Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 6kr4_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): HIS 1.A N GLU 28.A OE1 no hydrogen 2.852 N/A ILE 5.A N VAL 247.A O no hydrogen 2.671 N/A ILE 7.A N LYS 245.A O no hydrogen 3.277 N/A ASP 9.A N PRO 6.A O no hydrogen 2.795 N/A LEU 10.A N ILE 7.A O no hydrogen 3.194 N/A ASN 13.A N ASP 9.A O no hydrogen 3.024 N/A ASN 13.A ND2 ASP 9.A O no hydrogen 2.755 N/A ILE 14.A N LEU 10.A O no hydrogen 2.914 N/A GLU 15.A N ALA 11.A O no hydrogen 2.983 N/A ARG 16.A N ASP 12.A O no hydrogen 3.077 N/A LEU 17.A N ASN 13.A O no hydrogen 2.958 N/A LYS 18.A N ILE 14.A O no hydrogen 2.954 N/A LYS 18.A NZ GLU 275.A OE1 no hydrogen 2.703 N/A ALA 19.A N GLU 15.A O no hydrogen 3.089 N/A ALA 19.A N ARG 16.A O no hydrogen 3.388 N/A GLY 22.A N ALA 19.A O no hydrogen 2.813 N/A LEU 23.A N ALA 19.A O no hydrogen 3.231 N/A PHE 25.A N LEU 17.A O no hydrogen 3.127 N/A SER 26.A N GLY 22.A O no hydrogen 3.182 N/A SER 26.A OG GLY 22.A O no hydrogen 3.218 N/A SER 26.A OG GLU 267.A OE1 no hydrogen 2.839 N/A SER 26.A OG GLU 267.A OE2 no hydrogen 3.262 N/A GLN 27.A N LEU 23.A O no hydrogen 3.009 N/A GLU 28.A N LYS 24.A O no hydrogen 3.074 N/A TYR 29.A N PHE 25.A O no hydrogen 2.848 N/A TYR 29.A OH VAL 264.A O no hydrogen 2.934 N/A GLU 30.A N SER 26.A O no hydrogen 2.813 N/A SER 31.A N GLU 28.A O no hydrogen 3.086 N/A SER 31.A OG GLU 28.A O no hydrogen 2.889 N/A SER 31.A OG TYR 250.A OH no hydrogen 2.870 N/A GLY 35.A N ASP 33.A OD1 no hydrogen 2.731 N/A GLN 36.A NE2 SER 258.A OG no hydrogen 3.288 N/A THR 39.A OG1 ASP 61.A OD2 no hydrogen 2.759 N/A GLU 41.A N ASP 61.A OD2 no hydrogen 2.742 N/A ASN 42.A N ASP 61.A OD1 no hydrogen 3.353 N/A ASN 42.A ND2 ASP 61.A OD1 no hydrogen 2.800 N/A SER 43.A OG ALA 59.A O no hydrogen 3.518 N/A SER 43.A OG TYR 78.A OH no hydrogen 2.598 N/A ASN 44.A N GLU 41.A O no hydrogen 3.349 N/A ASN 48.A N LEU 45.A O no hydrogen 2.893 N/A ASN 48.A ND2 ASN 42.A O no hydrogen 2.696 N/A LYS 49.A N LEU 45.A O no hydrogen 2.909 N/A LYS 51.A N ASN 48.A O no hydrogen 2.793 N/A LYS 51.A NZ ASN 48.A OD1 no hydrogen 3.090 N/A ASN 52.A N LYS 49.A O no hydrogen 3.081 N/A ASN 52.A ND2 SER 43.A O no hydrogen 3.150 N/A ARG 53.A N GLN 97.A OE1 no hydrogen 2.958 N/A ARG 53.A NE GLY 98.A O no hydrogen 3.036 N/A ARG 53.A NH2 GLY 98.A O no hydrogen 2.683 N/A ARG 53.A NH2 ASP 134.A OD1 no hydrogen 3.278 N/A ASN 56.A N ASN 56.A OD1 no hydrogen 2.649 N/A VAL 57.A N TYR 54.A O no hydrogen 3.082 N/A ILE 58.A N ASN 261.A OD1 no hydrogen 3.047 N/A ALA 59.A N SER 43.A OG no hydrogen 3.073 N/A ASP 61.A N THR 39.A O no hydrogen 2.830 N/A HIS 62.A NE2 SER 258.A O no hydrogen 2.596 N/A SER 63.A N TYR 60.A O no hydrogen 3.437 N/A SER 63.A OG GLN 259.A O no hydrogen 2.485 N/A ARG 64.A NH1 ASP 77.A O no hydrogen 3.286 N/A ARG 64.A NH2 ASP 77.A OD2 no hydrogen 2.709 N/A VAL 65.A N ALA 81.A O no hydrogen 2.876 N/A LEU 67.A N ASP 77.A O no hydrogen 3.080 N/A THR 68.A N GLU 113.A OE1 no hydrogen 3.111 N/A THR 68.A OG1 GLU 113.A OE2 no hydrogen 2.659 N/A VAL 73.A N ILE 70.A O no hydrogen 2.990 N/A SER 76.A OG ILE 70.A O no hydrogen 3.449 N/A SER 76.A OG VAL 73.A O no hydrogen 2.278 N/A TYR 78.A N GLY 75.A O no hydrogen 3.113 N/A