Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 8pec_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLU 1.A N GLU 1.A OE2 no hydrogen 2.363 N/A GLU 1.A N GLN 30.A OE1 no hydrogen 2.737 N/A GLN 3.A N GLY 31.A O no hydrogen 2.905 N/A ASN 5.A N THR 33.A O no hydrogen 2.790 N/A SER 7.A N ASN 5.A OD1 no hydrogen 3.039 N/A SER 7.A OG ASN 5.A OD1 no hydrogen 2.539 N/A TRP 8.A N ASN 5.A O no hydrogen 3.283 N/A TRP 8.A NE1 GLU 224.A OE2 no hydrogen 3.128 N/A ASN 9.A N LYS 6.A O no hydrogen 2.907 N/A HIS 11.A N TRP 8.A O no hydrogen 2.918 N/A HIS 11.A ND1 GLU 219.A OE2 no hydrogen 2.849 N/A HIS 11.A NE2 GLN 223.A OE1 no hydrogen 3.023 N/A THR 13.A N ASN 9.A O no hydrogen 2.986 N/A THR 13.A OG1 ASN 9.A O no hydrogen 3.020 N/A THR 13.A OG1 VAL 10.A O no hydrogen 2.982 N/A GLU 14.A N VAL 10.A O no hydrogen 2.849 N/A HIS 15.A N PHE 12.A O no hydrogen 3.041 N/A HIS 15.A ND1 HIS 11.A O no hydrogen 3.006 N/A LYS 16.A N THR 13.A O no hydrogen 2.565 N/A SER 17.A N PHE 12.A O no hydrogen 2.800 N/A SER 17.A OG HIS 15.A O no hydrogen 3.110 N/A VAL 20.A N ASN 201.A O no hydrogen 2.764 N/A VAL 21.A N ASN 34.A OD1 no hydrogen 2.726 N/A VAL 22.A N ALA 199.A O no hydrogen 2.930 N/A LEU 23.A N PHE 32.A O no hydrogen 2.601 N/A TRP 24.A N PHE 197.A O no hydrogen 2.835 N/A TRP 24.A NE1 GLU 26.A OE2 no hydrogen 3.083 N/A TRP 24.A NE1 GLN 29.A OE1 no hydrogen 3.082 N/A ASN 25.A N GLN 30.A O no hydrogen 2.972 N/A GLU 26.A N VAL 195.A O no hydrogen 3.201 N/A ASN 27.A N ASN 194.A OD1 no hydrogen 3.020 N/A ASN 27.A ND2 ASP 193.A O no hydrogen 2.737 N/A GLU 28.A N ASN 25.A OD1 no hydrogen 3.317 N/A GLN 29.A N GLU 26.A O no hydrogen 2.967 N/A GLN 30.A N ASN 25.A O no hydrogen 3.323 N/A GLY 31.A N GLU 1.A O no hydrogen 3.054 N/A PHE 32.A N LEU 23.A O no hydrogen 2.611 N/A THR 33.A N GLN 3.A O no hydrogen 2.886 N/A THR 33.A OG1 VAL 21.A O no hydrogen 3.054 N/A THR 33.A OG1 ASN 35.A O no hydrogen 3.271 N/A ASN 34.A N VAL 21.A O no hydrogen 3.394 N/A ASN 34.A ND2 ASN 9.A OD1 no hydrogen 2.504 N/A ASN 34.A ND2 GLY 19.A O no hydrogen 3.277 N/A ASN 35.A N THR 33.A OG1 no hydrogen 3.152 N/A ARG 38.A NE ASN 201.A OD1 no hydrogen 2.831 N/A ARG 38.A NH1 ASN 201.A OD1 no hydrogen 3.299 N/A ARG 38.A NH1 ASP 203.A OD1 no hydrogen 3.115 N/A ARG 38.A NH2 ASP 203.A OD1 no hydrogen 3.437 N/A ALA 39.A N ASN 35.A O no hydrogen 2.990 N/A ASN 40.A N LYS 37.A O no hydrogen 3.210 N/A ASN 40.A ND2 LEU 36.A O no hydrogen 3.548 N/A GLN 41.A N ARG 38.A O no hydrogen 3.185 N/A PHE 43.A N ILE 127.A O no hydrogen 3.009 N/A THR 48.A N PRO 45.A O no hydrogen 2.616 N/A THR 48.A OG1 PRO 45.A O no hydrogen 2.317 N/A LEU 49.A N PRO 45.A O no hydrogen 3.290 N/A LEU 49.A N ALA 46.A O no hydrogen 3.318 N/A LYS 50.A