Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 1e58_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): ALA 1.A N.B GLU 218.A OE1 no hydrogen 2.536 N/A ALA 1.A N.B GLU 218.A OE2 no hydrogen 2.830 N/A THR 3.A N PHE 216.A O no hydrogen 2.979 N/A LYS 4.A NZ TYR 48.A OH no hydrogen 3.033 N/A LYS 4.A NZ TYR 226.A OH no hydrogen 3.462 N/A LEU 5.A N TYR 214.A O no hydrogen 2.931 N/A VAL 6.A N VAL 177.A O no hydrogen 3.214 N/A LEU 7.A N LEU 212.A O no hydrogen 2.858 N/A VAL 8.A N ILE 179.A O no hydrogen 2.888 N/A ARG 9.A NH1 ILE 206.A O no hydrogen 2.887 N/A GLY 10.A N THR 64.A OG1 no hydrogen 2.907 N/A GLU 11.A N GLU 35.A OE1.A no hydrogen 2.866 N/A GLU 11.A N GLU 35.A OE1.B no hydrogen 2.888 N/A SER 12.A N ASN 15.A OD1 no hydrogen 2.830 N/A GLN 13.A N ASP 27.A O no hydrogen 2.909 N/A GLN 13.A NE2 GLU 17.A OE2 no hydrogen 3.073 N/A ASN 15.A N SER 12.A OG no hydrogen 2.884 N/A LYS 16.A N SER 12.A O no hydrogen 3.110 N/A GLU 17.A N GLN 13.A O no hydrogen 2.979 N/A ASN 18.A N ASN 15.A O no hydrogen 3.192 N/A ASN 18.A ND2 ASN 243.A O no hydrogen 3.099 N/A ARG 19.A N TRP 14.A O no hydrogen 2.939 N/A ARG 19.A NE.A GLY 95.A O no hydrogen 2.778 N/A ARG 19.A NE.B GLU 17.A OE1 no hydrogen 3.392 N/A ARG 19.A NH1.B GLY 95.A O no hydrogen 3.078 N/A ARG 19.A NH2.A GLY 95.A O no hydrogen 2.958 N/A PHE 20.A N LEU 96.A O no hydrogen 2.973 N/A THR 21.A OG1 ARG 19.A O no hydrogen 3.337 N/A TRP 23.A N GLN 94.A OE1 no hydrogen 2.914 N/A TYR 24.A N THR 21.A O no hydrogen 3.049 N/A VAL 26.A N TYR 24.A O no hydrogen 3.045 N/A LEU 28.A N ASP 27.A OD1 no hydrogen 2.801 N/A SER 29.A N GLU 11.A O no hydrogen 2.967 N/A SER 29.A OG GLU 11.A O no hydrogen 3.134 N/A SER 29.A OG GLU 11.A OE1 no hydrogen 2.726 N/A GLY 32.A N SER 29.A OG no hydrogen 2.934 N/A VAL 33.A N SER 29.A O no hydrogen 2.988 N/A SER 34.A N GLU 30.A O no hydrogen 3.141 N/A SER 34.A OG GLU 30.A O no hydrogen 3.353 N/A GLU 35.A N LYS 31.A O no hydrogen 2.831 N/A ALA 36.A N GLY 32.A O no hydrogen 2.936 N/A LYS 37.A N VAL 33.A O no hydrogen 3.015 N/A LYS 37.A NZ.B ASN 67.A OD1 no hydrogen 3.009 N/A ALA 38.A N SER 34.A O no hydrogen 2.920 N/A ALA 39.A N GLU 35.A O no hydrogen 2.946 N/A GLY 40.A N ALA 36.A O no hydrogen 3.171 N/A LYS 41.A N LYS 37.A O no hydrogen 2.985 N/A LYS 41.A NZ.B GLU 71.A OE2 no hydrogen 3.117 N/A LEU 42.A N ALA 38.A O no hydrogen 2.949 N/A LEU 43.A N ALA 39.A O no hydrogen 2.977 N/A LYS 44.A N GLY 40.A O no hydrogen 3.017 N/A GLU 45.A N LYS 41.A O no hydrogen 2.971 N/A GLU 46.A N LEU 42.A O no hydrogen 2.920 N/A GLY 47.A