Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 3jcf_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 7.A NZ GLU 86.A OE2 no hydrogen 2.738 N/A THR 14.A N PRO 11.A O no hydrogen 3.069 N/A THR 14.A OG1 PRO 11.A O no hydrogen 2.656 N/A TYR 17.A OH TYR 21.A O no hydrogen 2.515 N/A THR 18.A N LEU 89.A O no hydrogen 3.040 N/A THR 18.A OG1 LEU 89.A O no hydrogen 3.388 N/A THR 18.A OG1 ASN 90.A OD1 no hydrogen 3.567 N/A GLU 26.A N THR 63.A O no hydrogen 2.842 N/A GLU 28.A N ASN 61.A O no hydrogen 2.666 N/A VAL 29.A N PHE 40.A O no hydrogen 3.210 N/A MET 30.A N TRP 59.A O no hydrogen 2.658 N/A ASN 31.A ND2 SER 54.A OG no hydrogen 3.333 N/A TYR 32.A N PRO 57.A O no hydrogen 3.392 N/A SER 33.A N GLU 36.A O no hydrogen 3.068 N/A GLU 36.A N SER 33.A OG no hydrogen 3.359 N/A ARG 38.A N ASN 31.A O no hydrogen 3.054 N/A PHE 40.A N VAL 29.A O no hydrogen 3.261 N/A THR 42.A N ILE 27.A O no hydrogen 3.139 N/A THR 42.A OG1 SER 47.A OG no hydrogen 3.299 N/A GLU 46.A N ASP 44.A OD1 no hydrogen 2.967 N/A SER 47.A OG THR 42.A OG1 no hydrogen 3.299 N/A SER 47.A OG ASP 44.A O no hydrogen 3.249 N/A LEU 49.A N GLU 46.A O no hydrogen 3.282 N/A ARG 52.A N LEU 49.A O no hydrogen 3.016 N/A SER 54.A N PHE 51.A O no hydrogen 3.163 N/A SER 54.A OG THR 56.A OG1 no hydrogen 2.998 N/A THR 56.A OG1 ASN 31.A OD1 no hydrogen 2.526 N/A THR 56.A OG1 SER 54.A OG no hydrogen 2.998 N/A THR 58.A N ASN 132.A O no hydrogen 2.920 N/A THR 58.A OG1 THR 56.A O no hydrogen 3.106 N/A TRP 59.A N MET 30.A O no hydrogen 2.850 N/A ILE 60.A N VAL 134.A O no hydrogen 2.929 N/A ASN 61.A N GLU 28.A O no hydrogen 2.492 N/A ILE 62.A N MET 136.A O no hydrogen 2.848 N/A THR 63.A N GLU 26.A O no hydrogen 2.555 N/A THR 63.A OG1 ASN 61.A OD1 no hydrogen 3.412 N/A ILE 65.A N GLN 138.A O no hydrogen 3.160 N/A ARG 67.A N GLY 64.A O no hydrogen 3.497 N/A ARG 67.A NH2 ASP 69.A OD2 no hydrogen 3.017 N/A VAL 70.A N ASP 69.A OD1 no hydrogen 2.747 N/A GLN 72.A N THR 68.A O no hydrogen 3.011 N/A GLN 72.A NE2 GLU 76.A OE2 no hydrogen 2.798 N/A ARG 73.A N ASP 69.A O no hydrogen 3.084 N/A ARG 73.A NH1 ARG 73.A O no hydrogen 3.015 N/A VAL 74.A N VAL 70.A O no hydrogen 2.870 N/A GLY 75.A N VAL 71.A O no hydrogen 2.872 N/A GLU 76.A N GLN 72.A O no hydrogen 2.774 N/A PHE 77.A N ARG 73.A O no hydrogen 3.258 N/A PHE 78.A N VAL 74.A O no hydrogen 3.048 N/A GLY 79.A N GLU 76.A O no hydrogen 3.165 N/A ILE 80.A N GLY 75.A O no hydrogen 2.575 N/A HIS 81.A N TYR 103.A OH no hydrogen 3.127 N/A LEU 85.A N HIS 81.A O no