USER MOD reduce.3.24.130724 H: found=0, std=0, add=791, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 794 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 350 SER OG : rot 110:sc= 0 USER MOD Set 1.2: A 404 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Set 2.1: A 390 SER OG : rot -94:sc= 1.23 USER MOD Set 2.2: A 394 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 359 SER OG : rot -89:sc= 1.26 USER MOD Set 3.2: A 365 MET CE :methyl -129:sc= -0.714 (180deg=-2.6!) USER MOD Set 4.1: A 349 TYR OH : rot 180:sc= 0 USER MOD Set 4.2: A 396 SER OG : rot 180:sc= 0 USER MOD Single : A 342 ASN : amide:sc=-0.00904 X(o=-0.009,f=-0.009) USER MOD Single : A 348 SER OG : rot 180:sc= 0 USER MOD Single : A 355 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0295) USER MOD Single : A 358 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 360 THR OG1 : rot -47:sc= 0.304 USER MOD Single : A 368 ASN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 371 TYR OH : rot 180:sc= 0 USER MOD Single : A 372 ASN : amide:sc= -0.499 X(o=-0.5,f=-0.63) USER MOD Single : A 376 SER OG : rot 81:sc= 0.229 USER MOD Single : A 377 ASN : amide:sc= 1.18 K(o=1.2,f=-0.0035) USER MOD Single : A 380 TYR OH : rot 180:sc= 0 USER MOD Single : A 383 ASN : amide:sc= -0.0052 X(o=-0.0052,f=-0.0052) USER MOD Single : A 385 THR OG1 : rot -97:sc= 0.0184 USER MOD Single : A 386 SER OG : rot 180:sc= 0 USER MOD Single : A 387 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 389 GLN : amide:sc= -2.35! K(o=-2.4!,f=-0.12) USER MOD Single : A 395 ASN : amide:sc= 0 X(o=0,f=-0.082) USER MOD Single : A 399 HIS : no HD1:sc= -1.71! K(o=-1.7!,f=0.53) USER MOD Single : A 400 ASN : amide:sc= -1.54 K(o=-1.5,f=-4.4) USER MOD Single : A 402 SER OG : rot -130:sc= 0.0424 USER MOD Single : A 405 SER OG : rot -43:sc= 0.534 USER MOD Single : A 408 MET CE :methyl -162:sc= -0.198 (180deg=-0.832) USER MOD Single : A 411 GLN : amide:sc= -0.518 X(o=-0.52,f=-0.67) USER MOD Single : A 412 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 417 LYS NZ :NH3+ 165:sc= -0.0136 (180deg=-0.25) USER MOD Single : A 418 SER OG : rot -140:sc= 0.518 USER MOD Single : A 419 SER OG : rot 180:sc= 0 USER MOD Single : A 424 ASN : amide:sc= -0.0772 K(o=-0.077,f=-6.5!) USER MOD Single : A 428 LYS NZ :NH3+ 174:sc= 0.051 (180deg=0.0459) USER MOD Single : A 432 ASN : amide:sc= 0.852 K(o=0.85,f=-1.6!) USER MOD Single : A 436 GLN : amide:sc= -0.0149 K(o=-0.015,f=-3!) USER MOD Single : A 438 SER OG : rot 180:sc= 0.536 USER MOD Single : A 440 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N ASN A 342 -1.855 -14.791 11.473 1.00 53.44 N ATOM 2 CA ASN A 342 -1.452 -13.669 10.614 1.00 72.10 C ATOM 3 C ASN A 342 -1.693 -12.375 11.329 1.00 62.31 C ATOM 4 O ASN A 342 -2.697 -12.236 12.017 1.00 11.43 O ATOM 5 CB ASN A 342 -2.195 -13.679 9.278 1.00 1.45 C ATOM 6 CG ASN A 342 -1.864 -14.878 8.433 1.00 50.55 C ATOM 7 OD1 ASN A 342 -0.923 -14.850 7.640 1.00 72.43 O ATOM 8 ND2 ASN A 342 -2.628 -15.932 8.580 1.00 20.31 N ATOM 0 HA ASN A 342 -0.389 -13.777 10.397 1.00 72.10 H new ATOM 0 HB2 ASN A 342 -3.269 -13.658 9.465 1.00 1.45 H new ATOM 0 HB3 ASN A 342 -1.950 -12.772 8.725 1.00 1.45 H new ATOM 0 HD21 ASN A 342 -2.453 -16.770 8.026 1.00 20.31 H new ATOM 0 HD22 ASN A 342 -3.398 -15.914 9.249 1.00 20.31 H new ATOM 17 N PRO A 343 -0.788 -11.389 11.160 1.00 74.50 N ATOM 18 CA PRO A 343 -0.847 -10.082 11.872 1.00 14.45 C ATOM 19 C PRO A 343 -1.949 -9.145 11.334 1.00 32.15 C ATOM 20 O PRO A 343 -1.738 -7.950 11.176 1.00 41.40 O ATOM 21 CB PRO A 343 0.536 -9.497 11.559 1.00 13.43 C ATOM 22 CG PRO A 343 0.848 -10.033 10.220 1.00 12.32 C ATOM 23 CD PRO A 343 0.386 -11.451 10.254 1.00 61.45 C ATOM 0 HA PRO A 343 -1.080 -10.196 12.931 1.00 14.45 H new ATOM 0 HB2 PRO A 343 0.519 -8.407 11.560 1.00 13.43 H new ATOM 0 HB3 PRO A 343 1.277 -9.805 12.296 1.00 13.43 H new ATOM 0 HG2 PRO A 343 0.336 -9.470 9.440 1.00 12.32 H new ATOM 0 HG3 PRO A 343 1.916 -9.971 10.009 1.00 12.32 H new ATOM 0 HD2 PRO A 343 0.114 -11.812 9.262 1.00 61.45 H new ATOM 0 HD3 PRO A 343 1.158 -12.119 10.636 1.00 61.45 H new ATOM 31 N TRP A 344 -3.124 -9.683 11.132 1.00 22.12 N ATOM 32 CA TRP A 344 -4.249 -8.936 10.606 1.00 3.33 C ATOM 33 C TRP A 344 -5.543 -9.748 10.684 1.00 65.14 C ATOM 34 O TRP A 344 -6.624 -9.189 10.890 1.00 12.23 O ATOM 35 CB TRP A 344 -3.981 -8.459 9.155 1.00 12.21 C ATOM 36 CG TRP A 344 -3.563 -9.542 8.179 1.00 21.23 C ATOM 37 CD1 TRP A 344 -4.283 -10.615 7.760 1.00 24.40 C ATOM 38 CD2 TRP A 344 -2.335 -9.599 7.452 1.00 10.12 C ATOM 39 NE1 TRP A 344 -3.554 -11.345 6.885 1.00 52.32 N ATOM 40 CE2 TRP A 344 -2.369 -10.740 6.665 1.00 53.51 C ATOM 41 CE3 TRP A 344 -1.220 -8.807 7.407 1.00 40.53 C ATOM 42 CZ2 TRP A 344 -1.329 -11.100 5.837 1.00 22.04 C ATOM 43 CZ3 TRP A 344 -0.180 -9.158 6.578 1.00 34.14 C ATOM 44 CH2 TRP A 344 -0.245 -10.296 5.802 1.00 73.24 C ATOM 0 H TRP A 344 -3.334 -10.662 11.328 1.00 22.12 H new ATOM 0 HA TRP A 344 -4.373 -8.051 11.231 1.00 3.33 H new ATOM 0 HB2 TRP A 344 -4.884 -7.981 8.776 1.00 12.21 H new ATOM 0 HB3 TRP A 344 -3.203 -7.696 9.180 1.00 12.21 H new ATOM 0 HD1 TRP A 344 -5.288 -10.850 8.078 1.00 24.40 H new ATOM 0 HE1 TRP A 344 -3.855 -12.220 6.457 1.00 52.32 H new ATOM 0 HE3 TRP A 344 -1.157 -7.917 8.015 1.00 40.53 H new ATOM 0 HZ2 TRP A 344 -1.379 -11.996 5.236 1.00 22.04 H new ATOM 0 HZ3 TRP A 344 0.700 -8.533 6.534 1.00 34.14 H new ATOM 0 HH2 TRP A 344 0.584 -10.548 5.157 1.00 73.24 H new ATOM 55 N GLY A 345 -5.421 -11.056 10.545 1.00 65.35 N