Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2y6i_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 3.A N GLN 27.A O no hydrogen 3.272 N/A PHE 5.A N ASP 4.A OD1 no hydrogen 2.740 N/A ASN 9.A ND2 GLY 37.A O no hydrogen 3.124 N/A GLY 10.A N TYR 7.A O no hydrogen 2.903 N/A TYR 13.A OH ASP 44.A OD2 no hydrogen 2.720 N/A GLU 15.A N SER 12.A OG no hydrogen 3.020 N/A LEU 16.A N SER 12.A O no hydrogen 2.822 N/A THR 17.A N TYR 13.A O no hydrogen 2.824 N/A THR 17.A OG1 TYR 13.A O no hydrogen 2.806 N/A THR 17.A OG1 THR 14.A O no hydrogen 3.324 N/A ASN 18.A N THR 14.A O no hydrogen 3.470 N/A LEU 19.A N GLU 15.A O no hydrogen 2.931 N/A ILE 20.A N LEU 16.A O no hydrogen 2.822 N/A LYS 21.A N THR 17.A O no hydrogen 2.943 N/A ASN 22.A N ASN 18.A O no hydrogen 3.316 N/A ASN 22.A N LEU 19.A O no hydrogen 3.107 N/A ILE 23.A N LEU 19.A O no hydrogen 3.042 N/A LYS 24.A N GLN 27.A OE1 no hydrogen 2.649 N/A GLN 27.A N LYS 24.A O no hydrogen 3.385 N/A ILE 28.A N TRP 25.A O no hydrogen 3.505 N/A ASN 29.A N TYR 3.A O no hydrogen 3.352 N/A ASN 29.A ND2 ASP 4.A OD2 no hydrogen 2.826 N/A ASN 33.A N GLY 30.A O no hydrogen 3.188 N/A SER 35.A N SER 38.A OG no hydrogen 2.689 N/A SER 35.A OG SER 38.A OG no hydrogen 3.128 N/A SER 38.A N SER 35.A OG no hydrogen 2.937 N/A SER 38.A OG ASN 33.A O no hydrogen 3.226 N/A SER 38.A OG SER 35.A O no hydrogen 3.175 N/A SER 38.A OG SER 35.A OG no hydrogen 3.128 N/A GLN 39.A N SER 35.A O no hydrogen 3.172 N/A GLN 39.A NE2 GLY 89.A O no hydrogen 3.033 N/A PHE 42.A N SER 38.A O no hydrogen 3.429 N/A GLY 43.A N GLN 39.A O no hydrogen 2.727 N/A ASN 46.A N ASP 44.A OD1 no hydrogen 3.249 N/A VAL 48.A N ASP 44.A O no hydrogen 3.309 N/A GLN 49.A N LYS 45.A O no hydrogen 3.133 N/A GLN 49.A NE2 GLN 49.A O no hydrogen 3.318 N/A GLN 49.A NE2 ASN 53.A OD1 no hydrogen 2.800 N/A ALA 50.A N ASN 46.A O no hydrogen 3.028 N/A ILE 51.A N ARG 47.A O no hydrogen 3.347 N/A ILE 52.A N VAL 48.A O no hydrogen 2.967 N/A ASN 53.A N GLN 49.A O no hydrogen 3.024 N/A ALA 54.A N ALA 50.A O no hydrogen 2.771 N/A LEU 55.A N ILE 51.A O no hydrogen 2.962 N/A GLN 56.A N ILE 52.A O no hydrogen 2.807 N/A GLU 57.A N ASN 53.A O no hydrogen 3.037 N/A SER 58.A N ALA 54.A O no hydrogen 2.806 N/A SER 58.A OG LYS 68.A O no hydrogen 2.591 N/A GLY 59.A N LEU 55.A O no hydrogen 2.646 N/A ARG 60.A N GLN 56.A O no hydrogen 3.209 N/A THR 61.A OG1 GLU 57.A O no hydrogen 3.279 N/A THR 61.A OG1 SER 58.A O no hydrogen 3.294 N/A TYR 62.A N SER 58.A O no hydrogen 3.374 N/A TYR 62.A OH ASN 114.A O no hydrogen 3.027 N/A THR 63.A N ASP 66.A O no hydrogen 3.176 N/A ASP 66.A N THR 63.A OG1 no hydrogen 3.339 N/A THR 72.A OG1 ILE 23.A O no hydrogen 2.760 N/A PHE 73.A N GLY 69.A O no hydrogen 2.992 N/A THR 74.A N ILE 70.A O no hydrogen 2.976 N/A THR 74.A OG1 ILE 70.A O no hydrogen 3.116 N/A THR 74.A OG1 GLU 71.A O no hydrogen 2.691 N/A GLU 75.A N GLU 71.A O no hydrogen 3.311 N/A VAL 76.A N THR 72.A O no hydrogen 3.169 N/A LEU 77.A N PHE 73.A O no hydrogen 3.167 N/A ARG 78.A N THR 74.A O no hydrogen 2.761 N/A ALA 79.A N GLU 75.A O no hydrogen 2.924 N/A GLY 80.A N VAL 76.A O no hydrogen 3.156 N/A PHE 81.A N LEU 77.A O no hydrogen 3.287 N/A TYR 82.A N ARG 78.A O no hydrogen 3.074 N/A LEU 83.A N ALA 79.A O no hydrogen 3.120 N/A GLY 84.A N GLY 80.A O no hydrogen 2.771 N/A TYR 85.A N PHE 81.A O no hydrogen 2.975 N/A TYR 86.A N TYR 82.A O no hydrogen 3.468 N/A ASN 87.A N LEU 83.A O no hydrogen 2.913 N/A LEU 90.A N ASN 87.A O no hydrogen 3.379 N/A SER 91.A OG ASP 88.A O no hydrogen 2.676 N/A TYR 92.A OH PHE 42.A O no hydrogen 2.583 N/A LEU 93.A N LEU 90.A O no hydrogen 3.263 N/A ASN 97.A N ASP 95.A OD1 no hydrogen 3.131 N/A PHE 98.A N ASP 95.A O