TYR 78.A OH SER 43.A OG no hydrogen 2.598 N/A TYR 78.A OH ASN 52.A OD1 no hydrogen 2.807 N/A ASN 80.A ND2 ASN 52.A OD1 no hydrogen 3.037 N/A ASN 80.A ND2 VAL 57.A O no hydrogen 2.951 N/A ASN 82.A N ALA 95.A O no hydrogen 3.078 N/A ASN 82.A ND2 TYR 60.A O no hydrogen 3.123 N/A ASN 82.A ND2 SER 63.A OG no hydrogen 2.709 N/A TYR 83.A N SER 63.A O no hydrogen 3.010 N/A TYR 83.A OH GLN 114.A OE1 no hydrogen 2.597 N/A ILE 84.A N TYR 93.A O no hydrogen 2.931 N/A ASP 85.A N GLN 259.A OE1 no hydrogen 3.189 N/A GLY 86.A N LYS 89.A O no hydrogen 2.706 N/A TYR 87.A OH HIS 243.A ND1 no hydrogen 2.822 N/A TYR 87.A OH GLU 244.A OE2 no hydrogen 2.626 N/A LYS 89.A NZ GLU 239.A OE2 no hydrogen 3.413 N/A ASN 91.A N ASP 85.A OD1 no hydrogen 3.018 N/A TYR 93.A N ILE 84.A O no hydrogen 2.958 N/A TYR 93.A OH ASP 235.A OD2 no hydrogen 2.483 N/A ILE 94.A N MET 217.A O no hydrogen 2.837 N/A ALA 95.A N ASN 82.A O no hydrogen 2.946 N/A THR 96.A N VAL 219.A O no hydrogen 3.104 N/A THR 96.A OG1 ASN 80.A O no hydrogen 3.118 N/A THR 96.A OG1 GLN 97.A O no hydrogen 3.191 N/A GLN 97.A NE2 LYS 51.A O no hydrogen 2.989 N/A GLY 98.A N SER 222.A O no hydrogen 3.254 N/A LEU 100.A N THR 103.A OG1 no hydrogen 3.214 N/A THR 103.A N LEU 100.A O no hydrogen 2.941 N/A PHE 107.A N THR 103.A O no hydrogen 2.806 N/A TRP 108.A N MET 104.A O no hydrogen 3.037 N/A TRP 108.A NE1 TYR 136.A O no hydrogen 2.918 N/A ARG 109.A N GLY 105.A O no hydrogen 3.058 N/A ARG 109.A NH1 THR 68.A O no hydrogen 2.859 N/A ARG 109.A NH2 THR 68.A O no hydrogen 3.354 N/A ARG 109.A NH2 SER 76.A O no hydrogen 2.715 N/A MET 110.A N ASP 106.A O no hydrogen 2.875 N/A VAL 111.A N PHE 107.A O no hydrogen 3.222 N/A TRP 112.A N TRP 108.A O no hydrogen 3.044 N/A GLU 113.A N ARG 109.A O no hydrogen 2.972 N/A GLN 114.A N MET 110.A O no hydrogen 2.932 N/A ARG 115.A N TRP 112.A O no hydrogen 2.998 N/A THR 116.A N VAL 111.A O no hydrogen 3.047 N/A THR 116.A OG1 PRO 216.A O no hydrogen 2.626 N/A THR 118.A OG1 ASN 210.A OD1 no hydrogen 2.534 N/A VAL 119.A N ARG 180.A O no hydrogen 2.970 N/A VAL 120.A N VAL 218.A O no hydrogen 2.733 N/A MET 121.A N PHE 182.A O no hydrogen 2.835 N/A MET 122.A N HIS 220.A O no hydrogen 2.971 N/A THR 123.A OG1 ARG 124.A O no hydrogen 2.809 N/A THR 123.A OG1 GLU 127.A OE2 no hydrogen 3.297 N/A ARG 124.A N GLU 127.A OE2 no hydrogen 3.453 N/A ARG 124.A NH1 ASP 189.A OD1 no hydrogen 3.029 N/A ARG 124.A NH2 ASP 189.A OD1 no hydrogen 2.850 N/A GLU 127.A N ARG 130.A O no hydrogen 3.034 N/A ARG 130.A N GLU 127.A O no hydrogen 3.213 N/A ARG 130.A NH1 TYR 54.A OH no hydrogen 3.072 N/A LYS 132.A N LEU 125.A O no hydrogen 3.228 N/A LYS 132.A NZ GLU 127.A OE1 no hydrogen 3.384 N/A CYS 133.A SG ASP 134.A O no hydrogen 3.393 N/A GLN 135.A NE2 TRP 137.A O no hydrogen 2.942 N/A TYR 136.A OH HIS 220.A NE2 no hydrogen 2.743 N/A THR 142.A OG1 THR 151.A OG1 no hydrogen 2.556 N/A GLU 143.A N VAL 150.A O no hydrogen 2.957 N/A CYS 145.A N ILE 148.A O no hydrogen 2.931 N/A ILE 148.A N CYS 145.A O no hydrogen 3.171 N/A GLN 149.A N HIS 169.A O no hydrogen 2.601 N/A VAL 150.A N GLU 143.A O no hydrogen 2.817 N/A THR 151.A N ALA 167.A O no hydrogen 3.037 N/A THR 151.A OG1 THR 142.A OG1 no hydrogen 2.556 N/A LEU 152.A N GLY 