Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jro_C.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ILE 6.A N PRO 3.A O no hydrogen 3.470 N/A ARG 8.A N PHE 4.A O no hydrogen 2.656 N/A ARG 8.A NE GLU 47.A OE2 no hydrogen 3.079 N/A GLU 9.A N ILE 6.A O no hydrogen 2.864 N/A PHE 10.A N ILE 6.A O no hydrogen 3.247 N/A PHE 10.A N ILE 7.A O no hydrogen 2.736 N/A ARG 11.A N ILE 7.A O no hydrogen 2.888 N/A ARG 11.A NH1 ALA 40.A O no hydrogen 3.539 N/A SER 12.A N ARG 8.A O no hydrogen 3.031 N/A SER 12.A OG GLU 9.A O no hydrogen 2.885 N/A ALA 14.A N PHE 10.A O no hydrogen 2.732 N/A GLY 15.A N ARG 11.A O no hydrogen 3.285 N/A GLN 16.A N SER 12.A O no hydrogen 3.194 N/A LEU 17.A N ALA 13.A O no hydrogen 2.881 N/A ALA 18.A N GLY 15.A O no hydrogen 3.032 N/A VAL 30.A N GLU 27.A O no hydrogen 3.364 N/A ILE 31.A N SER 28.A O no hydrogen 3.228 N/A SER 32.A N SER 28.A O no hydrogen 2.887 N/A SER 32.A OG SER 28.A O no hydrogen 3.011 N/A SER 33.A OG ASN 29.A O no hydrogen 2.690 N/A LYS 34.A N ILE 31.A O no hydrogen 2.987 N/A ASP 35.A N SER 32.A O no hydrogen 3.287 N/A GLU 39.A N ASP 35.A O no hydrogen 2.990 N/A ALA 40.A N TRP 36.A O no hydrogen 3.119 N/A ARG 41.A N GLU 37.A O no hydrogen 3.320 N/A ARG 41.A NE GLU 37.A O no hydrogen 3.149 N/A ARG 41.A NH1 ASN 94.A OD1 no hydrogen 2.499 N/A PHE 42.A N LEU 38.A O no hydrogen 3.085 N/A PHE 42.A N GLU 39.A O no hydrogen 2.738 N/A TRP 43.A N GLU 39.A O no hydrogen 2.807 N/A TRP 43.A NE1 GLU 39.A OE2 no hydrogen 2.778 N/A HIS 44.A N ALA 40.A O no hydrogen 3.191 N/A LEU 45.A N ARG 41.A O no hydrogen 3.404 N/A VAL 46.A N PHE 42.A O no hydrogen 2.843 N/A GLU 47.A N TRP 43.A O no hydrogen 2.867 N/A LEU 48.A N HIS 44.A O no hydrogen 3.011 N/A LEU 49.A N LEU 45.A O no hydrogen 3.112 N/A LEU 50.A N VAL 46.A O no hydrogen 3.336 N/A PHE 52.A N LEU 49.A O no hydrogen 3.143 N/A GLU 61.A N ASP 58.A O no hydrogen 2.858 N/A ASN 67.A N HIS 64.A O no hydrogen 3.086 N/A ASN 67.A ND2 ASP 184.A OD1 no hydrogen 2.859 N/A SER 68.A OG ASN 67.A O no hydrogen 2.354 N/A LYS 75.A N PHE 72.A O no hydrogen 2.828 N/A LEU 76.A N PHE 72.A O no hydrogen 2.718 N/A ASP 78.A N LYS 75.A O no hydrogen 2.882 N/A TYR 83.A N ASN 79.A O no hydrogen 3.454 N/A GLN 84.A N LYS 80.A O no hydrogen 3.152 N/A ILE 85.A N GLN 81.A O no hydrogen 3.182 N/A TRP 86.A N LEU 82.A O no hydrogen 3.065 N/A ILE 87.A N TYR 83.A O no hydrogen 2.926 N/A VAL 88.A N GLN 84.A O no hydrogen 3.302 N/A VAL 88.A N ILE 85.A O no hydrogen 2.796 N/A TRP 90.A N ILE 87.A O no hydrogen 3.343 N/A LEU 91.A N VAL 88.A O no hydrogen 2.799 N/A GLU 93.A N VAL 89.A O no hydrogen 3.230 N/A ASN 94.A N LEU 91.A O no hydrogen 2.910 N/A THR 95.A N LYS 92.A O no hydrogen 3.186 N/A THR 95.A OG1 LYS 92.A O no hydrogen 3.383 N/A THR 95.A OG1 GLU 243.A OE2 no hydrogen 2.919 