no hydrogen 3.334 N/A PHE 98.A N ASP 95.A OD2 no hydrogen 3.171 N/A GLN 99.A NE2 LEU 93.A O no hydrogen 2.961 N/A ASP 100.A N ARG 96.A O no hydrogen 3.312 N/A LYS 101.A N PHE 98.A O no hydrogen 2.987 N/A CYS 102.A N GLN 99.A O no hydrogen 3.084 N/A ILE 103.A N ASP 100.A O no hydrogen 3.360 N/A MET 106.A N CYS 102.A O no hydrogen 3.079 N/A ILE 107.A N ILE 103.A O no hydrogen 2.869 N/A ALA 108.A N PRO 104.A O no hydrogen 3.084 N/A ILE 109.A N ALA 105.A O no hydrogen 3.411 N/A GLN 110.A N MET 106.A O no hydrogen 3.096 N/A GLN 110.A NE2 VAL 142.A O no hydrogen 2.721 N/A LYS 111.A N ILE 107.A O no hydrogen 2.752 N/A ASN 112.A N ALA 108.A O no hydrogen 3.233 N/A ASN 112.A ND2 GLY 59.A O no hydrogen 3.132 N/A ASN 112.A ND2 TYR 62.A O no hydrogen 3.373 N/A ASN 114.A N ASN 112.A OD1 no hydrogen 2.760 N/A PHE 115.A N ASN 112.A O no hydrogen 3.142 N/A LEU 117.A N GLN 152.A OE1 no hydrogen 3.070 N/A THR 119.A N GLN 122.A OE1 no hydrogen 3.405 N/A THR 119.A OG1 ALA 64.A O no hydrogen 3.535 N/A GLN 122.A NE2 ASN 114.A O no hydrogen 2.741 N/A ASP 123.A N THR 119.A O no hydrogen 2.913 N/A GLU 124.A N ALA 120.A O no hydrogen 3.318 N/A VAL 125.A N VAL 121.A O no hydrogen 2.822 N/A ILE 126.A N GLN 122.A O no hydrogen 3.385 N/A THR 127.A N ASP 123.A O no hydrogen 3.183 N/A THR 127.A OG1 ASP 123.A O no hydrogen 2.722 N/A SER 128.A N GLU 124.A O no hydrogen 2.978 N/A SER 128.A OG GLU 124.A O no hydrogen 3.256 N/A LEU 129.A N VAL 125.A O no hydrogen 3.095 N/A GLY 130.A N ILE 126.A O no hydrogen 3.104 N/A LYS 131.A N THR 127.A O no hydrogen 3.160 N/A LEU 132.A N SER 128.A O no hydrogen 3.207 N/A ILE 133.A N LEU 129.A O no hydrogen 3.023 N/A GLY 134.A N GLY 130.A O no hydrogen 3.313 N/A ALA 136.A N LEU 132.A O no hydrogen 2.762 N/A SER 137.A OG ASP 100.A OD1 no hydrogen 2.618 N/A ALA 138.A N ASP 180.A OD2 no hydrogen 3.003 N/A VAL 142.A N ASN 139.A OD1 no hydrogen 2.954 N/A VAL 143.A N ASN 139.A O no hydrogen 3.107 N/A ASN 144.A N ALA 140.A O no hydrogen 2.979 N/A ASN 144.A ND2 LYS 198.A O no hydrogen 2.974 N/A CYS 146.A N VAL 143.A O no hydrogen 3.082 N/A CYS 146.A SG VAL 142.A O no hydrogen 3.590 N/A VAL 149.A N CYS 146.A O no hydrogen 2.926 N/A LEU 150.A N CYS 146.A O no hydrogen 3.226 N/A LYS 151.A N VAL 147.A O no hydrogen 2.839 N/A GLN 152.A N PRO 148.A O no hydrogen 3.375 N/A PHE 153.A N VAL 149.A O no hydrogen 2.866 N/A ARG 154.A N LEU 150.A O no hydrogen 3.049 N/A GLU 155.A N LYS 151.A O no hydrogen 2.935 N/A ASN 156.A N GLN 152.A O no hydrogen 3.132 N/A TYR 160.A N ASN 156.A O no hydrogen 3.054 N/A ALA 161.A N LEU 157.A O no hydrogen 2.861 N/A ASP 163.A N TYR 160.A O no hydrogen 2.883 N/A VAL 165.A N ASP 163.A OD1 no hydrogen 3.059 N/A LYS 166.A NZ GLY 118.A O no hydrogen 2.685 N/A GLY 167.A N ASP 163.A O no hydrogen 3.051 N/A THR 168.A N TYR 164.A O no hydrogen 2.762 N/A THR 168.A OG1 TYR 164.A O no hydrogen 2.556 N/A ALA 169.A N VAL 165.A O no hydrogen 3.014 N/A VAL 170.A N LYS 166.A O no hydrogen 3.434 N/A ASN 171.A N GLY 167.A O no hydrogen 3.088 N/A GLU 172.A N THR 168.A O no hydrogen 2.792 N/A LEU 173.A N ALA 169.A O no hydrogen 3.107 N/A ILE 174.A N VAL 170.A O no hydrogen 3.079 N/A LYS 175.A N ASN 171.A O no hydrogen 2.656 N/A GLY 176.A N GLU 172.A O no hydrogen 2.992 N/A ILE 177.A N LEU 173.A O no hydrogen 3.314 N/A GLU 178.A N ILE 174.A O no hydrogen 3.024 N/A PHE 179.A N LYS 175.A O no hydrogen 3.151 N/A ASP 180.A N GLY 176.A O no hydrogen 3.157 N/A PHE 181.A N ILE 177.A O no hydrogen 3.165 N/A SER 182.A N GLU 178.A O no hydrogen 2.845 N/A SER 182.A OG GLU 178.A O no hydrogen 2.953 N/A SER 182.A OG PHE 179.A O no hydrogen 3.115 N/A GLY 183.A N PHE 179.A O no hydrogen 3.402 N/A ALA 184.A N ASP 