141.A O no hydrogen 2.886 N/A LEU 153.A N THR 165.A O no hydrogen 2.750 N/A ASP 154.A N THR 165.A O no hydrogen 3.336 N/A VAL 156.A N VAL 163.A O no hydrogen 2.870 N/A LEU 158.A N TYR 161.A O no hydrogen 3.054 N/A ALA 159.A N TYR 373.A O no hydrogen 3.336 N/A THR 162.A N GLN 183.A O no hydrogen 2.910 N/A VAL 163.A N VAL 156.A O no hydrogen 3.035 N/A ARG 164.A N GLN 181.A O no hydrogen 2.864 N/A ARG 164.A NH1 GLN 181.A OE1 no hydrogen 2.794 N/A ARG 164.A NH1 GLN 183.A OE1 no hydrogen 2.633 N/A ARG 164.A NH2 GLN 183.A OE1 no hydrogen 2.950 N/A THR 165.A N ASP 154.A O no hydrogen 2.804 N/A PHE 166.A N LEU 179.A O no hydrogen 2.695 N/A ALA 167.A N THR 151.A O no hydrogen 2.935 N/A LEU 168.A N ARG 177.A O no hydrogen 2.677 N/A HIS 169.A N GLN 149.A O no hydrogen 3.021 N/A SER 171.A N LEU 147.A O no hydrogen 2.984 N/A SER 173.A N LYS 170.A O no hydrogen 3.224 N/A GLU 175.A N SER 173.A OG no hydrogen 2.982 N/A ARG 177.A N LEU 168.A O no hydrogen 3.126 N/A ARG 177.A NE GLU 175.A OE2 no hydrogen 3.101 N/A ARG 177.A NH1 TRP 112.A O no hydrogen 2.306 N/A ARG 177.A NH2 GLU 175.A OE2 no hydrogen 3.489 N/A LEU 179.A N PHE 166.A O no hydrogen 2.887 N/A ARG 180.A N ALA 117.A O no hydrogen 2.970 N/A ARG 180.A NH2 CYS 209.A O no hydrogen 3.506 N/A GLN 181.A N ARG 164.A O no hydrogen 2.744 N/A GLN 181.A NE2 TYR 136.A OH no hydrogen 3.002 N/A PHE 182.A N VAL 119.A O no hydrogen 2.836 N/A GLN 183.A N THR 162.A O no hydrogen 2.790 N/A GLN 183.A NE2 THR 123.A O no hydrogen 3.154 N/A PHE 184.A N MET 121.A O no hydrogen 2.824 N/A MET 185.A N THR 160.A O no hydrogen 2.572 N/A TRP 187.A NE1 GLY 191.A O no hydrogen 3.164 N/A THR 197.A OG1 GLU 279.A OE2 no hydrogen 2.899 N/A LEU 200.A N PRO 196.A O no hydrogen 3.064 N/A ALA 201.A N THR 197.A O no hydrogen 3.094 N/A PHE 202.A N PRO 198.A O no hydrogen 3.131 N/A LEU 203.A N ILE 199.A O no hydrogen 3.044 N/A ARG 204.A N LEU 200.A O no hydrogen 3.089 N/A ARG 205.A N ALA 201.A O no hydrogen 2.992 N/A ARG 205.A NH1 TYR 161.A OH no hydrogen 3.009 N/A VAL 206.A N PHE 202.A O no hydrogen 2.891 N/A LYS 207.A N LEU 203.A O no hydrogen 2.798 N/A LYS 207.A NZ ASP 235.A O no hydrogen 3.399 N/A ALA 208.A N ARG 204.A O no hydrogen 3.150 N/A CYS 209.A N VAL 206.A O no hydrogen 2.894 N/A CYS 209.A SG ARG 205.A O no hydrogen 3.706 N/A ASN 210.A N VAL 206.A O no hydrogen 2.943 N/A GLY 215.A N ARG 115.A O no hydrogen 2.693 N/A MET 217.A N ALA 92.A O no hydrogen 3.237 N/A VAL 218.A N THR 118.A O no hydrogen 3.164 N/A VAL 219.A N ILE 94.A O no hydrogen 2.890 N/A HIS 220.A N VAL 120.A O no hydrogen 2.884 N/A HIS 220.A NE2 TYR 136.A OH no hydrogen 2.743 N/A CYS 221.A SG THR 228.A OG1 no hydrogen 2.818 N/A SER 222.A OG LYS 132.A O no hydrogen 3.429 N/A ARG 227.A NH1 MET 122.A O no hydrogen 3.179 N/A ARG 227.A NH1 GLU 127.A OE2 no hydrogen 2.829 N/A ARG 227.A NH2 GLU 127.A OE1 no hydrogen 2.747 N/A ARG 227.A NH2 GLU 127.A OE2 no hydrogen 3.440 N/A CYS 230.A N GLY 226.A O no hydrogen 3.062 N/A CYS 230.A SG GLY 226.A O no hydrogen 3.616 N/A CYS 230.A SG GLN 269.A O no hydrogen 3.870 N/A PHE 231.A N ARG 227.A O no hydrogen 2.963 N/A ILE 232.A N THR 228.A O no hydrogen 3.120 N/A VAL 233.A N GLY 229.A O no hydrogen 2.959 N/A ILE 234.A N CYS 