Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 4x41_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): LEU 7.A N HIS 3.A O no hydrogen 3.047 N/A LEU 7.A N GLU 4.A O no hydrogen 2.741 N/A LYS 8.A N GLU 4.A O no hydrogen 2.904 N/A LYS 8.A NZ GLU 4.A OE1 no hydrogen 3.388 N/A ARG 12.A NE GLU 102.A OE1 no hydrogen 3.340 N/A ARG 12.A NH1 MET 6.A O no hydrogen 2.403 N/A THR 13.A N ASP 9.A O no hydrogen 3.305 N/A THR 13.A OG1 ASP 9.A O no hydrogen 2.984 N/A THR 13.A OG1 GLU 10.A O no hydrogen 3.384 N/A LEU 14.A N GLU 10.A O no hydrogen 2.924 N/A THR 15.A OG1 VAL 11.A O no hydrogen 2.668 N/A TYR 16.A N ARG 12.A O no hydrogen 2.828 N/A TYR 16.A OH SER 101.A O no hydrogen 2.402 N/A TYR 16.A OH GLU 102.A OE1 no hydrogen 3.106 N/A ARG 17.A N THR 13.A O no hydrogen 2.997 N/A ASN 18.A N LEU 14.A O no hydrogen 2.500 N/A SER 19.A N TYR 16.A O no hydrogen 3.234 N/A SER 19.A OG THR 15.A O no hydrogen 3.276 N/A SER 19.A OG TYR 16.A O no hydrogen 2.373 N/A MET 20.A N ARG 17.A O no hydrogen 3.100 N/A TYR 21.A N ARG 17.A O no hydrogen 2.825 N/A ASN 23.A N MET 20.A O no hydrogen 3.120 N/A LYS 24.A NZ TYR 21.A O no hydrogen 2.559 N/A LYS 28.A N LYS 24.A O no hydrogen 3.143 N/A LYS 28.A NZ ASP 29.A OD2 no hydrogen 3.213 N/A ASP 29.A N GLY 50.A O no hydrogen 2.944 N/A LYS 30.A N PHE 27.A O no hydrogen 3.002 N/A VAL 31.A N ASP 97.A OD2 no hydrogen 3.006 N/A VAL 32.A N LYS 53.A O no hydrogen 2.888 N/A LEU 33.A N ILE 98.A O no hydrogen 2.588 N/A ASP 34.A N PHE 55.A O no hydrogen 2.634 N/A VAL 35.A N ILE 100.A O no hydrogen 2.993 N/A GLY 36.A N ILE 57.A O no hydrogen 2.970 N/A GLY 40.A N SER 37.A O no hydrogen 2.906 N/A SER 43.A OG GLY 40.A O no hydrogen 3.005 N/A MET 44.A N GLY 40.A O no hydrogen 3.076 N/A PHE 45.A N ILE 41.A O no hydrogen 3.313 N/A ALA 46.A N LEU 42.A O no hydrogen 3.177 N/A ALA 47.A N SER 43.A O no hydrogen 3.044 N/A LYS 48.A N MET 44.A O no hydrogen 2.904 N/A ALA 49.A N PHE 45.A O no hydrogen 2.886 N/A GLY 50.A N ALA 46.A O no hydrogen 3.340 N/A ALA 51.A N ALA 46.A O no hydrogen 3.345 N/A LYS 52.A N LYS 30.A O no hydrogen 2.963 N/A LYS 53.A N LYS 30.A O no hydrogen 3.518 N/A LYS 53.A NZ ASN 77.A O no hydrogen 3.530 N/A VAL 54.A N ILE 78.A O no hydrogen 3.371 N/A PHE 55.A N VAL 32.A O no hydrogen 2.842 N/A GLY 56.A N THR 80.A O no hydrogen 3.053 N/A ILE 57.A N ASP 34.A O no hydrogen 3.075 N/A GLU 58.A N PHE 82.A O no hydrogen 3.182 N/A SER 60.A N GLU 58.A OE2 no hydrogen 3.176 N/A SER 60.A OG GLU 58.A OE2 no hydrogen 3.211 N/A ILE 62.A N SER 60.A OG no hydrogen 3.205 N/A SER 63.A N SER 60.A O no hydrogen 3.359 N/A SER 63.A OG GLU 58.A O no hydrogen 3.457 N/A SER 63.A OG SER 60.A O no hydrogen 2.711 N/A ASP 64.A N SER 61.A O no hydrogen 3.345 N/A SER 66.A N ILE 62.A O no hydrogen 