Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2p76_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TRP 2.A NE1 ASP 226.A OD1 no hydrogen 3.032 N/A ASN 5.A ND2 GLU 9.A O no hydrogen 2.807 N/A ASN 5.A ND2 ASP 251.A O no hydrogen 2.829 N/A THR 7.A OG1 GLU 9.A OE1 no hydrogen 2.855 N/A ASN 8.A N ASN 5.A O no hydrogen 3.064 N/A ARG 10.A NH1 ARG 10.A O no hydrogen 2.545 N/A ARG 10.A NH1 VAL 250.A O no hydrogen 3.255 N/A THR 12.A N ASP 251.A O no hydrogen 2.824 N/A THR 12.A OG1 GLU 9.A OE1 no hydrogen 2.813 N/A THR 13.A N SER 41.A OG no hydrogen 2.876 N/A ILE 14.A N VAL 253.A O no hydrogen 2.961 N/A ALA 15.A N TYR 42.A O no hydrogen 3.227 N/A HIS 16.A N THR 255.A O no hydrogen 2.971 N/A HIS 16.A ND1 ASN 256.A OD1 no hydrogen 2.923 N/A ARG 17.A N GLU 44.A OE1 no hydrogen 2.903 N/A ARG 17.A NH1 GLU 25.A OE1 no hydrogen 2.694 N/A ARG 17.A NH1 GLU 25.A OE2 no hydrogen 3.423 N/A GLY 18.A N ALA 15.A O no hydrogen 2.697 N/A ALA 19.A N ALA 30.A O no hydrogen 2.712 N/A SER 20.A OG ASN 256.A OD1 no hydrogen 3.089 N/A GLY 21.A N ASN 256.A O no hydrogen 2.892 N/A TYR 22.A N ALA 19.A O no hydrogen 2.874 N/A TYR 22.A OH ASP 259.A OD1 no hydrogen 2.906 N/A TYR 22.A OH ASP 259.A OD2 no hydrogen 2.880 N/A ALA 23.A N ALA 19.A O no hydrogen 2.912 N/A HIS 26.A N ARG 17.A O no hydrogen 3.056 N/A HIS 26.A ND1 TYR 31.A OH no hydrogen 2.586 N/A HIS 26.A NE2 ASP 46.A OD2 no hydrogen 2.954 N/A THR 27.A OG1 PRO 24.A O no hydrogen 2.576 N/A GLN 29.A N GLN 29.A OE1 no hydrogen 2.481 N/A ALA 30.A N THR 27.A OG1 no hydrogen 3.145 N/A TYR 31.A N THR 27.A O no hydrogen 2.861 N/A TYR 31.A OH HIS 26.A ND1 no hydrogen 2.586 N/A ASP 32.A N PHE 28.A O no hydrogen 2.566 N/A LYS 33.A N GLN 29.A O no hydrogen 2.909 N/A SER 34.A N ALA 30.A O no hydrogen 3.189 N/A SER 34.A OG ALA 30.A O no hydrogen 3.168 N/A SER 34.A OG TYR 31.A O no hydrogen 3.315 N/A HIS 35.A N TYR 31.A O no hydrogen 2.911 N/A ASN 36.A N ASP 32.A O no hydrogen 2.817 N/A LEU 38.A N LYS 33.A O no hydrogen 2.866 N/A LYS 39.A NZ ASN 36.A O no hydrogen 3.313 N/A ALA 40.A N SER 34.A O no hydrogen 2.797 N/A SER 41.A OG GLU 9.A OE1 no hydrogen 2.926 N/A SER 41.A OG GLU 9.A OE2 no hydrogen 2.795 N/A TYR 42.A N THR 13.A O no hydrogen 3.184 N/A TYR 42.A OH GLY 158.A O no hydrogen 2.687 N/A ILE 43.A N ASN 122.A O no hydrogen 2.854 N/A ILE 45.A N TYR 124.A O no hydrogen 2.793 N/A LEU 47.A N GLU 126.A O no hydrogen 3.323 N/A GLN 48.A N VAL 56.A O no hydrogen 2.893 N/A GLN 48.A NE2 MET 58.A O no hydrogen 3.465 N/A ARG 49.A NH1 PRO 134.A O no hydrogen 3.194 N/A ARG 49.A NH1 GLN 139.A OE1 no hydrogen 2.582 N/A ARG 49.A NH2 PRO 134.A O no hydrogen 3.055 N/A THR 50.A N HIS 54.A O no hydrogen 2.965 N/A THR 50.A OG1 ASP 52.A OD1 