230.A O no hydrogen 3.105 N/A ASP 235.A N PHE 231.A O no hydrogen 2.968 N/A ALA 236.A N ILE 232.A O no hydrogen 2.972 N/A MET 237.A N VAL 233.A O no hydrogen 2.837 N/A LEU 238.A N ILE 234.A O no hydrogen 2.839 N/A GLU 239.A N ASP 235.A O no hydrogen 3.360 N/A ARG 240.A N ALA 236.A O no hydrogen 3.012 N/A ARG 240.A NE THR 246.A OG1 no hydrogen 2.977 N/A ARG 240.A NH2 THR 246.A OG1 no hydrogen 3.230 N/A MET 241.A N MET 237.A O no hydrogen 2.983 N/A LYS 242.A N LEU 238.A O no hydrogen 3.133 N/A HIS 243.A N GLU 239.A O no hydrogen 3.196 N/A HIS 243.A N ARG 240.A O no hydrogen 3.195 N/A HIS 243.A ND1 TYR 87.A OH no hydrogen 2.822 N/A GLU 244.A N ARG 240.A O no hydrogen 2.719 N/A LYS 245.A N MET 241.A O no hydrogen 2.931 N/A THR 246.A OG1 GLU 244.A OE1 no hydrogen 3.104 N/A VAL 247.A N ILE 5.A O no hydrogen 2.715 N/A TYR 250.A OH SER 31.A O no hydrogen 3.382 N/A TYR 250.A OH SER 31.A OG no hydrogen 2.870 N/A GLY 251.A N ASP 248.A OD1 no hydrogen 3.003 N/A HIS 252.A N ASP 248.A O no hydrogen 2.897 N/A VAL 253.A N ILE 249.A O no hydrogen 2.895 N/A THR 254.A N TYR 250.A O no hydrogen 3.196 N/A THR 254.A OG1 TYR 250.A O no hydrogen 2.555 N/A CYS 255.A N GLY 251.A O no hydrogen 3.210 N/A CYS 255.A SG.B GLY 251.A O no hydrogen 3.651 N/A MET 256.A N HIS 252.A O no hydrogen 2.914 N/A ARG 257.A N VAL 253.A O no hydrogen 2.921 N/A ARG 257.A NE MET 263.A O no hydrogen 2.967 N/A ARG 257.A NH2 VAL 264.A O no hydrogen 3.360 N/A SER 258.A N CYS 255.A O no hydrogen 3.066 N/A GLN 259.A N MET 256.A O no hydrogen 3.020 N/A GLN 259.A NE2 ASP 85.A OD1 no hydrogen 3.258 N/A ARG 260.A N MET 256.A O no hydrogen 3.165 N/A ARG 260.A NE GLY 224.A O no hydrogen 3.257 N/A ARG 260.A NH1 ASN 80.A OD1 no hydrogen 2.883 N/A ARG 260.A NH1 ASN 82.A OD1 no hydrogen 2.880 N/A ARG 260.A NH2 ASN 80.A OD1 no hydrogen 3.017 N/A ARG 260.A NH2 ALA 223.A O no hydrogen 2.756 N/A ASN 261.A ND2 ILE 58.A O no hydrogen 3.260 N/A ASN 261.A ND2 ASN 261.A O no hydrogen 2.828 N/A TYR 262.A OH ASN 56.A O no hydrogen 3.106 N/A VAL 264.A N VAL 225.A O no hydrogen 2.801 N/A GLN 265.A N GLN 269.A OE1 no hydrogen 3.178 N/A THR 266.A OG1 ASP 268.A OD1 no hydrogen 2.363 N/A GLN 269.A N THR 266.A OG1 no hydrogen 3.358 N/A TYR 270.A N THR 266.A O no hydrogen 3.225 N/A TYR 270.A OH GLU 28.A OE2 no hydrogen 2.388 N/A VAL 271.A N GLU 267.A O no hydrogen 2.906 N/A PHE 272.A N ASP 268.A O no hydrogen 2.745 N/A ILE 273.A N GLN 269.A O no hydrogen 3.025 N/A HIS 274.A N TYR 270.A O no hydrogen 3.347 N/A HIS 274.A ND1 TYR 270.A O no hydrogen 2.850 N/A GLU 275.A N VAL 271.A O no hydrogen 2.980 N/A ALA 276.A N PHE 272.A O no hydrogen 2.894 N/A LEU 277.A N ILE 273.A O no hydrogen 3.070 N/A LEU 278.A N HIS 274.A O no hydrogen 2.943 N/A GLU 279.A N GLU 275.A O no hydrogen 3.081 N/A ALA 280.A N ALA 276.A O no hydrogen 3.113 N/A ALA 281.A N LEU 277.A O no hydrogen 2.931 N/A THR 282.A N LEU 278.A O no hydrogen 3.198 N/A THR 282.A N GLU 279.A O no hydrogen 3.254 N/A THR 282.A OG1 LEU 278.A O no hydrogen 2.798 N/A CYS 283.A N GLU 279.A O no hydrogen 3.039 N/A CYS 283.A SG GLU 279.A O no hydrogen 3.321 N/A THR 286.A OG1 ASP 536.A OD1 no hydrogen 2.507 N/A VAL 288.A N VAL 535.A O no hydrogen 3.182 N/A ALA 290.A N GLY 533.A