ATOM 56 CA GLY A 345 -6.569 -11.923 10.530 1.00 41.42 C ATOM 57 C GLY A 345 -6.193 -13.285 10.006 1.00 53.44 C ATOM 58 O GLY A 345 -5.117 -13.786 10.326 1.00 24.45 O ATOM 0 H GLY A 345 -4.528 -11.537 10.441 1.00 65.35 H new ATOM 0 HA2 GLY A 345 -6.977 -12.014 11.537 1.00 41.42 H new ATOM 0 HA3 GLY A 345 -7.351 -11.490 9.907 1.00 41.42 H new ATOM 62 N ALA A 346 -7.038 -13.865 9.172 1.00 20.14 N ATOM 63 CA ALA A 346 -6.805 -15.210 8.642 1.00 11.25 C ATOM 64 C ALA A 346 -6.277 -15.153 7.228 1.00 41.23 C ATOM 65 O ALA A 346 -5.800 -16.155 6.691 1.00 2.33 O ATOM 66 CB ALA A 346 -8.084 -16.027 8.681 1.00 20.31 C ATOM 0 H ALA A 346 -7.898 -13.428 8.842 1.00 20.14 H new ATOM 0 HA ALA A 346 -6.056 -15.690 9.272 1.00 11.25 H new ATOM 0 HB1 ALA A 346 -7.892 -17.023 8.283 1.00 20.31 H new ATOM 0 HB2 ALA A 346 -8.433 -16.108 9.711 1.00 20.31 H new ATOM 0 HB3 ALA A 346 -8.848 -15.537 8.077 1.00 20.31 H new ATOM 72 N GLU A 347 -6.379 -13.986 6.625 1.00 44.32 N ATOM 73 CA GLU A 347 -5.909 -13.753 5.271 1.00 43.44 C ATOM 74 C GLU A 347 -4.413 -14.014 5.201 1.00 52.24 C ATOM 75 O GLU A 347 -3.721 -13.892 6.195 1.00 63.03 O ATOM 76 CB GLU A 347 -6.191 -12.296 4.819 1.00 72.11 C ATOM 77 CG GLU A 347 -7.654 -11.819 4.921 1.00 24.54 C ATOM 78 CD GLU A 347 -8.128 -11.553 6.348 1.00 43.13 C ATOM 79 OE1 GLU A 347 -8.598 -12.497 7.029 1.00 62.52 O ATOM 80 OE2 GLU A 347 -8.036 -10.394 6.802 1.00 72.30 O ATOM 0 H GLU A 347 -6.794 -13.164 7.064 1.00 44.32 H new ATOM 0 HA GLU A 347 -6.444 -14.431 4.606 1.00 43.44 H new ATOM 0 HB2 GLU A 347 -5.571 -11.627 5.415 1.00 72.11 H new ATOM 0 HB3 GLU A 347 -5.868 -12.191 3.783 1.00 72.11 H new ATOM 0 HG2 GLU A 347 -7.768 -10.906 4.336 1.00 24.54 H new ATOM 0 HG3 GLU A 347 -8.302 -12.570 4.469 1.00 24.54 H new ATOM 87 N SER A 348 -3.918 -14.353 4.058 1.00 51.44 N ATOM 88 CA SER A 348 -2.512 -14.584 3.917 1.00 21.51 C ATOM 89 C SER A 348 -1.859 -13.356 3.351 1.00 15.42 C ATOM 90 O SER A 348 -2.544 -12.486 2.785 1.00 5.10 O ATOM 91 CB SER A 348 -2.251 -15.783 3.023 1.00 55.42 C ATOM 92 OG SER A 348 -2.784 -16.973 3.589 1.00 52.30 O ATOM 0 H SER A 348 -4.463 -14.477 3.205 1.00 51.44 H new ATOM 0 HA SER A 348 -2.088 -14.798 4.898 1.00 21.51 H new ATOM 0 HB2 SER A 348 -2.696 -15.613 2.043 1.00 55.42 H new ATOM 0 HB3 SER A 348 -1.178 -15.899 2.870 1.00 55.42 H new ATOM 0 HG SER A 348 -2.603 -17.729 2.992 1.00 52.30 H new ATOM 98 N TYR A 349 -0.555 -13.265 3.523 1.00 51.33 N ATOM 99 CA TYR A 349 0.222 -12.162 3.017 1.00 50.31 C ATOM 100 C TYR A 349 -0.023 -11.944 1.553 1.00 74.23 C ATOM 101 O TYR A 349 -0.535 -10.911 1.186 1.00 61.21 O ATOM 102 CB TYR A 349 1.699 -12.370 3.284 1.00 12.32 C ATOM 103 CG TYR A 349 2.118 -12.264 4.736 1.00 34.21 C ATOM 104 CD1 TYR A 349 1.887 -13.290 5.641 1.00 24.14 C ATOM 105 CD2 TYR A 349 2.774 -11.128 5.190 1.00 71.14 C ATOM 106 CE1 TYR A 349 2.292 -13.185 6.953 1.00 55.33 C ATOM 107 CE2 TYR A 349 3.178 -11.014 6.500 1.00 34.13 C ATOM 108 CZ TYR A 349 2.938 -12.042 7.376 1.00 41.14 C ATOM 109 OH TYR A 349 3.356 -11.934 8.686 1.00 42.23 O ATOM 0 H TYR A 349 -0.005 -13.963 4.023 1.00 51.33 H new ATOM 0 HA TYR A 349 -0.100 -11.266 3.548 1.00 50.31 H new ATOM 0 HB2 TYR A 349 1.983 -13.355 2.912 1.00 12.32 H new ATOM 0 HB3 TYR A 349 2.262 -11.637 2.706 1.00 12.32 H new ATOM 0 HD1 TYR A 349 1.381 -14.186 5.311 1.00 24.14 H new ATOM 0 HD2 TYR A 349 2.971 -10.319 4.502 1.00 71.14 H new ATOM 0 HE1 TYR A 349 2.105 -13.992 7.646 1.00 55.33 H new ATOM 0 HE2 TYR A 349 3.681 -10.120 6.837 1.00 34.13 H new ATOM 0 HH TYR A 349 3.794 -11.068 8.819 1.00 42.23 H new ATOM 119 N SER A 350 0.310 -12.927 0.723 1.00 12.11 N ATOM 120 CA SER A 350 0.093 -12.812 -0.724 1.00 63.13 C ATOM 121 C SER A 350 -1.370 -12.425 -1.078 1.00 60.31 C ATOM 122 O SER A 350 -1.597 -11.709 -2.056 1.00 64.11 O ATOM 123 CB SER A 350 0.499 -14.096 -1.428 1.00 30.31 C ATOM 124 OG SER A 350 1.856 -14.432 -1.123 1.00 63.41 O ATOM 0 H SER A 350 0.729 -13.809 1.020 1.00 12.11 H new ATOM 0 HA SER A 350 0.727 -12.000 -1.079 1.00 63.13 H new ATOM 0 HB2 SER A 350 -0.160 -14.909 -1.122 1.00 30.31 H new ATOM 0 HB3 SER A 350 0.381 -13.979 -2.505 1.00 30.31 H new ATOM 0 HG SER A 350 1.875 -15.226 -0.549 1.00 63.41 H new ATOM 130 N ASP A 351 -2.346 -12.864 -0.260 1.00 73.40 N ATOM 131 CA ASP A 351 -3.750 -12.488 -0.491 1.00 61.32 C ATOM 132 C ASP A 351 -3.939 -10.995 -0.305 1.00 61.14 C ATOM 133 O ASP A 351 -4.549 -10.325 -1.141 1.00 32.15 O ATOM 134 CB ASP A 351 -4.742 -13.241 0.422 1.00 72.40 C ATOM 135 CG ASP A 351 -4.859 -14.714 0.134 1.00 23.33 C ATOM 136 OD1 ASP A 351 -5.439 -15.091 -0.896 1.00 15.02 O ATOM 137 OD2 ASP A 351 -4.421 -15.518 0.956 1.00 3.53 O ATOM 0 H ASP A 351 -2.192 -13.466 0.549 1.00 73.40 H new ATOM 0 HA ASP A 351 -3.971 -12.773 -1.520 1.00 61.32 H new ATOM 0 HB2 ASP A 351 -4.433 -13.110 1.459 1.00 72.40 H new ATOM 0 HB3 ASP A 351 -5.727 -12.785 0.322 1.00 72.40 H new ATOM 142 N LEU A 352 -3.422 -10.467 0.787 1.00 52.14 N ATOM 143 CA LEU A 352 -3.526 -9.061 1.051 1.00 31.21 C ATOM 144 C LEU A 352 -2.587 -8.218 0.193 1.00 20.03 C ATOM 145 O LEU A 352 -2.922 -7.093 -0.149 1.00 31.23 O ATOM 146 CB LEU A 352 -3.351 -8.734 2.509 1.00 1.02 C ATOM 147 CG LEU A 352 -4.414 -9.228 3.484 1.00 33.31 C ATOM 148 CD1 LEU A 352 -4.185 -8.588 4.810 1.00 11.15 C ATOM 149 CD2 LEU A 352 -5.811 -8.929 2.980 1.00 51.33 C ATOM 0 H LEU A 352 -2.926 -10.999 1.502 1.00 52.14 H new ATOM 0 HA LEU A 352 -4.545 -8.794 0.769 1.00 31.21 H new ATOM 0 HB2 LEU A 352 -2.390 -9.137 2.829 1.00 1.02 H new ATOM 0 HB3 