Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2pm6_B.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): VAL 1.A N GLU 40.A OE2 no hydrogen 3.009 N/A HIS 12.A N CYS 26.A O no hydrogen 2.788 N/A HIS 12.A NE2 SER 28.A OG no hydrogen 3.186 N/A VAL 15.A N ALA 24.A O no hydrogen 2.905 N/A ASP 17.A N ARG 22.A O no hydrogen 3.156 N/A TYR 19.A N ASP 17.A OD1 no hydrogen 3.185 N/A GLY 20.A N ASP 17.A O no hydrogen 2.551 N/A LYS 21.A N ASP 17.A OD1 no hydrogen 3.530 N/A LYS 21.A NZ GLU 36.A OE1 no hydrogen 3.304 N/A LYS 21.A NZ GLU 38.A OE2 no hydrogen 2.950 N/A ARG 22.A N ASP 17.A OD1 no hydrogen 3.340 N/A ARG 22.A NE GLU 36.A OE2 no hydrogen 3.401 N/A LEU 23.A N PHE 35.A O no hydrogen 3.042 N/A THR 25.A N LYS 33.A O no hydrogen 2.983 N/A THR 25.A OG1 HIS 7.A NE2 no hydrogen 3.152 N/A CYS 26.A N ASP 13.A O no hydrogen 3.035 N/A CYS 26.A SG ASP 13.A O no hydrogen 3.945 N/A CYS 26.A SG VAL 55.A O no hydrogen 3.370 N/A SER 28.A N LEU 10.A O no hydrogen 3.196 N/A SER 28.A OG HIS 12.A NE2 no hydrogen 3.186 N/A LYS 30.A N SER 27.A O no hydrogen 3.105 N/A THR 31.A OG1 ASP 29.A OD1 no hydrogen 2.361 N/A ILE 32.A N LEU 48.A O no hydrogen 3.118 N/A LYS 33.A N THR 25.A O no hydrogen 3.026 N/A LYS 33.A NZ THR 47.A OG1 no hydrogen 2.586 N/A ILE 34.A N ASP 46.A O no hydrogen 3.301 N/A PHE 35.A N LEU 23.A O no hydrogen 3.107 N/A GLU 36.A N LYS 43.A O no hydrogen 3.282 N/A VAL 37.A N LYS 21.A O no hydrogen 3.459 N/A ILE 45.A N ILE 34.A O no hydrogen 2.767 N/A THR 47.A N ASP 46.A OD1 no hydrogen 2.837 N/A LEU 48.A N ILE 32.A O no hydrogen 2.658 N/A HIS 51.A NE2 SER 71.A OG no hydrogen 2.994 N/A VAL 55.A N SER 27.A O no hydrogen 3.105 N/A TRP 56.A N CYS 72.A O no hydrogen 3.014 N/A TRP 56.A NE1 SER 100.A OG no hydrogen 2.777 N/A ARG 57.A NE ASN 102.A O no hydrogen 3.210 N/A ARG 57.A NH1 ASP 196.A OD2 no hydrogen 3.530 N/A ARG 57.A NH2 ASP 196.A OD2 no hydrogen 2.782 N/A VAL 58.A N ASP 13.A OD2 no hydrogen 2.632 N/A ASP 59.A N ALA 70.A O no hydrogen 2.916 N/A TRP 60.A NE1 VAL 15.A O no hydrogen 2.581 N/A ALA 61.A N ILE 68.A O no hydrogen 3.284 N/A LYS 64.A N HIS 62.A ND1 no hydrogen 2.591 N/A LYS 64.A NZ HIS 109.A O no hydrogen 3.077 N/A PHE 65.A N HIS 62.A O no hydrogen 3.096 N/A GLY 66.A N PRO 63.A O no hydrogen 2.996 N/A LEU 69.A N TRP 81.A O no hydrogen 3.108 N/A ALA 70.A N ASP 59.A O no hydrogen 2.957 N/A SER 71.A N LEU 79.A O no hydrogen 2.974 N/A SER 71.A OG HIS 51.A NE2 no hydrogen 2.994 N/A SER 71.A OG LEU 79.A O no hydrogen 3.511 N/A CYS 72.A N ARG 57.A O no hydrogen 3.217 N/A CYS 72.A SG ARG 57.A O no hydrogen 3.843 N/A CYS 72.A SG VAL 101.A O no hydrogen 3.647 N/A SER 73.A N