hydrogen 3.179 N/A GLU 86.A N PRO 82.A O no hydrogen 2.757 N/A ASP 87.A N LEU 83.A O no hydrogen 2.853 N/A ILE 88.A N VAL 84.A O no hydrogen 3.227 N/A LEU 89.A N LEU 85.A O no hydrogen 3.407 N/A ASN 90.A N GLU 86.A O no hydrogen 3.200 N/A VAL 91.A N THR 18.A OG1 no hydrogen 3.020 N/A HIS 92.A N ASN 90.A OD1 no hydrogen 3.022 N/A LYS 96.A NZ ASP 87.A OD2 no hydrogen 3.427 N/A LYS 96.A NZ GLU 98.A OE2 no hydrogen 2.580 N/A GLU 98.A N PHE 105.A O no hydrogen 2.988 N/A PHE 100.A N TYR 103.A O no hydrogen 2.945 N/A VAL 104.A N LEU 129.A O no hydrogen 3.147 N/A PHE 105.A N GLU 98.A O no hydrogen 3.252 N/A ILE 106.A N LEU 127.A O no hydrogen 3.111 N/A VAL 107.A N LYS 96.A O no hydrogen 3.111 N/A LEU 108.A N VAL 125.A O no hydrogen 2.738 N/A LYS 109.A NZ VAL 91.A O no hydrogen 3.285 N/A MET 110.A N GLU 123.A O no hydrogen 2.861 N/A THR 112.A N GLU 121.A O no hydrogen 3.343 N/A ASP 114.A N GLU 119.A O no hydrogen 3.392 N/A HIS 118.A ND1 TYR 113.A OH no hydrogen 2.675 N/A GLU 119.A N ASP 114.A OD1 no hydrogen 2.677 N/A GLU 121.A N THR 112.A O no hydrogen 3.475 N/A GLU 123.A N MET 110.A O no hydrogen 3.218 N/A GLN 124.A NE2 ASP 87.A O no hydrogen 3.534 N/A VAL 125.A N LEU 108.A O no hydrogen 2.476 N/A SER 126.A N PHE 137.A O no hydrogen 3.263 N/A LEU 127.A N ILE 106.A O no hydrogen 3.051 N/A ILE 128.A N LEU 135.A O no hydrogen 3.341 N/A LEU 129.A N VAL 104.A O no hydrogen 3.153 N/A THR 130.A N CYS 133.A O no hydrogen 2.913 N/A THR 130.A OG1 ASN 102.A O no hydrogen 3.424 N/A LYS 131.A NZ ASP 53.A OD1 no hydrogen 2.760 N/A ASN 132.A ND2 SER 54.A O no hydrogen 3.531 N/A CYS 133.A N THR 130.A O no hydrogen 2.686 N/A CYS 133.A SG PHE 51.A O no hydrogen 3.099 N/A CYS 133.A SG ARG 52.A O no hydrogen 3.426 N/A VAL 134.A N THR 58.A O no hydrogen 2.996 N/A LEU 135.A N ILE 128.A O no hydrogen 2.764 N/A PHE 137.A N SER 126.A O no hydrogen 2.728 N/A GLN 138.A N ILE 62.A O no hydrogen 3.041 N/A GLU 139.A N GLU 123.A OE2 no hydrogen 2.461 N/A LYS 140.A N GLU 123.A OE2 no hydrogen 2.780 N/A LYS 140.A NZ GLU 121.A OE1 no hydrogen 3.247 N/A LYS 140.A NZ GLU 121.A OE2 no hydrogen 3.510 N/A ARG 149.A N PHE 145.A O no hydrogen 3.084 N/A ARG 149.A NH1 ASP 143.A OD1 no hydrogen 3.112 N/A ARG 149.A NH1 ASP 143.A OD2 no hydrogen 2.756 N/A ARG 149.A NH2 ASP 143.A OD2 no hydrogen 2.335 N/A GLU 150.A N ASP 146.A O no hydrogen 3.067 N/A ARG 151.A N PRO 147.A O no hydrogen 2.898 N/A ILE 152.A N VAL 148.A O no hydrogen 3.217 N/A ARG 153.A N ARG 149.A O no hydrogen 2.539 N/A ARG 