LEU A 352 -3.289 -7.650 2.603 1.00 1.02 H new ATOM 0 HG LEU A 352 -4.333 -10.311 3.578 1.00 33.31 H new ATOM 0 HD11 LEU A 352 -4.940 -8.934 5.516 1.00 11.15 H new ATOM 0 HD12 LEU A 352 -3.194 -8.856 5.177 1.00 11.15 H new ATOM 0 HD13 LEU A 352 -4.253 -7.505 4.708 1.00 11.15 H new ATOM 0 HD21 LEU A 352 -6.543 -9.295 3.700 1.00 51.33 H new ATOM 0 HD22 LEU A 352 -5.930 -7.853 2.856 1.00 51.33 H new ATOM 0 HD23 LEU A 352 -5.966 -9.424 2.021 1.00 51.33 H new ATOM 161 N ILE A 353 -1.410 -8.747 -0.134 1.00 21.22 N ATOM 162 CA ILE A 353 -0.465 -8.050 -1.023 1.00 34.33 C ATOM 163 C ILE A 353 -1.138 -7.794 -2.345 1.00 64.12 C ATOM 164 O ILE A 353 -1.003 -6.715 -2.921 1.00 35.31 O ATOM 165 CB ILE A 353 0.834 -8.867 -1.248 1.00 3.03 C ATOM 166 CG1 ILE A 353 1.544 -9.055 0.100 1.00 62.54 C ATOM 167 CG2 ILE A 353 1.752 -8.154 -2.259 1.00 31.11 C ATOM 168 CD1 ILE A 353 2.695 -10.021 0.085 1.00 71.50 C ATOM 0 H ILE A 353 -1.082 -9.654 0.199 1.00 21.22 H new ATOM 0 HA ILE A 353 -0.181 -7.111 -0.548 1.00 34.33 H new ATOM 0 HB ILE A 353 0.585 -9.844 -1.662 1.00 3.03 H new ATOM 0 HG12 ILE A 353 1.908 -8.085 0.440 1.00 62.54 H new ATOM 0 HG13 ILE A 353 0.813 -9.396 0.833 1.00 62.54 H new ATOM 0 HG21 ILE A 353 2.659 -8.741 -2.405 1.00 31.11 H new ATOM 0 HG22 ILE A 353 1.232 -8.048 -3.211 1.00 31.11 H new ATOM 0 HG23 ILE A 353 2.016 -7.168 -1.878 1.00 31.11 H new ATOM 0 HD11 ILE A 353 3.130 -10.084 1.083 1.00 71.50 H new ATOM 0 HD12 ILE A 353 2.340 -11.006 -0.219 1.00 71.50 H new ATOM 0 HD13 ILE A 353 3.452 -9.675 -0.619 1.00 71.50 H new ATOM 180 N ALA A 354 -1.885 -8.789 -2.809 1.00 22.53 N ATOM 181 CA ALA A 354 -2.678 -8.644 -4.007 1.00 14.23 C ATOM 182 C ALA A 354 -3.640 -7.463 -3.858 1.00 41.40 C ATOM 183 O ALA A 354 -3.750 -6.664 -4.754 1.00 55.21 O ATOM 184 CB ALA A 354 -3.440 -9.920 -4.303 1.00 2.23 C ATOM 0 H ALA A 354 -1.953 -9.705 -2.366 1.00 22.53 H new ATOM 0 HA ALA A 354 -2.010 -8.448 -4.846 1.00 14.23 H new ATOM 0 HB1 ALA A 354 -4.031 -9.789 -5.210 1.00 2.23 H new ATOM 0 HB2 ALA A 354 -2.736 -10.740 -4.444 1.00 2.23 H new ATOM 0 HB3 ALA A 354 -4.102 -10.150 -3.468 1.00 2.23 H new ATOM 190 N LYS A 355 -4.305 -7.348 -2.689 1.00 5.34 N ATOM 191 CA LYS A 355 -5.228 -6.220 -2.421 1.00 2.02 C ATOM 192 C LYS A 355 -4.509 -4.886 -2.416 1.00 52.42 C ATOM 193 O LYS A 355 -5.051 -3.880 -2.878 1.00 74.35 O ATOM 194 CB LYS A 355 -5.984 -6.366 -1.106 1.00 44.12 C ATOM 195 CG LYS A 355 -6.971 -7.448 -1.063 1.00 74.24 C ATOM 196 CD LYS A 355 -7.670 -7.426 0.255 1.00 2.41 C ATOM 197 CE LYS A 355 -8.973 -8.132 0.178 1.00 40.42 C ATOM 198 NZ LYS A 355 -8.864 -9.556 -0.256 1.00 41.43 N ATOM 0 H LYS A 355 -4.223 -8.014 -1.921 1.00 5.34 H new ATOM 0 HA LYS A 355 -5.947 -6.248 -3.240 1.00 2.02 H new ATOM 0 HB2 LYS A 355 -5.260 -6.526 -0.307 1.00 44.12 H new ATOM 0 HB3 LYS A 355 -6.492 -5.426 -0.893 1.00 44.12 H new ATOM 0 HG2 LYS A 355 -7.692 -7.330 -1.872 1.00 74.24 H new ATOM 0 HG3 LYS A 355 -6.480 -8.410 -1.211 1.00 74.24 H new ATOM 0 HD2 LYS A 355 -7.042 -7.896 1.012 1.00 2.41 H new ATOM 0 HD3 LYS A 355 -7.829 -6.394 0.569 1.00 2.41 H new ATOM 0 HE2 LYS A 355 -9.453 -8.096 1.156 1.00 40.42 H new ATOM 0 HE3 LYS A 355 -9.623 -7.600 -0.516 1.00 40.42 H new ATOM 0 HZ1 LYS A 355 -9.789 -10.021 -0.157 1.00 41.43 H new ATOM 0 HZ2 LYS A 355 -8.562 -9.594 -1.251 1.00 41.43 H new ATOM 0 HZ3 LYS A 355 -8.165 -10.047 0.337 1.00 41.43 H new ATOM 212 N ALA A 356 -3.313 -4.874 -1.874 1.00 43.11 N ATOM 213 CA ALA A 356 -2.511 -3.671 -1.848 1.00 14.22 C ATOM 214 C ALA A 356 -2.215 -3.254 -3.247 1.00 0.44 C ATOM 215 O ALA A 356 -2.492 -2.129 -3.645 1.00 51.21 O ATOM 216 CB ALA A 356 -1.215 -3.894 -1.070 1.00 33.50 C ATOM 0 H ALA A 356 -2.872 -5.687 -1.443 1.00 43.11 H new ATOM 0 HA ALA A 356 -3.067 -2.882 -1.342 1.00 14.22 H new ATOM 0 HB1 ALA A 356 -0.630 -2.974 -1.066 1.00 33.50 H new ATOM 0 HB2 ALA A 356 -1.451 -4.179 -0.045 1.00 33.50 H new ATOM 0 HB3 ALA A 356 -0.638 -4.688 -1.544 1.00 33.50 H new ATOM 222 N LEU A 357 -1.726 -4.194 -3.996 1.00 54.51 N ATOM 223 CA LEU A 357 -1.340 -4.017 -5.374 1.00 51.01 C ATOM 224 C LEU A 357 -2.578 -3.585 -6.174 1.00 14.34 C ATOM 225 O LEU A 357 -2.507 -2.734 -7.044 1.00 43.01 O ATOM 226 CB LEU A 357 -0.856 -5.368 -5.848 1.00 34.34 C ATOM 227 CG LEU A 357 0.317 -5.415 -6.826 1.00 62.32 C ATOM 228 CD1 LEU A 357 -0.050 -4.839 -8.188 1.00 11.40 C ATOM 229 CD2 LEU A 357 1.516 -4.671 -6.254 1.00 11.34 C ATOM 0 H LEU A 357 -1.577 -5.144 -3.657 1.00 54.51 H new ATOM 0 HA LEU A 357 -0.565 -3.261 -5.499 1.00 51.01 H new ATOM 0 HB2 LEU A 357 -0.579 -5.949 -4.968 1.00 34.34 H new ATOM 0 HB3 LEU A 357 -1.699 -5.878 -6.315 1.00 34.34 H new ATOM 0 HG LEU A 357 0.576 -6.464 -6.968 1.00 62.32 H new ATOM 0 HD11 LEU A 357 0.814 -4.893 -8.851 1.00 11.40 H new ATOM 0 HD12 LEU A 357 -0.872 -5.413 -8.616 1.00 11.40 H new ATOM 0 HD13 LEU A 357 -0.355 -3.799 -8.073 1.00 11.40 H new ATOM 0 HD21 LEU A 357 2.343 -4.714 -6.963 1.00 11.34 H new ATOM 0 HD22 LEU A 357 1.246 -3.630 -6.074 1.00 11.34 H new ATOM 0 HD23 LEU A 357 1.818 -5.135 -5.315 1.00 11.34 H new ATOM 241 N LYS A 358 -3.719 -4.176 -5.814 1.00 41.52 N ATOM 242 CA LYS A 358 -5.032 -3.874 -6.398 1.00 15.33 C ATOM 243 C LYS A 358 -5.419 -2.410 -6.344 1.00 72.25 C ATOM 244 O LYS A 358 -6.277 -1.981 -7.113 1.00 0.45 O ATOM 245 CB LYS A 358 -6.121 -4.693 -5.720 1.00 22.24 C ATOM 246 CG LYS A 358 -6.286 -6.104 -6.264 1.00 5.45 C ATOM 247 CD LYS A 358 -7.333 -6.207 -7.391 1.00 20.24 C ATOM 248 CE LYS A 358 -7.033 -5.331 -8.596 1.00 51.40 C ATOM 249 NZ LYS A 358 -8.057 -5.482 -9.652 1.00 45.11 N ATOM 0 H LYS A 358 -3.759 -4.895 -5.092 1.00 41.52 H new ATOM 0 HA LYS A 358 -4.940 -4.140 -7.451 1.00 15.33 H new ATOM 0 HB2 LYS A 358 -5.902 -4.752 -4.654 1.00 22.24 H new ATOM 0 HB3 LYS A 358 -7.070 -4.166 -5.821 1.00 22.24 H new ATOM 0 HG2 LYS A 358 -5.325 -6.456 -6.638 1.00 5.45 H new ATOM 0 HG3 LYS A 358 -6.574 -6.768 -5.449 1.00 5.45 H new ATOM 0 HD2 LYS A 358 -7.400 -7.245 -7.717 1.00 20.24 H new ATOM 0 HD3 LYS A 358 -8.310 -5.935 -6.991 1.00 20.24 H new ATOM 0 HE2 LYS A 358 -6.984 -4.288 -8.284 1.00 51.40 H new ATOM 0 HE3 LYS A 358 -6.054 -5.590 -8.999 1.00 51.40 H new ATOM 0 HZ1 LYS A 358 -7.818 -4.869 -10.457 1.00 45.11 H new ATOM 0 HZ2 LYS A 358 -8.087 -6.473 -9.968 1.00 45.11 H new ATOM 0 HZ3 LYS A 358 -8.987 -5.211 -9.275 1.00 45.11 H new ATOM 263 N SER A 359 -4.805 -1.635 -5.463 1.00 72.14 N ATOM 264 CA SER A 359 -5.148 -0.231 -5.365 1.00 34.35 C ATOM 265 C SER A 359 -4.615 0.581 -6.574 1.00 13.24 C ATOM 266 O SER A 359 -5.066 1.704 -6.822 1.00 51.53 O ATOM 267 CB SER A 359 -4.673 0.373 -4.025 1.00 31.34 C ATOM 268 OG SER A 359 -3.254 0.343 -3.885 1.00 63.13 O ATOM 0 H SER A 359 -4.080 -1.950 -4.818 1.00 72.14 H new ATOM 0 HA SER A 359 -6.236 -0.164 -5.390 1.00 34.35 H new ATOM 0 HB2 SER A 359 -5.020 1.404 -3.951 1.00 31.34 H new ATOM 0 HB3 SER A 359 -5.128 -0.177 -3.201 1.00 31.34 H new ATOM 0 HG SER A 359 -2.984 -0.502 -3.468 1.00 63.13 H new ATOM 274 N THR A 360 -3.679 0.003 -7.317 1.00 45.42 N ATOM 275 CA THR A 360 -3.059 0.673 -8.457 1.00 20.54 C ATOM 276 C THR A 360 -2.538 -0.420 -9.430 1.00 44.13 C ATOM 277 O THR A 360 -1.567 -0.232 -10.169 1.00 4.41 O ATOM 278 CB THR A 360 -1.875 1.553 -7.936 1.00 12.23 C ATOM 279 OG1 THR A 360 -1.300 2.352 -8.991 1.00 2.51 O ATOM 280 CG2 THR A 360 -0.806 0.677 -7.326 1.00 31.04 C ATOM 0 H THR A 360 -3.328 -0.940 -7.148 1.00 45.42 H new ATOM 0 HA THR A 360 -3.772 1.313 -8.977 1.00 20.54 H new ATOM 0 HB THR A 360 -2.275 2.228 -7.179 1.00 12.23 H new ATOM 0 HG1 THR A 360 -1.153 1.792 -9.782 1.00 2.51 H new ATOM 0 HG21 THR A 360 0.013 1.300 -6.967 1.00 31.04 H new ATOM 0 HG22 THR A 360 -1.228 0.115 -6.492 1.00 31.04 H new ATOM 0 HG23 THR A 360 -0.431 -0.017 -8.078 1.00 31.04 H new ATOM 288 N PHE A 361 -3.287 -1.507 -9.479 1.00 14.42 N ATOM 289 CA PHE A 361 -2.939 -2.759 -10.178 1.00 75.24 C ATOM 290 C PHE A 361 -2.736 -2.532 -11.672 1.00 51.33 C ATOM 291 O PHE A 361 -2.029 -3.300 -12.353 1.00 54.12 O ATOM 292 CB PHE A 361 -4.102 -3.715 -9.990 1.00 32.43 C ATOM 293 CG PHE A 361 -3.787 -5.172 -10.148 1.00 0.24 C ATOM 294 CD1 PHE A 361 -3.812 -5.796 -11.383 1.00 34.44 C ATOM 295 CD2 PHE A 361 -3.482 -5.923 -9.033 1.00 5.43 C ATOM 296 CE1 PHE A 361 -3.533 -7.144 -11.492 1.00 25.01 C ATOM 297 CE2 PHE A 361 -3.210 -7.256 -9.131 1.00 11.14 C ATOM 298 CZ PHE A 361 -3.232 -7.876 -10.362 1.00 31.43 C ATOM 0 H PHE A 361 -4.195 -1.557 -9.017 1.00 14.42 H new ATOM 0 HA PHE A 361 -2.008 -3.152 -9.769 1.00 75.24 H new ATOM 0 HB2 PHE A 361 -4.517 -3.559 -8.994 1.00 32.43 H new ATOM 0 HB3 PHE A 361 -4.882 -3.453 -10.705 1.00 32.43 H new ATOM 0 HD1 PHE A 361 -4.051 -5.225 -12.268 1.00 34.44 H new ATOM 0 HD2 PHE A 361 -3.458 -5.447 -8.064 1.00 5.43 H new ATOM 0 HE1 PHE A 361 -3.550 -7.624 -12.459 1.00 25.01 H new ATOM 0 HE2 PHE A 361 -2.977 -7.826 -8.244 1.00 11.14 H new ATOM 0 HZ PHE A 361 -3.014 -8.931 -10.442 1.00 31.43 H new ATOM 308 N ASP A 362 -3.334 -1.485 -12.170 1.00 41.11 N ATOM 309 CA ASP A 362 -3.301 -1.188 -13.600 1.00 44.40 C ATOM 310 C ASP A 362 -2.051 -0.430 -13.957 1.00 23.43 C ATOM 311 O ASP A 362 -1.720 -0.252 -15.137 1.00 13.11 O ATOM 312 CB ASP A 362 -4.550 -0.418 -14.050 1.00 30.20 C ATOM 313 CG ASP A 362 -5.828 -1.206 -13.866 1.00 32.33 C ATOM 314 OD1 ASP A 362 -6.122 -2.081 -14.693 1.00 22.51 O ATOM 315 OD2 ASP A 362 -6.556 -0.970 -12.869 1.00 22.44 O ATOM 0 H ASP A 362 -3.858 -0.810 -11.612 1.00 41.11 H new ATOM 0 HA ASP A 362 -3.294 -2.139 -14.132 1.00 44.40 H new ATOM 0 HB2 ASP A 362 -4.619 0.513 -13.487 1.00 30.20 H new ATOM 0 HB3 ASP A 362 -4.444 -0.147 -15.101 1.00 30.20 H new ATOM 320 N GLY A 363 -1.358 0.010 -12.947 1.00 14.15 N ATOM 321 CA GLY A 363 -0.136 0.702 -13.131 1.00 33.21 C ATOM 322 C GLY A 363 0.991 -0.044 -12.481 1.00 52.14 C ATOM 323 O GLY A 363 1.435 -1.085 -12.987 1.00 70.02 O ATOM 0 H GLY A 363 -1.634 -0.107 -11.972 1.00 14.15 H new ATOM 0 HA2 GLY A 363 0.065 0.821 -14.196 1.00 33.21 H new ATOM 0 HA3 GLY A 363 -0.210 1.703 -12.707 1.00 33.21 H new ATOM 327 N ARG A 364 1.442 0.458 -11.361 1.00 45.21 N ATOM 328 CA ARG A 364 2.546 -0.121 -10.634 1.00 3.41 C ATOM 329 C ARG A 364 2.526 0.344 -9.196 1.00 74.41 C ATOM 330 O ARG A 364 2.002 1.430 -8.904 1.00 5.44 O ATOM 331 CB ARG A 364 3.882 0.216 -11.359 1.00 75.33 C ATOM 332 CG ARG A 364 4.111 1.715 -11.658 1.00 72.53 C ATOM 333 CD ARG A 364 4.504 2.514 -10.431 1.00 74.23 C ATOM 334 NE ARG A 364 4.454 3.958 -10.672 1.00 12.53 N ATOM 335 CZ ARG A 364 5.484 4.724 -11.025 1.00 41.42 C ATOM 336 NH1 ARG A 364 6.678 4.179 -11.265 1.00 44.44 N ATOM 337 NH2 ARG A 364 5.315 6.037 -11.134 1.00 73.30 N ATOM 0 H ARG A 364 1.049 1.290 -10.921 1.00 45.21 H new ATOM 0 HA ARG A 364 2.452 -1.207 -10.613 1.00 3.41 H new ATOM 0 HB2 ARG A 364 4.709 -0.146 -10.748 1.00 75.33 H new ATOM 0 HB3 ARG A 364 3.915 -0.334 -12.299 1.00 75.33 H new ATOM 0 HG2 ARG A 364 4.891 1.813 -12.413 1.00 72.53 H new ATOM 0 HG3 ARG A 364 3.201 2.138 -12.083 1.00 72.53 H new ATOM 0 HD2 ARG A 364 3.837 2.262 -9.606 1.00 74.23 H new ATOM 0 HD3 ARG A 364 5.511 2.233 -10.124 1.00 74.23 H new ATOM 0 HE ARG A 364 3.550 4.417 -10.559 1.00 12.53 H new ATOM 0 HH11 ARG A 364 6.805 3.171 -11.178 1.00 44.44 H new ATOM 0 HH12 ARG A 364 7.464 4.771 -11.535 1.00 44.44 H new ATOM 0 HH21 ARG A 364 4.402 6.451 -10.948 1.00 73.30 H new ATOM 0 HH22 ARG A 364 6.099 6.631 -11.404 1.00 73.30 H new ATOM 351 N MET A 365 3.070 -0.442 -8.303 1.00 22.30 N ATOM 352 CA MET A 365 3.125 -0.055 -6.916 1.00 52.54 C ATOM 353 C MET A 365 4.519 -0.314 -6.440 1.00 32.54 C ATOM 354 O MET A 365 5.170 -1.196 -6.942 1.00 12.13 O ATOM 355 CB MET A 365 2.149 -0.907 -6.095 1.00 42.11 C ATOM 356 CG MET A 365 1.767 -0.311 -4.770 1.00 52.44 C ATOM 357 SD MET A 365 0.460 -1.221 -3.963 1.00 72.40 S ATOM 358 CE MET A 365 0.093 -0.124 -2.614 1.00 60.11 C ATOM 0 H MET A 365 3.481 -1.352 -8.510 1.00 22.30 H new ATOM 0 HA MET A 365 2.854 0.995 -6.801 1.00 52.54 H new ATOM 0 HB2 MET A 365 1.244 -1.068 -6.681 1.00 42.11 H new ATOM 0 HB3 MET A 365 2.596 -1.886 -5.924 1.00 42.11 H new ATOM 0 HG2 MET A 365 2.642 -0.286 -4.121 1.00 52.44 H new ATOM 0 HG3 MET A 365 1.449 0.721 -4.917 1.00 52.44 H new ATOM 0 HE1 MET A 365 0.102 -0.683 -1.678 1.00 60.11 H new ATOM 0 HE2 MET A 365 0.844 0.665 -2.572 1.00 60.11 H new ATOM 0 HE3 MET A 365 -0.892 0.319 -2.763 1.00 60.11 H new ATOM 368 N ARG A 366 4.997 0.457 -5.535 1.00 43.15 N ATOM 369 CA ARG A 366 6.288 0.173 -4.958 1.00 53.05 C ATOM 370 C ARG A 366 6.104 -0.731 -3.789 1.00 34.32 C ATOM 371 O ARG A 366 5.036 -0.740 -3.166 1.00 33.13 O ATOM 372 CB ARG A 366 7.062 1.415 -4.462 1.00 12.02 C ATOM 373 CG ARG A 366 7.724 2.327 -5.493 1.00 72.22 C ATOM 374 CD ARG A 366 6.758 3.081 -6.366 1.00 65.03 C ATOM 375 NE ARG A 366 7.482 4.037 -7.208 1.00 13.14 N ATOM 376 CZ ARG A 366 6.936 5.076 -7.843 1.00 21.41 C ATOM 377 NH1 ARG A 366 5.620 5.269 -7.814 1.00 11.10 N ATOM 378 NH2 ARG A 366 7.718 5.912 -8.517 1.00 35.42 N ATOM 0 H ARG A 366 4.530 1.287 -5.170 1.00 43.15 H new ATOM 0 HA ARG A 366 6.876 -0.274 -5.760 1.00 53.05 H new ATOM 0 HB2 ARG A 366 6.371 2.023 -3.878 1.00 12.02 H new ATOM 0 HB3 ARG A 366 7.838 1.070 -3.779 1.00 12.02 H new ATOM 0 HG2 ARG A 366 8.359 3.043 -4.972 1.00 72.22 H new ATOM 0 HG3 ARG A 366 8.375 1.726 -6.127 1.00 72.22 H new ATOM 0 HD2 ARG A 366 6.200 2.384 -6.991 1.00 65.03 H new ATOM 0 HD3 ARG A 366 6.031 3.607 -5.747 1.00 65.03 H new ATOM 0 HE ARG A 366 8.486 3.897 -7.318 1.00 13.14 H new ATOM 0 HH11 ARG A 366 5.021 4.620 -7.304 1.00 11.10 H new ATOM 0 HH12 ARG A 366 5.211 6.066 -8.302 1.00 11.10 H new ATOM 0 HH21 ARG A 366 8.726 5.757 -8.546 1.00 35.42 H new ATOM 0 HH22 ARG A 366 7.311 6.709 -9.006 1.00 35.42 H new ATOM 392 N LEU A 367 7.125 -1.478 -3.487 1.00 31.15 N ATOM 393 CA LEU A 367 7.159 -2.299 -2.315 1.00 41.44 C ATOM 394 C LEU A 367 6.927 -1.446 -1.048 1.00 42.34 C ATOM 395 O LEU A 367 6.230 -1.869 -0.120 1.00 70.21 O ATOM 396 CB LEU A 367 8.480 -3.066 -2.303 1.00 5.35 C ATOM 397 CG LEU A 367 8.861 -3.831 -1.055 1.00 31.11 C ATOM 398 CD1 LEU A 367 7.732 -4.711 -0.598 1.00 61.33 C ATOM 399 CD2 LEU A 367 10.055 -4.677 -1.380 1.00 14.11 C ATOM 0 H LEU A 367 7.969 -1.534 -4.057 1.00 31.15 H new ATOM 0 HA LEU A 367 6.350 -3.029 -2.326 1.00 41.44 H new ATOM 0 HB2 LEU A 367 8.460 -3.774 -3.132 1.00 5.35 H new ATOM 0 HB3 LEU A 367 9.278 -2.354 -2.512 1.00 5.35 H new ATOM 0 HG LEU A 367 9.086 -3.129 -0.252 1.00 31.11 H new ATOM 0 HD11 LEU A 367 8.032 -5.250 0.301 1.00 61.33 H new ATOM 0 HD12 LEU A 367 6.858 -4.097 -0.379 1.00 61.33 H new ATOM 0 HD13 LEU A 367 7.486 -5.425 -1.384 1.00 61.33 H new ATOM 0 HD21 LEU A 367 10.353 -5.241 -0.496 1.00 14.11 H new ATOM 0 HD22 LEU A 367 9.803 -5.368 -2.184 1.00 14.11 H new ATOM 0 HD23 LEU A 367 10.879 -4.037 -1.696 1.00 14.11 H new ATOM 411 N ASN A 368 7.467 -0.233 -1.048 1.00 52.13 N ATOM 412 CA ASN A 368 7.234 0.711 0.057 1.00 23.32 C ATOM 413 C ASN A 368 5.758 1.082 0.164 1.00 51.11 C ATOM 414 O ASN A 368 5.224 1.220 1.261 1.00 23.13 O ATOM 415 CB ASN A 368 8.075 1.993 -0.083 1.00 71.10 C ATOM 416 CG ASN A 368 9.573 1.793 0.107 1.00 13.40 C ATOM 417 OD1 ASN A 368 10.131 0.731 -0.181 1.00 64.43 O ATOM 418 ND2 ASN A 368 10.231 2.808 0.602 1.00 73.24 N ATOM 0 H ASN A 368 8.066 0.126 -1.792 1.00 52.13 H new ATOM 0 HA ASN A 368 7.544 0.198 0.967 1.00 23.32 H new ATOM 0 HB2 ASN A 368 7.901 2.420 -1.071 1.00 71.10 H new ATOM 0 HB3 ASN A 368 7.724 2.723 0.646 1.00 71.10 H new ATOM 0 HD21 ASN A 368 11.236 2.736 0.761 1.00 73.24 H new ATOM 0 HD22 ASN A 368 9.740 3.672 0.829 1.00 73.24 H new ATOM 425 N GLU A 369 5.095 1.207 -0.978 1.00 24.21 N ATOM 426 CA GLU A 369 3.687 1.579 -1.010 1.00 44.42 C ATOM 427 C GLU A 369 2.824 0.422 -0.551 1.00 32.25 C ATOM 428 O GLU A 369 1.819 0.627 0.122 1.00 73.04 O ATOM 429 CB GLU A 369 3.274 2.032 -2.391 1.00 41.33 C ATOM 430 CG GLU A 369 4.049 3.226 -2.895 1.00 34.31 C ATOM 431 CD GLU A 369 3.636 3.615 -4.277 1.00 32.24 C ATOM 432 OE1 GLU A 369 3.854 2.828 -5.197 1.00 65.12 O ATOM 433 OE2 GLU A 369 3.101 4.725 -4.462 1.00 30.42 O ATOM 0 H GLU A 369 5.511 1.056 -1.897 1.00 24.21 H new ATOM 0 HA GLU A 369 3.544 2.415 -0.326 1.00 44.42 H new ATOM 0 HB2 GLU A 369 3.404 1.205 -3.089 1.00 41.33 H new ATOM 0 HB3 GLU A 369 2.212 2.277 -2.381 1.00 41.33 H new ATOM 0 HG2 GLU A 369 3.897 4.068 -2.220 1.00 34.31 H new ATOM 0 HG3 GLU A 369 5.115 2.998 -2.885 1.00 34.31 H new ATOM 440 N ILE A 370 3.217 -0.793 -0.936 1.00 50.33 N ATOM 441 CA ILE A 370 2.572 -2.013 -0.445 1.00 65.41 C ATOM 442 C ILE A 370 2.554 -2.008 1.083 1.00 13.51 C ATOM 443 O ILE A 370 1.516 -2.243 1.699 1.00 21.32 