LYS 77.A O no hydrogen 3.392 N/A SER 73.A OG GLY 53.A O no hydrogen 2.728 N/A SER 73.A OG PRO 54.A O no hydrogen 2.352 N/A TYR 74.A N PRO 54.A O no hydrogen 3.139 N/A ASP 75.A N SER 73.A OG no hydrogen 3.289 N/A GLY 76.A N SER 73.A O no hydrogen 2.628 N/A VAL 78.A N HIS 94.A O no hydrogen 2.542 N/A LEU 79.A N SER 71.A O no hydrogen 2.988 N/A ILE 80.A N ALA 92.A O no hydrogen 3.435 N/A TRP 81.A N LEU 69.A O no hydrogen 2.760 N/A LYS 82.A N SER 89.A O no hydrogen 3.308 N/A LYS 82.A NZ GLU 84.A OE1 no hydrogen 3.271 N/A GLU 83.A N THR 67.A O no hydrogen 3.220 N/A SER 89.A N LYS 82.A O no hydrogen 2.865 N/A HIS 94.A N VAL 78.A O no hydrogen 2.683 N/A HIS 97.A NE2 SER 125.A OG no hydrogen 2.649 N/A SER 100.A OG VAL 101.A O no hydrogen 3.557 N/A SER 100.A OG ASN 102.A OD1 no hydrogen 3.280 N/A VAL 101.A N SER 73.A O no hydrogen 3.357 N/A ASN 102.A N ALA 118.A O no hydrogen 2.901 N/A ASN 102.A ND2 SER 120.A OG no hydrogen 3.268 N/A GLN 105.A N LEU 116.A O no hydrogen 2.943 N/A TRP 106.A N ASP 59.A OD2 no hydrogen 2.500 N/A ALA 107.A N LEU 114.A O no hydrogen 2.938 N/A GLU 110.A N GLU 110.A OE2 no hydrogen 2.780 N/A TYR 111.A N PRO 108.A O no hydrogen 2.873 N/A GLY 112.A N HIS 109.A O no hydrogen 3.310 N/A LEU 115.A N VAL 127.A O no hydrogen 2.819 N/A LEU 116.A N GLN 105.A O no hydrogen 2.627 N/A VAL 117.A N SER 125.A O no hydrogen 2.827 N/A ALA 118.A N SER 103.A O no hydrogen 3.281 N/A SER 119.A N LYS 123.A O no hydrogen 3.107 N/A SER 119.A OG ALA 99.A O no hydrogen 2.791 N/A SER 119.A OG SER 100.A O no hydrogen 2.682 N/A SER 119.A OG ASP 121.A OD1 no hydrogen 2.792 N/A SER 120.A N SER 100.A O no hydrogen 2.898 N/A ASP 121.A N SER 119.A OG no hydrogen 3.130 N/A GLY 122.A N SER 119.A O no hydrogen 2.715 N/A LYS 123.A N ASP 121.A OD1 no hydrogen 3.494 N/A VAL 124.A N ILE 140.A O no hydrogen 2.883 N/A SER 125.A N VAL 117.A O no hydrogen 2.734 N/A SER 125.A OG HIS 94.A NE2 no hydrogen 3.420 N/A SER 125.A OG HIS 97.A NE2 no hydrogen 2.649 N/A VAL 126.A N ILE 138.A O no hydrogen 2.903 N/A VAL 127.A N LEU 115.A O no hydrogen 3.035 N/A LYS 130.A N THR 134.A O no hydrogen 3.227 N/A THR 134.A N ASN 132.A OD1 no hydrogen 3.088 N/A THR 134.A OG1 ASN 132.A OD1 no hydrogen 2.780 N/A ILE 138.A N VAL 126.A O no hydrogen 2.967 N/A ILE 140.A N VAL 124.A O no hydrogen 2.936 N/A ALA 142.A N GLY 122.A O no hydrogen 3.033 N/A HIS 143.A N GLY 122.A O no hydrogen 3.225 N/A HIS 143.A ND1 ASP 166.A OD2 no hydrogen 3.087 N/A HIS 143.A NE2 THR 162.A OG1 no hydrogen 2.487 N/A ALA 144.A N ASP 166.A OD2 no hydrogen 3.416 N/A GLY 146.A N ALA 144.A O no hydrogen 2.499 N/A VAL 147.A N SER 119.A O no hydrogen 