153.A NH2 GLU 39.A OE1 no hydrogen 3.267 N/A TYR 154.A N GLU 150.A O no hydrogen 2.612 N/A ASN 155.A N ILE 152.A O no hydrogen 3.143 N/A ARG 156.A N ARG 151.A O no hydrogen 2.491 N/A ARG 160.A NH1 SER 33.A O no hydrogen 3.168 N/A ARG 160.A NH2 ILE 152.A O no hydrogen 2.244 N/A LYS 162.A N ILE 158.A O no hydrogen 3.117 N/A TYR 166.A N ARG 163.A O no hydrogen 3.153 N/A TYR 166.A N ASP 165.A OD1 no hydrogen 2.693 N/A LEU 167.A N ARG 163.A O no hydrogen 3.076 N/A LEU 168.A N ALA 164.A O no hydrogen 2.695 N/A TYR 169.A N ASP 165.A O no hydrogen 3.384 N/A SER 170.A N TYR 166.A O no hydrogen 2.986 N/A SER 170.A OG TYR 166.A O no hydrogen 3.201 N/A LEU 171.A N LEU 167.A O no hydrogen 2.794 N/A ILE 172.A N LEU 168.A O no hydrogen 3.004 N/A ASP 173.A N TYR 169.A O no hydrogen 2.664 N/A ALA 174.A N SER 170.A O no hydrogen 2.902 N/A LEU 175.A N LEU 171.A O no hydrogen 3.256 N/A VAL 176.A N ILE 172.A O no hydrogen 2.835 N/A ASP 177.A N ASP 173.A O no hydrogen 3.053 N/A ASP 178.A N LEU 175.A O no hydrogen 2.968 N/A TYR 179.A N VAL 176.A O no hydrogen 3.233 N/A PHE 180.A N ASP 177.A O no hydrogen 3.286 N/A LEU 182.A N ASP 178.A O no hydrogen 3.106 N/A LEU 183.A N TYR 179.A O no hydrogen 2.828 N/A GLU 184.A N PHE 180.A O no hydrogen 3.087 N/A LYS 185.A N VAL 181.A O no hydrogen 3.213 N/A ILE 186.A N LEU 182.A O no hydrogen 3.034 N/A ASP 187.A N LEU 183.A O no hydrogen 2.576 N/A ASP 188.A N GLU 184.A O no hydrogen 3.058 N/A GLU 189.A N LYS 185.A O no hydrogen 3.284 N/A ILE 190.A N ILE 186.A O no hydrogen 2.949 N/A ASP 191.A N ASP 187.A O no hydrogen 3.130 N/A VAL 192.A N ASP 188.A O no hydrogen 2.853 N/A LEU 193.A N GLU 189.A O no hydrogen 2.779 N/A GLU 194.A N ILE 190.A O no hydrogen 2.537 N/A GLU 195.A N ASP 191.A O no hydrogen 3.162 N/A GLU 196.A N VAL 192.A O no hydrogen 3.153 N/A VAL 197.A N LEU 193.A O no hydrogen 2.864 N/A LEU 198.A N GLU 194.A O no hydrogen 2.751 N/A GLU 199.A N GLU 195.A O no hydrogen 2.782 N/A THR 205.A OG1 GLU 196.A OE2 no hydrogen 2.271 N/A THR 205.A OG1 GLU 202.A O no hydrogen 2.929 N/A ARG 208.A N GLU 204.A O no hydrogen 3.042 N/A ARG 208.A NE HIS 118.A NE2 no hydrogen 3.253 N/A THR 209.A N THR 205.A O no hydrogen 3.096 N/A THR 209.A OG1 THR 205.A O no hydrogen 3.127 N/A HIS 210.A N VAL 206.A O no hydrogen 2.963 N/A GLN 211.A N GLN 207.A O no hydrogen 2.826 N/A LEU 212.A N ARG 208.A O no hydrogen 2.830 N/A LYS 213.A N THR 209.A O no hydrogen 2.831 N/A ARG 214.A N HIS 210.A O no hydrogen 3.021 N/A ASN 215.A N GLN 211.A O no