180.A O no hydrogen 2.867 N/A ALA 185.A N PHE 181.A O no hydrogen 3.087 N/A LYS 191.A N ASP 189.A OD1 no hydrogen 3.288 N/A THR 192.A N ASP 189.A O no hydrogen 3.031 N/A THR 192.A OG1 ASP 189.A O no hydrogen 2.537 N/A TYR 196.A N MET 193.A O no hydrogen 3.129 N/A GLY 197.A N TYR 236.A O no hydrogen 2.888 N/A LYS 198.A N TRP 195.A O no hydrogen 2.955 N/A PHE 202.A N ILE 199.A O no hydrogen 2.924 N/A ILE 203.A N ILE 199.A O no hydrogen 2.920 N/A ASN 204.A N ASP 200.A O no hydrogen 2.837 N/A LEU 206.A N PHE 202.A O no hydrogen 3.054 N/A LYS 207.A N ILE 203.A O no hydrogen 3.347 N/A LYS 207.A NZ ASN 204.A OD1 no hydrogen 3.550 N/A LYS 207.A NZ ASP 242.A OD1 no hydrogen 3.455 N/A LYS 207.A NZ ASP 242.A OD2 no hydrogen 2.720 N/A ALA 208.A N ASN 204.A O no hydrogen 3.501 N/A LEU 209.A N GLU 205.A O no hydrogen 3.446 N/A GLY 210.A N LEU 206.A O no hydrogen 2.778 N/A LEU 211.A N LYS 207.A O no hydrogen 2.575 N/A GLY 213.A N TYR 254.A OH no hydrogen 3.156 N/A ASN 214.A N TYR 212.A O no hydrogen 2.784 N/A THR 216.A N THR 219.A OG1 no hydrogen 3.058 N/A THR 216.A OG1 THR 219.A OG1 no hydrogen 3.144 N/A THR 219.A N THR 216.A O no hydrogen 3.283 N/A THR 219.A OG1 THR 216.A OG1 no hydrogen 3.144 N/A SER 223.A OG LEU 209.A O no hydrogen 2.754 N/A SER 223.A OG GLY 210.A O no hydrogen 2.832 N/A ASP 224.A N GLU 220.A O no hydrogen 2.791 N/A VAL 225.A N TRP 221.A O no hydrogen 2.725 N/A GLY 226.A N ALA 222.A O no hydrogen 3.249 N/A ILE 227.A N SER 223.A O no hydrogen 3.074 N/A TYR 228.A N ASP 224.A O no hydrogen 2.961 N/A TYR 229.A N VAL 225.A O no hydrogen 2.865 N/A LEU 230.A N GLY 226.A O no hydrogen 2.842 N/A SER 231.A N ILE 227.A O no hydrogen 3.101 N/A SER 231.A OG ASP 270.A OD2 no hydrogen 2.721 N/A LYS 232.A N TYR 228.A O no hydrogen 3.242 N/A LYS 232.A NZ ASP 270.A OD2 no hydrogen 2.829 N/A PHE 233.A N TYR 229.A O no hydrogen 2.888 N/A TYR 236.A N PHE 233.A O no hydrogen 2.968 N/A SER 237.A OG ASN 239.A O no hydrogen 3.570 N/A ARG 240.A NH2 ILE 274.A O no hydrogen 2.646 N/A ASP 242.A N ASN 239.A OD1 no hydrogen 3.301 N/A ILE 243.A N ARG 240.A O no hydrogen 3.143 N/A VAL 244.A N ARG 240.A O no hydrogen 3.265 N/A GLN 245.A N ASN 241.A O no hydrogen 2.924 N/A SER 246.A N ASP 242.A O no hydrogen 3.243 N/A SER 246.A OG ASP 242.A O no hydrogen 3.033 N/A LEU 247.A N ILE 243.A O no hydrogen 3.044 N/A GLU 248.A N VAL 244.A O no hydrogen 2.905 N/A LYS 249.A N GLN 245.A O no hydrogen 3.081 N/A ALA 250.A N SER 246.A O no hydrogen 3.157 N/A VAL 251.A N LEU 247.A O no hydrogen 3.104 N/A ASP 252.A N GLU 248.A O no hydrogen 3.150 N/A MET 253.A N LYS 249.A O no hydrogen 2.785 N/A TYR 254.A N ALA 250.A O no hydrogen 3.479 N/A TYR 254.A OH GLY 210.A O no hydrogen 2.768 N/A GLY 257.A N TYR 254.A O no hydrogen 2.690 N/A ALA 260.A N GLY 257.A O no hydrogen 3.144 N/A PHE 261.A N LYS 258.A O no hydrogen 2.964 N/A VAL 262.A N LYS 258.A O no hydrogen 3.236 N/A ALA 263.A N ILE 259.A O no hydrogen 2.807 N/A MET 264.A N ALA 260.A O no hydrogen 3.120 N/A GLU 265.A N PHE 261.A O no hydrogen 2.910 N/A ARG 266.A N VAL 262.A O no hydrogen 2.860 N/A ARG 266.A NH1 ASP 270.A OD2 no hydrogen 3.414 N/A ILE 267.A N ALA 263.A O no hydrogen 3.206 N/A THR 268.A N MET 264.A O no hydrogen 3.264 N/A THR 268.A OG1 MET 264.A O no hydrogen 3.263 N/A THR 268.A OG1 GLU 265.A O no hydrogen 3.176 N/A TRP 269.A N GLU 265.A O no hydrogen 2.984 N/A ASP 270.A N ARG 266.A O no hydrogen 3.041 N/A TYR 271.A N ILE 267.A O no hydrogen 3.280 N/A TYR 271.A OH SER 231.A O no hydrogen 2.855 N/A GLY 273.A N ILE 267.A O no hydrogen 2.818 N/A ILE 274.A N TYR 271.A O no hydrogen 3.140 N/A GLY 275.A N LYS 279.A O no hydrogen 3.098 N/A SER 276.A N GLU 248.A OE2 no hydrogen 