3.083 N/A ASN 148.A N GLY 163.A O no hydrogen 2.980 N/A SER 149.A OG ASP 196.A OD2 no hydrogen 2.727 N/A SER 149.A OG VAL 197.A O no hydrogen 3.482 N/A SER 151.A N VAL 161.A O no hydrogen 2.798 N/A SER 151.A OG VAL 197.A O no hydrogen 2.330 N/A TRP 152.A N GLN 105.A OE1 no hydrogen 3.105 N/A TRP 152.A NE1 GLN 105.A O no hydrogen 3.143 N/A ALA 153.A N LYS 159.A O no hydrogen 2.782 N/A THR 156.A OG1 SER 157.A O no hydrogen 3.309 N/A ARG 158.A NH2 TYR 111.A O no hydrogen 3.501 N/A LYS 159.A NZ GLU 184.A OE1 no hydrogen 2.784 N/A LYS 159.A NZ GLU 184.A OE2 no hydrogen 3.358 N/A PHE 160.A N TRP 172.A O no hydrogen 2.947 N/A VAL 161.A N SER 151.A O no hydrogen 2.755 N/A THR 162.A N LYS 170.A O no hydrogen 2.907 N/A THR 162.A OG1 HIS 143.A NE2 no hydrogen 2.487 N/A GLY 163.A N SER 149.A O no hydrogen 3.235 N/A GLY 164.A N LEU 168.A O no hydrogen 3.117 N/A ALA 165.A N GLY 146.A O no hydrogen 2.680 N/A LEU 168.A N ASP 166.A OD1 no hydrogen 3.262 N/A VAL 169.A N LEU 187.A O no hydrogen 3.247 N/A LYS 170.A N THR 162.A O no hydrogen 3.004 N/A LYS 170.A NZ ALA 142.A O no hydrogen 2.803 N/A LYS 170.A NZ HIS 143.A ND1 no hydrogen 3.308 N/A LYS 170.A NZ ASP 166.A OD2 no hydrogen 3.536 N/A ILE 171.A N SER 185.A O no hydrogen 3.041 N/A TRP 172.A N PHE 160.A O no hydrogen 2.780 N/A TRP 172.A NE1 THR 162.A OG1 no hydrogen 3.115 N/A LYS 173.A N VAL 182.A O no hydrogen 3.116 N/A TYR 174.A N ARG 158.A O no hydrogen 3.089 N/A ASN 175.A N THR 180.A O no hydrogen 2.898 N/A GLN 179.A N SER 176.A O no hydrogen 2.925 N/A THR 180.A N ASN 175.A O no hydrogen 3.363 N/A VAL 182.A N LYS 173.A O no hydrogen 2.719 N/A GLU 184.A N ILE 171.A O no hydrogen 3.042 N/A LEU 187.A N VAL 169.A O no hydrogen 2.882 N/A HIS 190.A ND1 ASP 215.A OD2 no hydrogen 3.172 N/A HIS 190.A NE2 SER 211.A OG no hydrogen 2.794 N/A SER 191.A N ASP 215.A OD2 no hydrogen 3.358 N/A TRP 193.A N ASP 192.A OD1 no hydrogen 2.831 N/A VAL 194.A N GLY 164.A O no hydrogen 3.016 N/A ARG 195.A N VAL 212.A O no hydrogen 2.739 N/A ARG 195.A NE GLN 214.A OE1 no hydrogen 3.043 N/A ARG 195.A NH2 GLN 214.A OE1 no hydrogen 3.105 N/A ASP 196.A N VAL 212.A O no hydrogen 3.446 N/A VAL 197.A N SER 149.A OG no hydrogen 3.249 N/A ALA 198.A N ALA 210.A O no hydrogen 2.841 N/A SER 200.A N TYR 208.A O no hydrogen 2.816 N/A SER 200.A OG ASN 254.A OD1 no hydrogen 2.566 N/A THR 202.A N SER 200.A OG no hydrogen 3.118 N/A ARG 206.A NE ASP 224.A OD1 no hydrogen 3.145 N/A ARG 206.A NH2 ASP 224.A OD1 no hydrogen 3.232 N/A SER 207.A N GLN 223.A O no hydrogen 3.204 N/A TYR 208.A OH GLU 270.A OE1 no hydrogen 2.623 N/A LEU 209.A N TRP 221.A O no hydrogen 2.711 N/A ALA 210.A N