hydrogen 2.938 N/A LEU 216.A N LEU 212.A O no hydrogen 2.755 N/A VAL 217.A N LYS 213.A O no hydrogen 3.023 N/A GLU 218.A N ARG 214.A O no hydrogen 3.215 N/A LEU 219.A N ASN 215.A O no hydrogen 3.074 N/A ARG 220.A N LEU 216.A O no hydrogen 3.100 N/A LYS 221.A N VAL 217.A O no hydrogen 2.921 N/A THR 222.A N LEU 219.A O no hydrogen 3.204 N/A ILE 223.A N LEU 219.A O no hydrogen 3.048 N/A TRP 224.A N ARG 220.A O no hydrogen 2.791 N/A ARG 227.A N ILE 223.A O no hydrogen 3.303 N/A ARG 227.A N TRP 224.A O no hydrogen 3.352 N/A VAL 229.A N PRO 225.A O no hydrogen 3.044 N/A LEU 230.A N LEU 226.A O no hydrogen 3.190 N/A SER 231.A N ARG 227.A O no hydrogen 2.814 N/A SER 232.A N GLU 228.A O no hydrogen 2.822 N/A SER 232.A OG GLU 228.A O no hydrogen 2.619 N/A TYR 234.A N LEU 230.A O no hydrogen 3.061 N/A ASP 236.A N LEU 233.A O no hydrogen 3.110 N/A THR 245.A N ILE 241.A O no hydrogen 3.026 N/A THR 245.A OG1 ILE 241.A O no hydrogen 2.279 N/A PHE 249.A N THR 245.A O no hydrogen 3.237 N/A ARG 250.A N VAL 246.A O no hydrogen 3.277 N/A ASP 251.A N TYR 248.A O no hydrogen 3.166 N/A VAL 252.A N TYR 248.A O no hydrogen 3.492 N/A TYR 253.A N PHE 249.A O no hydrogen 2.712 N/A ASP 254.A N ARG 250.A O no hydrogen 2.799 N/A HIS 255.A N ASP 251.A O no hydrogen 3.002 N/A THR 256.A N VAL 252.A O no hydrogen 3.055 N/A GLN 258.A N ASP 254.A O no hydrogen 3.271 N/A ILE 259.A N HIS 255.A O no hydrogen 2.822 N/A ALA 260.A N THR 256.A O no hydrogen 2.908 N/A ASP 261.A N ILE 257.A O no hydrogen 2.790 N/A THR 262.A N GLN 258.A O no hydrogen 2.893 N/A THR 262.A OG1 GLN 258.A O no hydrogen 2.436 N/A VAL 263.A N ILE 259.A O no hydrogen 2.925 N/A GLU 264.A N ALA 260.A O no hydrogen 3.071 N/A THR 265.A N ASP 261.A O no hydrogen 2.914 N/A THR 265.A OG1 ASP 261.A O no hydrogen 2.429 N/A PHE 266.A N THR 262.A O no hydrogen 3.253 N/A ARG 267.A N VAL 263.A O no hydrogen 3.132 N/A ARG 267.A NH2 GLU 264.A OE1 no hydrogen 3.152 N/A ASP 268.A N GLU 264.A O no hydrogen 3.331 N/A ILE 269.A N THR 265.A O no hydrogen 3.374 N/A VAL 270.A N PHE 266.A O no hydrogen 2.744 N/A SER 271.A N ARG 267.A O no hydrogen 2.952 N/A SER 271.A OG ARG 267.A O no hydrogen 2.379 N/A LEU 273.A N VAL 270.A O no hydrogen 3.191 N/A VAL 276.A N GLY 272.A O no hydrogen 3.316 N/A TYR 277.A N LEU 273.A O no hydrogen 3.369 N/A LEU 278.A N LEU 274.A O no hydrogen 3.049 N/A SER 279.A N ASP 275.A O no hydrogen 2.714 N/A SER 279.A OG ASP 275.A O no hydrogen 2.630 N/A SER 280.A N VAL 276.A O no hydrogen 2.980 N/A VAL 281.A N TYR 