2.965 N/A SER 276.A OG GLU 248.A OE1 no hydrogen 2.614 N/A SER 276.A OG GLU 248.A OE2 no hydrogen 3.446 N/A GLY 278.A N GLY 275.A O no hydrogen 3.034 N/A LYS 279.A N ASN 277.A OD1 no hydrogen 2.873 N/A VAL 281.A N GLY 273.A O no hydrogen 2.867 N/A PHE 286.A N ASP 282.A O no hydrogen 3.233 N/A LEU 287.A N HIS 283.A O no hydrogen 3.190 N/A ASP 288.A N ASP 284.A O no hydrogen 2.928 N/A ASP 289.A N LYS 285.A O no hydrogen 2.785 N/A ALA 290.A N PHE 286.A O no hydrogen 2.783 N/A GLU 291.A N LEU 287.A O no hydrogen 3.032 N/A LYS 292.A N ASP 288.A O no hydrogen 3.086 N/A HIS 293.A N ASP 289.A O no hydrogen 3.152 N/A TYR 294.A N ALA 290.A O no hydrogen 3.338 N/A TYR 294.A OH TYR 256.A O no hydrogen 2.357 N/A LEU 295.A N GLU 291.A O no hydrogen 2.661 N/A LYS 297.A N ALA 310.A O no hydrogen 3.112 N/A TYR 299.A N ILE 308.A O no hydrogen 2.806 N/A THR 300.A N GLN 594.A OE1 no hydrogen 3.157 N/A PHE 301.A N PHE 306.A O no hydrogen 2.747 N/A ASP 302.A N SER 593.A OG no hydrogen 3.068 N/A ASN 303.A N LYS 592.A O no hydrogen 2.986 N/A THR 305.A N PHE 301.A O no hydrogen 3.210 N/A THR 305.A OG1 ASP 302.A O no hydrogen 2.513 N/A PHE 306.A N PHE 301.A O no hydrogen 3.125 N/A ILE 307.A N LEU 352.A O no hydrogen 3.001 N/A ILE 308.A N TYR 299.A O no hydrogen 2.763 N/A ARG 309.A N MET 354.A O no hydrogen 2.821 N/A ARG 309.A NH2 LEU 295.A O no hydrogen 2.891 N/A ALA 310.A N LYS 297.A O no hydrogen 2.908 N/A GLY 311.A N ILE 356.A O no hydrogen 2.918 N/A LYS 313.A N ASN 358.A OD1 no hydrogen 2.883 N/A VAL 314.A N GLY 311.A O no hydrogen 3.242 N/A LYS 318.A NZ GLU 391.A OE1 no hydrogen 3.467 N/A LYS 318.A NZ GLU 391.A OE2 no hydrogen 3.167 N/A ILE 319.A N SER 315.A O no hydrogen 3.081 N/A LYS 320.A N GLU 316.A O no hydrogen 2.906 N/A ARG 321.A N GLU 317.A O no hydrogen 2.963 N/A ARG 321.A NH2 ASP 559.A OD1 no hydrogen 2.780 N/A LEU 322.A N LYS 318.A O no hydrogen 2.822 N/A TYR 323.A N ILE 319.A O no hydrogen 3.007 N/A TYR 323.A OH ASP 302.A OD1 no hydrogen 2.791 N/A TYR 323.A OH HIS 664.A NE2 no hydrogen 2.859 N/A TRP 324.A N LYS 320.A O no hydrogen 3.140 N/A ALA 325.A N ARG 321.A O no hydrogen 2.916 N/A SER 326.A N LEU 322.A O no hydrogen 3.166 N/A SER 326.A N TYR 323.A O no hydrogen 2.959 N/A SER 326.A OG TYR 323.A O no hydrogen 2.704 N/A ARG 327.A N TYR 323.A O no hydrogen 3.445 N/A ARG 327.A NH2 ASP 302.A OD2 no hydrogen 3.054 N/A GLU 328.A N TRP 324.A O no hydrogen 3.261 N/A VAL 329.A N ALA 325.A O no hydrogen 3.034 N/A LYS 330.A N SER 326.A O no hydrogen 2.835 N/A LYS 330.A NZ HIS 334.A NE2 no hydrogen 2.872 N/A SER 331.A N ARG 327.A O no hydrogen 3.290 N/A SER 331.A OG ARG 327.A O no hydrogen 3.130 N/A SER 331.A OG GLU 328.A O no hydrogen 2.947 N/A GLN 332.A N GLU 328.A O no hydrogen 3.464 N/A GLN 332.A NE2 THR 449.A O no hydrogen 3.503 N/A PHE 333.A N VAL 329.A O no hydrogen 3.135 N/A HIS 334.A N LYS 330.A O no hydrogen 2.976 N/A HIS 334.A ND1 ASN 339.A O no hydrogen 2.560 N/A ARG 335.A N SER 331.A O no hydrogen 3.095 N/A ARG 335.A NE ALA 644.A O no hydrogen 3.202 N/A ARG 335.A NH1 ASP 625.A OD1 no hydrogen 2.994 N/A ARG 335.A NH2 ASP 625.A OD1 no hydrogen 3.216 N/A ARG 335.A NH2 ALA 644.A O no hydrogen 2.947 N/A VAL 336.A N GLN 332.A O no hydrogen 3.108 N/A VAL 337.A N PHE 333.A O no hydrogen 2.851 N/A GLY 338.A N HIS 334.A O no hydrogen 2.751 N/A ASN 339.A ND2 LYS 341.A O no hydrogen 2.969 N/A ASN 339.A ND2 TYR 417.A O no hydrogen 3.151 N/A LYS 341.A N ASN 339.A OD1 no hydrogen 3.153 N/A LEU 343.A N ARG 416.A O no hydrogen 3.056 N/A ASN 347.A ND2 GLU 344.A OE1 no hydrogen 3.072 N/A ASP 350.A N ASN 347.A O no hydrogen 3.171 N/A VAL 351.A N ALA 348.A O no hydrogen 3.518 N/A LEU 352.A N THR 305.A O no hydrogen 