no hydrogen 2.686 N/A LYS 51.A N TYR 76.A O no hydrogen 2.657 N/A ASP 52.A N ASP 52.A OD1 no hydrogen 2.469 N/A GLY 53.A N THR 50.A O no hydrogen 2.818 N/A HIS 54.A N THR 50.A OG1 no hydrogen 2.840 N/A VAL 56.A N GLN 48.A O no hydrogen 2.820 N/A ALA 57.A N PRO 108.A O no hydrogen 2.876 N/A MET 58.A N ASP 46.A O no hydrogen 2.776 N/A HIS 59.A ND1 ASP 46.A OD2 no hydrogen 3.119 N/A VAL 63.A N GLY 71.A O no hydrogen 2.998 N/A ARG 65.A NE ASP 60.A OD2 no hydrogen 2.720 N/A ARG 65.A NH1 GLU 25.A OE1 no hydrogen 3.002 N/A ARG 65.A NH2 GLU 25.A OE1 no hydrogen 3.472 N/A ARG 65.A NH2 GLU 25.A OE2 no hydrogen 2.985 N/A ARG 65.A NH2 ASP 60.A OD1 no hydrogen 3.466 N/A ARG 65.A NH2 ASP 60.A OD2 no hydrogen 3.514 N/A THR 67.A OG1 VAL 63.A O no hydrogen 2.738 N/A THR 67.A OG1 GLY 69.A O no hydrogen 3.507 N/A ASN 68.A N ASN 68.A OD1 no hydrogen 2.621 N/A GLY 69.A N THR 67.A OG1 no hydrogen 2.943 N/A GLY 71.A N ASN 64.A OD1 no hydrogen 2.866 N/A VAL 73.A N GLU 61.A O no hydrogen 2.686 N/A ASP 75.A N LYS 72.A O no hydrogen 2.735 N/A TYR 76.A N VAL 73.A O no hydrogen 3.045 N/A TYR 76.A OH HIS 70.A O no hydrogen 2.632 N/A THR 77.A N GLU 80.A OE1 no hydrogen 2.828 N/A LEU 78.A N ASP 52.A OD1 no hydrogen 2.937 N/A GLU 80.A N THR 77.A OG1 no hydrogen 3.153 N/A LEU 81.A N THR 77.A O no hydrogen 2.814 N/A LYS 82.A N LEU 78.A O no hydrogen 2.905 N/A LYS 82.A NZ VAL 107.A O no hydrogen 2.708 N/A LYS 82.A NZ GLU 112.A OE1 no hydrogen 2.770 N/A LYS 82.A NZ GLU 112.A OE2 no hydrogen 3.174 N/A GLN 83.A N GLU 80.A O no hydrogen 2.817 N/A LEU 84.A N LEU 81.A O no hydrogen 3.161 N/A ASP 85.A N ASN 68.A OD1 no hydrogen 2.448 N/A ALA 86.A N ALA 105.A O no hydrogen 2.718 N/A GLY 87.A N ASP 85.A OD1 no hydrogen 2.912 N/A SER 88.A N ASP 85.A OD1 no hydrogen 2.727 N/A SER 88.A OG ASP 85.A OD1 no hydrogen 3.104 N/A SER 88.A OG ASP 85.A OD2 no hydrogen 2.703 N/A TRP 89.A NE1 ALA 86.A O no hydrogen 2.942 N/A PHE 90.A N GLY 87.A O no hydrogen 2.784 N/A ASN 91.A ND2 ARG 99.A O no hydrogen 3.129 N/A LYS 92.A N SER 88.A O no hydrogen 3.178 N/A LYS 93.A N TRP 89.A O no hydrogen 3.072 N/A TYR 94.A N PHE 90.A O no hydrogen 2.850 N/A TYR 97.A N TYR 94.A O no hydrogen 2.800 N/A ALA 98.A N PRO 95.A O no hydrogen 3.405 N/A ARG 99.A N ASN 91.A OD1 no hydrogen 2.724 N/A ARG 99.A NE ALA 98.A O no hydrogen 3.626 N/A TYR 102.A N ARG 99.A O no hydrogen 3.000 N/A TYR 102.A OH TYR 22.A O no hydrogen 2.589 N/A LYS 103.A N ALA 100.A O no hydrogen 3.105 N/A LYS 103.A NZ SER 88.A OG no hydrogen 3.138 N/A ASN 104.A N ASP 85.A OD1 no hydrogen 3.344 N/A ASN 104.A N ASP 85.A OD2 no hydrogen 2.973 N/A ALA 105.A N TYR 102.A O no hydrogen 3.235 N/A LYS 106.A NZ LYS 82.A O no hydrogen 3.482 N/A LYS 106.A NZ LEU 