Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4f70_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): PHE 6.A N ASP 3.A OD2 no hydrogen 3.008 N/A LYS 7.A N ASP 3.A O no hydrogen 2.937 N/A VAL 8.A N TYR 4.A O no hydrogen 2.858 N/A LYS 9.A N ASP 5.A O no hydrogen 3.009 N/A LYS 9.A NZ GLU 13.A OE2 no hydrogen 2.633 N/A LEU 10.A N PHE 6.A O no hydrogen 3.255 N/A SER 11.A N LYS 7.A O no hydrogen 3.093 N/A SER 12.A N VAL 8.A O no hydrogen 2.941 N/A GLU 13.A N LYS 9.A O no hydrogen 3.179 N/A ARG 14.A N LEU 10.A O no hydrogen 2.786 N/A ARG 16.A NH2 SER 11.A O no hydrogen 3.544 N/A GLU 18.A N GLU 18.A OE1 no hydrogen 2.838 N/A ASP 19.A N ARG 16.A O no hydrogen 3.163 N/A LEU 20.A N ARG 16.A O no hydrogen 3.182 N/A PHE 21.A N VAL 17.A O no hydrogen 3.068 N/A GLU 22.A N LYS 40.A O no hydrogen 2.715 N/A CYS 26.A N TYR 23.A O no hydrogen 3.216 N/A CYS 26.A SG GLU 24.A O no hydrogen 3.866 N/A VAL 28.A N VAL 36.A O no hydrogen 2.715 N/A GLY 29.A N VAL 36.A O no hydrogen 3.327 N/A GLY 31.A N GLY 34.A O no hydrogen 3.029 N/A GLY 34.A N GLY 31.A O no hydrogen 3.313 N/A HIS 35.A N GLN 54.A O no hydrogen 3.119 N/A VAL 36.A N GLY 29.A O no hydrogen 2.865 N/A TYR 37.A N LEU 52.A O no hydrogen 2.914 N/A LYS 38.A N CYS 26.A O no hydrogen 3.071 N/A ALA 39.A N TYR 50.A O no hydrogen 2.748 N/A LYS 40.A N GLU 22.A O no hydrogen 3.129 N/A ARG 41.A NH2 TYR 50.A OH no hydrogen 3.506 N/A LYS 42.A N LEU 20.A O no hydrogen 3.001 N/A LYS 42.A NZ GLU 18.A O no hydrogen 2.745 N/A LYS 45.A N ASP 43.A O no hydrogen 2.661 N/A LYS 48.A N ASP 46.A OD1 no hydrogen 2.940 N/A TYR 50.A N ALA 39.A O no hydrogen 3.085 N/A TYR 50.A OH ASP 46.A OD2 no hydrogen 2.679 N/A ALA 51.A N PHE 98.A O no hydrogen 2.843 N/A LEU 52.A N TYR 37.A O no hydrogen 2.850 N/A LYS 53.A N LEU 96.A O no hydrogen 2.805 N/A LYS 53.A NZ GLU 67.A OE1 no hydrogen 3.306 N/A LYS 53.A NZ GLU 67.A OE2 no hydrogen 3.008 N/A GLN 54.A N HIS 35.A O no hydrogen 2.983 N/A ILE 55.A N VAL 94.A O no hydrogen 3.117 N/A GLU 56.A N TYR 33.A O no hydrogen 2.824 N/A GLY 59.A N ARG 92.A O no hydrogen 2.713 N/A SER 61.A OG SER 63.A OG no hydrogen 2.823 N/A SER 63.A OG SER 61.A OG no hydrogen 2.823 N/A CYS 65.A N SER 61.A O no hydrogen 2.777 N/A ARG 66.A N MET 62.A O no hydrogen 3.183 N/A GLU 67.A N SER 63.A O no hydrogen 3.119 N/A ILE 68.A N ALA 64.A O no hydrogen 3.217 N/A ALA 69.A N CYS 65.A O no hydrogen 3.093 N/A LEU 70.A N ARG 66.A O no hydrogen 2.886 N/A LEU 71.A N GLU 67.A O no hydrogen 3.090 N/A ARG 72.A N ILE 68.A O