2.961 N/A THR 353.A N GLY 385.A O no hydrogen 3.130 N/A MET 354.A N ILE 307.A O no hydrogen 2.733 N/A LYS 355.A N PHE 387.A O no hydrogen 3.099 N/A LYS 355.A NZ GLU 291.A OE2 no hydrogen 2.898 N/A LYS 355.A NZ ASN 370.A OD1 no hydrogen 3.306 N/A ILE 356.A N ARG 309.A O no hydrogen 2.926 N/A PHE 357.A N THR 389.A O no hydrogen 2.848 N/A ASN 358.A ND2 ASP 312.A OD1 no hydrogen 3.320 N/A ASN 358.A ND2 GLU 362.A OE1 no hydrogen 2.679 N/A SER 359.A OG GLU 361.A OE1 no hydrogen 3.284 N/A GLU 362.A N SER 359.A OG no hydrogen 2.996 N/A TYR 363.A N SER 359.A O no hydrogen 2.775 N/A TYR 363.A OH ASN 376.A OD1 no hydrogen 2.912 N/A LYS 364.A N PRO 360.A O no hydrogen 3.229 N/A LYS 364.A N GLU 361.A O no hydrogen 3.412 N/A ASN 366.A N TYR 363.A O no hydrogen 3.024 N/A THR 367.A N LYS 364.A O no hydrogen 3.422 N/A THR 367.A OG1 VAL 372.A O no hydrogen 2.920 N/A ASN 368.A N PHE 365.A O no hydrogen 2.855 N/A ILE 369.A N PHE 365.A O no hydrogen 3.075 N/A ASN 370.A N ASN 366.A O no hydrogen 2.759 N/A ASN 370.A ND2 GLU 291.A OE2 no hydrogen 3.206 N/A ASN 370.A ND2 ASN 366.A OD1 no hydrogen 2.780 N/A THR 374.A OG1 VAL 372.A O no hydrogen 3.304 N/A ASN 376.A ND2 SER 373.A OG no hydrogen 3.236 N/A LEU 379.A N TYR 388.A O no hydrogen 2.998 N/A ILE 381.A N THR 386.A O no hydrogen 2.864 N/A ARG 384.A N ILE 381.A O no hydrogen 3.226 N/A ARG 384.A NH1 ASN 370.A O no hydrogen 2.852 N/A ARG 384.A NH1 TYR 388.A OH no hydrogen 3.108 N/A ARG 384.A NH2 ASN 370.A O no hydrogen 3.220 N/A GLY 385.A N GLU 382.A O no hydrogen 2.853 N/A THR 386.A N ILE 381.A O no hydrogen 3.225 N/A THR 386.A OG1 ARG 384.A O no hydrogen 2.823 N/A PHE 387.A N THR 353.A O no hydrogen 3.117 N/A TYR 388.A N LEU 379.A O no hydrogen 2.888 N/A THR 389.A N LYS 355.A O no hydrogen 2.980 N/A THR 389.A OG1 GLY 377.A O no hydrogen 3.327 N/A THR 389.A OG1 TYR 390.A O no hydrogen 3.475 N/A TYR 390.A N THR 389.A OG1 no hydrogen 2.518 N/A GLU 391.A N PHE 357.A O no hydrogen 2.872 N/A ARG 392.A N GLU 391.A OE1 no hydrogen 3.123 N/A ARG 392.A NH2 THR 389.A OG1 no hydrogen 3.125 N/A THR 393.A N GLN 396.A OE1 no hydrogen 2.819 N/A THR 393.A OG1 GLN 396.A OE1 no hydrogen 3.064 N/A GLN 396.A N THR 393.A O no hydrogen 3.163 N/A SER 397.A N THR 393.A O no hydrogen 3.365 N/A SER 397.A OG PHE 399.A O no hydrogen 3.406 N/A PHE 399.A N SER 397.A OG no hydrogen 3.115 N/A SER 400.A N GLU 403.A OE2 no hydrogen 3.270 N/A SER 400.A OG GLU 403.A OE2 no hydrogen 3.283 N/A LEU 404.A N SER 400.A O no hydrogen 3.048 N/A PHE 405.A N LEU 401.A O no hydrogen 2.886 N/A ARG 406.A N GLU 402.A O no hydrogen 2.857 N/A ARG 406.A NE ALA 446.A O no hydrogen 3.226 N/A ARG 406.A NH2 GLU 328.A OE1 no hydrogen 3.433 N/A HIS 407.A N GLU 403.A O no hydrogen 3.140 N/A HIS 407.A ND1 GLU 443.A OE1 no hydrogen 3.128 N/A GLU 408.A N LEU 404.A O no hydrogen 2.966 N/A TYR 409.A N PHE 405.A O no hydrogen 2.788 N/A THR 410.A N ARG 406.A O no hydrogen 3.244 N/A THR 410.A OG1 ARG 406.A O no hydrogen 2.921 N/A HIS 411.A ND1 GLN 414.A OE1 no hydrogen 3.014 N/A TYR 412.A N GLU 408.A O no hydrogen 3.366 N/A LEU 413.A N TYR 409.A O no hydrogen 3.110 N/A GLN 414.A N THR 410.A O no hydrogen 2.726 N/A GLN 414.A NE2 ASP 438.A O no hydrogen 3.319 N/A ALA 415.A N HIS 411.A O no hydrogen 2.940 N/A ARG 416.A N TYR 412.A O no hydrogen 3.079 N/A ARG 416.A N LEU 413.A O no hydrogen 3.148 N/A ARG 416.A NE TYR 417.A OH no hydrogen 2.990 N/A ARG 416.A NH1 ASP 349.A OD1 no hydrogen 2.760 N/A ARG 416.A NH1 ASP 350.A OD1 no hydrogen 2.876 N/A TYR 417.A N LEU 413.A O no hydrogen 2.806 N/A LEU 418.A N GLN 414.A O no hydrogen 3.001 N/A VAL 419.A N GLN 414.A O no hydrogen 3.001 N/A GLN 425.A N LEU 422.A O no hydrogen 3.390 N/A TYR 