Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4z1e_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): GLY 5.A N ASN 10.A O no hydrogen 2.887 N/A ASN 10.A ND2 HIS 3.A O no hydrogen 2.941 N/A HIS 14.A N GLY 11.A O no hydrogen 2.800 N/A HIS 14.A NE2 LYS 8.A O no hydrogen 2.952 N/A TRP 15.A N PRO 12.A O no hydrogen 3.315 N/A TRP 15.A NE1 GLY 5.A O no hydrogen 3.151 N/A TRP 15.A NE1 ASN 10.A O no hydrogen 3.114 N/A LYS 17.A N HIS 14.A O no hydrogen 3.179 N/A LYS 17.A NZ HIS 14.A ND1 no hydrogen 2.936 N/A PHE 19.A N TRP 15.A O no hydrogen 2.880 N/A ALA 22.A N PHE 19.A O no hydrogen 2.974 N/A LYS 23.A N PRO 20.A O no hydrogen 3.308 N/A GLY 24.A N ILE 21.A O no hydrogen 2.725 N/A ARG 26.A N GLU 203.A OE2 no hydrogen 3.005 N/A ARG 26.A NE GLY 194.A O no hydrogen 3.007 N/A ARG 26.A NH1 PRO 136.A O no hydrogen 3.525 N/A ARG 26.A NH2 PRO 136.A O no hydrogen 3.236 N/A ARG 26.A NH2 GLY 194.A O no hydrogen 2.994 N/A ARG 26.A NH2 VAL 205.A O no hydrogen 3.102 N/A GLN 27.A NE2 LEU 201.A O no hydrogen 3.240 N/A GLN 27.A NE2 GLU 203.A OE2 no hydrogen 3.067 N/A SER 28.A N SER 195.A OG no hydrogen 2.920 N/A SER 28.A OG TYR 192.A OH no hydrogen 2.797 N/A SER 28.A OG SER 195.A O no hydrogen 3.568 N/A ILE 32.A N THR 107.A O no hydrogen 2.738 N/A THR 34.A N ASP 109.A OD1 no hydrogen 2.848 N/A THR 34.A OG1 ASP 109.A OD1 no hydrogen 3.266 N/A THR 34.A OG1 ASP 109.A OD2 no hydrogen 2.561 N/A THR 36.A N ASP 33.A O no hydrogen 3.016 N/A THR 36.A OG1 ASP 33.A OD2 no hydrogen 2.440 N/A ALA 37.A N ASP 33.A O no hydrogen 3.067 N/A LYS 38.A N ILE 254.A O no hydrogen 3.218 N/A ASP 40.A N ALA 256.A O no hydrogen 2.933 N/A SER 42.A N ASP 40.A OD1 no hydrogen 2.970 N/A SER 42.A OG ASP 40.A OD1 no hydrogen 2.454 N/A SER 42.A OG ASP 40.A OD2 no hydrogen 3.263 N/A LEU 43.A N ASP 40.A O no hydrogen 2.995 N/A LYS 44.A N GLY 81.A O no hydrogen 3.449 N/A SER 47.A N LYS 79.A O no hydrogen 2.817 N/A SER 49.A N VAL 77.A O no hydrogen 2.906 N/A TYR 50.A OH HIS 121.A NE2 no hydrogen 2.727 N/A ALA 53.A N TYR 50.A O no hydrogen 3.170 N/A SER 55.A OG PHE 174.A O no hydrogen 2.708 N/A LEU 56.A N GLU 68.A O no hydrogen 2.936 N/A ARG 57.A NE GLU 68.A OE1 no hydrogen 2.779 N/A ARG 57.A NH2 GLU 68.A OE1 no hydrogen 3.419 N/A ARG 57.A NH2 GLU 68.A OE2 no hydrogen 2.928 N/A ILE 58.A N ALA 172.A O no hydrogen 2.771 N/A LEU 59.A