no hydrogen 3.113 N/A ARG 72.A NH2 ARG 72.A O no hydrogen 3.451 N/A GLU 73.A N LEU 70.A O no hydrogen 3.030 N/A LEU 74.A N LEU 70.A O no hydrogen 3.136 N/A LYS 75.A N TYR 136.A OH no hydrogen 2.841 N/A ASN 78.A N HIS 76.A ND1 no hydrogen 3.221 N/A ASN 78.A ND2 GLN 129.A OE1 no hydrogen 3.141 N/A ASN 78.A ND2 VAL 164.A O no hydrogen 3.058 N/A VAL 79.A N HIS 76.A O no hydrogen 3.028 N/A ILE 80.A N ILE 166.A O no hydrogen 3.011 N/A GLN 83.A N LEU 97.A O no hydrogen 2.763 N/A GLN 83.A NE2 SER 81.A O no hydrogen 3.606 N/A LYS 84.A NZ GLU 15.A OE2 no hydrogen 3.373 N/A PHE 86.A N TRP 95.A O no hydrogen 2.886 N/A SER 88.A N LYS 93.A O no hydrogen 3.015 N/A SER 88.A OG ASP 91.A OD1 no hydrogen 2.650 N/A HIS 89.A ND1 LEU 87.A O no hydrogen 3.264 N/A LYS 93.A NZ GLY 57.A O no hydrogen 2.773 N/A TRP 95.A N PHE 86.A O no hydrogen 2.845 N/A LEU 96.A N LYS 53.A O no hydrogen 2.755 N/A LEU 97.A N LYS 84.A O no hydrogen 2.924 N/A PHE 98.A N ALA 51.A O no hydrogen 2.715 N/A HIS 103.A N VAL 154.A O no hydrogen 3.027 N/A LEU 105.A N ILE 152.A O no hydrogen 3.017 N/A HIS 107.A N ASP 104.A OD1 no hydrogen 3.039 N/A ILE 108.A N ASP 104.A O no hydrogen 3.050 N/A ILE 109.A N LEU 105.A O no hydrogen 2.986 N/A LYS 110.A N TRP 106.A O no hydrogen 3.146 N/A PHE 111.A N HIS 107.A O no hydrogen 2.851 N/A HIS 112.A N ILE 108.A O no hydrogen 3.254 N/A HIS 112.A NE2 TYR 321.A OH no hydrogen 2.614 N/A ARG 113.A N ILE 109.A O no hydrogen 2.763 N/A ALA 114.A N LYS 110.A O no hydrogen 2.833 N/A SER 115.A N PHE 111.A O no hydrogen 2.909 N/A LYS 116.A NZ GLU 206.A OE2 no hydrogen 2.807 N/A ARG 120.A NH1 LEU 203.A O no hydrogen 3.241 N/A ARG 120.A NH2 LEU 203.A O no hydrogen 3.145 N/A VAL 123.A N PRO 119.A O no hydrogen 3.119 N/A LYS 124.A N ARG 120.A O no hydrogen 3.200 N/A LYS 124.A NZ TYR 302.A O no hydrogen 2.867 N/A LYS 124.A NZ PRO 307.A O no hydrogen 2.625 N/A SER 125.A N GLY 121.A O no hydrogen 3.164 N/A SER 125.A OG GLY 121.A O no hydrogen 2.865 N/A SER 125.A OG THR 310.A O no hydrogen 3.564 N/A SER 125.A OG THR 310.A OG1 no hydrogen 3.297 N/A LEU 126.A N MET 122.A O no hydrogen 2.766 N/A LEU 127.A N VAL 123.A O no hydrogen 2.928 N/A TYR 128.A N LYS 124.A O no hydrogen 2.889 N/A GLN 129.A N SER 125.A O no hydrogen 3.099 N/A GLN 129.A NE2 THR 310.A O no hydrogen 3.095 N/A GLN 129.A NE2 SER 311.A O no hydrogen 2.917 N/A ILE 130.A N LEU 126.A O no hydrogen 3.045 N/A LEU 131.A N LEU 127.A O no hydrogen 2.981 N/A ASP 132.A N TYR 128.A O no hydrogen 2.872 N/A GLY 133.A N GLN 