84.A O no hydrogen 3.148 N/A LYS 106.A NZ ASN 104.A OD1 no hydrogen 3.102 N/A THR 109.A N GLU 112.A OE1 no hydrogen 2.768 N/A LEU 110.A N LEU 55.A O no hydrogen 2.889 N/A GLU 112.A N THR 109.A OG1 no hydrogen 2.954 N/A ILE 113.A N THR 109.A O no hydrogen 3.055 N/A LEU 114.A N LEU 110.A O no hydrogen 2.990 N/A GLU 115.A N ASP 111.A O no hydrogen 2.777 N/A ARG 116.A N GLU 112.A O no hydrogen 2.747 N/A ARG 116.A NE ASP 32.A OD1 no hydrogen 3.059 N/A ARG 116.A NH2 ASP 32.A OD1 no hydrogen 3.404 N/A ARG 116.A NH2 ASP 32.A OD2 no hydrogen 2.783 N/A TYR 117.A N ILE 113.A O no hydrogen 3.053 N/A TYR 117.A OH ASP 32.A OD1 no hydrogen 2.818 N/A GLY 118.A N LEU 114.A O no hydrogen 3.030 N/A ALA 121.A N GLY 118.A O no hydrogen 3.361 N/A ASN 122.A ND2 SER 41.A O no hydrogen 3.173 N/A TYR 123.A N HIS 159.A O no hydrogen 2.923 N/A TYR 123.A OH GLY 118.A O no hydrogen 2.668 N/A TYR 124.A N ILE 43.A O no hydrogen 3.028 N/A TYR 124.A OH HIS 232.A ND1 no hydrogen 2.779 N/A ILE 125.A N MET 161.A O no hydrogen 2.976 N/A GLU 126.A N ILE 45.A O no hydrogen 2.936 N/A THR 127.A N GLN 163.A O no hydrogen 3.061 N/A THR 127.A OG1 SER 169.A OG no hydrogen 2.777 N/A VAL 132.A N SER 129.A O no hydrogen 2.779 N/A TYR 133.A N SER 129.A O no hydrogen 3.476 N/A TYR 133.A OH GLN 48.A OE1 no hydrogen 2.570 N/A MET 136.A N TYR 133.A O no hydrogen 2.886 N/A GLU 137.A N GLU 137.A OE1 no hydrogen 2.661 N/A GLN 139.A N GLY 135.A O no hydrogen 2.847 N/A GLN 139.A NE2 GLY 53.A O no hydrogen 3.136 N/A LEU 140.A N MET 136.A O no hydrogen 2.750 N/A LEU 141.A N GLU 137.A O no hydrogen 3.020 N/A ALA 142.A N GLU 138.A O no hydrogen 3.057 N/A SER 143.A N GLN 139.A O no hydrogen 2.853 N/A LEU 144.A N LEU 140.A O no hydrogen 2.801 N/A LYS 145.A N LEU 141.A O no hydrogen 2.887 N/A LYS 146.A N ALA 142.A O no hydrogen 2.892 N/A LYS 146.A NZ ASP 111.A OD1 no hydrogen 3.203 N/A LYS 146.A NZ ASP 111.A OD2 no hydrogen 3.278 N/A HIS 147.A N SER 143.A O no hydrogen 3.124 N/A HIS 147.A NE2 ASP 111.A OD1 no hydrogen 2.819 N/A HIS 148.A N LYS 145.A O no hydrogen 2.910 N/A LEU 149.A N LEU 144.A O no hydrogen 2.995 N/A ASN 152.A ND2 HIS 179.A ND1 no hydrogen 3.377 N/A ASN 153.A N ASN 151.A OD1 no hydrogen 2.967 N/A LYS 154.A NZ PRO 119.A O no hydrogen 3.102 N/A LEU 155.A N ASN 151.A O no hydrogen 2.993 N/A LYS 156.A N ASN 152.A O no hydrogen 3.072 N/A ASN 157.A N LYS 154.A O no hydrogen 3.321 N/A GLY 158.A N LEU 155.A O no hydrogen 3.440 N/A HIS 159.A N LYS 154.A O no hydrogen 3.179 N/A HIS 159.A ND1 ALA 121.A O no hydrogen 2.859 N/A MET 161.A N TYR 123.A O no hydrogen 3.009 N/A ILE 162.A N PRO 181.A O no hydrogen 3.091 N/A GLN 163.A N ILE 125.A O no hydrogen 2.709 N/A GLN 163.A NE2 GLU 44.A OE2 no hydrogen 