277.A O no hydrogen 2.976 N/A SER 282.A N LEU 278.A O no hydrogen 3.184 N/A SER 282.A OG LEU 278.A O no hydrogen 3.245 N/A SER 282.A OG SER 279.A O no hydrogen 2.896 N/A ASN 283.A N SER 279.A O no hydrogen 3.202 N/A LYS 284.A N SER 280.A O no hydrogen 2.860 N/A THR 285.A N VAL 281.A O no hydrogen 2.840 N/A THR 285.A OG1 VAL 281.A O no hydrogen 3.092 N/A ASN 286.A N SER 282.A O no hydrogen 2.796 N/A GLU 287.A N ASN 283.A O no hydrogen 2.945 N/A VAL 288.A N LYS 284.A O no hydrogen 2.810 N/A MET 289.A N THR 285.A O no hydrogen 2.678 N/A LYS 290.A N ASN 286.A O no hydrogen 3.132 N/A VAL 291.A N GLU 287.A O no hydrogen 3.168 N/A LEU 292.A N VAL 288.A O no hydrogen 2.994 N/A THR 293.A N MET 289.A O no hydrogen 2.979 N/A THR 293.A OG1 MET 289.A O no hydrogen 3.010 N/A ILE 294.A N LYS 290.A O no hydrogen 3.034 N/A ALA 296.A N LEU 292.A O no hydrogen 3.063 N/A THR 297.A N THR 293.A O no hydrogen 2.894 N/A THR 297.A OG1 THR 293.A O no hydrogen 2.705 N/A ILE 298.A N ILE 295.A O no hydrogen 3.053 N/A MET 300.A N ALA 296.A O no hydrogen 3.361 N/A THR 303.A N PHE 299.A O no hydrogen 2.360 N/A THR 303.A OG1 PHE 299.A O no hydrogen 2.613 N/A PHE 304.A N MET 300.A O no hydrogen 2.975 N/A ILE 305.A N PRO 301.A O no hydrogen 3.000 N/A ALA 306.A N LEU 302.A O no hydrogen 3.174 N/A GLY 307.A N THR 303.A O no hydrogen 3.009 N/A ILE 308.A N PHE 304.A O no hydrogen 3.006 N/A ILE 308.A N ILE 305.A O no hydrogen 3.217 N/A TYR 309.A N ILE 305.A O no hydrogen 3.420 N/A GLY 310.A N GLY 307.A O no hydrogen 3.294 N/A MET 311.A N GLY 307.A O no hydrogen 2.995 N/A GLU 318.A N GLU 318.A OE1 no hydrogen 2.692 N/A ARG 320.A N PRO 317.A O no hydrogen 3.138 N/A TRP 321.A N GLU 318.A O no hydrogen 3.200 N/A VAL 328.A N GLY 324.A O no hydrogen 2.976 N/A LEU 329.A N TYR 325.A O no hydrogen 3.459 N/A ALA 330.A N PRO 326.A O no hydrogen 2.861 N/A VAL 331.A N VAL 327.A O no hydrogen 2.714 N/A MET 332.A N VAL 328.A O no hydrogen 3.286 N/A GLY 333.A N ALA 330.A O no hydrogen 3.010 N/A VAL 334.A N ALA 330.A O no hydrogen 3.315 N/A ILE 335.A N VAL 331.A O no hydrogen 3.320 N/A ALA 336.A N MET 332.A O no hydrogen 2.924 N/A VAL 337.A N GLY 333.A O no hydrogen 3.008 N/A ILE 338.A N VAL 334.A O no hydrogen 2.960 N/A MET 339.A N ILE 335.A O no hydrogen 3.305 N/A VAL 340.A N ALA 336.A O no hydrogen 3.480 N/A VAL 341.A N VAL 337.A O no hydrogen 2.800 N/A TYR 342.A N ILE 338.A O no hydrogen 2.586 N/A PHE 343.A N MET 339.A O no hydrogen 2.548 N/A LYS 345.A NZ TYR 342.A OH no hydrogen 2.641 N/A