O ATOM 444 CB ILE A 370 3.310 -3.269 -0.992 1.00 64.32 C ATOM 445 CG1 ILE A 370 3.080 -3.377 -2.507 1.00 62.41 C ATOM 446 CG2 ILE A 370 2.902 -4.573 -0.263 1.00 44.12 C ATOM 447 CD1 ILE A 370 3.856 -4.476 -3.156 1.00 63.43 C ATOM 0 H ILE A 370 3.982 -0.959 -1.589 1.00 50.33 H new ATOM 0 HA ILE A 370 1.543 -2.046 -0.802 1.00 65.41 H new ATOM 0 HB ILE A 370 4.375 -3.143 -0.795 1.00 64.32 H new ATOM 0 HG12 ILE A 370 2.018 -3.535 -2.694 1.00 62.41 H new ATOM 0 HG13 ILE A 370 3.348 -2.430 -2.975 1.00 62.41 H new ATOM 0 HG21 ILE A 370 3.450 -5.414 -0.688 1.00 44.12 H new ATOM 0 HG22 ILE A 370 3.137 -4.486 0.798 1.00 44.12 H new ATOM 0 HG23 ILE A 370 1.831 -4.738 -0.385 1.00 44.12 H new ATOM 0 HD11 ILE A 370 3.642 -4.490 -4.225 1.00 63.43 H new ATOM 0 HD12 ILE A 370 4.922 -4.309 -3.001 1.00 63.43 H new ATOM 0 HD13 ILE A 370 3.571 -5.432 -2.716 1.00 63.43 H new ATOM 459 N TYR A 371 3.697 -1.691 1.682 1.00 24.34 N ATOM 460 CA TYR A 371 3.787 -1.563 3.144 1.00 34.41 C ATOM 461 C TYR A 371 2.823 -0.510 3.673 1.00 35.11 C ATOM 462 O TYR A 371 2.145 -0.722 4.688 1.00 65.33 O ATOM 463 CB TYR A 371 5.199 -1.214 3.605 1.00 13.35 C ATOM 464 CG TYR A 371 6.249 -2.256 3.332 1.00 72.53 C ATOM 465 CD1 TYR A 371 6.019 -3.593 3.607 1.00 60.31 C ATOM 466 CD2 TYR A 371 7.482 -1.899 2.814 1.00 44.35 C ATOM 467 CE1 TYR A 371 6.983 -4.541 3.369 1.00 31.13 C ATOM 468 CE2 TYR A 371 8.455 -2.841 2.579 1.00 34.22 C ATOM 469 CZ TYR A 371 8.201 -4.161 2.860 1.00 53.42 C ATOM 470 OH TYR A 371 9.173 -5.108 2.636 1.00 0.34 O ATOM 0 H TYR A 371 4.572 -1.518 1.187 1.00 24.34 H new ATOM 0 HA TYR A 371 3.516 -2.539 3.548 1.00 34.41 H new ATOM 0 HB2 TYR A 371 5.500 -0.285 3.121 1.00 13.35 H new ATOM 0 HB3 TYR A 371 5.174 -1.021 4.678 1.00 13.35 H new ATOM 0 HD1 TYR A 371 5.066 -3.895 4.015 1.00 60.31 H new ATOM 0 HD2 TYR A 371 7.683 -0.862 2.590 1.00 44.35 H new ATOM 0 HE1 TYR A 371 6.785 -5.581 3.581 1.00 31.13 H new ATOM 0 HE2 TYR A 371 9.412 -2.545 2.176 1.00 34.22 H new ATOM 0 HH TYR A 371 9.974 -4.675 2.273 1.00 0.34 H new ATOM 480 N ASN A 372 2.763 0.609 2.981 1.00 71.30 N ATOM 481 CA ASN A 372 1.889 1.723 3.360 1.00 2.32 C ATOM 482 C ASN A 372 0.429 1.303 3.366 1.00 40.54 C ATOM 483 O ASN A 372 -0.332 1.709 4.253 1.00 5.44 O ATOM 484 CB ASN A 372 2.078 2.948 2.445 1.00 20.35 C ATOM 485 CG ASN A 372 3.467 3.559 2.517 1.00 23.44 C ATOM 486 OD1 ASN A 372 4.147 3.496 3.548 1.00 54.44 O ATOM 487 ND2 ASN A 372 3.894 4.175 1.436 1.00 34.23 N ATOM 0 H ASN A 372 3.314 0.781 2.140 1.00 71.30 H new ATOM 0 HA ASN A 372 2.177 2.011 4.371 1.00 2.32 H new ATOM 0 HB2 ASN A 372 1.873 2.656 1.415 1.00 20.35 H new ATOM 0 HB3 ASN A 372 1.343 3.707 2.713 1.00 20.35 H new ATOM 0 HD21 ASN A 372 4.812 4.620 1.431 1.00 34.23 H new ATOM 0 HD22 ASN A 372 3.307 4.208 0.602 1.00 34.23 H new ATOM 494 N TRP A 373 0.042 0.485 2.383 1.00 50.41 N ATOM 495 CA TRP A 373 -1.319 -0.025 2.283 1.00 21.03 C ATOM 496 C TRP A 373 -1.675 -0.784 3.541 1.00 11.34 C ATOM 497 O TRP A 373 -2.706 -0.524 4.145 1.00 41.41 O ATOM 498 CB TRP A 373 -1.470 -0.932 1.063 1.00 4.24 C ATOM 499 CG TRP A 373 -2.869 -1.485 0.830 1.00 51.22 C ATOM 500 CD1 TRP A 373 -3.832 -0.957 0.019 1.00 23.12 C ATOM 501 CD2 TRP A 373 -3.444 -2.687 1.400 1.00 0.11 C ATOM 502 NE1 TRP A 373 -4.958 -1.752 0.038 1.00 1.34 N ATOM 503 CE2 TRP A 373 -4.744 -2.821 0.877 1.00 74.42 C ATOM 504 CE3 TRP A 373 -2.975 -3.657 2.294 1.00 31.32 C ATOM 505 CZ2 TRP A 373 -5.584 -3.897 1.219 1.00 1.10 C ATOM 506 CZ3 TRP A 373 -3.805 -4.715 2.634 1.00 65.30 C ATOM 507 CH2 TRP A 373 -5.092 -4.828 2.094 1.00 62.44 C ATOM 0 H TRP A 373 0.663 0.162 1.641 1.00 50.41 H new ATOM 0 HA TRP A 373 -1.998 0.820 2.167 1.00 21.03 H new ATOM 0 HB2 TRP A 373 -1.166 -0.375 0.177 1.00 4.24 H new ATOM 0 HB3 TRP A 373 -0.779 -1.769 1.166 1.00 4.24 H new ATOM 0 HD1 TRP A 373 -3.727 -0.048 -0.555 1.00 23.12 H new ATOM 0 HE1 TRP A 373 -5.814 -1.576 -0.487 1.00 1.34 H new ATOM 0 HE3 TRP A 373 -1.982 -3.583 2.712 1.00 31.32 H new ATOM 0 HZ2 TRP A 373 -6.578 -3.985 0.807 1.00 1.10 H new ATOM 0 HZ3 TRP A 373 -3.453 -5.465 3.327 1.00 65.30 H new ATOM 0 HH2 TRP A 373 -5.710 -5.668 2.374 1.00 62.44 H new ATOM 518 N PHE A 374 -0.814 -1.705 3.942 1.00 43.25 N ATOM 519 CA PHE A 374 -1.041 -2.496 5.148 1.00 21.13 C ATOM 520 C PHE A 374 -1.139 -1.623 6.369 1.00 40.03 C ATOM 521 O PHE A 374 -2.050 -1.770 7.159 1.00 40.14 O ATOM 522 CB PHE A 374 0.047 -3.550 5.360 1.00 11.04 C ATOM 523 CG PHE A 374 0.048 -4.670 4.387 1.00 71.34 C ATOM 524 CD1 PHE A 374 -0.809 -5.737 4.557 1.00 53.34 C ATOM 525 CD2 PHE A 374 0.900 -4.667 3.319 1.00 62.13 C ATOM 526 CE1 PHE A 374 -0.813 -6.781 3.668 1.00 42.14 C ATOM 527 CE2 PHE A 374 0.904 -5.713 2.419 1.00 43.15 C ATOM 528 CZ PHE A 374 0.045 -6.773 2.598 1.00 70.22 C ATOM 0 H PHE A 374 0.052 -1.926 3.451 1.00 43.25 H new ATOM 0 HA PHE A 374 -1.991 -3.009 5.001 1.00 21.13 H new ATOM 0 HB2 PHE A 374 1.019 -3.057 5.322 1.00 11.04 H new ATOM 0 HB3 PHE A 374 -0.062 -3.963 6.363 1.00 11.04 H new ATOM 0 HD1 PHE A 374 -1.484 -5.750 5.400 1.00 53.34 H new ATOM 0 HD2 PHE A 374 1.577 -3.838 3.178 1.00 62.13 H new ATOM 0 HE1 PHE A 374 -1.491 -7.609 3.810 1.00 42.14 H new ATOM 0 HE2 PHE A 374 1.579 -5.700 1.576 1.00 43.15 H new ATOM 0 HZ PHE A 374 0.046 -7.596 1.898 1.00 70.22 H new ATOM 538 N ALA A 375 -0.221 -0.708 6.497 1.00 54.52 N ATOM 539 CA ALA A 375 -0.172 0.178 7.658 1.00 12.51 C ATOM 540 C ALA A 375 -1.446 1.012 7.781 1.00 33.31 C ATOM 541 O ALA A 375 -1.982 1.195 8.868 1.00 23.44 O ATOM 542 CB ALA A 375 1.054 1.071 