129.A O no hydrogen 3.032 N/A ILE 134.A N ILE 130.A O no hydrogen 3.057 N/A HIS 135.A N LEU 131.A O no hydrogen 3.073 N/A TYR 136.A N ASP 132.A O no hydrogen 3.269 N/A LEU 137.A N GLY 133.A O no hydrogen 3.262 N/A HIS 138.A N ILE 134.A O no hydrogen 2.682 N/A HIS 138.A NE2 ASP 191.A OD2 no hydrogen 2.909 N/A ALA 139.A N HIS 135.A O no hydrogen 2.888 N/A ASN 140.A N TYR 136.A O no hydrogen 3.297 N/A ASN 140.A ND2 TYR 136.A O no hydrogen 2.725 N/A TRP 141.A N HIS 138.A O no hydrogen 3.025 N/A VAL 142.A N LEU 137.A O no hydrogen 2.813 N/A HIS 144.A N ASP 191.A OD2 no hydrogen 2.924 N/A HIS 144.A NE2 ALA 167.A O no hydrogen 2.688 N/A ARG 145.A N ASP 191.A OD1 no hydrogen 3.140 N/A ASP 146.A N HIS 144.A ND1 no hydrogen 3.384 N/A LYS 148.A NZ ASP 146.A OD2 no hydrogen 3.405 N/A ASN 151.A N LYS 148.A O no hydrogen 2.871 N/A ASN 151.A ND2 ASP 146.A O no hydrogen 2.695 N/A ILE 152.A N PRO 149.A O no hydrogen 2.985 N/A LEU 153.A N LYS 165.A O no hydrogen 2.971 N/A VAL 154.A N HIS 103.A O no hydrogen 2.850 N/A MET 155.A N ARG 163.A O no hydrogen 2.959 N/A ARG 161.A NE GLU 157.A OE1 no hydrogen 2.994 N/A ARG 161.A NH2 GLU 157.A OE2 no hydrogen 3.249 N/A GLY 162.A N MET 155.A O no hydrogen 3.080 N/A ARG 163.A N GLU 160.A O no hydrogen 3.179 N/A ARG 163.A NH1 GLU 160.A OE1 no hydrogen 3.232 N/A VAL 164.A N GLN 129.A OE1 no hydrogen 2.737 N/A LYS 165.A N LEU 153.A O no hydrogen 2.768 N/A LYS 165.A NZ PRO 77.A O no hydrogen 2.672 N/A LYS 165.A NZ GLU 160.A OE1 no hydrogen 2.741 N/A ILE 166.A N ASN 78.A O no hydrogen 2.850 N/A ALA 167.A N ASN 151.A O no hydrogen 2.859 N/A MET 169.A N ASN 151.A OD1 no hydrogen 3.284 N/A TYR 174.A OH GLU 201.A OE1 no hydrogen 2.802 N/A GLU 178.A N GLU 178.A OE1 no hydrogen 2.713 N/A LEU 180.A N ALA 176.A O no hydrogen 3.385 N/A LEU 181.A N PRO 177.A O no hydrogen 2.954 N/A GLY 182.A N LEU 179.A O no hydrogen 3.050 N/A ALA 183.A N GLU 178.A O no hydrogen 2.872 N/A LYS 188.A NZ HIS 138.A O no hydrogen 2.761 N/A ILE 190.A N THR 187.A OG1 no hydrogen 3.180 N/A ILE 192.A N LYS 188.A O no hydrogen 3.206 N/A TRP 193.A N ALA 189.A O no hydrogen 3.037 N/A ALA 194.A N ILE 190.A O no hydrogen 3.467 N/A ILE 195.A N ASP 191.A O no hydrogen 3.100 N/A GLY 196.A N ILE 192.A O no hydrogen 2.953 N/A CYS 197.A N TRP 193.A O no hydrogen 2.951 N/A CYS 197.A SG TRP 173.A O no hydrogen 3.892 N/A CYS 197.A SG TRP 193.A O no hydrogen 3.327 N/A ILE 198.A N ALA 194.A O no hydrogen 3.075 N/A PHE 199.A N ILE 195.A O no hydrogen 2.932 N/A ALA 200.A N GLY 