2.862 N/A SER 66.A OG SER 63.A O no hydrogen 2.516 N/A GLN 67.A N SER 63.A O no hydrogen 3.322 N/A GLN 67.A NE2 ILE 81.A O no hydrogen 3.357 N/A ILE 69.A N TYR 65.A O no hydrogen 3.076 N/A ILE 70.A N SER 66.A O no hydrogen 2.724 N/A LYS 71.A N GLN 67.A O no hydrogen 3.180 N/A ALA 72.A N LYS 68.A O no hydrogen 3.111 N/A ASN 73.A N ILE 69.A O no hydrogen 2.912 N/A ASN 73.A ND2 ILE 69.A O no hydrogen 2.846 N/A HIS 74.A N LYS 71.A O no hydrogen 3.410 N/A LEU 75.A N ILE 70.A O no hydrogen 2.922 N/A ILE 78.A N LEU 75.A O no hydrogen 3.322 N/A ILE 79.A N LEU 75.A O no hydrogen 3.046 N/A THR 80.A N VAL 54.A O no hydrogen 2.805 N/A PHE 82.A N GLY 56.A O no hydrogen 2.694 N/A LYS 83.A NZ ASP 64.A OD1 no hydrogen 3.530 N/A LYS 83.A NZ ASP 64.A OD2 no hydrogen 2.818 N/A GLY 84.A N GLU 58.A O no hydrogen 3.399 N/A VAL 89.A N LYS 85.A O no hydrogen 2.990 N/A VAL 96.A N TRP 124.A O no hydrogen 2.602 N/A ASP 97.A N VAL 31.A O no hydrogen 2.836 N/A ILE 98.A N VAL 31.A O no hydrogen 3.029 N/A ILE 99.A N LEU 130.A O no hydrogen 3.153 N/A ILE 100.A N LEU 33.A O no hydrogen 2.675 N/A SER 101.A N PHE 132.A O no hydrogen 2.864 N/A GLY 105.A N LEU 108.A O no hydrogen 3.087 N/A CYS 107.A SG THR 226.A OG1 no hydrogen 3.680 N/A LEU 108.A N GLY 105.A O no hydrogen 2.937 N/A PHE 109.A N CYS 107.A O no hydrogen 2.676 N/A TYR 110.A N TYR 106.A O no hydrogen 3.101 N/A SER 112.A OG PHE 109.A O no hydrogen 3.179 N/A MET 113.A N TRP 103.A O no hydrogen 3.207 N/A THR 116.A OG1 GLU 87.A OE1 no hydrogen 3.404 N/A VAL 117.A N MET 113.A O no hydrogen 2.616 N/A ILE 118.A N LEU 114.A O no hydrogen 2.796 N/A PHE 119.A N ASN 115.A O no hydrogen 3.277 N/A ALA 120.A N THR 116.A O no hydrogen 3.069 N/A ARG 121.A N VAL 117.A O no hydrogen 2.794 N/A ARG 121.A NE ASP 122.A OD1 no hydrogen 2.538 N/A ARG 121.A NH2 VAL 200.A O no hydrogen 2.774 N/A ASP 122.A N ILE 118.A O no hydrogen 2.966 N/A LYS 123.A N PHE 119.A O no hydrogen 3.028 N/A LYS 123.A NZ GLU 90.A OE2 no hydrogen 3.080 N/A TRP 124.A N ALA 120.A O no hydrogen 3.204 N/A LEU 125.A N ARG 121.A O no hydrogen 3.130 N/A LYS 126.A N VAL 96.A O no hydrogen 2.990 N/A GLY 129.A N LYS 126.A O no hydrogen 2.880 N/A LEU 130.A N ASP 97.A O no hydrogen 3.218 N/A MET 131.A N TYR 198.A OH no hydrogen 3.353 N/A PHE 132.A N ILE 99.A O no hydrogen 2.916 N/A ALA 136.A N VAL 195.A O no hydrogen 2.933 N/A ALA 137.A N ASN 229.A O no hydrogen 3.029 N/A LEU 138.A N LYS 193.A O no hydrogen 2.683 N/A TYR 139.A N TYR 227.A O no hydrogen 2.769 N/A VAL 140.A N CYS 190.A O no hydrogen 3.105 N/A VAL 141.A N VAL 225.A O no hydrogen 2.943 N/A ALA 142.A N THR 187.A OG1 no hydrogen 2.880 N/A ILE 143.A N ALA 223.A O no hydrogen 3.267 N/A LYS 152.A NZ GLN 147.A O no hydrogen 3.083 N/A LYS 152.A NZ ASP 150.A OD1 