N SER 47.A O no hydrogen 3.000 N/A ILE 51.A N THR 48.A O no hydrogen 3.388 N/A ASN 53.A N LEU 49.A O no hydrogen 2.951 N/A SER 54.A N LYS 50.A O no hydrogen 2.955 N/A SER 54.A OG LYS 50.A O no hydrogen 2.532 N/A SER 54.A OG TYR 100.A OH no hydrogen 2.649 N/A LEU 55.A N ILE 51.A O no hydrogen 3.037 N/A ILE 56.A N PRO 52.A O no hydrogen 2.888 N/A ALA 57.A N ASN 53.A O no hydrogen 2.867 N/A LEU 58.A N SER 54.A O no hydrogen 2.873 N/A ASP 59.A N LEU 55.A O no hydrogen 2.870 N/A LEU 60.A N ILE 56.A O no hydrogen 3.059 N/A GLY 61.A N LEU 58.A O no hydrogen 2.772 N/A VAL 63.A N ALA 57.A O no hydrogen 3.244 N/A LYS 64.A N GLN 68.A OE1 no hydrogen 2.735 N/A GLU 66.A N GLU 66.A OE1 no hydrogen 2.740 N/A HIS 67.A N ASP 65.A OD1 no hydrogen 3.044 N/A GLN 68.A N ASP 65.A O no hydrogen 3.205 N/A PHE 70.A N HIS 86.A O no hydrogen 2.750 N/A TRP 72.A N ASP 85.A OD1 no hydrogen 2.683 N/A TRP 72.A NE1 GLN 75.A O no hydrogen 3.088 N/A GLN 75.A N ASP 73.A OD1 no hydrogen 2.623 N/A ARG 77.A N ASN 83.A OD1 no hydrogen 2.912 N/A ARG 77.A NH1 ASP 73.A OD2 no hydrogen 2.462 N/A ARG 77.A NH2 ASP 73.A OD1 no hydrogen 3.001 N/A ARG 77.A NH2 ASP 73.A OD2 no hydrogen 3.229 N/A TRP 82.A N ILE 79.A O no hydrogen 3.126 N/A TRP 82.A NE1 TYR 94.A O no hydrogen 3.125 N/A ASN 83.A N ALA 80.A O no hydrogen 2.987 N/A ASN 83.A ND2 ARG 77.A O no hydrogen 2.966 N/A ARG 84.A N TRP 82.A O no hydrogen 2.695 N/A HIS 86.A N PHE 70.A O no hydrogen 3.201 N/A HIS 86.A ND1 THR 90.A OG1 no hydrogen 3.113 N/A ASN 87.A N THR 90.A OG1 no hydrogen 2.784 N/A THR 90.A N ASN 87.A OD1 no hydrogen 3.040 N/A THR 90.A OG1 HIS 86.A ND1 no hydrogen 3.113 N/A THR 90.A OG1 ASN 87.A O no hydrogen 3.242 N/A THR 90.A OG1 ASN 87.A OD1 no hydrogen 3.499 N/A ALA 91.A N ASN 87.A O no hydrogen 2.622 N/A MET 92.A N LEU 88.A O no hydrogen 3.074 N/A LYS 93.A N ILE 89.A O no hydrogen 3.007 N/A LYS 93.A NZ TYR 94.A OH no hydrogen 3.482 N/A TYR 94.A N THR 90.A O no hydrogen 2.977 N/A SER 95.A N MET 92.A O no hydrogen 3.203 N/A VAL 96.A N ALA 91.A O no hydrogen 2.951 N/A VAL 99.A N VAL 96.A O no hydrogen 3.122 N/A TYR 100.A OH SER 54.A OG no hydrogen 2.649 N/A GLN 101.A N VAL 97.A O no hydrogen 3.034 N/A GLU 102.A N PRO 98.A O no hydrogen 3.271 N/A PHE 103.A N VAL 99.A O no hydrogen 3.306 N/A ALA 104.A N TYR 100.A O no hydrogen 2.921 N/A ARG 105.A N GLN 101.A O no hydrogen 2.870 N/A ARG 105.A NH1 GLU 102.A OE2 no hydrogen 2.804 N/A GLN 106.A N GLU 102.A O no hydrogen 3.005 N/A ILE 107.A N PHE 103.A O no hydrogen 2.883 N/A GLY 108.A N ALA 104.A O no hydrogen 2.854 N/A ARG 111.A NE ILE 107.A O no hydrogen 3.264 N/A MET 112.A N GLY 108.A O no hydrogen 3.111 N/A SER 113.A N GLU 109.A O no hydrogen 3.026 N/A SER 113.A OG GLU 109.A O