196.A O no hydrogen 2.937 N/A GLU 201.A N CYS 197.A O no hydrogen 2.981 N/A LEU 202.A N ILE 198.A O no hydrogen 2.754 N/A LEU 203.A N PHE 199.A O no hydrogen 3.264 N/A THR 204.A N ALA 200.A O no hydrogen 3.140 N/A THR 204.A OG1 ALA 200.A O no hydrogen 2.864 N/A THR 204.A OG1 GLU 206.A O no hydrogen 2.970 N/A SER 205.A N GLU 201.A O no hydrogen 2.740 N/A GLU 206.A N THR 204.A OG1 no hydrogen 3.138 N/A HIS 210.A N PRO 207.A O no hydrogen 3.063 N/A TYR 215.A OH ASP 250.A OD2 no hydrogen 3.167 N/A HIS 217.A ND1 ASP 218.A OD1 no hydrogen 2.775 N/A GLN 219.A NE2 PHE 209.A O no hydrogen 3.096 N/A GLN 219.A NE2 GLN 219.A O no hydrogen 3.094 N/A LEU 220.A N HIS 216.A O no hydrogen 3.248 N/A ASP 221.A N HIS 217.A O no hydrogen 2.912 N/A ARG 222.A N ASP 218.A O no hydrogen 3.147 N/A ARG 222.A NE ILE 208.A O no hydrogen 3.263 N/A ILE 223.A N GLN 219.A O no hydrogen 3.254 N/A PHE 224.A N LEU 220.A O no hydrogen 3.044 N/A ASN 225.A N ASP 221.A O no hydrogen 2.936 N/A VAL 226.A N ARG 222.A O no hydrogen 3.130 N/A VAL 226.A N ILE 223.A O no hydrogen 3.184 N/A MET 227.A N ILE 223.A O no hydrogen 2.677 N/A GLY 228.A N PHE 224.A O no hydrogen 2.821 N/A ALA 231.A N ASP 234.A OD2 no hydrogen 3.014 N/A TRP 235.A N ALA 231.A O no hydrogen 3.201 N/A LYS 240.A N ASP 237.A O no hydrogen 2.997 N/A MET 241.A N ILE 238.A O no hydrogen 3.005 N/A GLU 243.A N LEU 181.A O no hydrogen 3.156 N/A HIS 244.A N MET 241.A O no hydrogen 3.155 N/A THR 246.A OG1 GLU 243.A OE1 no hydrogen 3.147 N/A LEU 247.A N GLU 243.A O no hydrogen 3.004 N/A MET 248.A N HIS 244.A O no hydrogen 2.970 N/A LYS 249.A N SER 245.A O no hydrogen 2.921 N/A ASP 250.A N THR 246.A O no hydrogen 3.040 N/A PHE 251.A N LEU 247.A O no hydrogen 2.830 N/A THR 255.A N ARG 252.A O no hydrogen 2.894 N/A THR 255.A OG1 ARG 252.A O no hydrogen 2.900 N/A TYR 256.A N ARG 253.A O no hydrogen 2.962 N/A TYR 256.A OH ASP 221.A OD1 no hydrogen 2.497 N/A THR 257.A OG1 ASN 254.A O no hydrogen 2.570 N/A CYS 259.A SG ASN 225.A O no hydrogen 3.328 N/A LYS 263.A N SER 260.A OG no hydrogen 3.145 N/A LYS 263.A NZ ASN 258.A O no hydrogen 3.427 N/A TYR 264.A N SER 260.A O no hydrogen 2.930 N/A MET 265.A N LEU 261.A O no hydrogen 2.950 N/A GLU 266.A N ILE 262.A O no hydrogen 3.068 N/A LYS 269.A N GLU 266.A O no hydrogen 3.184 N/A VAL 270.A N MET 265.A O no hydrogen 2.906 N/A ASP 273.A N ASP 273.A OD1 no hydrogen 2.739 N/A SER 274.A N LYS 271.A O no hydrogen 3.359 N/A SER 274.A OG LYS 271.A O no hydrogen 3.006 N/A LYS 275.A NZ GLU 305.A