1 no hydrogen 2.763 N/A HIS 92.A N LEU 88.A O no hydrogen 3.036 N/A THR 93.A N ALA 89.A O no hydrogen 3.104 N/A THR 93.A OG1 ALA 89.A O no hydrogen 2.662 N/A ASN 94.A N VAL 90.A O no hydrogen 2.889 N/A ASN 94.A ND2 ASP 64.A OD2 no hydrogen 3.062 N/A GLU 95.A N SER 91.A O no hydrogen 2.867 N/A HIS 96.A N THR 93.A O no hydrogen 3.264 N/A ASN 97.A N HIS 92.A O no hydrogen 2.966 N/A ASN 97.A ND2 HIS 92.A ND1 no hydrogen 3.206 N/A ALA 101.A N ASN 97.A O no hydrogen 3.014 N/A LEU 102.A N ALA 98.A O no hydrogen 2.939 N/A ALA 103.A N ASN 99.A O no hydrogen 3.011 N/A SER 104.A N ALA 100.A O no hydrogen 2.825 N/A SER 104.A N ALA 101.A O no hydrogen 3.213 N/A SER 104.A OG ALA 100.A O no hydrogen 2.820 N/A LEU 105.A N ALA 101.A O no hydrogen 3.004 N/A ARG 106.A N LEU 102.A O no hydrogen 2.944 N/A ARG 106.A NH2 GLU 129.A OE2 no hydrogen 3.009 N/A ALA 107.A N ALA 103.A O no hydrogen 3.133 N/A TRP 108.A N SER 104.A O no hydrogen 2.753 N/A LEU 109.A N LEU 105.A O no hydrogen 3.125 N/A LEU 110.A N ARG 106.A O no hydrogen 2.920 N/A SER 111.A N ALA 107.A O no hydrogen 3.107 N/A SER 111.A OG PRO 79.A O no hydrogen 3.397 N/A SER 111.A OG ALA 107.A O no hydrogen 2.680 N/A GLN 112.A N LEU 109.A O no hydrogen 3.111 N/A GLN 112.A NE2 TRP 108.A O no hydrogen 3.074 N/A TYR 115.A N GLN 112.A O no hydrogen 2.943 N/A TYR 115.A OH ASP 144.A OD2 no hydrogen 2.437 N/A GLU 116.A N GLN 112.A O no hydrogen 2.750 N/A ALA 123.A N PHE 120.A O no hydrogen 3.135 N/A GLU 126.A N GLU 126.A OE1 no hydrogen 2.880 N/A TYR 127.A N ALA 123.A O no hydrogen 2.994 N/A TYR 127.A OH SER 158.A OG no hydrogen 2.675 N/A ARG 128.A N PRO 124.A O no hydrogen 2.901 N/A GLU 129.A N ASN 125.A O no hydrogen 2.886 N/A CYS 130.A N GLU 126.A O no hydrogen 3.103 N/A CYS 130.A SG LEU 102.A O no hydrogen 3.131 N/A ARG 131.A N TYR 127.A O no hydrogen 2.846 N/A THR 132.A N ARG 128.A O no hydrogen 3.051 N/A THR 132.A OG1 ARG 128.A O no hydrogen 2.829 N/A LEU 133.A N GLU 129.A O no hydrogen 2.911 N/A LEU 134.A N CYS 130.A O no hydrogen 2.894 N/A HIS 135.A N ARG 131.A O no hydrogen 3.016 N/A HIS 135.A NE2 TYR 155.A OH no hydrogen 2.663 N/A ALA 136.A N THR 132.A O no hydrogen 2.926 N/A ALA 137.A N LEU 133.A O no hydrogen 2.812 N/A LEU 138.A N LEU 134.A O no hydrogen 2.998 N/A GLU 139.A N ALA 136.A O no hydrogen 3.313 N/A MET 140.A N ALA 136.A O no hydrogen 3.230 N/A ASN 141.A N ALA 137.A O no hydrogen 2.874 N/A ASN 143.A N ASN 141.A OD1 no hydrogen 3.363 N/A ASP 144.A N ASN 141.A O no hydrogen 3.395 N/A LEU 147.A N ASP 144.A OD1 no hydrogen 3.227 N/A HIS 148.A N ASP 144.A O no hydrogen 3.149 N/A HIS 148.A NE2 PRO 142.A O no hydrogen 2.897 N/A ALA 149.A N ALA 145.A O no hydrogen 2.939 N/A SER 150.A N GLN 146.A O no hydrogen 2.972 N/A SER 150.A OG GLN 146.A O no hydrogen 3.092 N/A LEU 151.A N LEU 147.A O no hydrogen 3.026 N/A GLY 152.A N HIS 148.A O no hydrogen 2.913 N/A VAL 153.A N ALA 149.A O no hydrogen 2.974 N/A LEU 154.A N SER 150.A O no hydrogen 2.861 N/A TYR 155.A N LEU 151.A O no hydrogen 2.815 N/A TYR 155.A OH HIS 135.A NE2 no hydrogen 2.663 N/A ASN 156.A