Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pjj_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 2.A N SER 1.A OG no hydrogen 2.633 N/A ARG 6.A N GLN 8.A OE1 no hydrogen 2.745 N/A ARG 6.A NH1 ASP 203.A OD2 no hydrogen 3.363 N/A ARG 6.A NH2 ASP 203.A OD1 no hydrogen 2.922 N/A GLY 7.A N THR 4.A O no hydrogen 3.091 N/A GLN 8.A N GLN 8.A OE1 no hydrogen 2.615 N/A GLN 9.A N ASN 93.A OD1 no hydrogen 2.956 N/A TYR 10.A OH PRO 3.A O no hydrogen 2.578 N/A PHE 15.A N ASN 90.A O no hydrogen 2.748 N/A GLN 17.A NE2 PHE 19.A O no hydrogen 2.878 N/A SER 20.A N GLN 84.A O no hydrogen 2.918 N/A VAL 22.A N ALA 82.A O no hydrogen 3.159 N/A ALA 27.A N PRO 25.A O no hydrogen 2.828 N/A ILE 32.A N LEU 288.A O no hydrogen 2.915 N/A ASN 33.A ND2 LEU 290.A O no hydrogen 2.921 N/A PHE 37.A N ASN 33.A O no hydrogen 2.907 N/A ALA 38.A N ALA 34.A O no hydrogen 3.026 N/A GLU 39.A N GLY 35.A O no hydrogen 3.078 N/A GLN 40.A N ASP 36.A O no hydrogen 2.689 N/A GLN 40.A NE2 GLN 40.A O no hydrogen 3.126 N/A GLN 40.A NE2 PRO 249.A O no hydrogen 2.895 N/A ILE 41.A N PHE 37.A O no hydrogen 2.837 N/A ASN 42.A N ALA 38.A O no hydrogen 2.947 N/A HIS 43.A N GLU 39.A O no hydrogen 3.119 N/A ILE 44.A N GLN 40.A O no hydrogen 3.121 N/A ARG 45.A N ILE 41.A O no hydrogen 2.925 N/A ASN 46.A N ASN 42.A O no hydrogen 3.053 N/A ASN 46.A ND2 ASN 42.A OD1 no hydrogen 3.573 N/A SER 47.A N HIS 43.A O no hydrogen 2.799 N/A SER 48.A N ILE 44.A O no hydrogen 2.901 N/A TYR 52.A N SER 48.A O no hydrogen 3.022 N/A GLY 53.A N PRO 49.A O no hydrogen 2.916 N/A ASN 54.A N ARG 50.A O no hydrogen 3.303 N/A GLN 55.A N TYR 52.A O no hydrogen 2.841 N/A SER 56.A N TYR 52.A O no hydrogen 2.566 N/A SER 56.A OG GLY 53.A O no hydrogen 3.392 N/A VAL 58.A N GLN 55.A O no hydrogen 2.724 N/A TYR 59.A N GLN 55.A O no hydrogen 3.196 N/A TYR 59.A OH GLY 266.A O no hydrogen 2.692 N/A ASN 60.A N SER 56.A O no hydrogen 2.732 N/A ALA 61.A N ASN 57.A O no hydrogen 3.296 N/A VAL 62.A N VAL 58.A O no hydrogen 2.990 N/A GLN 63.A N TYR 59.A O no hydrogen 2.919 N/A GLU 64.A N ASN 60.A O no hydrogen 2.835 N/A TRP 65.A N ALA 61.A O no hydrogen 2.835 N/A TRP 65.A NE1 ASP 71.A O no hydrogen 2.816 N/A LEU 66.A N VAL 62.A O no hydrogen 2.700 N/A ARG 67.A N GLN 63.A O no hydrogen 2.916 N/A ARG 67.A NH2 GLU 64.A OE1 no hydrogen 2.932 N/A ALA 68.A N GLU 64.A O no hydrogen 3.040 N/A ALA 68.A N TRP 65.A O no hydrogen 3.118 N/A GLY 69.A N LEU 66.A O no hydrogen 3.022 N/A GLY 70.A N TRP 65.A O no hydrogen 2.949 N/A THR 72.A N GLY 29.A O no hydrogen 2.957 N/A THR 72.A OG1 ALA 27.A O no hydrogen 2.541 N/A ARG 73.A N ASP 71.A OD2 no hydrogen 3.152 N/A ASN 74.A N ASP 71.A O no hydrogen 3.092 