N ASN 66.A O no hydrogen 2.865 N/A ASN 60.A N LYS 170.A O no hydrogen 2.951 N/A ASN 60.A ND2 ILE 165.A O no hydrogen 3.265 N/A ASN 60.A ND2 ASN 228.A O no hydrogen 3.159 N/A ASN 61.A N ALA 64.A O no hydrogen 3.217 N/A GLY 62.A N ASN 60.A OD1 no hydrogen 2.801 N/A HIS 63.A N ASN 61.A OD1 no hydrogen 2.804 N/A ALA 64.A N ASN 61.A OD1 no hydrogen 2.973 N/A ASN 66.A N LEU 59.A O no hydrogen 2.822 N/A VAL 67.A N PHE 92.A O no hydrogen 2.980 N/A GLU 68.A N ARG 57.A O no hydrogen 2.802 N/A PHE 69.A N ILE 90.A O no hydrogen 2.880 N/A ASP 70.A N THR 54.A O no hydrogen 2.848 N/A SER 72.A N ASP 70.A OD1 no hydrogen 3.092 N/A SER 72.A OG ASP 70.A OD1 no hydrogen 2.553 N/A SER 72.A OG ASP 70.A OD2 no hydrogen 3.432 N/A LYS 75.A N GLN 73.A O no hydrogen 2.858 N/A VAL 77.A N SER 49.A O no hydrogen 2.953 N/A LEU 78.A N TYR 87.A O no hydrogen 2.915 N/A LYS 79.A N SER 47.A O no hydrogen 3.067 N/A GLY 81.A N PRO 45.A O no hydrogen 3.057 N/A LEU 83.A N GLY 80.A O no hydrogen 2.958 N/A TYR 87.A N LEU 78.A O no hydrogen 2.995 N/A TYR 87.A OH ASP 137.A O no hydrogen 3.013 N/A ARG 88.A N TRP 122.A O no hydrogen 2.784 N/A ARG 88.A NE ASP 74.A OD1 no hydrogen 2.844 N/A ARG 88.A NH1 ASP 71.A O no hydrogen 2.889 N/A LEU 89.A N ALA 76.A O no hydrogen 2.968 N/A ILE 90.A N VAL 120.A O no hydrogen 2.910 N/A PHE 92.A N VAL 67.A O no hydrogen 2.913 N/A HIS 93.A N HIS 118.A O no hydrogen 3.087 N/A HIS 93.A ND1 GLN 91.A OE1 no hydrogen 2.841 N/A HIS 93.A NE2 HIS 95.A NE2 no hydrogen 3.096 N/A HIS 95.A N GLU 116.A O no hydrogen 2.838 N/A HIS 95.A ND1 ASN 242.A O no hydrogen 2.768 N/A HIS 95.A NE2 HIS 93.A NE2 no hydrogen 3.096 N/A HIS 95.A NE2 HIS 118.A ND1 no hydrogen 2.937 N/A TRP 96.A N ASN 242.A OD1 no hydrogen 2.903 N/A TRP 96.A NE1 MET 239.A O no hydrogen 2.796 N/A SER 98.A N ASP 241.A OD1 no hydrogen 3.053 N/A SER 98.A OG ASP 241.A OD1 no hydrogen 3.546 N/A SER 98.A OG ASP 241.A OD2 no hydrogen 2.737 N/A GLN 102.A N LEU 99.A O no hydrogen 3.268 N/A GLN 102.A NE2 ASP 241.A OD1 no hydrogen 2.808 N/A GLN 102.A NE2 ASP 241.A OD2 no hydrogen 3.382 N/A SER 104.A N TYR 113.A O no hydrogen 2.948 N/A SER 104.A OG HIS 106.A O no hydrogen 2.854 N/A GLU 105.A N GLU 116.A OE1 no hydrogen 2.908 N/A HIS 106.A N GLU 116.A OE1 no hydrogen 2.893 N/A HIS 106.A ND1 GLU 116.A OE2 no hydrogen 2.784 N/A HIS 106.A NE2 TYR 192.A OH