no hydrogen 2.714 N/A LYS 114.A N ALA 110.A O no hydrogen 3.045 N/A MET 115.A N ARG 111.A O no hydrogen 3.142 N/A LEU 116.A N MET 112.A O no hydrogen 3.086 N/A HIS 117.A N SER 113.A O no hydrogen 2.801 N/A ALA 118.A N LYS 114.A O no hydrogen 2.920 N/A ALA 118.A N MET 115.A O no hydrogen 2.498 N/A PHE 119.A N MET 115.A O no hydrogen 2.786 N/A TYR 121.A N LEU 116.A O no hydrogen 3.326 N/A ILE 127.A N PHE 43.A O no hydrogen 2.875 N/A SER 128.A N GLU 131.A OE1 no hydrogen 2.802 N/A SER 128.A OG THR 130.A OG1 no hydrogen 2.965 N/A THR 130.A N ALA 39.A O no hydrogen 3.323 N/A THR 130.A OG1 ASN 40.A OD1 no hydrogen 2.781 N/A THR 130.A OG1 SER 128.A OG no hydrogen 2.965 N/A GLU 131.A N SER 128.A OG no hydrogen 2.894 N/A GLN 132.A N SER 128.A O no hydrogen 3.026 N/A GLN 132.A NE2 THR 48.A OG1 no hydrogen 2.902 N/A ILE 133.A N ALA 129.A O no hydrogen 3.342 N/A SER 134.A N THR 130.A O no hydrogen 3.274 N/A PHE 135.A N GLU 131.A O no hydrogen 3.230 N/A LEU 136.A N GLN 132.A O no hydrogen 2.846 N/A ARG 137.A N ILE 133.A O no hydrogen 2.742 N/A ARG 137.A NH1 GLU 26.A OE2 no hydrogen 3.284 N/A LYS 138.A N PHE 135.A O no hydrogen 3.010 N/A LEU 139.A N PHE 135.A O no hydrogen 3.007 N/A TYR 140.A N LEU 136.A O no hydrogen 2.709 N/A HIS 141.A N ARG 137.A O no hydrogen 3.306 N/A HIS 141.A NE2 GLU 26.A OE1 no hydrogen 3.167 N/A ASN 142.A N LEU 139.A O no hydrogen 2.862 N/A LYS 143.A N LYS 138.A O no hydrogen 2.751 N/A LEU 144.A N GLN 151.A OE1 no hydrogen 3.152 N/A VAL 146.A N LEU 144.A O no hydrogen 2.725 N/A SER 147.A N ASP 59.A OD2 no hydrogen 2.685 N/A SER 147.A OG ASP 59.A OD2 no hydrogen 3.110 N/A SER 147.A OG SER 150.A OG no hydrogen 2.784 N/A ARG 149.A NH1 LYS 64.A O no hydrogen 2.886 N/A SER 150.A N SER 147.A OG no hydrogen 3.068 N/A SER 150.A OG ASP 59.A OD2 no hydrogen 3.073 N/A SER 150.A OG SER 147.A OG no hydrogen 2.784 N/A GLN 151.A N SER 147.A O no hydrogen 3.321 N/A GLN 151.A NE2 VAL 146.A O no hydrogen 3.094 N/A GLN 151.A NE2 SER 147.A O no hydrogen 3.344 N/A ARG 152.A N GLU 148.A O no hydrogen 2.857 N/A ILE 153.A N ARG 149.A O no hydrogen 2.980 N/A VAL 154.A N SER 150.A O no hydrogen 3.062 N/A LYS 155.A N GLN 151.A O no hydrogen 3.036 N/A LYS 155.A NZ LEU 139.A O no hydrogen 3.483 N/A LYS 155.A NZ TYR 140.A O no hydrogen 3.430 N/A LYS 155.A NZ ASN 142.A OD1 no hydrogen 2.561 N/A GLN 156.A N ARG 152.A O no hydrogen 2.855 N/A ALA 157.A N ILE 153.A O no hydrogen 2.992 N/A MET 158.A N VAL 154.A O no hydrogen 2.933 N/A LEU 159.A N GLN 156.A O no hydrogen 3.086 N/A THR 160.A N ILE 168.A O no hydrogen 2.849 N/A THR 160.A OG1 MET 158.A O no hydrogen 3.110 N/A GLU 161.A N ILE 168.A O no hydrogen 3.451 N/A ASN 163.A N TYR 166.A O no hydrogen 3.015 N/A ASP 165.A