O no hydrogen 2.986 N/A ASN 292.A N PRO 289.A O no hydrogen 2.798 N/A LEU 293.A N ALA 290.A O no hydrogen 3.247 N/A HIS 296.A N ASN 292.A O no hydrogen 3.065 N/A ILE 297.A N LEU 293.A O no hydrogen 2.963 N/A GLN 298.A N TYR 294.A O no hydrogen 3.122 N/A LYS 299.A N ALA 295.A O no hydrogen 2.906 N/A LEU 300.A N HIS 296.A O no hydrogen 2.965 N/A GLY 301.A N ILE 297.A O no hydrogen 3.261 N/A GLY 301.A N GLN 298.A O no hydrogen 3.296 N/A GLN 302.A N LYS 299.A O no hydrogen 3.211 N/A GLU 307.A N PRO 304.A O no hydrogen 3.148 N/A ALA 311.A N GLN 302.A O no hydrogen 2.951 N/A MET 312.A N LEU 300.A O no hydrogen 2.774 N/A GLU 313.A N THR 310.A OG1 no hydrogen 3.243 N/A LEU 314.A N THR 310.A O no hydrogen 3.151 N/A GLU 315.A N ALA 311.A O no hydrogen 2.805 N/A PHE 316.A N MET 312.A O no hydrogen 2.844 N/A LYS 317.A N GLU 313.A O no hydrogen 2.821 N/A LEU 318.A N LEU 314.A O no hydrogen 3.071 N/A LEU 319.A N PHE 316.A O no hydrogen 3.061 N/A ALA 320.A N LYS 317.A O no hydrogen 3.113 N/A SER 321.A N LYS 317.A O no hydrogen 3.232 N/A SER 321.A OG LYS 317.A O no hydrogen 3.231 N/A SER 322.A OG SER 322.A O no hydrogen 2.545 N/A SER 324.A OG SER 324.A O no hydrogen 2.561 N/A SER 328.A N GLU 347.A OE2 no hydrogen 2.870 N/A SER 328.A OG GLU 347.A OE1 no hydrogen 2.998 N/A SER 328.A OG GLU 347.A OE2 no hydrogen 3.083 N/A ASN 330.A N ILE 327.A O no hydrogen 3.345 N/A LEU 331.A N SER 328.A O no hydrogen 3.244 N/A ASN 334.A N LEU 331.A O no hydrogen 2.801 N/A ASN 334.A ND2 SER 328.A O no hydrogen 3.136 N/A LYS 335.A N LEU 331.A O no hydrogen 3.191 N/A LYS 335.A N PRO 332.A O no hydrogen 3.451 N/A LYS 337.A N ASN 334.A O no hydrogen 2.857 N/A LYS 337.A NZ ASN 334.A OD1 no hydrogen 2.901 N/A ASN 338.A N LYS 335.A O no hydrogen 3.348 N/A ASN 338.A ND2 ALA 329.A O no hydrogen 3.125 N/A ARG 339.A N GLN 383.A OE1 no hydrogen 2.714 N/A ARG 339.A NE GLY 384.A O no hydrogen 2.576 N/A ARG 339.A NH1 GLU 417.A OE2 no hydrogen 3.365 N/A ARG 339.A NH2 GLY 384.A O no hydrogen 2.930 N/A ARG 339.A NH2 PRO 385.A O no hydrogen 2.822 N/A ARG 339.A NH2 GLU 417.A OE2 no hydrogen 3.158 N/A ILE 343.A N LEU 340.A O no hydrogen 3.243 N/A TYR 346.A OH ARG 545.A O no hydrogen 3.197 N/A GLU 347.A N ARG 325.A O no hydrogen 2.920 N/A THR 349.A OG1 GLN 547.A O no hydrogen 2.726 N/A ARG 350.A NE GLU 347.A OE1 no hydrogen 2.961 N/A ARG 350.A NH1 ASP 363.A OD2 no hydrogen 3.132 N/A ARG 350.A NH2 ASP 363.A O no hydrogen 3.410 N/A VAL 351.A N ALA 367.A O no hydrogen 2.930 N/A CYS 352.A SG ARG 350.A O no hydrogen 3.753 N/A LEU 353.A N ASP 363.A O no hydrogen 2.855 N/A GLN 354.A N GLU 399.A OE2 no hydrogen 2.800 N/A ILE 356.A N SER 362.A OG no hydrogen 2.822 N/A VAL 359.A N ILE 356.A O no hydrogen 3.125 N/A SER 362.A N VAL 359.A O no hydrogen 3.300 N/A SER 362.A OG ILE 356.A O no hydrogen 3.396 N/A SER 362.A OG VAL 359.A O no hydrogen 2.774 N/A TYR 364.A N GLY 361.A O no hydrogen 3.232 N/A TYR 364.A OH ASN 338.A OD1 no hydrogen 2.620 N/A ASN 366.A ND2 ASN 338.A OD1 no hydrogen 3.061 N/A ASN 366.A ND2 ILE 343.A O no hydrogen 2.765 N/A SER 368.A N ALA 381.A O no hydrogen 2.979 N/A PHE 369.A N THR 349.A O no hydrogen 2.787 N/A LEU 370.A N TYR 379.A O no hydrogen 2.758 N/A ASP 371.A N GLN 547.A