Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4r77_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LYS 5.A N SER 1.A O no hydrogen 3.085 N/A ILE 6.A N HIS 2.A O no hydrogen 3.006 N/A ILE 7.A N MET 3.A O no hydrogen 3.175 N/A LYS 8.A N GLU 4.A O no hydrogen 3.324 N/A GLU 9.A N LYS 5.A O no hydrogen 3.107 N/A LYS 10.A N ILE 6.A O no hydrogen 2.969 N/A ILE 11.A N ILE 7.A O no hydrogen 3.092 N/A SER 12.A OG GLU 9.A O no hydrogen 3.417 N/A LEU 14.A N ILE 11.A O no hydrogen 2.986 N/A LEU 15.A N SER 12.A O no hydrogen 3.039 N/A LEU 18.A N LYS 34.A O no hydrogen 2.876 N/A SER 19.A N LYS 34.A O no hydrogen 3.383 N/A GLU 21.A N LEU 32.A O no hydrogen 2.962 N/A GLN 22.A NE2 ASN 28.A O no hydrogen 2.843 N/A LEU 23.A N ASN 30.A O no hydrogen 2.925 N/A THR 27.A OG1 MET 26.A O no hydrogen 3.430 N/A ASN 30.A ND2 GLY 24.A O no hydrogen 3.671 N/A TYR 31.A N VAL 42.A O no hydrogen 2.780 N/A LEU 32.A N GLU 21.A O no hydrogen 2.750 N/A ALA 33.A N TYR 40.A O no hydrogen 2.805 N/A LYS 34.A N SER 19.A O no hydrogen 2.719 N/A THR 35.A N LYS 38.A O no hydrogen 2.903 N/A THR 36.A N GLU 16.A O no hydrogen 3.257 N/A THR 36.A OG1 ASN 37.A OD1 no hydrogen 3.392 N/A LYS 38.A NZ TYR 75.A OH no hydrogen 2.883 N/A TYR 40.A N ALA 33.A O no hydrogen 2.819 N/A ILE 41.A N ASN 86.A O no hydrogen 2.782 N/A VAL 42.A N TYR 31.A O no hydrogen 2.807 N/A LYS 43.A N LYS 84.A O no hydrogen 2.658 N/A LYS 43.A NZ ASP 192.A OD1 no hydrogen 3.079 N/A PHE 44.A N GLN 29.A O no hydrogen 2.678 N/A PHE 45.A N GLY 82.A O no hydrogen 2.956 N/A LEU 52.A N THR 49.A O no hydrogen 3.070 N/A ILE 53.A N THR 49.A O no hydrogen 2.692 N/A ASP 57.A N ASN 54.A OD1 no hydrogen 2.847 N/A GLU 58.A N ASN 54.A O no hydrogen 2.857 N/A LYS 59.A N ARG 55.A O no hydrogen 2.858 N/A LYS 59.A NZ PHE 77.A O no hydrogen 2.901 N/A TYR 60.A N GLN 56.A O no hydrogen 3.033 N/A ASN 61.A N ASP 57.A O no hydrogen 2.881 N/A ASN 61.A ND2 ARG 122.A O no hydrogen 3.123 N/A LEU 62.A N GLU 58.A O no hydrogen 2.864 N/A GLU 63.A N LYS 59.A O no hydrogen 3.154 N/A LEU 64.A N TYR 60.A O no hydrogen 2.831 N/A LEU 65.A N ASN 61.A O no hydrogen 3.102 N/A LEU 68.A N LEU 65.A O no hydrogen 2.969 N/A GLY 69.A N LYS 66.A O no hydrogen 3.139 N/A VAL 72.A N ASP 71.A OD1 no hydrogen 2.801 N/A LYS 73.A N GLU 87.A OE1 no hydrogen 2.969 N/A ASN 74.A ND2 LEU 76.A O no hydrogen 3.114 N/A ASN 74.A ND2 ASN 86.A OD1 no hydrogen 2.697 N/A TYR 75.A N VAL 85.A O no hydrogen 2.836 N/A LEU 76.A N VAL 85.A O no hydrogen 3.248 N/A ASP 78.A N ILE 83.A O no hydrogen 2.910 N/A ALA 81.A N ASP 78.A OD2 no hydrogen 