2.981 N/A GLN 163.A NE2 TYR 124.A O no hydrogen 3.319 N/A SER 164.A N VAL 183.A O no hydrogen 3.039 N/A SER 164.A OG THR 127.A O no hydrogen 2.785 N/A SER 164.A OG THR 127.A OG1 no hydrogen 3.116 N/A SER 166.A N SER 164.A OG no hydrogen 3.111 N/A SER 169.A N SER 166.A OG no hydrogen 2.989 N/A SER 169.A OG THR 127.A OG1 no hydrogen 2.777 N/A SER 169.A OG LYS 128.A O no hydrogen 3.493 N/A SER 169.A OG GLU 137.A OE2 no hydrogen 2.532 N/A LEU 170.A N SER 166.A O no hydrogen 3.103 N/A LYS 171.A N ASP 167.A O no hydrogen 2.782 N/A LYS 172.A N GLU 168.A O no hydrogen 2.931 N/A ILE 173.A N SER 169.A O no hydrogen 3.132 N/A HIS 174.A N LEU 170.A O no hydrogen 2.791 N/A ARG 175.A N LYS 171.A O no hydrogen 3.025 N/A GLN 176.A N LYS 172.A O no hydrogen 3.082 N/A GLN 176.A NE2 GLU 138.A OE2 no hydrogen 3.408 N/A ASN 177.A N ILE 173.A O no hydrogen 2.749 N/A HIS 179.A N ASN 177.A OD1 no hydrogen 2.973 N/A VAL 180.A N ASN 177.A O no hydrogen 3.438 N/A VAL 183.A N ILE 162.A O no hydrogen 2.783 N/A LYS 184.A N GLY 208.A O no hydrogen 2.981 N/A LYS 184.A NZ PHE 165.A O no hydrogen 2.836 N/A LYS 184.A NZ ASP 167.A OD1 no hydrogen 3.457 N/A LYS 184.A NZ ASP 167.A OD2 no hydrogen 2.958 N/A LEU 185.A N SER 164.A O no hydrogen 2.755 N/A VAL 186.A N GLY 210.A O no hydrogen 2.927 N/A ASP 187.A N GLU 190.A OE1 no hydrogen 2.775 N/A LYS 188.A N ASP 187.A OD1 no hydrogen 2.679 N/A LYS 188.A NZ THR 214.A OG1 no hydrogen 2.610 N/A LYS 188.A NZ ASP 215.A OD1 no hydrogen 2.760 N/A GLY 189.A N ASP 215.A OD2 no hydrogen 2.765 N/A GLU 190.A N ASP 187.A O no hydrogen 3.119 N/A ARG 198.A N ASN 195.A OD1 no hydrogen 2.784 N/A ARG 198.A NH1 GLU 201.A OE1 no hydrogen 3.266 N/A ARG 198.A NH2 ASP 167.A OD1 no hydrogen 3.212 N/A ARG 198.A NH2 ASP 167.A OD2 no hydrogen 3.011 N/A LEU 199.A N ASN 195.A O no hydrogen 3.093 N/A LYS 200.A N ASP 196.A O no hydrogen 2.680 N/A GLU 201.A N GLN 197.A O no hydrogen 3.044 N/A ILE 202.A N ARG 198.A O no hydrogen 2.906 N/A ARG 203.A N LEU 199.A O no hydrogen 2.789 N/A ARG 203.A NE GLY 228.A O no hydrogen 3.255 N/A ARG 203.A NH1 ARG 203.A O no hydrogen 2.508 N/A SER 204.A N GLU 201.A O no hydrogen 2.771 N/A SER 204.A OG GLU 201.A O no hydrogen 2.285 N/A TYR 205.A N ILE 202.A O no hydrogen 3.167 N/A TYR 205.A OH ASP 167.A OD1 no hydrogen 2.375 N/A ALA 206.A N ILE 202.A O no hydrogen 2.937 N/A GLY 208.A N LEU 182.A O no hydrogen 3.125 N/A LEU 209.A N ILE 230.A O no hydrogen 2.902 N/A GLY 210.A N LYS 184.A O no hydrogen 2.741 N/A THR 214.A N ASP 212.A OD1 no hydrogen 2.807 N/A THR 214.A OG1 ASP 212.A OD1 no hydrogen 2.808 N/A ASP 215.A N ASP 212.A O no hydrogen 3.033 N/A LEU 216.A N TYR 213.A O no hydrogen 3.153 N/A THR 217.A N ASN 220.A OD1 no hydrogen 