no hydrogen 2.620 N/A THR 107.A N VAL 30.A O no hydrogen 3.446 N/A THR 107.A OG1 ASP 31.A OD1 no hydrogen 2.689 N/A VAL 108.A N LYS 111.A O no hydrogen 3.127 N/A ASP 109.A N ILE 32.A O no hydrogen 2.804 N/A LYS 110.A N ASP 31.A OD1 no hydrogen 2.733 N/A LYS 111.A N VAL 108.A O no hydrogen 3.037 N/A TYR 113.A N SER 104.A OG no hydrogen 2.844 N/A ALA 115.A N LEU 146.A O no hydrogen 3.327 N/A GLU 116.A N HIS 95.A O no hydrogen 2.847 N/A LEU 117.A N ILE 144.A O no hydrogen 2.860 N/A HIS 118.A N HIS 93.A O no hydrogen 2.798 N/A HIS 118.A ND1 HIS 93.A NE2 no hydrogen 3.163 N/A HIS 118.A NE2 GLU 116.A OE2 no hydrogen 2.738 N/A LEU 119.A N LEU 142.A O no hydrogen 2.972 N/A VAL 120.A N GLN 91.A O no hydrogen 2.891 N/A HIS 121.A N ALA 140.A O no hydrogen 2.937 N/A HIS 121.A ND1 ALA 140.A O no hydrogen 2.978 N/A HIS 121.A NE2 TYR 50.A OH no hydrogen 2.727 N/A TRP 122.A N ARG 88.A O no hydrogen 2.977 N/A TRP 122.A NE1 ASP 71.A OD2 no hydrogen 2.758 N/A ASN 123.A N GLY 138.A O no hydrogen 2.805 N/A ASN 123.A ND2 ASP 137.A O no hydrogen 3.125 N/A THR 124.A N THR 86.A O no hydrogen 3.005 N/A THR 124.A OG1 THR 86.A O no hydrogen 3.282 N/A LYS 125.A N ASN 123.A OD1 no hydrogen 3.209 N/A TYR 126.A N ASN 123.A O no hydrogen 3.065 N/A TYR 126.A OH ASP 137.A OD1 no hydrogen 2.674 N/A GLY 127.A N THR 124.A O no hydrogen 3.031 N/A ASP 128.A N TYR 126.A O no hydrogen 2.890 N/A LYS 131.A N ASP 128.A OD1 no hydrogen 2.782 N/A ALA 132.A N ASP 128.A O no hydrogen 3.025 N/A VAL 133.A N PHE 129.A O no hydrogen 3.066 N/A GLN 134.A N LYS 131.A O no hydrogen 3.279 N/A GLN 134.A NE2 GLY 130.A O no hydrogen 3.116 N/A GLN 135.A N ALA 132.A O no hydrogen 2.966 N/A GLY 138.A N GLN 135.A O no hydrogen 3.137 N/A LEU 139.A N CYS 204.A O no hydrogen 2.902 N/A ALA 140.A N HIS 121.A O no hydrogen 2.861 N/A VAL 141.A N THR 206.A O no hydrogen 3.205 N/A LEU 142.A N LEU 119.A O no hydrogen 2.954 N/A GLY 143.A N ILE 208.A O no hydrogen 2.789 N/A ILE 144.A N LEU 117.A O no hydrogen 2.927 N/A LEU 146.A N ALA 115.A O no hydrogen 2.911 N/A LYS 147.A N ILE 214.A O no hydrogen 2.968 N/A LYS 147.A NZ SER 215.A OG no hydrogen 3.220 N/A GLY 149.A N VAL 216.A O no hydrogen 2.877 N/A LYS 152.A N GLN 220.A OE1 no hydrogen 2.999 N/A LYS 152.A NZ LEU 183.A O no hydrogen 3.375 N/A LEU 155.A N LYS 152.A O no hydrogen 3.025 N/A GLN 156.A N PRO 