no hydrogen 3.319 N/A TRP 155.A N ASP 150.A O no hydrogen 3.273 N/A GLU 157.A N HIS 154.A O no hydrogen 2.768 N/A VAL 159.A N PHE 162.A O no hydrogen 2.750 N/A PHE 162.A N VAL 159.A O no hydrogen 2.993 N/A THR 165.A N ASP 163.A OD1 no hydrogen 2.982 N/A THR 165.A OG1 ASP 169.A OD1 no hydrogen 3.465 N/A ILE 167.A N MET 164.A O no hydrogen 3.334 N/A ARG 168.A NH1 THR 165.A OG1 no hydrogen 2.877 N/A ASP 169.A N THR 165.A O no hydrogen 3.315 N/A ALA 171.A N ILE 167.A O no hydrogen 2.858 N/A MET 172.A N ARG 168.A O no hydrogen 2.653 N/A LYS 173.A N ASP 169.A O no hydrogen 3.142 N/A LEU 176.A N VAL 256.A O no hydrogen 3.232 N/A ASP 178.A N GLN 254.A O no hydrogen 3.301 N/A VAL 180.A N GLN 254.A OE1 no hydrogen 2.936 N/A LYS 183.A N ASP 181.A OD1 no hydrogen 3.162 N/A GLN 184.A N ASP 181.A O no hydrogen 3.230 N/A VAL 185.A N PRO 182.A O no hydrogen 3.359 N/A VAL 186.A N ALA 142.A O no hydrogen 3.076 N/A THR 187.A OG1 ASN 188.A O no hydrogen 3.461 N/A ASN 188.A N ASN 188.A OD1 no hydrogen 2.445 N/A CYS 190.A N VAL 140.A O no hydrogen 3.280 N/A CYS 190.A SG LEU 191.A O no hydrogen 4.032 N/A CYS 190.A SG CYS 212.A O no hydrogen 3.628 N/A ILE 192.A N LEU 138.A O no hydrogen 3.088 N/A LYS 193.A N LEU 138.A O no hydrogen 3.402 N/A LYS 193.A NZ GLU 204.A O no hydrogen 3.108 N/A VAL 195.A N ALA 136.A O no hydrogen 2.612 N/A ILE 197.A N ASP 134.A O no hydrogen 3.233 N/A THR 199.A N ASP 196.A O no hydrogen 3.049 N/A THR 199.A OG1 ASP 196.A O no hydrogen 3.320 N/A THR 199.A OG1 ASP 196.A OD2 no hydrogen 3.013 N/A VAL 200.A N ASP 196.A O no hydrogen 2.726 N/A LYS 201.A N GLU 204.A OE2 no hydrogen 2.663 N/A THR 202.A OG1 GLU 203.A OE1 no hydrogen 3.112 N/A GLU 204.A N LYS 201.A O no hydrogen 2.967 N/A SER 206.A N GLU 203.A O no hydrogen 3.500 N/A PHE 207.A N MET 277.A O no hydrogen 3.244 N/A SER 209.A N ILE 275.A O no hydrogen 2.809 N/A SER 209.A OG ILE 192.A O no hydrogen 2.304 N/A PHE 211.A N GLY 273.A O no hydrogen 2.882 N/A LEU 213.A N ILE 271.A O no hydrogen 3.083 N/A GLN 214.A N ASN 188.A OD1 no hydrogen 2.906 N/A GLN 214.A NE2 GLU 270.A OE2 no hydrogen 3.372 N/A ILE 215.A N GLU 269.A O no hydrogen 2.790 N/A ARG 217.A NH1 LYS 183.A O no hydrogen 2.740 N/A ARG 217.A NH2 LYS 183.A O no hydrogen 2.724 N/A HIS 222.A N ILE 143.A O no hydrogen 3.416 N/A HIS 222.A ND1 ASP 145.A OD1 no hydrogen 2.361 N/A LEU 224.A N PHE 257.A O no hydrogen 2.848 N/A VAL 225.A N VAL 141.A O no hydrogen 2.778 N/A THR 226.A N THR 255.A O no hydrogen 2.982 N/A PHE 228.A N THR 243.A OG1 no hydrogen 2.919 N/A ASN 229.A N ALA 137.A O no hydrogen 2.651 N/A ILE 230.A N PHE 241.A O no hydrogen 3.078 N/A PHE 232.A N MET 239.A O no hydrogen 2.689 N/A THR 233.A N ASP 134.A OD1 no hydrogen 3.260 N/A THR 233.A N ASP 134.A OD2 no