2.909 N/A THR 217.A OG1 GLN 219.A OE1 no hydrogen 2.680 N/A ASN 220.A ND2 ASP 215.A O no hydrogen 2.982 N/A THR 221.A N THR 217.A O no hydrogen 3.054 N/A THR 221.A OG1 THR 217.A O no hydrogen 2.858 N/A THR 221.A OG1 ASN 220.A OD1 no hydrogen 3.251 N/A HIS 222.A N GLU 218.A O no hydrogen 3.096 N/A HIS 222.A ND1 GLU 218.A O no hydrogen 2.548 N/A HIS 223.A N GLN 219.A O no hydrogen 2.845 N/A HIS 223.A NE2 ASP 196.A OD2 no hydrogen 2.966 N/A LEU 224.A N ASN 220.A O no hydrogen 2.759 N/A LYS 225.A N THR 221.A O no hydrogen 2.966 N/A LYS 225.A NZ HIS 3.A O no hydrogen 2.567 N/A LYS 225.A NZ PHE 229.A O no hydrogen 2.963 N/A LYS 225.A NZ ASP 251.A OD1 no hydrogen 3.203 N/A LYS 225.A NZ ASP 251.A OD2 no hydrogen 3.027 N/A ASP 226.A N HIS 222.A O no hydrogen 2.781 N/A LEU 227.A N HIS 223.A O no hydrogen 2.933 N/A GLY 228.A N LYS 225.A O no hydrogen 3.139 N/A PHE 229.A N LEU 224.A O no hydrogen 3.212 N/A ILE 230.A N ILE 207.A O no hydrogen 3.149 N/A VAL 231.A N ASP 251.A OD2 no hydrogen 2.712 N/A HIS 232.A N LEU 209.A O no hydrogen 3.263 N/A HIS 232.A ND1 TYR 124.A OH no hydrogen 2.779 N/A HIS 232.A NE2 ASN 5.A OD1 no hydrogen 2.818 N/A TYR 234.A N PRO 211.A O no hydrogen 2.898 N/A TYR 234.A OH VAL 186.A O no hydrogen 2.742 N/A VAL 236.A N PHE 254.A O no hydrogen 3.003 N/A LYS 239.A NZ GLU 263.A OE2 no hydrogen 2.798 N/A MET 242.A N GLU 238.A O no hydrogen 2.945 N/A LEU 243.A N LYS 239.A O no hydrogen 2.923 N/A ARG 244.A N ALA 240.A O no hydrogen 2.977 N/A ARG 244.A NE TYR 248.A OH no hydrogen 2.918 N/A ARG 244.A NH2 ASP 241.A OD1 no hydrogen 2.581 N/A LEU 245.A N ASP 241.A O no hydrogen 2.823 N/A ASN 246.A N MET 242.A O no hydrogen 3.009 N/A ASN 246.A ND2 TYR 261.A OH no hydrogen 2.627 N/A LYS 247.A N LEU 243.A O no hydrogen 3.073 N/A TYR 248.A N ARG 244.A O no hydrogen 3.030 N/A GLY 249.A N LEU 245.A O no hydrogen 3.130 N/A ASP 251.A N VAL 231.A O no hydrogen 2.886 N/A VAL 253.A N THR 12.A O no hydrogen 3.383 N/A PHE 254.A N PRO 233.A O no hydrogen 3.258 N/A THR 255.A N ILE 14.A O no hydrogen 2.904 N/A THR 255.A OG1 VAL 236.A O no hydrogen 2.880 N/A THR 255.A OG1 ASN 237.A OD1 no hydrogen 3.091 N/A ASN 256.A N ASN 237.A OD1 no hydrogen 2.669 N/A PHE 257.A N THR 255.A OG1 no hydrogen 2.904 N/A LYS 260.A N ASP 259.A OD1 no hydrogen 2.545 N/A TYR 261.A N PHE 257.A O no hydrogen 3.371 N/A LYS 262.A N ALA 258.A O no hydrogen 2.887 N/A LYS 262.A NZ LYS 39.A O no hydrogen 3.226 N/A GLU 263.A N ASP 259.A O no hydrogen 2.832 N/A VAL 264.A N LYS 260.A O no hydrogen 3.032 N/A ILE 265.A N TYR 261.A O no hydrogen 3.010 N/A ILE 265.A N LYS 262.A O no hydrogen 3.238 N/A LYS 266.A N LYS 262.A O no hydrogen 2.979 N/A GLU 267.A N GLU 263.A O no hydrogen 3.134 N/A