N/A ARG 76.A NH2 ASN 23.A OD1 no hydrogen 3.440 N/A GLN 77.A N ASN 74.A O no hydrogen 3.234 N/A PHE 78.A N MET 75.A O no hydrogen 2.897 N/A GLY 79.A N ARG 76.A O no hydrogen 2.856 N/A ILE 80.A N MET 75.A O no hydrogen 3.452 N/A ASP 81.A N LYS 332.A O no hydrogen 2.605 N/A TRP 83.A N VAL 330.A O no hydrogen 2.911 N/A GLN 84.A N SER 20.A O no hydrogen 2.962 N/A GLN 84.A NE2 ASP 12.A OD2 no hydrogen 3.277 N/A MET 85.A N VAL 328.A O no hydrogen 2.998 N/A GLU 86.A N PRO 18.A O no hydrogen 3.089 N/A GLY 87.A N GLN 303.A OE1 no hydrogen 2.667 N/A ALA 88.A N ASN 93.A O no hydrogen 2.905 N/A TYR 91.A N ASP 89.A OD2 no hydrogen 2.835 N/A GLY 92.A N GLU 86.A O no hydrogen 2.717 N/A ASN 93.A N ASP 89.A OD2 no hydrogen 3.445 N/A ASN 93.A ND2 GLN 9.A O no hydrogen 2.968 N/A ASN 93.A ND2 ASP 89.A OD1 no hydrogen 2.662 N/A ASN 93.A ND2 ASP 89.A OD2 no hydrogen 3.545 N/A VAL 94.A N GLY 326.A O no hydrogen 2.773 N/A GLN 95.A NE2 ASN 323.A OD1 no hydrogen 2.685 N/A PHE 96.A N HIS 324.A O no hydrogen 2.777 N/A THR 97.A N PHE 305.A O no hydrogen 2.983 N/A THR 97.A OG1 HIS 304.A NE2 no hydrogen 2.883 N/A THR 97.A OG1 PHE 305.A O no hydrogen 3.529 N/A TYR 99.A N ILE 307.A O no hydrogen 3.021 N/A TYR 99.A OH ASP 295.A OD2 no hydrogen 2.690 N/A THR 101.A N GLY 310.A O no hydrogen 2.748 N/A THR 101.A OG1 TYR 308.A OH no hydrogen 2.664 N/A ILE 104.A N TYR 164.A O no hydrogen 2.867 N/A GLN 105.A NE2 ASP 166.A OD1 no hydrogen 2.962 N/A ALA 106.A N ASP 166.A O no hydrogen 3.105 N/A ARG 107.A N TYR 147.A O no hydrogen 2.994 N/A ARG 107.A NH1 GLN 105.A OE1 no hydrogen 3.268 N/A ARG 107.A NH1 ALA 106.A O no hydrogen 2.856 N/A ARG 110.A NH1 GLN 115.A OE1 no hydrogen 3.442 N/A GLN 111.A N PHE 114.A O no hydrogen 3.209 N/A GLN 111.A NE2 THR 109.A O no hydrogen 3.388 N/A GLN 111.A NE2 THR 109.A OG1 no hydrogen 2.748 N/A PHE 114.A N GLN 111.A O no hydrogen 2.692 N/A GLN 115.A N GLU 113.A O no hydrogen 3.073 N/A GLN 115.A NE2 GLY 112.A O no hydrogen 2.760 N/A TYR 116.A N SER 148.A O no hydrogen 3.163 N/A ILE 118.A N ALA 146.A O no hydrogen 2.960 N/A ARG 120.A N TYR 143.A O no hydrogen 2.904 N/A ARG 120.A NE LYS 142.A O no hydrogen 3.391 N/A ARG 120.A NH1 LYS 142.A O no hydrogen 3.087 N/A ARG 127.A N PRO 123.A O no hydrogen 3.145 N/A ARG 127.A NH1 PRO 122.A O no hydrogen 2.879 N/A LEU 128.A N ARG 125.A O no hydrogen 3.442 N/A SER 129.A N GLY 126.A O no hydrogen 3.305 N/A SER 129.A OG GLY 126.A O no hydrogen 3.435 N/A SER 130.A N GLU 133.A OE1 no hydrogen 2.650 N/A ARG 131.A N PRO 229.A O no hydrogen 2.920 N/A ARG 131.A NE ASN 228.A O no hydrogen 3.162 N/A ARG 131.A NE SER 230.A O no hydrogen 2.794 N/A ARG 131.A NH1 TYR 135.A OH no hydrogen 