153.A O no hydrogen 3.418 N/A GLN 156.A NE2 ASP 160.A OD1 no hydrogen 3.091 N/A VAL 158.A N LEU 155.A O no hydrogen 2.881 N/A VAL 159.A N LEU 155.A O no hydrogen 3.160 N/A ASP 160.A N GLN 156.A O no hydrogen 2.920 N/A VAL 161.A N VAL 158.A O no hydrogen 3.248 N/A LEU 162.A N VAL 159.A O no hydrogen 3.228 N/A SER 164.A N VAL 161.A O no hydrogen 2.921 N/A SER 164.A OG VAL 161.A O no hydrogen 2.906 N/A ILE 165.A N LEU 162.A O no hydrogen 3.087 N/A LYS 168.A N ASN 230.A O no hydrogen 3.048 N/A GLY 169.A N ASN 60.A O no hydrogen 2.762 N/A LYS 170.A N THR 167.A O no hydrogen 3.231 N/A LYS 170.A NZ GLU 232.A OE2 no hydrogen 3.423 N/A ALA 172.A N ILE 58.A O no hydrogen 2.843 N/A PHE 174.A N LEU 56.A O no hydrogen 3.139 N/A THR 175.A OG1 ASN 176.A OD1 no hydrogen 3.170 N/A PHE 177.A N SER 55.A OG no hydrogen 2.949 N/A ARG 180.A N ASP 178.A OD1 no hydrogen 3.008 N/A ARG 180.A NE ASP 178.A OD1 no hydrogen 3.139 N/A ARG 180.A NE ASP 178.A OD2 no hydrogen 3.196 N/A ARG 180.A NH2 ASP 178.A OD2 no hydrogen 2.759 N/A GLY 181.A N ASP 178.A O no hydrogen 3.260 N/A LEU 182.A N PRO 179.A O no hydrogen 3.037 N/A LEU 183.A N ARG 180.A O no hydrogen 3.195 N/A SER 186.A N GLU 212.A OE1 no hydrogen 2.908 N/A ASP 188.A N SER 186.A OG no hydrogen 3.210 N/A TYR 189.A N SER 257.A OG no hydrogen 2.991 N/A TYR 189.A OH LYS 44.A O no hydrogen 2.982 N/A TRP 190.A N VAL 209.A O no hydrogen 2.792 N/A THR 191.A N LYS 255.A O no hydrogen 2.845 N/A THR 191.A OG1 TRP 207.A O no hydrogen 2.745 N/A TYR 192.A N TRP 207.A O no hydrogen 3.322 N/A TYR 192.A OH SER 28.A OG no hydrogen 2.797 N/A TYR 192.A OH HIS 106.A NE2 no hydrogen 2.620 N/A GLY 194.A N VAL 205.A O no hydrogen 2.753 N/A SER 195.A N SER 28.A OG no hydrogen 2.936 N/A SER 195.A OG LEU 196.A O no hydrogen 2.737 N/A LEU 196.A N LEU 202.A O no hydrogen 3.008 N/A THR 197.A OG1 GLU 105.A OE1 no hydrogen 2.603 N/A THR 197.A OG1 GLU 105.A OE2 no hydrogen 3.411 N/A THR 198.A OG1 PRO 199.A O no hydrogen 3.299 N/A LEU 201.A N THR 198.A O no hydrogen 2.767 N/A CYS 204.A N LEU 202.A O no hydrogen 2.988 N/A CYS 204.A SG LEU 202.A O no hydrogen 3.796 N/A VAL 205.A N GLY 194.A O no hydrogen 3.234 N/A THR 206.A N LEU 139.A O no hydrogen 2.942 N/A TRP 207.A N TYR 192.A O no hydrogen 3.007 N/A TRP 207.A NE1 SER 195.A O no hydrogen 2.938 N/A ILE 208.A N VAL 141.A O no hydrogen 