3.305 N/A GLY 82.A N ILE 79.A O no hydrogen 2.921 N/A ILE 83.A N ASP 78.A O no hydrogen 2.992 N/A LYS 84.A N LYS 43.A O no hydrogen 2.791 N/A LYS 84.A NZ GLU 194.A OE2 no hydrogen 3.443 N/A VAL 85.A N LEU 76.A O no hydrogen 2.806 N/A ASN 86.A N ILE 41.A O no hydrogen 2.741 N/A GLU 87.A N LYS 73.A O no hydrogen 2.810 N/A ALA 92.A N ILE 89.A O no hydrogen 3.360 N/A ILE 93.A N GLU 182.A O no hydrogen 2.777 N/A LEU 95.A N PHE 180.A O no hydrogen 2.867 N/A ASP 96.A N SER 99.A OG no hydrogen 2.965 N/A THR 98.A N ASP 96.A OD1 no hydrogen 2.834 N/A SER 99.A N ASP 96.A OD1 no hydrogen 3.064 N/A SER 99.A OG ASP 96.A O no hydrogen 3.560 N/A ILE 100.A N ASP 96.A O no hydrogen 2.962 N/A LYS 101.A N THR 98.A O no hydrogen 3.260 N/A LYS 101.A NZ SER 97.A O no hydrogen 3.485 N/A LYS 101.A NZ SER 212.A O no hydrogen 3.001 N/A LYS 101.A NZ GLU 213.A O no hydrogen 3.204 N/A LYS 101.A NZ GLU 218.A OE1 no hydrogen 3.415 N/A THR 102.A N SER 99.A O no hydrogen 2.956 N/A THR 102.A OG1 SER 99.A O no hydrogen 2.602 N/A LYS 103.A N ILE 100.A O no hydrogen 3.102 N/A LYS 103.A NZ GLU 182.A OE1 no hydrogen 3.380 N/A LYS 103.A NZ GLU 182.A OE2 no hydrogen 3.203 N/A LYS 106.A N LYS 103.A O no hydrogen 2.861 N/A LYS 106.A NZ GLU 182.A OE2 no hydrogen 2.820 N/A LYS 106.A NZ GLY 186.A O no hydrogen 3.107 N/A ILE 107.A N LYS 103.A O no hydrogen 2.851 N/A ALA 108.A N PHE 104.A O no hydrogen 2.896 N/A ILE 110.A N LYS 106.A O no hydrogen 3.356 N/A LEU 111.A N ILE 107.A O no hydrogen 2.916 N/A GLN 112.A N ALA 108.A O no hydrogen 2.847 N/A GLN 112.A NE2 TYR 226.A O no hydrogen 2.872 N/A THR 113.A N PRO 109.A O no hydrogen 2.931 N/A THR 113.A OG1 PRO 109.A O no hydrogen 2.791 N/A ILE 114.A N ILE 110.A O no hydrogen 3.159 N/A HIS 115.A N LEU 111.A O no hydrogen 2.926 N/A HIS 115.A ND1 TYR 226.A OH no hydrogen 2.674 N/A HIS 115.A NE2 ASP 204.A OD2 no hydrogen 2.808 N/A THR 116.A N GLN 112.A O no hydrogen 2.924 N/A THR 116.A OG1 GLN 112.A O no hydrogen 2.621 N/A SER 117.A N ILE 114.A O no hydrogen 3.178 N/A SER 117.A OG ILE 114.A O no hydrogen 2.943 N/A SER 117.A OG SER 170.A OG no hydrogen 2.919 N/A LYS 119.A N SER 117.A OG no hydrogen 2.988 N/A LYS 119.A NZ ASP 67.A OD1 no hydrogen 3.187 N/A LYS 119.A NZ ASP 67.A OD2 no hydrogen 2.947 N/A ARG 122.A N ASN 61.A OD1 no hydrogen 2.826 N/A ARG 122.A NH1 ASP 57.A OD1 no hydrogen 2.987 N/A PHE 125.A N MET 198.A O no hydrogen 2.672 N/A GLU 130.A N ALA 126.A O no hydrogen 2.907 N/A ILE 131.A N PRO 127.A O no hydrogen 2.968 N/A LYS 132.A N PHE 128.A O no hydrogen 3.105 N/A LYS 133.A N GLU 129.A O