N/A VAL 97.A N GLU 147.A OE2 no hydrogen 2.720 N/A LYS 104.A N SER 164.A O no hydrogen 2.972 N/A SER 108.A OG ASP 134.A OD2 no hydrogen 2.564 N/A ILE 109.A N LEU 106.A O no hydrogen 3.281 N/A THR 110.A N LEU 106.A O no hydrogen 3.481 N/A THR 110.A OG1 ASN 107.A O no hydrogen 3.145 N/A SER 111.A OG ASN 107.A O no hydrogen 2.594 N/A GLY 112.A N SER 108.A O no hydrogen 2.821 N/A SER 116.A N GLY 113.A O no hydrogen 3.229 N/A SER 116.A OG GLY 113.A O no hydrogen 3.019 N/A CYS 117.A SG PRO 122.A O no hydrogen 2.917 N/A ASP 118.A N LEU 114.A O no hydrogen 2.446 N/A LEU 119.A N CYS 117.A O no hydrogen 2.785 N/A PHE 121.A N ASP 120.A OD1 no hydrogen 2.568 N/A LEU 123.A N ASP 120.A O no hydrogen 2.758 N/A ARG 124.A NH1 GLN 213.A OE1 no hydrogen 2.653 N/A ASN 126.A N LEU 123.A O no hydrogen 2.587 N/A THR 127.A OG1 ASN 126.A O no hydrogen 2.380 N/A ASN 128.A N ASN 126.A O no hydrogen 2.840 N/A ASP 134.A N ASP 131.A OD1 no hydrogen 3.335 N/A GLU 136.A N LYS 133.A O no hydrogen 3.112 N/A GLU 137.A N LYS 133.A O no hydrogen 2.940 N/A ASP 138.A N ASP 134.A O no hydrogen 2.954 N/A HIS 139.A ND1 ASP 217.A OD2 no hydrogen 2.814 N/A ILE 140.A N GLU 136.A O no hydrogen 3.032 N/A PHE 142.A N ASP 138.A O no hydrogen 3.158 N/A LYS 143.A N HIS 139.A O no hydrogen 3.036 N/A LYS 143.A N ILE 140.A O no hydrogen 3.217 N/A TYR 144.A N ILE 140.A O no hydrogen 3.020 N/A TYR 144.A N PHE 141.A O no hydrogen 2.959 N/A TYR 144.A OH GLU 160.A OE2 no hydrogen 3.411 N/A ILE 145.A N PHE 141.A O no hydrogen 2.958 N/A TYR 146.A N PHE 142.A O no hydrogen 3.042 N/A GLU 147.A N LYS 143.A O no hydrogen 3.271 N/A LEU 148.A N TYR 144.A O no hydrogen 3.061 N/A ILE 149.A N ILE 145.A O no hydrogen 2.638 N/A LEU 150.A N TYR 146.A O no hydrogen 3.182 N/A ALA 151.A N GLU 147.A O no hydrogen 3.386 N/A GLY 152.A N ILE 149.A O no hydrogen 2.799 N/A ALA 153.A N LEU 148.A O no hydrogen 3.086 N/A ALA 157.A N ALA 153.A O no hydrogen 2.886 N/A ALA 157.A N ILE 154.A O no hydrogen 2.809 N/A LEU 158.A N ILE 154.A O no hydrogen 3.163 N/A GLU 160.A N ALA 157.A O no hydrogen 3.130 N/A ALA 161.A N ALA 157.A O no hydrogen 3.061 N/A LYS 162.A N LEU 158.A O no hydrogen 3.251 N/A SER 164.A N GLU 160.A O no hydrogen 3.248 N/A SER 164.A OG ALA 161.A O no hydrogen 3.365 N/A ASP 165.A N LYS 162.A O no hydrogen 2.757 N/A CYS 170.A N ASN 166.A O no hydrogen 3.248 N/A CYS 170.A SG LEU 158.A O no hydrogen 3.885 N/A CYS 173.A SG CYS 170.A O no hydrogen 3.805 N/A GLY 174.A N ILE 171.A O no hydrogen 2.977 N/A GLN 176.A NE2 ASP 155.A OD1 no hydrogen 3.124 N/A THR 185.A OG1 GLN 186.A OE1 no hydrogen 2.880 N/A GLN 186.A N GLN 186.A OE1 no hydrogen 2.816 N/A ILE 187.A N ASP 184.A O no hydrogen 3.213 N/A ALA 188.A N THR 185.A O no hydrogen 2.940 N/A GLU 190.A N ILE 187.A O no hydrogen 3.035 N/A ILE 