hydrogen 3.213 N/A THR 233.A OG1 ASP 134.A OD2 no hydrogen 2.433 N/A CYS 235.A SG LYS 237.A O no hydrogen 4.035 N/A LYS 238.A NZ GLU 231.A OE2 no hydrogen 2.927 N/A PHE 241.A N ILE 230.A O no hydrogen 3.177 N/A SER 242.A OG ASN 229.A OD1 no hydrogen 2.562 N/A THR 243.A N PHE 228.A O no hydrogen 3.131 N/A THR 243.A OG1 PHE 228.A O no hydrogen 3.204 N/A ALA 244.A N SER 242.A OG no hydrogen 3.158 N/A ALA 247.A N ALA 244.A O no hydrogen 2.816 N/A HIS 251.A N ASP 9.A OD2 no hydrogen 2.923 N/A HIS 251.A ND1 ASP 9.A OD2 no hydrogen 2.505 N/A TRP 252.A NE1 MET 104.A O no hydrogen 3.008 N/A LYS 253.A N THR 250.A O no hydrogen 2.889 N/A GLN 254.A NE2 THR 243.A O no hydrogen 2.676 N/A VAL 256.A N LEU 176.A O no hydrogen 3.003 N/A PHE 257.A N LEU 224.A O no hydrogen 2.695 N/A TYR 258.A OH ASP 145.A OD2 no hydrogen 3.125 N/A LEU 259.A N HIS 222.A O no hydrogen 2.807 N/A TYR 262.A OH ASP 145.A O no hydrogen 2.256 N/A TYR 262.A OH ASP 145.A OD1 no hydrogen 3.288 N/A LEU 263.A N VAL 221.A O no hydrogen 3.321 N/A VAL 265.A N ASP 219.A O no hydrogen 2.882 N/A ARG 266.A N GLU 269.A OE1 no hydrogen 3.024 N/A ARG 266.A NE GLN 298.A OE1 no hydrogen 3.268 N/A ARG 267.A N ASN 218.A OD1 no hydrogen 2.985 N/A GLY 268.A N ILE 215.A O no hydrogen 2.925 N/A GLU 269.A N ARG 266.A O no hydrogen 3.380 N/A ILE 271.A N LEU 213.A O no hydrogen 2.695 N/A TYR 272.A N ASP 294.A O no hydrogen 3.154 N/A GLY 273.A N PHE 211.A O no hydrogen 3.157 N/A THR 274.A N ASP 292.A O no hydrogen 3.206 N/A ILE 275.A N SER 209.A O no hydrogen 2.935 N/A SER 276.A N THR 290.A O no hydrogen 3.000 N/A MET 277.A N PHE 207.A O no hydrogen 3.134 N/A LYS 278.A N ASP 288.A O no hydrogen 2.986 N/A ASN 280.A N ASP 286.A O no hydrogen 2.982 N/A ASP 286.A N ASN 283.A O no hydrogen 3.208 N/A ASP 288.A N LYS 278.A O no hydrogen 2.988 N/A PHE 289.A N TYR 308.A O no hydrogen 2.914 N/A THR 290.A N SER 276.A O no hydrogen 3.058 N/A THR 290.A OG1 PHE 289.A O no hydrogen 2.741 N/A VAL 291.A N ASN 306.A O no hydrogen 3.292 N/A ASP 292.A N THR 274.A O no hydrogen 2.889 N/A LEU 293.A N VAL 304.A O no hydrogen 2.763 N/A ASP 294.A N TYR 272.A O no hydrogen 2.526 N/A PHE 295.A N THR 302.A O no hydrogen 2.833 N/A LYS 296.A N GLU 270.A O no hydrogen 3.301 N/A LYS 296.A NZ ASP 294.A OD2 no hydrogen 3.069 N/A LYS 296.A NZ GLU 301.A OE2 no hydrogen 2.878 N/A THR 302.A N PHE 295.A O no hydrogen 3.131 N/A SER 303.A OG LEU 293.A O no hydrogen 2.895 N/A VAL 304.A N LEU 293.A O no hydrogen 2.961 N/A SER 305.A OG ASP 292.A OD1 no hydrogen 2.533 N/A ASN 306.A N VAL 291.A O no hydrogen 3.091 N/A TYR 308.A N PHE 289.A O no hydrogen 3.020 N/A TYR 308.A OH TYR 258.A O no hydrogen 2.654 N/A MET 310.A N LEU 287.A O no hydrogen 2.994 N/A ARG 311.A N GLU 174.A OE2 no hydrogen 3.306 N/A