N LYS 44.A O no hydrogen 3.041 N/A TYR 48.A N LEU 43.A O no hydrogen 2.962 N/A PHE 50.A N GLN 74.A OE1 no hydrogen 2.947 N/A ASP 51.A N ARG 176.A O no hydrogen 2.793 N/A PHE 52.A N ARG 176.A O no hydrogen 3.288 N/A ALA 53.A N PRO 78.A O no hydrogen 2.970 N/A TYR 54.A N ILE 178.A O no hydrogen 2.941 N/A THR 55.A N GLU 80.A O no hydrogen 2.992 N/A THR 55.A OG1 ALA 180.A O no hydrogen 2.791 N/A SER 56.A OG HIS 182.A NE2 no hydrogen 2.826 N/A VAL 57.A N ASN 86.A OD1 no hydrogen 3.323 N/A LEU 58.A N SER 56.A OG no hydrogen 3.046 N/A LYS 59.A N ASP 25.A OD1 no hydrogen 2.742 N/A ARG 60.A NH1 TYR 24.A O no hydrogen 2.944 N/A ARG 60.A NH2 GLY 22.A O no hydrogen 2.820 N/A ALA 61.A N LEU 58.A O no hydrogen 2.994 N/A ILE 62.A N LEU 58.A O no hydrogen 3.048 N/A HIS 63.A N LYS 59.A O no hydrogen 2.817 N/A HIS 63.A ND1 ASP 27.A OD1 no hydrogen 2.727 N/A THR 64.A N ARG 60.A O no hydrogen 3.309 N/A THR 64.A OG1 ARG 60.A O no hydrogen 2.779 N/A LEU 65.A N ALA 61.A O no hydrogen 2.983 N/A TRP 66.A N ILE 62.A O no hydrogen 2.880 N/A ASN 67.A N HIS 63.A O no hydrogen 3.063 N/A VAL 68.A N THR 64.A O no hydrogen 3.001 N/A LEU 69.A N LEU 65.A O no hydrogen 2.805 N/A ASP 70.A N TRP 66.A O no hydrogen 2.982 N/A GLU 71.A N ASN 67.A O no hydrogen 3.171 N/A LEU 72.A N VAL 68.A O no hydrogen 3.105 N/A ASP 73.A N ASP 70.A O no hydrogen 3.036 N/A GLN 74.A N LEU 69.A O no hydrogen 2.887 N/A GLN 74.A NE2 PHE 50.A O no hydrogen 2.858 N/A TRP 76.A NE1 ASP 73.A O no hydrogen 3.124 N/A LEU 77.A N GLN 74.A O no hydrogen 3.022 N/A GLU 80.A N ALA 53.A O no hydrogen 2.944 N/A SER 82.A N THR 55.A O no hydrogen 2.855 N/A LYS 84.A N SER 82.A OG no hydrogen 3.191 N/A LEU 85.A N SER 82.A O no hydrogen 3.102 N/A ASN 86.A N TRP 83.A O no hydrogen 2.950 N/A ASN 86.A ND2 TYR 138.A OH no hydrogen 2.993 N/A ARG 88.A N GLU 87.A OE1 no hydrogen 2.922 N/A ARG 88.A NH1.B TRP 113.A O no hydrogen 2.739 N/A ARG 88.A NH2.A ARG 114.A O no hydrogen 2.428 N/A ARG 88.A NH2.B TRP 113.A O no hydrogen 3.204 N/A HIS 89.A N GLU 150.A OE1 no hydrogen 2.844 N/A TYR 90.A N GLN 94.A OE1 no hydrogen 2.989 N/A GLY 91.A N HIS 89.A ND1 no hydrogen 3.141 N/A ALA 92.A N PRO 122.A O no hydrogen 2.849 N/A LEU 93.A N TYR 90.A O no hydrogen 3.044 N/A GLN 94.A N GLY 91.A O no hydrogen 3.212 N/A GLY 95.A N PHE 20.A O no hydrogen 2.854 N/A LEU 96.A N LEU 93.A O no hydrogen 2.977 N/A LYS 98.A N ASN 18.A O no hydrogen 2.876 N/A GLU 100.A N ASN 97.A OD1 no hydrogen 2.901 N/A THR 101.A N ASN 97.A O no hydrogen 2.963 N/A THR 101.A OG1 ASN 97.A O no hydrogen 2.745 N/A