no hydrogen 2.903 N/A LYS 133.A NZ LEU 52.A O no hydrogen 3.559 N/A LYS 133.A NZ GLU 130.A OE1 no hydrogen 2.800 N/A TYR 134.A N GLU 130.A O no hydrogen 3.044 N/A GLU 135.A N ILE 131.A O no hydrogen 3.021 N/A SER 136.A N LYS 132.A O no hydrogen 2.972 N/A LEU 137.A N LYS 133.A O no hydrogen 2.929 N/A ILE 138.A N TYR 134.A O no hydrogen 2.810 N/A GLU 139.A N GLU 258.A OE1 no hydrogen 2.948 N/A GLU 140.A N GLU 258.A OE2 no hydrogen 2.986 N/A TYR 144.A OH SER 250.A O no hydrogen 2.532 N/A TYR 147.A OH GLU 135.A OE2 no hydrogen 2.431 N/A VAL 150.A N ASN 146.A O no hydrogen 2.960 N/A ARG 151.A N TYR 147.A O no hydrogen 2.702 N/A ARG 151.A NE GLU 135.A OE1 no hydrogen 3.247 N/A ARG 151.A NE GLU 135.A OE2 no hydrogen 2.621 N/A ARG 151.A NH2 GLU 135.A OE1 no hydrogen 2.996 N/A ASN 152.A N GLU 148.A O no hydrogen 3.150 N/A ALA 153.A N SER 149.A O no hydrogen 3.121 N/A VAL 154.A N VAL 150.A O no hydrogen 2.805 N/A PHE 155.A N ARG 151.A O no hydrogen 2.851 N/A SER 156.A N ASN 152.A O no hydrogen 3.179 N/A SER 156.A OG ASN 152.A O no hydrogen 3.201 N/A LEU 157.A N VAL 154.A O no hydrogen 2.956 N/A GLU 158.A N PHE 155.A O no hydrogen 3.200 N/A LYS 159.A NZ ASP 163.A OD2 no hydrogen 2.805 N/A ARG 160.A NE GLU 236.A OE2 no hydrogen 2.815 N/A ARG 160.A NH2 GLU 236.A OE1 no hydrogen 2.816 N/A ARG 160.A NH2 GLU 236.A OE2 no hydrogen 3.333 N/A LEU 161.A N LEU 157.A O no hydrogen 2.818 N/A ALA 162.A N GLU 158.A O no hydrogen 2.977 N/A ASP 163.A N LYS 159.A O no hydrogen 2.894 N/A LEU 164.A N ARG 160.A O no hydrogen 2.963 N/A GLY 165.A N LEU 161.A O no hydrogen 2.912 N/A GLY 165.A N ALA 162.A O no hydrogen 3.302 N/A ASP 167.A N ASP 200.A OD2 no hydrogen 2.743 N/A ARG 168.A NH1 GLU 120.A OE1 no hydrogen 2.834 N/A ARG 168.A NH2 GLU 124.A OE2 no hydrogen 2.751 N/A LYS 169.A N ASN 199.A O no hydrogen 2.790 N/A SER 170.A OG ILE 114.A O no hydrogen 2.694 N/A SER 170.A OG SER 117.A OG no hydrogen 2.919 N/A CYS 171.A N SER 197.A O no hydrogen 3.167 N/A CYS 171.A SG LYS 169.A O no hydrogen 3.594 N/A HIS 172.A N ASP 204.A OD2 no hydrogen 2.834 N/A HIS 172.A NE2 ILE 191.A O no hydrogen 2.854 N/A ILE 173.A N ASP 204.A OD1 no hydrogen 2.790 N/A ASP 174.A N HIS 172.A ND1 no hydrogen 3.048 N/A ASN 179.A N VAL 176.A O no hydrogen 3.067 N/A ASN 179.A ND2 ASP 174.A O no hydrogen 2.819 N/A ASN 179.A ND2 ASP 174.A OD2 no hydrogen 3.543 N/A PHE 180.A N PRO 177.A O no hydrogen 3.058 N/A ILE 181.A N TYR 189.A O no hydrogen 2.984 N/A GLU 182.A N ILE 93.A O no hydrogen 2.731 N/A SER 183.A N ARG 187.A O no hydrogen 3.005 N/A SER 183.A OG ARG 