N ASN 163.A OD1 no hydrogen 2.327 N/A TYR 166.A N ASN 163.A OD1 no hydrogen 2.750 N/A TYR 166.A OH GLU 161.A OE2 no hydrogen 2.690 N/A ILE 167.A N GLU 190.A O no hydrogen 3.416 N/A ILE 168.A N GLU 161.A O no hydrogen 2.808 N/A ARG 169.A N TRP 188.A O no hydrogen 3.050 N/A ARG 169.A NE GLU 190.A OE1 no hydrogen 2.729 N/A ARG 169.A NH1 LYS 155.A O no hydrogen 2.878 N/A ALA 170.A N MET 158.A O no hydrogen 2.998 N/A LYS 171.A N VAL 186.A O no hydrogen 2.960 N/A LYS 171.A NZ SER 95.A OG no hydrogen 2.660 N/A LYS 171.A NZ THR 172.A O no hydrogen 2.998 N/A GLY 173.A N TRP 184.A O no hydrogen 3.278 N/A ALA 175.A N ILE 182.A O no hydrogen 3.124 N/A ILE 182.A N ALA 175.A O no hydrogen 3.000 N/A GLY 183.A N MET 202.A O no hydrogen 2.926 N/A TRP 184.A N GLY 173.A O no hydrogen 2.757 N/A TRP 184.A NE1 LEU 44.A O no hydrogen 2.706 N/A TRP 185.A N MET 200.A O no hydrogen 2.853 N/A VAL 186.A N LYS 171.A O no hydrogen 3.320 N/A GLY 187.A N PHE 198.A O no hydrogen 2.846 N/A TRP 188.A N ARG 169.A O no hydrogen 2.834 N/A TRP 188.A NE1 GLU 190.A OE1 no hydrogen 3.166 N/A VAL 189.A N TRP 196.A O no hydrogen 2.747 N/A GLU 190.A N ILE 167.A O no hydrogen 2.748 N/A LEU 191.A N ASN 194.A O no hydrogen 2.780 N/A ASN 194.A ND2 ASN 25.A OD1 no hydrogen 2.869 N/A VAL 195.A N ASN 194.A OD1 no hydrogen 2.721 N/A TRP 196.A N VAL 189.A O no hydrogen 2.889 N/A PHE 197.A N TRP 24.A O no hydrogen 3.093 N/A PHE 198.A N GLY 187.A O no hydrogen 2.911 N/A ALA 199.A N VAL 22.A O no hydrogen 2.825 N/A MET 200.A N TRP 185.A O no hydrogen 2.657 N/A ASN 201.A N VAL 20.A O no hydrogen 3.157 N/A MET 202.A N GLY 183.A O no hydrogen 3.025 N/A ASP 203.A N GLN 18.A O no hydrogen 2.821 N/A MET 204.A N LYS 181.A O no hydrogen 2.572 N/A THR 206.A OG1 ASP 208.A OD2 no hydrogen 2.783 N/A LEU 210.A N SER 207.A O no hydrogen 3.103 N/A LEU 212.A N GLY 209.A O no hydrogen 2.965 N/A ARG 213.A N LEU 210.A O no hydrogen 3.110 N/A ARG 213.A NE LEU 210.A O no hydrogen 2.884 N/A ARG 213.A NH2 GLY 173.A O no hydrogen 2.968 N/A GLN 214.A N GLN 214.A OE1 no hydrogen 2.556 N/A ALA 215.A N GLY 211.A O no hydrogen 3.177 N/A ILE 216.A N LEU 212.A O no hydrogen 2.943 N/A THR 217.A OG1 ARG 213.A O no hydrogen 2.715 N/A LYS 218.A N GLN 214.A O no hydrogen 2.881 N/A LYS 218.A NZ GLU 161.A OE1 no hydrogen 2.886 N/A LYS 218.A NZ GLU 161.A OE2 no hydrogen 3.096 N/A GLU 219.A N ALA 215.A O no hydrogen 3.120 N/A VAL 220.A N THR 217.A O no hydrogen 2.645 N/A LEU 221.A N THR 217.A O no hydrogen 2.930 N/A LYS 222.A N LYS 218.A O no hydrogen 2.504 N/A GLN 223.A N GLU 219.A O no hydrogen 2.982 N/A GLU 224.A N LEU 221.A O no hydrogen 2.964 N/A LYS 225.A N LYS 222.A O no hydrogen 3.450 N/A ILE 226.A N LEU 221.A O no hydrogen 3.167 N/A