ALA 102.A N LYS 98.A O no hydrogen 2.978 N/A GLU 103.A N ALA 99.A O no hydrogen 2.963 N/A LYS 104.A N GLU 100.A O no hydrogen 3.039 N/A LYS 104.A NZ.B GLU 100.A O no hydrogen 2.889 N/A TYR 105.A N THR 101.A O no hydrogen 2.972 N/A GLY 106.A N ALA 102.A O no hydrogen 2.814 N/A GLN 109.A NE2 GLN 109.A O no hydrogen 3.093 N/A VAL 110.A N GLY 106.A O no hydrogen 3.040 N/A LYS 111.A N ASP 107.A O no hydrogen 2.975 N/A GLN 112.A N GLU 108.A O no hydrogen 2.956 N/A TRP 113.A N GLN 109.A O no hydrogen 2.929 N/A ARG 114.A N VAL 110.A O no hydrogen 2.860 N/A ARG 114.A NH1 VAL 241.A O no hydrogen 3.073 N/A ARG 114.A NH1 ASN 243.A OD1 no hydrogen 2.829 N/A ARG 114.A NH2 VAL 241.A O no hydrogen 3.194 N/A ARG 115.A N LYS 111.A O no hydrogen 2.950 N/A ARG 115.A NH1 LEU 202.A O no hydrogen 2.970 N/A ARG 115.A NH1 LEU 204.A O no hydrogen 2.964 N/A GLY 116.A N GLN 112.A O no hydrogen 2.883 N/A VAL 119.A N GLY 116.A O no hydrogen 3.143 N/A LEU 124.A N LEU 148.A O no hydrogen 3.009 N/A THR 125.A OG1.A ASP 127.A OD1 no hydrogen 2.556 N/A LYS 126.A NZ GLU 143.A OE2 no hydrogen 3.027 N/A ASP 128.A N THR 125.A O no hydrogen 3.109 N/A ARG 130.A N ASP 128.A OD1 no hydrogen 2.862 N/A ARG 130.A NE ASP 128.A OD1 no hydrogen 2.982 N/A ARG 130.A NH1 ALA 92.A O no hydrogen 3.009 N/A ARG 130.A NH1 GLN 94.A O no hydrogen 2.884 N/A ARG 130.A NH2 ASP 128.A OD2 no hydrogen 2.895 N/A TYR 131.A N ASP 128.A O no hydrogen 3.003 N/A HIS 134.A N TYR 131.A O no hydrogen 3.180 N/A HIS 134.A NE2 ASP 128.A O no hydrogen 2.978 N/A ASP 135.A N PRO 132.A O no hydrogen 3.061 N/A ARG 137.A N ASP 135.A OD1.A no hydrogen 2.491 N/A ARG 137.A N ASP 135.A OD1.B no hydrogen 3.275 N/A ARG 137.A NE ASP 135.A OD1.A no hydrogen 3.048 N/A ARG 137.A NE ASP 135.A OD1.B no hydrogen 3.104 N/A ARG 137.A NH1 ASP 25.A OD2 no hydrogen 2.738 N/A ARG 137.A NH1 VAL 57.A O no hydrogen 3.005 N/A ARG 137.A NH2 ASP 25.A OD2 no hydrogen 3.565 N/A ARG 137.A NH2 ASP 135.A OD1.B no hydrogen 3.550 N/A ARG 137.A NH2 ASP 135.A OD2.A no hydrogen 2.949 N/A TYR 138.A N ASP 135.A O no hydrogen 3.079 N/A ALA 139.A N PRO 136.A O no hydrogen 3.403 N/A LEU 141.A N TYR 138.A O no hydrogen 2.957 N/A SER 142.A N GLU 145.A OE1 no hydrogen 2.934 N/A SER 142.A OG GLU 145.A OE1 no hydrogen 3.428 N/A GLU 145.A N SER 142.A OG no hydrogen 3.091 N/A LEU 146.A N SER 142.A O no hydrogen 2.960 N/A THR 149.A OG1 PRO 121.A O no hydrogen 2.792 N/A GLU 150.A N HIS 89.A O no hydrogen 3.121 N/A ALA 153.A N PHE 117.A O no hydrogen 3.024 N/A LEU 154.A N SER 151.A OG no hydrogen 3.000 N/A THR 