187.A O no hydrogen 3.479 N/A GLY 186.A N SER 183.A O no hydrogen 2.731 N/A ARG 187.A NH2 GLY 69.A O no hydrogen 2.637 N/A TYR 189.A N ILE 181.A O no hydrogen 2.768 N/A LEU 190.A N LEU 70.A O no hydrogen 2.820 N/A ILE 191.A N ASN 179.A O no hydrogen 2.818 N/A TRP 193.A NE1 LEU 190.A O no hydrogen 2.721 N/A GLU 194.A N GLU 194.A OE1 no hydrogen 3.048 N/A SER 196.A N TRP 193.A O no hydrogen 3.130 N/A SER 196.A OG CYS 171.A O no hydrogen 2.688 N/A SER 197.A N CYS 171.A O no hydrogen 3.280 N/A MET 198.A N GLY 123.A O no hydrogen 2.878 N/A ASN 199.A N LYS 169.A O no hydrogen 2.864 N/A ASP 200.A N ASN 199.A OD1 no hydrogen 2.803 N/A MET 202.A N ASP 200.A OD1 no hydrogen 2.851 N/A TRP 203.A N ASP 200.A O no hydrogen 2.812 N/A TRP 203.A NE1 ILE 173.A O no hydrogen 3.134 N/A LEU 205.A N PRO 201.A O no hydrogen 3.137 N/A ALA 206.A N MET 202.A O no hydrogen 2.869 N/A ALA 207.A N TRP 203.A O no hydrogen 2.823 N/A LEU 208.A N ASP 204.A O no hydrogen 2.912 N/A PHE 209.A N LEU 205.A O no hydrogen 2.971 N/A LEU 210.A N ALA 206.A O no hydrogen 2.801 N/A GLU 211.A N ALA 207.A O no hydrogen 2.858 N/A GLU 213.A N LEU 210.A O no hydrogen 3.214 N/A PHE 214.A N PHE 209.A O no hydrogen 2.946 N/A THR 215.A N GLU 218.A OE1 no hydrogen 2.701 N/A GLU 218.A N THR 215.A OG1 no hydrogen 2.970 N/A GLU 219.A N THR 215.A O no hydrogen 2.926 N/A GLU 220.A N SER 216.A O no hydrogen 3.075 N/A THR 221.A N GLN 217.A O no hydrogen 2.927 N/A THR 221.A OG1 GLN 217.A O no hydrogen 3.057 N/A THR 221.A OG1 GLN 217.A OE1 no hydrogen 3.237 N/A PHE 222.A N GLU 218.A O no hydrogen 2.824 N/A LEU 223.A N GLU 219.A O no hydrogen 2.831 N/A SER 224.A N GLU 220.A O no hydrogen 3.049 N/A SER 224.A OG THR 221.A O no hydrogen 2.743 N/A HIS 225.A N THR 221.A O no hydrogen 3.364 N/A HIS 225.A N PHE 222.A O no hydrogen 2.975 N/A TYR 226.A N PHE 222.A O no hydrogen 2.984 N/A TYR 226.A N LEU 223.A O no hydrogen 3.102 N/A TYR 226.A OH HIS 115.A ND1 no hydrogen 2.674 N/A GLU 227.A N LEU 223.A O no hydrogen 2.699 N/A SER 228.A N THR 231.A O no hydrogen 3.216 N/A SER 228.A OG THR 231.A OG1 no hydrogen 2.614 N/A THR 231.A N SER 228.A O no hydrogen 2.993 N/A THR 231.A N SER 228.A OG no hydrogen 3.176 N/A THR 231.A OG1 TYR 226.A O no hydrogen 2.738 N/A THR 231.A OG1 SER 228.A OG no hydrogen 2.614 N/A LYS 237.A N SER 234.A OG no hydrogen 3.189 N/A LYS 237.A NZ GLY 165.A O no hydrogen 2.633 N/A LYS 237.A NZ ASP 200.A OD2 no hydrogen 2.691 N/A ILE 238.A N SER 234.A O no hydrogen 3.218 N/A ALA 239.A N HIS 235.A O no hydrogen 3.170 N/A ILE 240.A N GLU 236.A O no hydrogen 