197.A N LEU 179.A O no hydrogen 3.282 N/A LEU 202.A N LYS 199.A O no hydrogen 2.904 N/A TRP 203.A N LYS 199.A O no hydrogen 2.628 N/A ARG 204.A N HIS 200.A O no hydrogen 2.624 N/A ARG 204.A NE SER 228.A O no hydrogen 2.735 N/A ARG 204.A NH2 SER 228.A O no hydrogen 2.900 N/A ARG 205.A NH1 LEU 275.A O no hydrogen 2.889 N/A THR 206.A N TRP 203.A O no hydrogen 2.835 N/A THR 206.A OG1 LEU 202.A O no hydrogen 3.160 N/A VAL 207.A N TRP 203.A O no hydrogen 3.042 N/A TYR 208.A N ARG 204.A O no hydrogen 3.034 N/A TYR 208.A OH GLN 212.A OE1 no hydrogen 2.756 N/A SER 209.A OG THR 206.A O no hydrogen 3.045 N/A LEU 210.A N THR 206.A O no hydrogen 3.117 N/A LEU 210.A N VAL 207.A O no hydrogen 2.998 N/A SER 211.A N VAL 207.A O no hydrogen 2.994 N/A SER 211.A OG TYR 208.A O no hydrogen 2.910 N/A GLN 212.A N TYR 208.A O no hydrogen 3.194 N/A GLN 213.A N LEU 210.A O no hydrogen 3.451 N/A TYR 219.A N ASP 217.A OD1 no hydrogen 2.716 N/A GLU 220.A N ASP 217.A OD1 no hydrogen 3.331 N/A ARG 221.A N ASP 217.A O no hydrogen 2.861 N/A ALA 222.A N TYR 219.A O no hydrogen 2.631 N/A ILE 223.A N TYR 219.A O no hydrogen 2.938 N/A TYR 224.A N GLU 220.A O no hydrogen 3.392 N/A TYR 224.A OH GLU 220.A OE2 no hydrogen 3.181 N/A SER 225.A OG ARG 221.A O no hydrogen 3.561 N/A SER 225.A OG ALA 222.A O no hydrogen 2.576 N/A TYR 226.A N ALA 222.A O no hydrogen 3.280 N/A SER 228.A N TYR 224.A O no hydrogen 3.378 N/A SER 228.A N SER 225.A O no hydrogen 2.800 N/A SER 228.A OG TYR 224.A O no hydrogen 3.282 N/A SER 228.A OG SER 225.A O no hydrogen 2.954 N/A GLY 229.A N SER 225.A O no hydrogen 2.526 N/A VAL 236.A N ASN 233.A O no hydrogen 2.706 N/A LEU 237.A N GLN 234.A O no hydrogen 2.985 N/A SER 240.A OG SER 240.A O no hydrogen 2.194 N/A ASP 245.A N TRP 242.A O no hydrogen 3.001 N/A LEU 246.A N TRP 242.A O no hydrogen 3.142 N/A HIS 247.A N GLU 243.A O no hydrogen 2.870 N/A ILE 248.A N SER 244.A O no hydrogen 3.350 N/A HIS 249.A N ASP 245.A O no hydrogen 3.031 N/A HIS 249.A NE2 ASP 245.A OD2 no hydrogen 2.867 N/A LEU 250.A N LEU 246.A O no hydrogen 3.470 N/A ASN 251.A N HIS 247.A O no hydrogen 2.961 N/A ILE 253.A N HIS 249.A O no hydrogen 2.929 N/A LEU 254.A N LEU 250.A O no hydrogen 3.050 N/A THR 256.A N GLN 252.A O no hydrogen 3.349 N/A THR 256.A OG1 GLN 252.A O no hydrogen 3.213 N/A THR 256.A OG1 ILE 253.A O no hydrogen 3.013 N/A GLU 257.A N ILE 253.A O no hydrogen 2.923 N/A GLU 259.A N GLN 255.A O no hydrogen 2.642 N/A ASN 260.A N GLU 257.A O no hydrogen 3.139 N/A TYR 261.A N GLU 257.A O no hydrogen 3.147 N/A LEU 262.A N ILE 258.A O no hydrogen 3.024 N/A LEU 263.A N GLU 259.A O no hydrogen 3.169 N/A GLU 264.A N ASN 260.A O no hydrogen 3.141 N/A ASN 265.A N LEU 262.A O no hydrogen 3.006 N/A GLU 272.A N GLY 269.A O no hydrogen 3.270 N/A LEU 273.A N THR 270.A