155.A N SER 151.A O no hydrogen 2.936 N/A THR 155.A OG1 SER 151.A O no hydrogen 2.901 N/A ILE 156.A N LEU 152.A O no hydrogen 2.906 N/A ASP 157.A N ALA 153.A O no hydrogen 3.160 N/A ARG 158.A N THR 155.A O no hydrogen 3.085 N/A ARG 158.A NE GLU 150.A OE2 no hydrogen 2.806 N/A ARG 158.A NH1 LYS 84.A O no hydrogen 2.884 N/A ARG 158.A NH1 ASN 86.A O no hydrogen 2.931 N/A ARG 158.A NH2 ASN 86.A O no hydrogen 3.066 N/A ARG 158.A NH2 GLU 87.A O no hydrogen 2.991 N/A ARG 158.A NH2 GLU 150.A OE1 no hydrogen 2.802 N/A ARG 158.A NH2 GLU 150.A OE2 no hydrogen 3.510 N/A VAL 159.A N THR 155.A O no hydrogen 2.921 N/A ILE 160.A N ILE 156.A O no hydrogen 3.031 N/A TYR 162.A OH GLU 80.A OE2 no hydrogen 2.694 N/A TRP 163.A N VAL 159.A O no hydrogen 2.926 N/A ASN 164.A N ILE 160.A O no hydrogen 2.910 N/A ASN 164.A ND2 TYR 192.A OH no hydrogen 3.256 N/A GLU 165.A N PRO 161.A O no hydrogen 2.816 N/A THR 166.A N TYR 162.A O no hydrogen 2.971 N/A ILE 167.A N TYR 162.A O no hydrogen 3.240 N/A LEU 168.A N TRP 163.A O no hydrogen 2.842 N/A ARG 170.A N THR 166.A O no hydrogen 3.396 N/A ARG 170.A NE TYR 54.A OH no hydrogen 2.987 N/A ARG 170.A NH1 GLU 175.A OE1 no hydrogen 3.161 N/A ARG 170.A NH1 GLU 175.A OE2 no hydrogen 3.397 N/A MET 171.A N ILE 167.A O no hydrogen 3.061 N/A LYS 172.A N LEU 168.A O no hydrogen 2.919 N/A SER 173.A N PRO 169.A O no hydrogen 3.079 N/A SER 173.A N ARG 170.A O no hydrogen 3.167 N/A SER 173.A OG ARG 170.A O no hydrogen 2.685 N/A GLY 174.A N MET 171.A O no hydrogen 3.024 N/A ARG 176.A N ASP 51.A OD2 no hydrogen 2.842 N/A ARG 176.A NE ASP 51.A OD2 no hydrogen 3.008 N/A ARG 176.A NH2 ASP 51.A OD1 no hydrogen 3.014 N/A ILE 178.A N PHE 52.A O no hydrogen 3.212 N/A ILE 179.A N VAL 6.A O no hydrogen 2.902 N/A ALA 180.A N TYR 54.A O no hydrogen 2.969 N/A ALA 181.A N VAL 8.A O no hydrogen 2.956 N/A HIS 182.A NE2 SER 56.A OG no hydrogen 2.826 N/A ASN 184.A N GLU 87.A OE1 no hydrogen 2.971 N/A ASN 184.A ND2.A GLU 87.A OE1 no hydrogen 2.836 N/A ASN 184.A ND2.B GLU 87.A OE1 no hydrogen 3.064 N/A SER 185.A OG LEU 85.A O no hydrogen 2.838 N/A SER 185.A OG HIS 182.A O no hydrogen 3.479 N/A LEU 186.A N HIS 182.A O no hydrogen 2.914 N/A ARG 187.A N GLY 183.A O no hydrogen 2.903 N/A ARG 187.A NE LEU 204.A O no hydrogen 2.998 N/A ARG 187.A NH1 ASN 184.A OD1.A no hydrogen 2.512 N/A ARG 187.A NH2 ILE 201.A O no hydrogen 2.908 N/A ALA 188.A N ASN 184.A O no hydrogen 2.937 N/A LEU 189.A N SER 185.A O no hydrogen 3.199 N/A VAL 190.A N LEU 186.A O no hydrogen 2.849 N/A LYS 191.A N ARG 187.A O no hydrogen 2.887 