3.031 N/A TYR 241.A N LYS 237.A O no hydrogen 2.828 N/A LYS 242.A N ILE 238.A O no hydrogen 2.991 N/A LYS 242.A NZ GLU 219.A OE2 no hydrogen 2.417 N/A LEU 244.A N ILE 240.A O no hydrogen 3.037 N/A GLN 245.A N TYR 241.A O no hydrogen 2.820 N/A GLN 245.A NE2 TRP 203.A O no hydrogen 2.753 N/A ASP 246.A N LYS 242.A O no hydrogen 3.008 N/A THR 247.A N ILE 243.A O no hydrogen 3.017 N/A THR 247.A OG1 ILE 243.A O no hydrogen 2.859 N/A ILE 248.A N LEU 244.A O no hydrogen 2.815 N/A TRP 249.A N GLN 245.A O no hydrogen 2.833 N/A SER 250.A N ASP 246.A O no hydrogen 2.951 N/A SER 250.A OG ASP 246.A O no hydrogen 3.394 N/A SER 250.A OG THR 247.A O no hydrogen 2.859 N/A LEU 251.A N THR 247.A O no hydrogen 3.154 N/A TRP 252.A N ILE 248.A O no hydrogen 2.819 N/A THR 253.A N TRP 249.A O no hydrogen 2.926 N/A THR 253.A OG1 TRP 249.A O no hydrogen 2.741 N/A VAL 254.A N SER 250.A O no hydrogen 3.278 N/A TYR 255.A N LEU 251.A O no hydrogen 3.034 N/A TYR 255.A OH GLY 48.A O no hydrogen 2.835 N/A LYS 256.A N TRP 252.A O no hydrogen 2.880 N/A GLU 257.A N THR 253.A O no hydrogen 2.885 N/A GLU 258.A N VAL 254.A O no hydrogen 3.123 N/A GLN 259.A N TYR 255.A O no hydrogen 3.143 N/A GLN 259.A N LYS 256.A O no hydrogen 3.070 N/A GLU 261.A N LYS 256.A O no hydrogen 3.152 N/A PHE 263.A N GLU 257.A OE2 no hydrogen 2.987 N/A GLY 264.A N ASP 262.A OD1 no hydrogen 3.235 N/A TYR 266.A N PHE 263.A O no hydrogen 3.033 N/A ASN 269.A N ASP 265.A O no hydrogen 2.874 N/A ARG 270.A N TYR 266.A O no hydrogen 3.049 N/A ARG 270.A NE ASP 246.A OD1 no hydrogen 2.955 N/A ARG 270.A NH1 GLU 211.A OE2 no hydrogen 3.566 N/A ARG 270.A NH1 ASP 246.A OD1 no hydrogen 3.140 N/A ARG 270.A NH2 GLU 211.A OE2 no hydrogen 2.724 N/A ARG 270.A NH2 TYR 266.A OH no hydrogen 2.910 N/A TYR 271.A N GLY 267.A O no hydrogen 2.880 N/A TYR 271.A OH ALA 145.A O no hydrogen 2.813 N/A GLN 272.A N VAL 268.A O no hydrogen 2.898 N/A ARG 273.A N ASN 269.A O no hydrogen 3.154 N/A ARG 273.A NE ASP 246.A OD1 no hydrogen 3.220 N/A ARG 273.A NE ASP 246.A OD2 no hydrogen 2.881 N/A ARG 273.A NH2 ASP 246.A OD1 no hydrogen 2.854 N/A ALA 274.A N ARG 270.A O no hydrogen 2.939 N/A VAL 275.A N TYR 271.A O no hydrogen 2.983 N/A LYS 276.A N GLN 272.A O no hydrogen 2.925 N/A GLY 277.A N ARG 273.A O no hydrogen 2.760 N/A LEU 278.A N ALA 274.A O no hydrogen 2.887 N/A ALA 279.A N VAL 275.A O no hydrogen 3.056 N/A SER 280.A N LYS 276.A O no hydrogen 2.975 N/A SER 280.A OG LYS 276.A O no hydrogen 2.843 N/A TYR 281.A N GLY 277.A O no hydrogen 2.918 N/A TYR 281.A OH GLU 236.A OE2 no hydrogen 2.503 N/A