2.979 N/A VAL 209.A N TRP 190.A O no hydrogen 2.875 N/A LEU 210.A N GLY 143.A O no hydrogen 2.964 N/A LYS 211.A N ASP 188.A O no hydrogen 3.041 N/A ILE 214.A N PHE 145.A O no hydrogen 2.893 N/A VAL 216.A N LYS 147.A O no hydrogen 2.882 N/A SER 217.A N GLN 220.A OE1 no hydrogen 3.137 N/A SER 218.A OG.B GLU 219.A OE1 no hydrogen 3.095 N/A GLU 219.A N GLU 219.A OE1 no hydrogen 2.895 N/A GLN 220.A N SER 217.A OG no hydrogen 3.154 N/A GLN 220.A NE2 LYS 152.A O no hydrogen 3.005 N/A GLN 220.A NE2 GLN 156.A OE1 no hydrogen 2.843 N/A VAL 221.A N SER 217.A O no hydrogen 3.201 N/A LEU 222.A N SER 218.A O no hydrogen 2.897 N/A LYS 223.A N GLU 219.A O no hydrogen 3.304 N/A PHE 224.A N GLN 220.A O no hydrogen 3.397 N/A ARG 225.A N VAL 221.A O no hydrogen 3.175 N/A ARG 225.A NE GLY 97.A O no hydrogen 2.944 N/A ARG 225.A NH1 ASP 100.A OD1 no hydrogen 3.549 N/A ARG 225.A NH2 ASP 100.A OD1 no hydrogen 2.672 N/A LYS 226.A N LYS 223.A O no hydrogen 3.099 N/A LEU 227.A N PHE 224.A O no hydrogen 3.258 N/A ASN 228.A N LYS 166.A O no hydrogen 2.811 N/A ASN 228.A ND2 GLU 236.A OE1 no hydrogen 3.017 N/A PHE 229.A N GLU 237.A O no hydrogen 3.029 N/A ASN 230.A ND2 GLY 231.A O no hydrogen 3.141 N/A GLU 234.A N GLY 231.A O no hydrogen 3.115 N/A GLU 237.A N ASN 230.A OD1 no hydrogen 2.699 N/A MET 239.A N LEU 227.A O no hydrogen 2.758 N/A ASN 242.A N TRP 96.A O no hydrogen 3.351 N/A ASN 242.A ND2 HIS 63.A O no hydrogen 2.825 N/A TRP 243.A NE1 ASP 241.A OD1 no hydrogen 3.037 N/A ARG 244.A N GLU 105.A OE2 no hydrogen 2.806 N/A ARG 244.A NH1 GLN 27.A OE1 no hydrogen 2.757 N/A ARG 244.A NH1 SER 28.A O no hydrogen 2.724 N/A ARG 244.A NH2 ALA 22.A O no hydrogen 3.155 N/A ARG 244.A NH2 GLN 27.A OE1 no hydrogen 3.158 N/A GLN 247.A N PRO 29.A O no hydrogen 2.749 N/A GLN 247.A NE2 PRO 245.A O no hydrogen 2.807 N/A LYS 250.A NZ.B GLY 24.A O no hydrogen 2.522 N/A ARG 252.A N LYS 250.A O no hydrogen 3.118 N/A ARG 252.A NE LEU 249.A O no hydrogen 2.865 N/A ARG 252.A NH1 GLN 27.A O no hydrogen 3.044 N/A ARG 252.A NH1 PRO 193.A O no hydrogen 2.887 N/A ARG 252.A NH2 GLN 27.A O no hydrogen 2.775 N/A ARG 252.A NH2 PRO 248.A O no hydrogen 3.018 N/A LYS 255.A N THR 191.A O no hydrogen 3.012 N/A ALA 256.A N LYS 38.A O no hydrogen 2.860 N/A SER 257.A N TYR 189.A O no hydrogen 2.924 N/A SER 257.A OG TYR 189.A O no hydrogen 3.344 N/A