2.872 N/A ARG 131.A NH2 ASP 158.A OD2 no hydrogen 3.130 N/A ARG 131.A NH2 SER 230.A O no hydrogen 3.105 N/A GLU 133.A N SER 130.A OG no hydrogen 3.319 N/A ILE 134.A N SER 130.A O no hydrogen 2.900 N/A TYR 135.A N ARG 131.A O no hydrogen 2.845 N/A ALA 136.A N ALA 132.A O no hydrogen 3.089 N/A ALA 136.A N GLU 133.A O no hydrogen 3.054 N/A GLY 137.A N ILE 134.A O no hydrogen 2.989 N/A ALA 138.A N GLU 133.A O no hydrogen 2.987 N/A LYS 142.A N SER 140.A OG no hydrogen 3.284 N/A TYR 143.A N SER 140.A O no hydrogen 3.382 N/A ILE 144.A N ASP 141.A O no hydrogen 3.082 N/A LEU 145.A N ILE 118.A O no hydrogen 2.609 N/A TYR 147.A N ARG 107.A O no hydrogen 2.923 N/A SER 148.A N TYR 116.A O no hydrogen 2.800 N/A SER 148.A OG TYR 116.A O no hydrogen 3.541 N/A SER 148.A OG SER 150.A O no hydrogen 2.938 N/A SER 148.A OG ASN 154.A OD1 no hydrogen 2.675 N/A SER 150.A N SER 148.A OG no hydrogen 3.025 N/A ASP 153.A N SER 150.A OG no hydrogen 3.174 N/A ASN 154.A N SER 150.A O no hydrogen 3.334 N/A ASN 154.A ND2 TYR 116.A O no hydrogen 3.198 N/A PHE 155.A N LEU 151.A O no hydrogen 3.214 N/A ILE 156.A N MET 152.A O no hydrogen 2.988 N/A MET 157.A N ASP 153.A O no hydrogen 3.031 N/A ASP 158.A N ASN 154.A O no hydrogen 2.893 N/A VAL 159.A N PHE 155.A O no hydrogen 3.061 N/A GLN 160.A N ILE 156.A O no hydrogen 3.084 N/A GLY 161.A N MET 157.A O no hydrogen 2.842 N/A GLY 163.A N PHE 176.A O no hydrogen 2.919 N/A TYR 164.A OH ALA 240.A O no hydrogen 3.001 N/A ILE 165.A N ASN 174.A O no hydrogen 2.663 N/A ASP 166.A N ILE 104.A O no hydrogen 2.845 N/A GLY 168.A N ASP 166.A OD2 no hydrogen 2.728 N/A SER 171.A N ASP 169.A OD2 no hydrogen 2.917 N/A SER 171.A OG ASP 169.A OD2 no hydrogen 2.672 N/A ASN 174.A N ILE 165.A O no hydrogen 2.867 N/A PHE 176.A N GLY 163.A O no hydrogen 2.972 N/A SER 177.A N LYS 235.A O no hydrogen 3.055 N/A ALA 179.A N PHE 233.A O no hydrogen 2.902 N/A GLY 180.A N PHE 233.A O no hydrogen 3.252 N/A LYS 181.A NZ ASN 182.A O no hydrogen 3.108 N/A LYS 181.A NZ ASN 182.A OD1 no hydrogen 3.192 N/A LYS 181.A NZ HIS 184.A O no hydrogen 2.599 N/A LYS 181.A NZ SER 230.A OG no hydrogen 2.888 N/A ASN 182.A N PHE 231.A O no hydrogen 2.858 N/A ASN 182.A ND2 SER 129.A O no hydrogen 2.930 N/A ASN 182.A ND2 PRO 229.A O no hydrogen 3.097 N/A GLY 183.A N ARG 127.A O no hydrogen 2.611 N/A HIS 184.A N ASN 182.A OD1 no hydrogen 3.289 N/A HIS 184.A NE2 LEU 128.A O no hydrogen 2.773 N/A ARG 187.A N ASN 228.A OD1 no hydrogen 2.830 N/A LYS 191.A N SER 188.A OG no hydrogen 2.957 N/A LYS 191.A NZ ASP 195.A OD2 no hydrogen 3.303 N/A VAL 192.A N SER 188.A O no hydrogen 3.297 N/A LEU 193.A N ILE 189.A O no hydrogen 3.110 N/A ILE 194.A N GLY 