N GLY 152.A O no hydrogen 2.975 N/A ASN 156.A ND2 GLY 152.A O no hydrogen 2.528 N/A ASN 156.A ND2 THR 188.A OG1 no hydrogen 2.990 N/A LEU 157.A N VAL 153.A O no hydrogen 3.118 N/A SER 158.A N LEU 154.A O no hydrogen 3.340 N/A SER 158.A OG TYR 127.A OH no hydrogen 2.675 N/A SER 158.A OG TYR 155.A O no hydrogen 3.337 N/A SER 158.A OG ASN 160.A OD1 no hydrogen 3.037 N/A ASN 159.A N ASN 156.A O no hydrogen 3.110 N/A ASN 160.A N TYR 155.A O no hydrogen 2.832 N/A SER 163.A N ASN 160.A O no hydrogen 3.233 N/A ALA 164.A N ASN 160.A O no hydrogen 3.129 N/A ALA 165.A N TYR 161.A O no hydrogen 2.892 N/A ALA 166.A N ASP 162.A O no hydrogen 3.308 N/A ASN 167.A N SER 163.A O no hydrogen 3.198 N/A ASN 167.A ND2 HIS 148.A ND1 no hydrogen 3.133 N/A LEU 168.A N ALA 164.A O no hydrogen 2.884 N/A ARG 169.A N ALA 165.A O no hydrogen 2.819 N/A ARG 170.A N ALA 166.A O no hydrogen 3.038 N/A ALA 171.A N ASN 167.A O no hydrogen 2.977 N/A VAL 172.A N LEU 168.A O no hydrogen 3.039 N/A GLU 173.A N ARG 169.A O no hydrogen 3.192 N/A LEU 174.A N ARG 170.A O no hydrogen 3.194 N/A ARG 175.A N ALA 171.A O no hydrogen 2.932 N/A ASP 178.A N ARG 175.A O no hydrogen 3.203 N/A GLN 180.A NE2.B GLU 60.A OE2 no hydrogen 3.459 N/A LEU 181.A N ASP 178.A OD1 no hydrogen 3.182 N/A TRP 182.A N ASP 178.A O no hydrogen 3.150 N/A TRP 182.A NE1 PRO 176.A O no hydrogen 2.955 N/A ASN 183.A N ALA 179.A O no hydrogen 2.961 N/A LYS 184.A N GLN 180.A O no hydrogen 3.057 N/A LEU 185.A N LEU 181.A O no hydrogen 3.030 N/A GLY 186.A N TRP 182.A O no hydrogen 2.748 N/A ALA 187.A N ASN 183.A O no hydrogen 2.763 N/A THR 188.A N LYS 184.A O no hydrogen 3.007 N/A THR 188.A OG1 LYS 184.A O no hydrogen 2.696 N/A LEU 189.A N LEU 185.A O no hydrogen 2.938 N/A ALA 190.A N GLY 186.A O no hydrogen 2.764 N/A ASN 191.A N ALA 187.A O no hydrogen 2.749 N/A GLY 192.A N THR 188.A O no hydrogen 2.867 N/A ASN 193.A N ALA 190.A O no hydrogen 2.812 N/A ARG 194.A N LEU 189.A O no hydrogen 2.809 N/A ALA 198.A N ARG 194.A O no hydrogen 2.899 N/A LEU 199.A N PRO 195.A O no hydrogen 3.129 N/A ASP 200.A N GLN 196.A O no hydrogen 3.327 N/A ALA 201.A N GLU 197.A O no hydrogen 3.260 N/A TYR 202.A N ALA 198.A O no hydrogen 2.731 N/A ASN 203.A N LEU 199.A O no hydrogen 2.690 N/A ARG 204.A N ASP 200.A O no hydrogen 3.040 N/A ALA 205.A N ALA 201.A O no hydrogen 2.949 N/A LEU 206.A N TYR 202.A O no hydrogen 2.980 N/A ASP 207.A N ASN 203.A O no hydrogen 3.239 N/A ILE 208.A N ARG 204.A O no hydrogen 3.249 N/A ASN 209.A N ALA 205.A O no hydrogen 2.990 N/A GLY 211.A N ASN 209.A OD1 no hydrogen 3.280 N/A TYR 212.A N ASN 209.A O no hydrogen 3.109 N/A ARG 214.A N GLU 60.A O no hydrogen 2.906 N/A ARG 214.A NE GLU 62.A OE1 no hydrogen 3.036 N/A ARG 214.A NH1 ASP 64.A OD1 no hydrogen 2.937 N/A ARG 214.A NH2 GLU 62.A OE2 no hydrogen 3.266 N/A ARG 214.A NH2 ASP 64.A OD1 no hydrogen 3.223 N/A ARG 214.A NH2 ASP 64.A OD2 no hydrogen 2.913 N/A MET 216.A N TYR 212.A O no hydrogen 3.207 N/A TYR 217.A N VAL 213.A O no hydrogen 2.982 N/A ASN 218.A N ARG 214.A O no hydrogen 2.958 N/A ASN 218.A ND2 ASN 183.A