429.A N GLY 426.A O no hydrogen 2.782 N/A TYR 429.A OH ASP 438.A OD2 no hydrogen 2.919 N/A GLU 430.A N GLY 426.A O no hydrogen 3.169 N/A ARG 433.A NE ASP 522.A OD1 no hydrogen 2.994 N/A ARG 433.A NE ASP 522.A OD2 no hydrogen 3.154 N/A ARG 433.A NH2 ASP 522.A OD2 no hydrogen 2.671 N/A THR 435.A OG1 ASN 432.A OD1 no hydrogen 3.033 N/A ASP 438.A N LEU 434.A O no hydrogen 2.796 N/A GLY 440.A N TRP 436.A O no hydrogen 2.752 N/A THR 441.A N PHE 437.A O no hydrogen 2.838 N/A THR 441.A OG1 PHE 437.A O no hydrogen 2.671 N/A ALA 442.A N ASP 438.A O no hydrogen 3.303 N/A GLU 443.A N GLU 439.A O no hydrogen 3.074 N/A PHE 444.A N GLY 440.A O no hydrogen 3.083 N/A PHE 445.A N THR 441.A O no hydrogen 2.795 N/A ALA 446.A N ALA 442.A O no hydrogen 3.022 N/A GLY 447.A N PHE 444.A O no hydrogen 2.796 N/A SER 448.A N PHE 445.A O no hydrogen 3.077 N/A SER 448.A OG PHE 445.A O no hydrogen 2.560 N/A THR 449.A N GLY 453.A O no hydrogen 3.016 N/A THR 449.A OG1 GLY 453.A O no hydrogen 2.545 N/A ARG 450.A NH1 TYR 639.A O no hydrogen 3.275 N/A ARG 450.A NH1 LEU 642.A O no hydrogen 2.699 N/A ARG 450.A NH2 LEU 628.A O no hydrogen 3.350 N/A THR 451.A OG1 GLU 629.A OE2 no hydrogen 3.043 N/A SER 452.A N THR 449.A OG1 no hydrogen 3.044 N/A VAL 454.A N TYR 499.A OH no hydrogen 3.243 N/A LEU 455.A N GLY 447.A O no hydrogen 3.043 N/A ARG 457.A NE GLU 443.A O no hydrogen 3.442 N/A LYS 458.A N GLY 553.A O no hydrogen 3.078 N/A ILE 460.A N ARG 457.A O no hydrogen 3.051 N/A LEU 461.A N ARG 457.A O no hydrogen 3.082 N/A GLY 462.A N LYS 458.A O no hydrogen 2.698 N/A TYR 463.A N LEU 459.A O no hydrogen 3.040 N/A LEU 464.A N ILE 460.A O no hydrogen 3.290 N/A ALA 465.A N LEU 461.A O no hydrogen 3.234 N/A ALA 465.A N GLY 462.A O no hydrogen 3.202 N/A LYS 466.A N LEU 464.A O no hydrogen 2.897 N/A LYS 466.A NZ TYR 490.A OH no hydrogen 3.125 N/A ARG 472.A N ASP 470.A O no hydrogen 2.231 N/A ARG 472.A NH1 GLN 543.A OE1 no hydrogen 2.706 N/A ARG 472.A NH2 GLN 543.A OE1 no hydrogen 2.898 N/A LEU 475.A N ASN 535.A OD1 no hydrogen 2.832 N/A THR 478.A N SER 474.A O no hydrogen 3.021 N/A THR 478.A OG1 SER 474.A O no hydrogen 2.929 N/A THR 478.A OG1 LEU 475.A O no hydrogen 2.636 N/A LEU 479.A N LEU 475.A O no hydrogen 3.149 N/A ASN 480.A N LYS 476.A O no hydrogen 3.242 N/A PHE 487.A N ASP 484.A O no hydrogen 3.135 N/A ASN 489.A N MET 486.A O no hydrogen 3.037 N/A TYR 490.A N MET 486.A O no hydrogen 3.108 N/A GLY 491.A N PHE 487.A O no hydrogen 2.871 N/A PHE 492.A N TYR 488.A O no hydrogen 3.068 N/A ALA 493.A N ASN 489.A O no hydrogen 3.133 N/A VAL 494.A N TYR 490.A O no hydrogen 2.979 N/A ALA 495.A N GLY 491.A O no hydrogen 3.179 N/A HIS 496.A N PHE 492.A O no hydrogen 2.806 N/A HIS 496.A ND1 HIS 541.A NE2 no hydrogen 3.039 N/A TYR 497.A N ALA 493.A O no hydrogen 3.063 N/A TYR 497.A OH GLU 537.A OE2 no hydrogen 2.743 N/A LEU 498.A N VAL 494.A O no hydrogen 3.095 N/A TYR 499.A N ALA 495.A O no hydrogen 2.984 N/A GLU 500.A N HIS 496.A O no hydrogen 2.802 N/A LYS 501.A N TYR 497.A O no hydrogen 2.795 N/A LYS 501.A NZ HIS 541.A ND1 no hydrogen 3.103 N/A LYS 501.A NZ GLU 544.A OE1 no hydrogen 2.915 N/A ASP 502.A N LEU 498.A O no hydrogen 2.934 N/A THR 505.A OG1 ASP 502.A OD1 no hydrogen 3.053 N/A THR 505.A OG1 ASP 502.A OD2 no hydrogen 2.587 N/A PHE 506.A N ASP 502.A O no hydrogen 3.422 N/A ILE 507.A N MET 503.A O no hydrogen 2.793 N/A LYS 508.A N PRO 504.A O no hydrogen 2.810 N/A MET 509.A N THR 505.A O no hydrogen 2.867 N/A ASN 510.A N PHE 506.A O no hydrogen 3.351 N/A ASN 510.A ND2 PHE 506.A O no hydrogen 2.699 N/A LYS 511.A N ILE 507.A O no hydrogen 2.919 N/A ALA 512.A N LYS 508.A O no hydrogen 3.052 N/A ILE 513.A N MET 509.A O no hydrogen 3.115 