190.A O no hydrogen 3.075 N/A ASP 195.A N LYS 191.A O no hydrogen 2.819 N/A ARG 196.A N VAL 192.A O no hydrogen 2.901 N/A ARG 196.A NH1 GLU 223.A OE1 no hydrogen 3.133 N/A ARG 196.A NH2 GLU 223.A OE1 no hydrogen 3.128 N/A GLY 197.A N ILE 194.A O no hydrogen 2.914 N/A GLU 198.A N LEU 193.A O no hydrogen 2.850 N/A VAL 199.A N LEU 193.A O no hydrogen 3.369 N/A ASP 203.A N LYS 200.A O no hydrogen 3.096 N/A MET 204.A N LYS 201.A O no hydrogen 3.099 N/A GLN 207.A NE2 GLY 320.A O no hydrogen 3.161 N/A ALA 208.A N SER 205.A OG no hydrogen 3.191 N/A ILE 209.A N SER 205.A O no hydrogen 3.029 N/A ARG 210.A N MET 206.A O no hydrogen 2.802 N/A HIS 211.A N GLN 207.A O no hydrogen 2.860 N/A TRP 212.A N ALA 208.A O no hydrogen 3.050 N/A GLY 213.A N ILE 209.A O no hydrogen 3.108 N/A GLU 214.A N HIS 211.A O no hydrogen 2.951 N/A THR 215.A N HIS 211.A O no hydrogen 3.061 N/A THR 215.A N TRP 212.A O no hydrogen 3.327 N/A THR 215.A OG1 HIS 211.A O no hydrogen 3.116 N/A THR 215.A OG1 TRP 212.A O no hydrogen 3.215 N/A THR 215.A OG1 HIS 216.A ND1 no hydrogen 3.128 N/A HIS 216.A ND1 TRP 212.A O no hydrogen 2.658 N/A SER 217.A N GLU 220.A OE2 no hydrogen 2.971 N/A GLU 220.A N SER 217.A OG no hydrogen 3.260 N/A VAL 221.A N SER 217.A O no hydrogen 2.898 N/A ARG 222.A N GLU 218.A O no hydrogen 2.894 N/A ARG 222.A NE GLU 226.A OE2 no hydrogen 3.343 N/A GLU 223.A N ALA 219.A O no hydrogen 2.956 N/A LEU 224.A N GLU 220.A O no hydrogen 2.998 N/A LEU 225.A N VAL 221.A O no hydrogen 2.801 N/A GLU 226.A N ARG 222.A O no hydrogen 3.052 N/A GLN 227.A N LEU 224.A O no hydrogen 2.932 N/A GLN 227.A NE2 GLU 223.A O no hydrogen 3.343 N/A ASN 228.A N LEU 225.A O no hydrogen 3.410 N/A SER 230.A N ASN 228.A OD1 no hydrogen 3.356 N/A SER 230.A OG HIS 184.A O no hydrogen 3.363 N/A PHE 231.A N ASN 182.A OD1 no hydrogen 2.926 N/A PHE 233.A N GLY 180.A O no hydrogen 2.881 N/A PHE 234.A N TYR 119.A O no hydrogen 2.851 N/A LYS 235.A N SER 177.A O no hydrogen 3.060 N/A GLN 237.A N PHE 175.A O no hydrogen 3.103 N/A GLY 244.A N VAL 248.A O no hydrogen 3.277 N/A ALA 245.A N ASP 295.A OD1 no hydrogen 2.779 N/A SER 246.A N LEU 294.A O no hydrogen 3.426 N/A SER 246.A OG LEU 294.A O no hydrogen 2.689 N/A ALA 247.A N GLY 244.A O no hydrogen 2.777 N/A LEU 250.A N VAL 242.A O no hydrogen 3.051 N/A VAL 251.A N GLN 40.A OE1 no hydrogen 2.829 N/A ARG 253.A N TYR 308.A O no hydrogen 2.727 N/A ALA 254.A N VAL 251.A O no hydrogen 3.019 N/A SER 255.A OG VAL 251.A O no hydrogen 3.062 N/A VAL 256.A N VAL 292.A O no hydrogen 2.966 N/A ALA 257.A N ALA 306.A O no hydrogen 2.821 N/A SER 258.A N ASP 295.A O no hydrogen 2.875 N/A SER 258.A OG ILE 263.A O no hydrogen 2.687 N/A