OE1 no hydrogen 2.913 N/A GLY 372.A N GLN 375.A O no hydrogen 2.706 N/A TYR 373.A OH GLU 532.A OE2 no hydrogen 2.408 N/A ARG 374.A NE GLU 527.A OE2 no hydrogen 2.865 N/A ARG 374.A NH2 GLU 527.A OE2 no hydrogen 3.302 N/A LYS 377.A N.A ASP 371.A OD1 no hydrogen 3.400 N/A LYS 377.A N.B ASP 371.A OD1 no hydrogen 3.383 N/A ALA 378.A N LEU 370.A O no hydrogen 2.978 N/A TYR 379.A N LEU 370.A O no hydrogen 3.086 N/A TYR 379.A OH HIS 493.A NE2 no hydrogen 2.508 N/A ILE 380.A N ILE 505.A O no hydrogen 3.004 N/A ALA 381.A N SER 368.A O no hydrogen 3.047 N/A THR 382.A N VAL 507.A O no hydrogen 3.023 N/A THR 382.A OG1 ASN 366.A O no hydrogen 2.650 N/A THR 382.A OG1 GLN 383.A O no hydrogen 3.436 N/A GLN 383.A NE2 LYS 337.A O no hydrogen 3.070 N/A GLY 384.A N SER 510.A O no hydrogen 2.692 N/A LEU 386.A N SER 389.A OG no hydrogen 2.900 N/A GLU 388.A N GLU 388.A OE1 no hydrogen 2.358 N/A SER 389.A N LEU 386.A O no hydrogen 2.914 N/A SER 389.A OG LEU 386.A O no hydrogen 3.239 N/A THR 390.A OG1 LEU 386.A O no hydrogen 2.867 N/A PHE 393.A N SER 389.A O no hydrogen 2.795 N/A TRP 394.A N THR 390.A O no hydrogen 3.069 N/A TRP 394.A NE1 TYR 422.A O no hydrogen 2.851 N/A ARG 395.A N GLU 391.A O no hydrogen 3.148 N/A ARG 395.A NE GLU 399.A OE1 no hydrogen 3.057 N/A ARG 395.A NH2 GLN 354.A O no hydrogen 2.311 N/A ARG 395.A NH2 SER 362.A O no hydrogen 2.990 N/A MET 396.A N ASP 392.A O no hydrogen 2.899 N/A LEU 397.A N PHE 393.A O no hydrogen 3.294 N/A TRP 398.A N TRP 394.A O no hydrogen 3.229 N/A GLU 399.A N ARG 395.A O no hydrogen 2.908 N/A HIS 400.A N MET 396.A O no hydrogen 3.015 N/A HIS 400.A NE2 CYS 352.A O no hydrogen 3.074 N/A ASN 401.A N TRP 398.A O no hydrogen 3.285 N/A SER 402.A N LEU 397.A O no hydrogen 2.892 N/A SER 402.A OG PRO 504.A O no hydrogen 2.984 N/A SER 402.A OG THR 506.A OG1 no hydrogen 2.645 N/A THR 403.A OG1 GLN 501.A OE1 no hydrogen 2.856 N/A ILE 405.A N ARG 466.A O no hydrogen 2.682 N/A VAL 406.A N THR 506.A O no hydrogen 2.670 N/A MET 407.A N PHE 468.A O no hydrogen 2.927 N/A LEU 408.A N HIS 508.A O no hydrogen 3.076 N/A THR 409.A OG1 LYS 410.A O no hydrogen 3.394 N/A LYS 410.A N GLU 413.A OE2 no hydrogen 3.153 N/A LYS 410.A NZ GLU 475.A OE2 no hydrogen 3.479 N/A ARG 412.A NH2 GLY 415.A O no hydrogen 3.134 N/A GLU 413.A N ARG 416.A O no hydrogen 2.932 N/A MET 414.A N GLU 475.A OE1 no hydrogen 3.210 N/A ARG 416.A N GLU 413.A O no hydrogen 2.967 N/A LYS 418.A N LEU 411.A O no hydrogen 2.998 N/A CYS 419.A N LEU 411.A O no hydrogen 3.196 N/A CYS 419.A SG HIS 420.A O no hydrogen 3.344 N/A HIS 420.A N PRO 385.A O no hydrogen 3.123 N/A GLN 421.A NE2 TRP 423.A O no hydrogen 3.339 N/A TYR 422.A OH HIS 508.A NE2 no hydrogen 2.736 N/A SER 428.A OG ASP 437.A OD1 no hydrogen 2.265 N/A ALA 429.A N VAL 436.A O no hydrogen 3.320 N/A ARG 430.A NE GLN 432.A O no hydrogen 3.191 N/A TYR 431.A N PHE 434.A O no hydrogen 2.620 N/A PHE 434.A N TYR 431.A O no hydrogen 3.161 N/A VAL 435.A N THR 455.A O no hydrogen 2.875 N/A VAL 436.A N ALA 429.A O no hydrogen 2.961 N/A ASP 437.A N LYS 453.A O no hydrogen 3.040 N/A MET 439.A N GLU 451.A O no hydrogen 2.951 N/A TYR 442.A N LEU 449.A O no hydrogen 2.850 N/A MET 444.A N TYR 447.A O no hydrogen 2.949 N/A ILE 448.A