N/A LEU 514.A N ASN 510.A O no hydrogen 2.952 N/A ASN 515.A N LYS 511.A O no hydrogen 2.765 N/A THR 516.A N ILE 513.A O no hydrogen 3.057 N/A ASP 517.A N ALA 512.A O no hydrogen 2.742 N/A SER 520.A N ASP 517.A O no hydrogen 3.007 N/A SER 520.A N ASP 517.A OD1 no hydrogen 2.975 N/A SER 520.A OG ASP 517.A OD1 no hydrogen 2.880 N/A TYR 521.A N ASP 517.A O no hydrogen 3.086 N/A TYR 521.A OH ARG 433.A O no hydrogen 2.748 N/A ASP 522.A N VAL 518.A O no hydrogen 3.018 N/A GLU 523.A N LYS 519.A O no hydrogen 3.275 N/A ILE 524.A N SER 520.A O no hydrogen 3.015 N/A ILE 525.A N TYR 521.A O no hydrogen 2.944 N/A LYS 526.A N ASP 522.A O no hydrogen 2.801 N/A LYS 527.A N GLU 523.A O no hydrogen 2.990 N/A LEU 528.A N ILE 524.A O no hydrogen 3.070 N/A SER 529.A N ILE 525.A O no hydrogen 2.975 N/A SER 529.A OG ILE 525.A O no hydrogen 2.323 N/A SER 529.A OG LYS 526.A O no hydrogen 3.056 N/A ASP 530.A N LYS 526.A O no hydrogen 2.834 N/A ASP 531.A N LEU 528.A O no hydrogen 3.427 N/A LYS 534.A N ASP 531.A OD1 no hydrogen 2.854 N/A LYS 534.A NZ ASP 502.A OD2 no hydrogen 3.341 N/A ASN 535.A N ASP 531.A O no hydrogen 3.414 N/A THR 536.A N ALA 532.A O no hydrogen 3.084 N/A THR 536.A OG1 ALA 532.A O no hydrogen 2.737 N/A GLU 537.A N ASN 533.A O no hydrogen 2.774 N/A TYR 538.A N LYS 534.A O no hydrogen 2.964 N/A TYR 538.A OH TYR 490.A O no hydrogen 3.087 N/A GLN 539.A N ASN 535.A O no hydrogen 2.605 N/A GLN 539.A NE2 TYR 473.A O no hydrogen 2.822 N/A GLN 539.A NE2 ASN 535.A OD1 no hydrogen 3.610 N/A ASN 540.A N THR 536.A O no hydrogen 3.070 N/A HIS 541.A N GLU 537.A O no hydrogen 3.346 N/A HIS 541.A NE2 HIS 496.A ND1 no hydrogen 3.039 N/A ILE 542.A N TYR 538.A O no hydrogen 3.197 N/A GLU 544.A N ASN 540.A O no hydrogen 3.144 N/A LEU 545.A N HIS 541.A O no hydrogen 2.910 N/A VAL 546.A N ILE 542.A O no hydrogen 2.867 N/A ASP 547.A N GLN 543.A O no hydrogen 2.782 N/A LYS 548.A N GLU 544.A O no hydrogen 2.910 N/A LYS 548.A N LEU 545.A O no hydrogen 3.250 N/A TYR 549.A N VAL 546.A O no hydrogen 3.205 N/A ALA 552.A N TYR 549.A O no hydrogen 3.192 N/A VAL 557.A N GLU 402.A OE2 no hydrogen 2.655 N/A ASP 560.A N SER 558.A OG no hydrogen 3.236 N/A TYR 561.A N SER 558.A O no hydrogen 3.203 N/A TYR 561.A OH GLU 328.A OE2 no hydrogen 2.830 N/A LEU 562.A N ASP 559.A O no hydrogen 2.891 N/A LYS 563.A N ASP 560.A O no hydrogen 3.310 N/A HIS 565.A ND1 SER 637.A OG no hydrogen 2.846 N/A LYS 568.A N THR 668.A OG1 no hydrogen 3.236 N/A LYS 568.A NZ GLU 572.A OE1 no hydrogen 3.444 N/A LYS 568.A NZ GLU 576.A OE2 no hydrogen 3.498 N/A ALA 570.A N ASP 669.A OD2 no hydrogen 3.041 N/A VAL 573.A N LYS 569.A O no hydrogen 3.452 N/A TYR 574.A N ALA 570.A O no hydrogen 3.310 N/A SER 575.A N SER 571.A O no hydrogen 3.070 N/A SER 575.A OG SER 571.A O no hydrogen 2.899 N/A GLU 576.A N GLU 572.A O no hydrogen 3.024 N/A ILE 577.A N VAL 573.A O no hydrogen 2.884 N/A SER 578.A N TYR 574.A O no hydrogen 2.647 N/A SER 578.A OG TYR 574.A O no hydrogen 2.924 N/A LYS 579.A N SER 575.A O no hydrogen 2.853 N/A ALA 580.A N GLU 576.A O no hydrogen 3.140 N/A ALA 581.A N ILE 577.A O no hydrogen 2.968 N/A SER 582.A N LYS 579.A O no hydrogen 3.264 N/A LEU 583.A N SER 578.A O no hydrogen 2.972 N/A THR 584.A N THR 604.A O no hydrogen 2.796 N/A THR 584.A OG1 THR 604.A O no hydrogen 3.329 N/A SER 587.A N ARG 602.A O no hydrogen 3.112 N/A THR 589.A N THR 600.A O no hydrogen 3.093 N/A GLU 591.A N THR 598.A O no hydrogen 2.688 N/A LYS 592.A N ASN 303.A OD1 no hydrogen 3.024 N/A SER 593.A N PHE 596.A O no hydrogen 2.916 N/A GLN 594.A N THR 300.A O no hydrogen 2.725 N/A THR 598.A N GLU 591.A O no hydrogen 2.926 N/A THR 598.A OG1 GLU 591.A O no hydrogen 3.238 N/A PHE 599.A