SER 261.A N ASP 259.A OD2 no hydrogen 3.138 N/A SER 261.A OG ASP 259.A OD2 no hydrogen 3.012 N/A ILE 262.A N ASP 259.A O no hydrogen 2.954 N/A ILE 263.A N ASP 259.A O no hydrogen 2.710 N/A GLY 266.A N ALA 293.A O no hydrogen 2.736 N/A THR 267.A N PRO 264.A O no hydrogen 3.129 N/A THR 267.A OG1 PRO 264.A O no hydrogen 2.576 N/A LEU 269.A N MET 291.A O no hydrogen 2.722 N/A LEU 270.A N TRP 329.A O no hydrogen 2.960 N/A ALA 271.A N ARG 289.A O no hydrogen 2.842 N/A GLU 272.A N ARG 327.A O no hydrogen 2.850 N/A VAL 273.A N GLU 287.A O no hydrogen 2.878 N/A LEU 275.A N GLN 285.A O no hydrogen 2.868 N/A ASP 277.A N LYS 281.A O no hydrogen 2.757 N/A ASN 279.A N ASP 277.A OD2 no hydrogen 2.799 N/A GLY 280.A N ASP 277.A O no hydrogen 2.809 N/A LYS 281.A N ASP 277.A OD2 no hydrogen 2.796 N/A ASN 283.A N LEU 275.A O no hydrogen 3.037 N/A GLN 285.A N ASN 283.A OD1 no hydrogen 2.846 N/A TYR 286.A OH GLY 7.A O no hydrogen 2.603 N/A GLU 287.A N VAL 273.A O no hydrogen 2.872 N/A ARG 289.A N ALA 271.A O no hydrogen 2.951 N/A ARG 289.A NE GLU 287.A OE1 no hydrogen 3.031 N/A ARG 289.A NH1 GLU 287.A OE1 no hydrogen 2.935 N/A LEU 290.A N ASN 33.A OD1 no hydrogen 3.112 N/A MET 291.A N LEU 269.A O no hydrogen 2.804 N/A VAL 292.A N ALA 254.A O no hydrogen 3.046 N/A ALA 293.A N THR 267.A O no hydrogen 3.138 N/A LEU 294.A N VAL 256.A O no hydrogen 2.987 N/A ILE 300.A N GLY 297.A O no hydrogen 3.137 N/A GLY 302.A N ASP 259.A OD1 no hydrogen 3.009 N/A GLN 303.A NE2 PRO 18.A O no hydrogen 3.222 N/A HIS 304.A N LYS 301.A O no hydrogen 3.312 N/A HIS 304.A NE2 THR 97.A OG1 no hydrogen 2.883 N/A PHE 305.A N GLN 95.A O no hydrogen 2.920 N/A ALA 306.A N ALA 257.A O no hydrogen 3.216 N/A ILE 307.A N THR 97.A O no hydrogen 2.847 N/A TYR 308.A N SER 255.A O no hydrogen 3.198 N/A TYR 308.A OH THR 101.A OG1 no hydrogen 2.664 N/A GLN 309.A N TYR 99.A O no hydrogen 2.791 N/A GLY 312.A N THR 101.A O no hydrogen 2.934 N/A GLY 316.A N GLY 312.A O no hydrogen 3.138 N/A HIS 317.A N PRO 313.A O no hydrogen 2.996 N/A ARG 318.A N GLU 314.A O no hydrogen 3.196 N/A ARG 318.A NE GLN 309.A OE1 no hydrogen 2.769 N/A ARG 318.A NH2 GLN 309.A O no hydrogen 2.921 N/A ALA 319.A N ALA 315.A O no hydrogen 3.024 N/A ALA 319.A N GLY 316.A O no hydrogen 3.121 N/A ASN 323.A ND2 GLU 202.A O no hydrogen 3.278 N/A HIS 324.A N PHE 96.A O no hydrogen 3.148 N/A TYR 325.A N ARG 6.A O no hydrogen 2.976 N/A GLY 326.A N VAL 94.A O no hydrogen 3.123 N/A ARG 327.A N GLU 272.A O no hydrogen 3.232 N/A TRP 329.A N LEU 270.A O no hydrogen 2.768 N/A VAL 330.A N TRP 83.A O no hydrogen 2.840 N/A LEU 331.A N THR 268.A O no hydrogen 2.971 N/A LYS 332.A N ASP 81.A O no hydrogen 3.045 N/A