O no hydrogen 3.524 N/A THR 283.A N ALA 281.A O no hydrogen 2.846 N/A GLU 286.A N THR 283.A O no hydrogen 2.593 N/A VAL 287.A N THR 283.A O no hydrogen 3.021 N/A VAL 287.A N VAL 284.A O no hydrogen 2.989 N/A LEU 288.A N VAL 284.A O no hydrogen 2.927 N/A ARG 290.A N GLU 286.A O no hydrogen 3.110 N/A VAL 291.A N VAL 287.A O no hydrogen 3.147 N/A ALA 292.A N ASN 289.A O no hydrogen 3.016 N/A SER 293.A OG ARG 290.A O no hydrogen 3.217 N/A ARG 294.A N VAL 291.A O no hydrogen 3.108 N/A SER 297.A OG PRO 296.A O no hydrogen 2.546 N/A HIS 301.A NE2 ASP 35.A OD1 no hydrogen 2.757 N/A ILE 303.A N HIS 301.A ND1 no hydrogen 3.361 N/A ARG 304.A N HIS 301.A O no hydrogen 3.180 N/A VAL 305.A N HIS 301.A O no hydrogen 3.154 N/A VAL 305.A N PRO 302.A O no hydrogen 3.253 N/A SER 308.A OG LEU 306.A O no hydrogen 3.065 N/A VAL 309.A N LEU 306.A O no hydrogen 2.967 N/A LEU 311.A N SER 308.A O no hydrogen 2.621 N/A SER 316.A OG SER 313.A O no hydrogen 3.069 N/A ILE 318.A N LEU 314.A O no hydrogen 3.384 N/A HIS 319.A N PRO 315.A O no hydrogen 3.131 N/A SER 320.A N SER 316.A O no hydrogen 2.903 N/A SER 320.A OG SER 316.A O no hydrogen 3.043 N/A SER 320.A OG VAL 317.A O no hydrogen 2.940 N/A SER 321.A N VAL 317.A O no hydrogen 3.043 N/A SER 321.A OG VAL 317.A O no hydrogen 3.042 N/A SER 321.A OG ILE 318.A O no hydrogen 2.593 N/A VAL 322.A N ILE 318.A O no hydrogen 3.318 N/A LEU 325.A N VAL 322.A O no hydrogen 2.926 N/A ASP 326.A N GLU 323.A O no hydrogen 3.176 N/A LEU 333.A N LYS 330.A O no hydrogen 3.300 N/A LEU 334.A N PRO 331.A O no hydrogen 3.174 N/A VAL 337.A N LEU 334.A O no hydrogen 3.185 N/A LEU 340.A N VAL 337.A O no hydrogen 3.056 N/A ALA 341.A N THR 338.A O no hydrogen 2.960 N/A ILE 346.A N CYS 343.A O no hydrogen 3.224 N/A ILE 347.A N CYS 343.A O no hydrogen 3.134 N/A SER 351.A N ILE 347.A O no hydrogen 2.736 N/A VAL 352.A N ASN 348.A O no hydrogen 3.370 N/A GLU 353.A N ASN 348.A O no hydrogen 2.623 N/A LYS 359.A NZ HIS 319.A NE2 no hydrogen 3.189 N/A LEU 360.A N ASP 356.A O no hydrogen 3.182 N/A ILE 361.A N LYS 357.A O no hydrogen 3.143 N/A THR 362.A N SER 358.A O no hydrogen 3.058 N/A THR 362.A OG1 SER 358.A O no hydrogen 3.073 N/A THR 362.A OG1 LYS 359.A O no hydrogen 3.325 N/A THR 363.A OG1 LYS 359.A O no hydrogen 3.387 N/A THR 363.A OG1 LEU 360.A O no hydrogen 3.169 N/A TYR 364.A N LEU 360.A O no hydrogen 3.178 N/A TYR 364.A N ILE 361.A O no hydrogen 3.137 N/A TYR 364.A OH ASP 345.A O no hydrogen 2.788 N/A ILE 365.A N ILE 361.A O no hydrogen 3.173 N/A SER 366.A N THR 362.A O no hydrogen 2.990 N/A SER 366.A OG THR 362.A O no hydrogen 3.487 N/A LEU 368.A N TYR 364.A O no hydrogen 3.185 N/A LYS 369.A N SER 366.A O no hydrogen 3.227 N/A LEU 370.A N SER 366.A O no hydrogen 3.056 N/A GLN 371.A NE2 LEU 367.A O no hydrogen 2.788 N/A