N GLN 469.A O no hydrogen 2.853 N/A LEU 449.A N TYR 442.A O no hydrogen 3.014 N/A ARG 450.A N GLN 467.A O no hydrogen 2.806 N/A ARG 450.A NH1 GLN 467.A OE1 no hydrogen 3.191 N/A ARG 450.A NH1 GLN 469.A OE1 no hydrogen 2.743 N/A ARG 450.A NH2 GLN 469.A OE1 no hydrogen 3.065 N/A GLU 451.A N ALA 440.A O no hydrogen 3.214 N/A PHE 452.A N ILE 465.A O no hydrogen 2.791 N/A LYS 453.A N ASP 437.A O no hydrogen 2.926 N/A VAL 454.A N ARG 463.A O no hydrogen 2.847 N/A THR 455.A N VAL 435.A O no hydrogen 2.845 N/A ASP 456.A N GLN 461.A O no hydrogen 2.913 N/A ALA 457.A N TYR 433.A O no hydrogen 2.772 N/A ARG 458.A N ASP 456.A OD1 no hydrogen 2.886 N/A ARG 458.A NE ASP 456.A OD1 no hydrogen 3.039 N/A ARG 458.A NE ASP 456.A OD2 no hydrogen 3.387 N/A ARG 458.A NH2 ASP 456.A OD2 no hydrogen 3.260 N/A GLY 460.A N ASP 456.A O no hydrogen 2.752 N/A GLN 461.A N ASP 459.A OD1 no hydrogen 3.148 N/A GLN 461.A NE2 ASP 459.A OD2 no hydrogen 3.342 N/A ARG 463.A N VAL 454.A O no hydrogen 2.951 N/A ARG 463.A NH1 TRP 398.A O no hydrogen 2.911 N/A ARG 463.A NH2 TRP 398.A O no hydrogen 3.399 N/A ILE 465.A N PHE 452.A O no hydrogen 2.982 N/A ARG 466.A N THR 403.A O no hydrogen 2.981 N/A ARG 466.A NE.B GLU 451.A OE2 no hydrogen 3.225 N/A GLN 467.A N ARG 450.A O no hydrogen 2.707 N/A PHE 468.A N ILE 405.A O no hydrogen 2.865 N/A GLN 469.A N ILE 448.A O no hydrogen 2.757 N/A GLN 469.A NE2 THR 409.A O no hydrogen 2.939 N/A PHE 470.A N MET 407.A O no hydrogen 2.808 N/A THR 471.A N GLN 446.A O no hydrogen 2.998 N/A GLY 482.A N GLU 567.A OE1 no hydrogen 2.676 N/A ILE 486.A N GLY 482.A O no hydrogen 2.769 N/A ASP 487.A N GLU 483.A O no hydrogen 3.145 N/A PHE 488.A N GLY 484.A O no hydrogen 3.066 N/A ILE 489.A N PHE 485.A O no hydrogen 2.927 N/A GLY 490.A N ILE 486.A O no hydrogen 2.901 N/A GLN 491.A N ASP 487.A O no hydrogen 2.923 N/A VAL 492.A N PHE 488.A O no hydrogen 2.918 N/A HIS 493.A N ILE 489.A O no hydrogen 3.203 N/A HIS 493.A ND1 ILE 489.A O no hydrogen 2.862 N/A HIS 493.A NE2 TYR 379.A OH no hydrogen 2.508 N/A LYS 494.A N GLY 490.A O no hydrogen 2.731 N/A THR 495.A N GLN 491.A O no hydrogen 2.995 N/A THR 495.A OG1 GLN 491.A O no hydrogen 2.694 N/A LYS 496.A N VAL 492.A O no hydrogen 3.173 N/A GLU 497.A N HIS 493.A O no hydrogen 3.158 N/A GLN 498.A N LYS 494.A O no hydrogen 2.929 N/A PHE 499.A N THR 495.A O no hydrogen 2.967 N/A GLY 500.A N GLU 497.A O no hydrogen 3.171 N/A GLN 501.A N LYS 496.A O no hydrogen 2.910 N/A GLN 501.A NE2 PHE 499.A O no hydrogen 2.527 N/A ILE 505.A N ALA 378.A O no hydrogen 3.023 N/A THR 506.A N ILE 404.A O no hydrogen 3.123 N/A THR 506.A OG1 SER 402.A OG no hydrogen 2.645 N/A VAL 507.A N ILE 380.A O no hydrogen 2.702 N/A HIS 508.A N VAL 406.A O no hydrogen 2.860 N/A HIS 508.A NE2 TYR 422.A OH no hydrogen 2.736 N/A CYS 509.A SG THR 516.A OG1 no hydrogen 3.277 N/A ARG 515.A NH1 LEU 408.A O no hydrogen 2.714 N/A ARG 515.A NH1 GLU 413.A OE2 no hydrogen 3.310 N/A ARG 515.A NH2 GLU 413.A OE1 no hydrogen 3.146 N/A GLY 517.A N VAL 513.A O no hydrogen 3.130 N/A VAL 518.A N GLY 514.A O no hydrogen 3.203 N/A PHE 519.A N ARG 515.A O no hydrogen 2.919 N/A ILE 520.A N THR 516.A O no hydrogen 2.990 N/A THR 521.A N GLY 517.A O no hydrogen 2.736 N/A