ALA 198.A O no hydrogen 3.036 N/A SER 211.A N ILE 219.A O no hydrogen 2.942 N/A SER 211.A OG HIS 190.A NE2 no hydrogen 2.794 N/A SER 211.A OG ILE 219.A O no hydrogen 3.484 N/A VAL 212.A N ASP 196.A O no hydrogen 2.955 N/A SER 213.A N THR 217.A O no hydrogen 3.366 N/A SER 213.A OG ASP 192.A O no hydrogen 2.761 N/A SER 213.A OG TRP 193.A O no hydrogen 2.487 N/A GLN 214.A N TRP 193.A O no hydrogen 2.769 N/A ASP 215.A N SER 213.A OG no hydrogen 3.095 N/A ARG 216.A N SER 213.A O no hydrogen 3.102 N/A ARG 216.A NH1 PHE 240.A O no hydrogen 3.448 N/A THR 217.A OG1 ASP 215.A OD1 no hydrogen 2.706 N/A THR 217.A OG1 ASP 215.A OD2 no hydrogen 3.022 N/A CYS 218.A SG SER 211.A O no hydrogen 3.922 N/A ILE 219.A N SER 211.A O no hydrogen 3.024 N/A ILE 220.A N THR 233.A O no hydrogen 3.033 N/A TRP 221.A N LEU 209.A O no hydrogen 2.678 N/A TRP 221.A NE1 SER 211.A OG no hydrogen 2.899 N/A THR 222.A N LYS 231.A O no hydrogen 3.230 N/A GLN 223.A N SER 207.A O no hydrogen 3.262 N/A GLN 223.A NE2 GLY 228.A O no hydrogen 3.021 N/A GLY 228.A N ASN 225.A O no hydrogen 2.838 N/A LYS 231.A N THR 222.A O no hydrogen 2.929 N/A LYS 232.A NZ GLY 189.A O no hydrogen 3.481 N/A THR 233.A OG1 LYS 232.A O no hydrogen 2.960 N/A LEU 235.A N CYS 218.A O no hydrogen 2.829 N/A GLU 238.A N GLU 238.A OE1 no hydrogen 2.634 N/A PHE 240.A N ARG 216.A O no hydrogen 2.823 N/A TRP 245.A N SER 259.A O no hydrogen 2.882 N/A ARG 246.A NH1 ASP 13.A OD1 no hydrogen 3.386 N/A ARG 246.A NH2 HIS 12.A O no hydrogen 3.515 N/A ARG 246.A NH2 ASP 13.A OD1 no hydrogen 3.538 N/A ALA 247.A N ASP 196.A OD1 no hydrogen 3.087 N/A SER 248.A N ALA 257.A O no hydrogen 3.108 N/A TRP 249.A NE1 ALA 198.A O no hydrogen 2.926 N/A SER 250.A N VAL 255.A O no hydrogen 2.949 N/A SER 250.A OG SER 252.A O no hydrogen 2.873 N/A SER 250.A OG VAL 255.A O no hydrogen 3.221 N/A VAL 255.A N SER 250.A OG no hydrogen 2.879 N/A LEU 256.A N TRP 268.A O no hydrogen 2.967 N/A ALA 257.A N SER 248.A O no hydrogen 2.679 N/A LEU 258.A N THR 266.A O no hydrogen 3.021 N/A SER 259.A N ARG 246.A O no hydrogen 3.204 N/A GLY 260.A N LYS 264.A O no hydrogen 2.960 N/A ASN 263.A ND2 ASN 263.A O no hydrogen 3.034 N/A THR 266.A N LEU 258.A O no hydrogen 3.072 N/A TRP 268.A N LEU 256.A O no hydrogen 2.918 N/A TRP 268.A NE1 THR 266.A OG1 no hydrogen 2.741 N/A LYS 269.A N GLU 277.A O no hydrogen 2.938 N/A ASN 271.A N LYS 275.A O no hydrogen 3.238 N/A ASN 271.A ND2 GLU 277.A OE1 no hydrogen 2.984 N/A GLU 273.A N ASN 271.A OD1 no hydrogen 2.966 N/A GLY 274.A N ASN 271.A O no hydrogen 2.659 N/A GLU 277.A N LYS 269.A O no hydrogen 3.061 N/A ALA 279.A N LEU 267.A O no hydrogen 3.052 N/A