OE2 no hydrogen 2.859 N/A PHE 277.A N SER 274.A O no hydrogen 3.226 N/A PHE 277.A N SER 274.A OG no hydrogen 3.239 N/A HIS 278.A N SER 274.A O no hydrogen 3.329 N/A LEU 279.A N LYS 275.A O no hydrogen 3.270 N/A LEU 280.A N ALA 276.A O no hydrogen 3.193 N/A GLN 281.A N PHE 277.A O no hydrogen 2.879 N/A LYS 282.A N HIS 278.A O no hydrogen 3.287 N/A LEU 283.A N LEU 279.A O no hydrogen 2.923 N/A LEU 284.A N LEU 280.A O no hydrogen 2.729 N/A THR 285.A OG1 GLN 281.A O no hydrogen 3.153 N/A THR 285.A OG1 LYS 282.A O no hydrogen 3.248 N/A ILE 289.A N ASP 287.A OD1 no hydrogen 3.210 N/A LYS 290.A N ASP 287.A O no hydrogen 3.068 N/A LYS 290.A NZ LYS 233.A O no hydrogen 2.919 N/A LYS 290.A NZ ASP 234.A O no hydrogen 3.101 N/A ARG 291.A N PRO 288.A O no hydrogen 3.370 N/A ARG 291.A NE THR 285.A O no hydrogen 2.701 N/A ARG 291.A NH1 GLU 178.A OE2 no hydrogen 3.036 N/A ARG 291.A NH1 ALA 189.A O no hydrogen 3.129 N/A ARG 291.A NH2 GLU 178.A OE1 no hydrogen 2.916 N/A ARG 291.A NH2 THR 285.A O no hydrogen 3.359 N/A ARG 291.A NH2 MET 286.A O no hydrogen 3.050 N/A THR 293.A N GLN 296.A OE1 no hydrogen 2.862 N/A THR 293.A OG1 GLN 296.A OE1 no hydrogen 2.990 N/A SER 294.A OG GLU 295.A OE1 no hydrogen 3.381 N/A GLU 295.A N GLU 295.A OE1 no hydrogen 2.806 N/A GLN 296.A N THR 293.A OG1 no hydrogen 3.384 N/A ALA 297.A N THR 293.A O no hydrogen 2.875 N/A MET 298.A N SER 294.A O no hydrogen 3.130 N/A GLN 299.A N GLU 295.A O no hydrogen 3.214 N/A ASP 300.A N ALA 297.A O no hydrogen 3.063 N/A TYR 302.A N ASP 300.A OD2 no hydrogen 2.974 N/A PHE 303.A N ASP 300.A O no hydrogen 3.190 N/A LEU 304.A N PRO 301.A O no hydrogen 2.870 N/A GLU 305.A N PRO 301.A O no hydrogen 3.086 N/A THR 310.A N SER 125.A OG no hydrogen 2.831 N/A THR 310.A OG1 SER 125.A OG no hydrogen 3.297 N/A THR 310.A OG1 ASP 312.A O no hydrogen 2.527 N/A VAL 313.A N GLY 162.A O no hydrogen 2.771 N/A PHE 314.A N ASP 312.A OD1 no hydrogen 3.017 N/A ALA 315.A N ASP 312.A O no hydrogen 3.182 N/A GLY 316.A N ASP 312.A OD2 no hydrogen 2.983 N/A CYS 317.A N PHE 314.A O no hydrogen 3.259 N/A CYS 317.A SG PHE 314.A O no hydrogen 3.177 N/A CYS 317.A SG ALA 315.A O no hydrogen 3.966 N/A TYR 321.A OH HIS 112.A NE2 no hydrogen 2.614 N/A ARG 324.A N GLU 102.A OE2 no hydrogen 3.217 N/A ARG 324.A NE ALA 101.A O no hydrogen 3.195 N/A ARG 324.A NH1 ASP 104.A OD2 no hydrogen 3.127 N/A ARG 324.A NH2 ALA 101.A O no hydrogen 3.192 N/A ARG 324.A NH2 ASP 104.A OD2 no hydrogen 3.345 N/A LEU 327.A N LYS 27.A O no hydrogen 2.678 N/A