OD1 no hydrogen 2.776 N/A MET 219.A N VAL 215.A O no hydrogen 2.920 N/A ALA 220.A N MET 216.A O no hydrogen 3.091 N/A VAL 221.A N TYR 217.A O no hydrogen 2.840 N/A SER 222.A N ASN 218.A O no hydrogen 3.067 N/A TYR 223.A N MET 219.A O no hydrogen 2.962 N/A SER 224.A N ALA 220.A O no hydrogen 2.964 N/A ASN 225.A N VAL 221.A O no hydrogen 2.823 N/A MET 226.A N SER 222.A O no hydrogen 2.937 N/A SER 227.A N SER 224.A O no hydrogen 2.923 N/A GLN 228.A N TYR 223.A O no hydrogen 2.812 N/A ALA 232.A N GLN 228.A O no hydrogen 3.072 N/A ALA 233.A N TYR 229.A O no hydrogen 2.771 N/A LYS 234.A N ASP 230.A O no hydrogen 3.006 N/A GLN 235.A N LEU 231.A O no hydrogen 3.287 N/A LEU 236.A N ALA 232.A O no hydrogen 3.177 N/A LEU 236.A N ALA 233.A O no hydrogen 2.999 N/A VAL 237.A N ALA 233.A O no hydrogen 2.967 N/A ARG 238.A N LYS 234.A O no hydrogen 3.259 N/A ALA 239.A N GLN 235.A O no hydrogen 2.885 N/A ILE 240.A N LEU 236.A O no hydrogen 2.939 N/A TYR 241.A N VAL 237.A O no hydrogen 2.998 N/A MET 242.A N ARG 238.A O no hydrogen 2.888 N/A GLN 243.A N ALA 239.A O no hydrogen 2.872 N/A VAL 244.A N ILE 240.A O no hydrogen 3.423 N/A GLY 245.A N TYR 241.A O no hydrogen 3.357 N/A THR 255.A N SER 251.A O no hydrogen 2.937 N/A THR 255.A OG1 SER 251.A O no hydrogen 3.341 N/A ARG 256.A N ARG 252.A O no hydrogen 2.765 N/A SER 257.A N GLU 253.A O no hydrogen 2.903 N/A SER 257.A OG GLU 253.A O no hydrogen 2.535 N/A SER 257.A OG ALA 254.A O no hydrogen 3.008 N/A MET 258.A N ALA 254.A O no hydrogen 3.179 N/A TRP 259.A N THR 255.A O no hydrogen 2.899 N/A ASP 260.A N ARG 256.A O no hydrogen 2.802 N/A PHE 261.A N SER 257.A O no hydrogen 3.081 N/A PHE 262.A N MET 258.A O no hydrogen 3.061 N/A ARG 263.A N TRP 259.A O no hydrogen 2.889 N/A ARG 263.A NE ASP 260.A OD1 no hydrogen 3.223 N/A ARG 263.A NH2 ASP 260.A OD1 no hydrogen 2.957 N/A MET 264.A N ASP 260.A O no hydrogen 2.947 N/A LEU 265.A N PHE 261.A O no hydrogen 3.130 N/A LEU 266.A N PHE 262.A O no hydrogen 2.883 N/A ASN 267.A N ARG 263.A O no hydrogen 2.995 N/A VAL 268.A N MET 264.A O no hydrogen 2.889 N/A MET 269.A N LEU 265.A O no hydrogen 2.875 N/A ASN 270.A N ASN 267.A O no hydrogen 3.085 N/A ARG 271.A N LEU 266.A O no hydrogen 3.004 N/A ARG 271.A NE ASP 273.A OD1 no hydrogen 3.174 N/A ARG 271.A NH1 GLU 289.A OE2 no hydrogen 3.307 N/A ARG 271.A NH2 ASP 273.A OD1 no hydrogen 3.254 N/A VAL 275.A N ARG 271.A O no hydrogen 2.904 N/A GLU 276.A N PRO 272.A O no hydrogen 3.215 N/A THR 278.A N VAL 275.A O no hydrogen 3.246 N/A THR 278.A OG1 VAL 275.A O no hydrogen 2.517 N/A TYR 279.A N GLU 276.A O no hydrogen 3.416 N/A GLN 281.A N THR 278.A O no hydrogen 2.921 N/A GLU 284.A N GLU 284.A OE1 no hydrogen 2.709 N/A PHE 286.A N VAL 283.A O no hydrogen 2.772 N/A ALA 287.A N VAL 283.A O no hydrogen 3.045 N/A LYS 288.A N GLU 284.A O no hydrogen 2.985 N/A GLU 289.A N PRO 285.A O no hydrogen 3.119 N/A PHE 290.A N PHE 286.A O no hydrogen 2.846 N/A GLY 291.A N LYS 288.A O no hydrogen 3.485 N/A LEU 292.A N ALA 287.A O no hydrogen 2.688 N/A GLN 293.A N ALA 287.A O no hydrogen 3.290 N/A