N/A LYS 191.A NZ.A MET 196.A O no hydrogen 3.001 N/A LYS 191.A NZ.B MET 196.A O no hydrogen 2.602 N/A TYR 192.A N ALA 188.A O no hydrogen 3.280 N/A LEU 193.A N LEU 189.A O no hydrogen 2.881 N/A ASP 194.A N VAL 190.A O no hydrogen 2.807 N/A MET 196.A N LYS 191.A O no hydrogen 3.050 N/A SER 197.A N GLU 200.A OE1 no hydrogen 3.005 N/A GLU 200.A N SER 197.A OG no hydrogen 3.056 N/A ILE 201.A N SER 197.A O no hydrogen 3.017 N/A LEU 202.A N GLU 198.A O no hydrogen 3.185 N/A GLU 203.A N GLU 200.A O no hydrogen 3.125 N/A LEU 204.A N ILE 201.A O no hydrogen 3.127 N/A ASN 205.A ND2 ALA 238.A O no hydrogen 3.152 N/A THR 208.A OG1 GLU 35.A OE1.A no hydrogen 2.768 N/A THR 208.A OG1 GLU 35.A OE1.B no hydrogen 2.796 N/A THR 208.A OG1 GLU 35.A OE2.A no hydrogen 3.447 N/A GLY 209.A N ARG 9.A O no hydrogen 2.961 N/A LEU 212.A N LEU 7.A O no hydrogen 2.891 N/A VAL 213.A N TYR 226.A O no hydrogen 2.840 N/A TYR 214.A N LEU 5.A O no hydrogen 2.879 N/A TYR 214.A OH ASP 194.A OD1 no hydrogen 2.679 N/A GLU 215.A N LYS 224.A O no hydrogen 2.934 N/A PHE 216.A N THR 3.A O no hydrogen 2.864 N/A ASP 217.A N LYS 221.A O no hydrogen 2.964 N/A ASN 219.A N ASP 217.A OD1 no hydrogen 2.775 N/A PHE 220.A N ASP 217.A O no hydrogen 2.892 N/A LYS 221.A N ASP 217.A OD1 no hydrogen 2.895 N/A LYS 221.A NZ PRO 222.A O no hydrogen 3.440 N/A LEU 223.A N GLU 215.A O no hydrogen 2.708 N/A ARG 225.A NE ASP 194.A OD1 no hydrogen 3.007 N/A ARG 225.A NH2 ASP 194.A OD1 no hydrogen 2.953 N/A TYR 226.A N VAL 213.A O no hydrogen 2.949 N/A TYR 226.A OH GLU 215.A OE2 no hydrogen 2.741 N/A LEU 228.A N PRO 211.A O no hydrogen 2.983 N/A GLU 233.A N ASN 230.A OD1 no hydrogen 3.000 N/A ILE 234.A N ASN 230.A O no hydrogen 2.926 N/A ALA 235.A N ALA 231.A O no hydrogen 2.882 N/A ALA 236.A N ASP 232.A O no hydrogen 3.133 N/A LYS 237.A N GLU 233.A O no hydrogen 3.056 N/A LYS 237.A NZ GLU 35.A OE2.A no hydrogen 2.805 N/A LYS 237.A NZ GLU 35.A OE2.B no hydrogen 3.160 N/A LYS 237.A NZ THR 208.A O no hydrogen 2.798 N/A LYS 237.A NZ THR 208.A OG1 no hydrogen 3.124 N/A ALA 238.A N ILE 234.A O no hydrogen 2.931 N/A ALA 238.A N ALA 235.A O no hydrogen 3.295 N/A ALA 239.A N ALA 236.A O no hydrogen 3.467 N/A ASN 243.A ND2 ASP 107.A O no hydrogen 3.286 N/A ASN 243.A ND2 ASP 107.A OD1.A no hydrogen 3.271 N/A ASN 243.A ND2 ASP 107.A OD1.B no hydrogen 2.540 N/A GLN 244.A NE2 ASP 107.A OD1.A no hydrogen 2.606 N/A GLN 244.A NE2 ASP 107.A OD1.B no hydrogen 3.200 N/A GLN 244.A NE2 ASP 107.A OD2.A no hydrogen 3.534 N/A GLY 245.A N ALA 242.A O no hydrogen 2.959 N/A