THR 521.A OG1 GLY 517.A O no hydrogen 2.695 N/A LEU 522.A N VAL 518.A O no hydrogen 3.125 N/A SER 523.A N PHE 519.A O no hydrogen 2.946 N/A SER 523.A OG PHE 519.A O no hydrogen 2.804 N/A ILE 524.A N ILE 520.A O no hydrogen 3.119 N/A ILE 524.A N THR 521.A O no hydrogen 3.220 N/A VAL 525.A N THR 521.A O no hydrogen 2.884 N/A LEU 526.A N LEU 522.A O no hydrogen 2.983 N/A ARG 528.A N ILE 524.A O no hydrogen 2.937 N/A ARG 528.A NE GLU 532.A OE2 no hydrogen 3.445 N/A ARG 528.A NH1 GLU 287.A OE1 no hydrogen 3.232 N/A MET 529.A N VAL 525.A O no hydrogen 2.803 N/A ARG 530.A N LEU 526.A O no hydrogen 3.146 N/A TYR 531.A N GLU 527.A O no hydrogen 3.056 N/A GLU 532.A N ARG 528.A O no hydrogen 2.761 N/A GLY 533.A N MET 529.A O no hydrogen 3.044 N/A VAL 535.A N VAL 288.A O no hydrogen 2.785 N/A GLN 539.A N ASP 536.A OD1 no hydrogen 3.297 N/A THR 540.A N ASP 536.A O no hydrogen 3.072 N/A THR 540.A OG1 ASP 536.A O no hydrogen 2.764 N/A VAL 541.A N MET 537.A O no hydrogen 3.060 N/A LYS 542.A N PHE 538.A O no hydrogen 2.961 N/A LYS 542.A NZ GLU 279.A OE1 no hydrogen 3.431 N/A LYS 542.A NZ SER 322.A OG no hydrogen 3.178 N/A THR 543.A N GLN 539.A O no hydrogen 2.981 N/A THR 543.A OG1 GLN 539.A O no hydrogen 2.676 N/A LEU 544.A N THR 540.A O no hydrogen 3.177 N/A ARG 545.A N VAL 541.A O no hydrogen 2.864 N/A ARG 545.A NE MET 551.A O no hydrogen 2.815 N/A ARG 545.A NH2 MET 551.A O no hydrogen 3.188 N/A ARG 545.A NH2 VAL 552.A O no hydrogen 2.709 N/A THR 546.A N THR 543.A O no hydrogen 3.145 N/A THR 546.A OG1 THR 543.A O no hydrogen 2.540 N/A GLN 547.A N LEU 544.A O no hydrogen 2.883 N/A GLN 547.A NE2 THR 543.A O no hydrogen 3.351 N/A ARG 548.A N LEU 544.A O no hydrogen 3.103 N/A ARG 548.A NE GLY 512.A O no hydrogen 3.081 N/A ARG 548.A NH1 ASN 366.A OD1 no hydrogen 3.241 N/A ARG 548.A NH1 SER 368.A OG no hydrogen 3.060 N/A ARG 548.A NH2 ASN 366.A OD1 no hydrogen 2.902 N/A ARG 548.A NH2 ALA 511.A O no hydrogen 2.845 N/A VAL 552.A N VAL 513.A O no hydrogen 2.948 N/A GLN 553.A N GLN 557.A OE1 no hydrogen 2.999 N/A THR 554.A N GLN 557.A OE1 no hydrogen 3.351 N/A THR 554.A OG1 ASP 556.A OD1 no hydrogen 2.705 N/A GLN 557.A N THR 554.A O no hydrogen 3.146 N/A TYR 558.A N THR 554.A O no hydrogen 3.186 N/A TYR 558.A OH GLU 315.A OE2 no hydrogen 2.302 N/A GLN 559.A N GLU 555.A O no hydrogen 2.655 N/A LEU 560.A N ASP 556.A O no hydrogen 2.901 N/A CYS 561.A N GLN 557.A O no hydrogen 3.177 N/A CYS 561.A SG GLN 557.A O no hydrogen 3.476 N/A TYR 562.A N TYR 558.A O no hydrogen 3.278 N/A TYR 562.A OH GLU 315.A OE2 no hydrogen 2.370 N/A ARG 563.A N GLN 559.A O no hydrogen 3.022 N/A ARG 563.A NH1 PRO 479.A O no hydrogen 3.035 N/A ARG 563.A NH1 LYS 480.A O no hydrogen 2.728 N/A ALA 564.A N LEU 560.A O no hydrogen 2.770 N/A ALA 565.A N CYS 561.A O no hydrogen 2.977 N/A LEU 566.A N TYR 562.A O no hydrogen 3.026 N/A GLU 567.A N ARG 563.A O no hydrogen 3.089 N/A TYR 568.A N ALA 564.A O no hydrogen 2.887 N/A LEU 569.A N ALA 565.A O no hydrogen 3.062 N/A GLY 570.A N LEU 566.A O no hydrogen 3.197 N/A GLY 570.A N GLU 567.A O no hydrogen 3.115 N/A SER 571.A N TYR 568.A O no hydrogen 3.175 N/A SER 571.A OG TYR 568.A O no hydrogen 2.747 N/A PHE 572.A N LEU 569.A O no hydrogen 2.966 N/A