N GLY 665.A O no hydrogen 3.037 N/A THR 600.A N THR 589.A O no hydrogen 2.855 N/A THR 600.A OG1 GLU 591.A OE2 no hydrogen 3.012 N/A THR 600.A OG1 HIS 664.A ND1 no hydrogen 2.598 N/A LEU 601.A N PHE 663.A O no hydrogen 2.672 N/A ARG 602.A N SER 587.A O no hydrogen 2.889 N/A GLY 603.A N VAL 661.A O no hydrogen 2.972 N/A THR 604.A N THR 584.A O no hydrogen 3.009 N/A TYR 605.A N TYR 659.A O no hydrogen 3.117 N/A GLY 607.A N VAL 657.A O no hydrogen 2.791 N/A SER 610.A N ASN 655.A O no hydrogen 2.727 N/A SER 610.A OG ASP 616.A OD1 no hydrogen 3.288 N/A SER 610.A OG ASP 616.A OD2 no hydrogen 2.608 N/A LYS 611.A N ASP 616.A OD1 no hydrogen 2.922 N/A LYS 611.A NZ GLU 619.A OE1 no hydrogen 3.123 N/A LYS 611.A NZ GLU 619.A OE2 no hydrogen 2.797 N/A GLY 612.A N SER 610.A OG no hydrogen 2.784 N/A ASP 616.A N GLY 612.A O no hydrogen 2.841 N/A TRP 617.A N GLU 613.A O no hydrogen 2.904 N/A TRP 617.A NE1 ARG 335.A O no hydrogen 3.030 N/A ASP 618.A N PHE 614.A O no hydrogen 3.233 N/A GLU 619.A N LYS 615.A O no hydrogen 2.912 N/A MET 620.A N ASP 616.A O no hydrogen 2.782 N/A SER 621.A N TRP 617.A O no hydrogen 3.064 N/A SER 621.A OG TRP 617.A O no hydrogen 2.734 N/A LYS 622.A N ASP 618.A O no hydrogen 3.317 N/A LYS 622.A NZ ASP 618.A OD1 no hydrogen 3.521 N/A LYS 623.A N GLU 619.A O no hydrogen 2.649 N/A LEU 624.A N MET 620.A O no hydrogen 2.672 N/A ASP 625.A N SER 621.A O no hydrogen 2.825 N/A GLY 626.A N LYS 622.A O no hydrogen 3.143 N/A THR 627.A N LYS 623.A O no hydrogen 3.059 N/A THR 627.A OG1 LYS 623.A O no hydrogen 3.014 N/A LEU 628.A N LEU 624.A O no hydrogen 3.050 N/A GLU 629.A N ASP 625.A O no hydrogen 3.004 N/A SER 630.A N GLY 626.A O no hydrogen 2.876 N/A LEU 631.A N THR 627.A O no hydrogen 3.172 N/A ALA 632.A N LEU 628.A O no hydrogen 3.288 N/A LYS 633.A N SER 630.A O no hydrogen 2.980 N/A ASN 634.A N LEU 631.A O no hydrogen 3.225 N/A TRP 636.A NE1 GLY 566.A O no hydrogen 3.125 N/A SER 637.A OG HIS 565.A ND1 no hydrogen 2.846 N/A TYR 639.A N TRP 636.A O no hydrogen 3.155 N/A TYR 639.A OH GLU 576.A OE1 no hydrogen 2.443 N/A LYS 640.A N SER 637.A O no hydrogen 3.274 N/A THR 641.A N GLY 638.A O no hydrogen 3.387 N/A THR 641.A OG1 GLY 638.A O no hydrogen 2.559 N/A LEU 642.A N TYR 639.A O no hydrogen 3.470 N/A THR 643.A N HIS 664.A O no hydrogen 2.809 N/A THR 643.A OG1 HIS 664.A O no hydrogen 3.369 N/A TYR 645.A N VAL 662.A O no hydrogen 3.025 N/A TYR 645.A OH ASP 340.A OD2 no hydrogen 3.263 N/A THR 647.A N ASP 660.A O no hydrogen 2.908 N/A ASN 648.A N GLY 338.A O no hydrogen 3.323 N/A ASN 648.A ND2 ASP 660.A OD2 no hydrogen 3.419 N/A TYR 649.A OH ASP 616.A OD2 no hydrogen 2.785 N/A ARG 650.A N GLN 658.A O no hydrogen 2.993 N/A ARG 650.A NE GLN 658.A OE1 no hydrogen 3.496 N/A ARG 650.A NH1 ASN 648.A O no hydrogen 2.688 N/A ARG 650.A NH1 ASP 660.A OD2 no hydrogen 3.075 N/A THR 652.A N LYS 656.A O no hydrogen 3.024 N/A THR 652.A OG1 LYS 656.A O no hydrogen 3.382 N/A ASN 655.A N THR 652.A O no hydrogen 2.863 N/A LYS 656.A N THR 652.A OG1 no hydrogen 3.169 N/A VAL 657.A N GLU 608.A O no hydrogen 2.909 N/A GLN 658.A N ARG 650.A O no hydrogen 2.903 N/A TYR 659.A N TYR 605.A O no hydrogen 3.000 N/A ASP 660.A N THR 647.A O no hydrogen 2.953 N/A VAL 661.A N GLY 603.A O no hydrogen 2.859 N/A VAL 662.A N TYR 645.A O no hydrogen 2.876 N/A PHE 663.A N LEU 601.A O no hydrogen 2.760 N/A HIS 664.A N THR 643.A O no hydrogen 2.826 N/A HIS 664.A ND1 THR 600.A OG1 no hydrogen 2.598 N/A HIS 664.A NE2 TYR 323.A OH no hydrogen 2.859 N/A GLY 665.A N PHE 599.A O no hydrogen 3.194 N/A VAL 666.A N THR 641.A OG1 no hydrogen 2.941 N/A LEU 667.A N ASN 597.A O no hydrogen 2.807 N/A THR 668.A OG1 GLY 566.A O no hydrogen 2.826 N/A