7.589 1.00 32.45 C ATOM 0 H ALA A 375 0.517 -0.544 5.812 1.00 54.52 H new ATOM 0 HA ALA A 375 -0.101 -0.443 8.551 1.00 12.51 H new ATOM 0 HB1 ALA A 375 1.077 1.725 8.460 1.00 32.45 H new ATOM 0 HB2 ALA A 375 1.953 0.455 7.574 1.00 32.45 H new ATOM 0 HB3 ALA A 375 1.014 1.675 6.683 1.00 32.45 H new ATOM 548 N SER A 376 -1.914 1.510 6.680 1.00 30.12 N ATOM 549 CA SER A 376 -3.106 2.317 6.663 1.00 33.10 C ATOM 550 C SER A 376 -4.410 1.483 6.723 1.00 1.01 C ATOM 551 O SER A 376 -5.368 1.857 7.415 1.00 32.33 O ATOM 552 CB SER A 376 -3.092 3.208 5.439 1.00 23.23 C ATOM 553 OG SER A 376 -1.916 4.022 5.424 1.00 12.14 O ATOM 0 H SER A 376 -1.485 1.372 5.765 1.00 30.12 H new ATOM 0 HA SER A 376 -3.101 2.926 7.567 1.00 33.10 H new ATOM 0 HB2 SER A 376 -3.130 2.597 4.537 1.00 23.23 H new ATOM 0 HB3 SER A 376 -3.979 3.841 5.433 1.00 23.23 H new ATOM 0 HG SER A 376 -1.161 3.500 5.081 1.00 12.14 H new ATOM 559 N ASN A 377 -4.444 0.352 6.026 1.00 53.14 N ATOM 560 CA ASN A 377 -5.680 -0.424 5.938 1.00 71.42 C ATOM 561 C ASN A 377 -5.835 -1.394 7.077 1.00 54.12 C ATOM 562 O ASN A 377 -6.955 -1.772 7.433 1.00 4.04 O ATOM 563 CB ASN A 377 -5.846 -1.110 4.570 1.00 41.24 C ATOM 564 CG ASN A 377 -6.072 -0.113 3.451 1.00 33.23 C ATOM 565 OD1 ASN A 377 -7.204 0.241 3.139 1.00 54.05 O ATOM 566 ND2 ASN A 377 -5.012 0.349 2.854 1.00 2.43 N ATOM 0 H ASN A 377 -3.649 -0.043 5.523 1.00 53.14 H new ATOM 0 HA ASN A 377 -6.494 0.295 6.029 1.00 71.42 H new ATOM 0 HB2 ASN A 377 -4.957 -1.702 4.352 1.00 41.24 H new ATOM 0 HB3 ASN A 377 -6.687 -1.802 4.613 1.00 41.24 H new ATOM 0 HD21 ASN A 377 -5.107 1.029 2.099 1.00 2.43 H new ATOM 0 HD22 ASN A 377 -4.086 0.031 3.141 1.00 2.43 H new ATOM 573 N VAL A 378 -4.741 -1.781 7.659 1.00 71.22 N ATOM 574 CA VAL A 378 -4.761 -2.646 8.798 1.00 23.10 C ATOM 575 C VAL A 378 -4.283 -1.848 10.005 1.00 21.31 C ATOM 576 O VAL A 378 -3.107 -1.480 10.091 1.00 74.53 O ATOM 577 CB VAL A 378 -3.872 -3.895 8.590 1.00 62.24 C ATOM 578 CG1 VAL A 378 -3.955 -4.825 9.794 1.00 13.33 C ATOM 579 CG2 VAL A 378 -4.272 -4.626 7.305 1.00 21.20 C ATOM 0 H VAL A 378 -3.807 -1.505 7.356 1.00 71.22 H new ATOM 0 HA VAL A 378 -5.777 -3.008 8.954 1.00 23.10 H new ATOM 0 HB VAL A 378 -2.837 -3.569 8.490 1.00 62.24 H new ATOM 0 HG11 VAL A 378 -3.322 -5.696 9.625 1.00 13.33 H new ATOM 0 HG12 VAL A 378 -3.616 -4.297 10.685 1.00 13.33 H new ATOM 0 HG13 VAL A 378 -4.987 -5.148 9.934 1.00 13.33 H new ATOM 0 HG21 VAL A 378 -3.638 -5.502 7.172 1.00 21.20 H new ATOM 0 HG22 VAL A 378 -5.314 -4.939 7.374 1.00 21.20 H new ATOM 0 HG23 VAL A 378 -4.150 -3.957 6.453 1.00 21.20 H new ATOM 589 N PRO A 379 -5.183 -1.577 10.957 1.00 51.40 N ATOM 590 CA PRO A 379 -4.893 -0.710 12.111 1.00 4.32 C ATOM 591 C PRO A 379 -3.794 -1.271 13.013 1.00 4.21 C ATOM 592 O PRO A 379 -3.132 -0.523 13.756 1.00 72.51 O ATOM 593 CB PRO A 379 -6.227 -0.619 12.852 1.00 35.41 C ATOM 594 CG PRO A 379 -7.031 -1.785 12.382 1.00 1.42 C ATOM 595 CD PRO A 379 -6.556 -2.116 10.995 1.00 51.54 C ATOM 0 HA PRO A 379 -4.513 0.262 11.796 1.00 4.32 H new ATOM 0 HB2 PRO A 379 -6.079 -0.655 13.931 1.00 35.41 H new ATOM 0 HB3 PRO A 379 -6.734 0.320 12.632 1.00 35.41 H new ATOM 0 HG2 PRO A 379 -6.900 -2.638 13.048 1.00 1.42 H new ATOM 0 HG3 PRO A 379 -8.094 -1.544 12.378 1.00 1.42 H new ATOM 0 HD2 PRO A 379 -6.569 -3.191 10.813 1.00 51.54 H new ATOM 0 HD3 PRO A 379 -7.188 -1.656 10.235 1.00 51.54 H new ATOM 603 N TYR A 380 -3.595 -2.576 12.937 1.00 2.43 N ATOM 604 CA TYR A 380 -2.557 -3.244 13.679 1.00 52.04 C ATOM 605 C TYR A 380 -1.186 -2.747 13.213 1.00 21.30 C ATOM 606 O TYR A 380 -0.284 -2.491 14.028 1.00 4.20 O ATOM 607 CB TYR A 380 -2.699 -4.747 13.465 1.00 71.31 C ATOM 608 CG TYR A 380 -1.703 -5.597 14.195 1.00 54.14 C ATOM 609 CD1 TYR A 380 -1.650 -5.613 15.578 1.00 2.12 C ATOM 610 CD2 TYR A 380 -0.841 -6.414 13.500 1.00 42.34 C ATOM 611 CE1 TYR A 380 -0.757 -6.418 16.244 1.00 42.25 C ATOM 612 CE2 TYR A 380 0.060 -7.222 14.148 1.00 13.54 C ATOM 613 CZ TYR A 380 0.103 -7.224 15.521 1.00 52.41 C ATOM 614 OH TYR A 380 0.988 -8.047 16.179 1.00 10.44 O ATOM 0 H TYR A 380 -4.155 -3.198 12.354 1.00 2.43 H new ATOM 0 HA TYR A 380 -2.648 -3.025 14.743 1.00 52.04 H new ATOM 0 HB2 TYR A 380 -3.701 -5.047 13.771 1.00 71.31 H new ATOM 0 HB3 TYR A 380 -2.616 -4.955 12.398 1.00 71.31 H new ATOM 0 HD1 TYR A 380 -2.321 -4.983 16.143 1.00 2.12 H new ATOM 0 HD2 TYR A 380 -0.874 -6.420 12.421 1.00 42.34 H new ATOM 0 HE1 TYR A 380 -0.727 -6.421 17.324 1.00 42.25 H new ATOM 0 HE2 TYR A 380 0.730 -7.852 13.582 1.00 13.54 H new ATOM 0 HH TYR A 380 1.519 -8.547 15.524 1.00 10.44 H new ATOM 624 N PHE A 381 -1.044 -2.589 11.909 1.00 44.23 N ATOM 625 CA PHE A 381 0.186 -2.110 11.327 1.00 53.24 C ATOM 626 C PHE A 381 0.339 -0.636 11.503 1.00 53.22 C ATOM 627 O PHE A 381 1.447 -0.141 11.602 1.00 5.00 O ATOM 628 CB PHE A 381 0.291 -2.477 9.884 1.00 43.05 C ATOM 629 CG PHE A 381 0.336 -3.924 9.642 1.00 40.43 C ATOM 630 CD1 PHE A 381 1.085 -4.760 10.450 1.00 72.25 C ATOM 631 CD2 PHE A 381 -0.358 -4.453 8.609 1.00 40.45 C ATOM 632 CE1 PHE A 381 1.127 -6.098 10.207 1.00 30.14 C ATOM 633 CE2 PHE A 381 -0.321 -5.781 8.355 1.00 1.11 C ATOM 634 CZ PHE A 381 0.428 -6.612 9.158 1.00 21.12 C ATOM 0 H PHE A 381 -1.778 -2.790 11.230 1.00 44.23 H new ATOM 0 HA PHE A 381 1.000 -2.601 11.860 1.00 53.24 H new ATOM 0 HB2 PHE A 381 -0.560 -2.055 9.349 1.00 43.05 H new ATOM 0 HB3 PHE A 381 1.189 -2.020 9.467 1.00 43.05 H new ATOM 0 HD1 PHE A 381 1.640 -4.348 11.280 1.00 72.25 H new ATOM 0 HD2 PHE A 381 -0.950 -3.806 7.978 1.00 40.45 H new ATOM 0 HE1 PHE A 381 1.711 -6.748 10.842 1.00 30.14 H new ATOM 0 HE2 PHE A 381 -0.878 -6.189 7.524 1.00 1.11 H new ATOM 0 HZ PHE A 381 0.461 -7.672 8.955 1.00 21.12 H new ATOM 644 N GLY A 382 -0.783 0.065 11.550 1.00 11.22 N ATOM 645 CA GLY A 382 -0.769 1.501 11.781 1.00 62.42 C ATOM 646 C GLY A 382 -0.158 1.839 13.127 1.00 43.00 C ATOM 647 O GLY A 382 0.360 2.926 13.338 1.00 61.41 O ATOM 0 H GLY A 382 -1.713 -0.336 11.432 1.00 11.22 H new ATOM 0 HA2 GLY A 382 -0.204 1.993 10.989 1.00 62.42 H new ATOM 0 HA3 GLY A 382 -1.787 1.889 11.734 1.00 62.42 H new ATOM 651 N ASN A 383 -0.215 0.882 14.026 1.00 73.00 N ATOM 652 CA ASN A 383 0.350 0.977 15.328 1.00 21.22 C ATOM 653 C ASN A 383 1.826 0.511 15.322 1.00 33.14 C ATOM 654 O ASN A 383 2.597 0.815 16.223 1.00 70.41 O ATOM 655 CB ASN A 383 -0.543 0.141 16.264 1.00 4.24 C ATOM 656 CG ASN A 383 0.166 -0.449 17.438 1.00 61.22 C ATOM 657 OD1 ASN A 383 0.306 0.169 18.491 1.00 33.35 O ATOM 658 ND2 ASN A 383 0.576 -1.677 17.275 1.00 51.45 N ATOM 0 H ASN A 383 -0.676 -0.011 13.851 1.00 73.00 H new ATOM 0 HA ASN A 383 0.376 2.008 15.681 1.00 21.22 H new ATOM 0 HB2 ASN A 383 -1.356 0.770 16.626 1.00 4.24 H new ATOM 0 HB3 ASN A 383 -0.996 -0.665 15.687 1.00 4.24 H new ATOM 0 HD21 ASN A 383 1.036 -2.167 18.042 1.00 51.45 H new ATOM 0 HD22 ASN A 383 0.436 -2.147 16.381 1.00 51.45 H new ATOM 665 N ARG A 384 2.220 -0.160 14.261 1.00 75.43 N ATOM 666 CA ARG A 384 3.572 -0.691 14.124 1.00 35.24 C ATOM 667 C ARG A 384 4.370 0.028 13.059 1.00 42.13 C ATOM 668 O ARG A 384 5.300 -0.524 12.524 1.00 33.24 O ATOM 669 CB ARG A 384 3.562 -2.191 13.820 1.00 71.22 C ATOM 670 CG ARG A 384 3.185 -3.072 14.986 1.00 5.22 C ATOM 671 CD ARG A 384 3.397 -4.533 14.642 1.00 62.13 C ATOM 672 NE ARG A 384 3.228 -5.401 15.808 1.00 2.43 N ATOM 673 CZ ARG A 384 4.074 -6.391 16.146 1.00 73.34 C ATOM 674 NH1 ARG A 384 5.160 -6.622 15.415 1.00 14.30 N ATOM 675 NH2 ARG A 384 3.839 -7.132 17.225 1.00 21.12 N ATOM 0 H ARG A 384 1.615 -0.357 13.464 1.00 75.43 H new ATOM 0 HA ARG A 384 4.055 -0.523 15.087 1.00 35.24 H new ATOM 0 HB2 ARG A 384 2.865 -2.377 13.003 1.00 71.22 H new ATOM 0 HB3 ARG A 384 4.552 -2.482 13.468 1.00 71.22 H new ATOM 0 HG2 ARG A 384 3.784 -2.807 15.857 1.00 5.22 H new ATOM 0 HG3 ARG A 384 2.142 -2.904 15.254 1.00 5.22 H new ATOM 0 HD2 ARG A 384 2.692 -4.828 13.865 1.00 62.13 H new ATOM 0 HD3 ARG A 384 4.398 -4.667 14.232 1.00 62.13 H new ATOM 0 HE ARG A 384 2.415 -5.245 16.404 1.00 2.43 H new ATOM 0 HH11 ARG A 384 5.354 -6.048 14.595 1.00 14.30 H new ATOM 0 HH12 ARG A 384 5.799 -7.373 15.674 1.00 14.30 H new ATOM 0 HH21 ARG A 384 3.016 -6.950 17.799 1.00 21.12 H new ATOM 0 HH22 ARG A 384 4.482 -7.882 17.479 1.00 21.12 H new ATOM 689 N THR A 385 4.065 1.273 12.818 1.00 12.52 N ATOM 690 CA THR A 385 4.739 2.046 11.778 1.00 30.13 C ATOM 691 C THR A 385 6.169 2.516 12.160 1.00 2.42 C ATOM 692 O THR A 385 6.768 3.341 11.455 1.00 24.43 O ATOM 693 CB THR A 385 3.880 3.244 11.380 1.00 23.11 C ATOM 694 OG1 THR A 385 3.468 3.952 12.564 1.00 62.41 O ATOM 695 CG2 THR A 385 2.666 2.780 10.609 1.00 10.33 C ATOM 0 H THR A 385 3.348 1.790 13.327 1.00 12.52 H new ATOM 0 HA THR A 385 4.864 1.369 10.933 1.00 30.13 H new ATOM 0 HB THR A 385 4.465 3.909 10.745 1.00 23.11 H new ATOM 0 HG1 THR A 385 2.568 3.662 12.822 1.00 62.41 H new ATOM 0 HG21 THR A 385 2.061 3.642 10.330 1.00 10.33 H new ATOM 0 HG22 THR A 385 2.985 2.255 9.709 1.00 10.33 H new ATOM 0 HG23 THR A 385 2.075 2.108 11.231 1.00 10.33 H new ATOM 703 N SER A 386 6.729 1.958 13.219 1.00 72.54 N ATOM 704 CA SER A 386 8.056 2.327 13.647 1.00 65.44 C ATOM 705 C SER A 386 9.016 1.305 13.042 1.00 63.43 C ATOM 706 O SER A 386 8.586 0.207 12.726 1.00 33.41 O ATOM 707 CB SER A 386 8.121 2.340 15.182 1.00 12.44 C ATOM 708 OG SER A 386 9.374 2.803 15.654 1.00 2.02 O ATOM 0 H SER A 386 6.280 1.247 13.796 1.00 72.54 H new ATOM 0 HA SER A 386 8.328 3.328 13.313 1.00 65.44 H new ATOM 0 HB2 SER A 386 7.328 2.977 15.574 1.00 12.44 H new ATOM 0 HB3 SER A 386 7.939 1.335 15.562 1.00 12.44 H new ATOM 0 HG SER A 386 9.376 2.799 16.634 1.00 2.02 H new ATOM 714 N GLN A 387 10.290 1.650 12.880 1.00 14.21 N ATOM 715 CA GLN A 387 11.251 0.779 12.168 1.00 1.14 C ATOM 716 C GLN A 387 11.316 -0.663 12.690 1.00 45.32 C ATOM 717 O GLN A 387 11.091 -1.601 11.927 1.00 21.34 O ATOM 718 CB GLN A 387 12.649 1.391 12.167 1.00 21.53 C ATOM 719 CG GLN A 387 13.698 0.487 11.542 1.00 71.03 C ATOM 720 CD GLN A 387 15.057 1.109 11.517 1.00 12.40 C ATOM 721 OE1 GLN A 387 15.833 0.970 12.457 1.00 4.21 O ATOM 722 NE2 GLN A 387 15.366 1.783 10.450 1.00 13.23 N ATOM 0 H GLN A 387 10.691 2.521 13.227 1.00 14.21 H new ATOM 0 HA GLN A 387 10.868 0.717 11.150 1.00 1.14 H new ATOM 0 HB2 GLN A 387 12.624 2.336 11.625 1.00 21.53 H new ATOM 0 HB3 GLN A 387 12.940 1.619 13.193 1.00 21.53 H new ATOM 0 HG2 GLN A 387 13.742 -0.449 12.098 1.00 71.03 H new ATOM 0 HG3 GLN A 387 13.398 0.239 10.524 1.00 71.03 H new ATOM 0 HE21 GLN A 387 14.691 1.874 9.691 1.00 13.23 H new ATOM 0 HE22 GLN A 387 16.284 2.221 10.371 1.00 13.23 H new ATOM 731 N GLU A 388 11.545 -0.845 13.972 1.00 1.12 N ATOM 732 CA GLU A 388 11.671 -2.192 14.503 1.00 12.33 C ATOM 733 C GLU A 388 10.321 -2.843 14.582 1.00 33.13 C ATOM 734 O GLU A 388 10.188 -4.042 14.338 1.00 44.15 O ATOM 735 CB GLU A 388 12.349 -2.216 15.870 1.00 55.01 C ATOM 736 CG GLU A 388 13.753 -1.651 15.884 1.00 73.33 C ATOM 737 CD GLU A 388 14.383 -1.770 17.241 1.00 72.52 C ATOM 738 OE1 GLU A 388 14.206 -0.866 18.073 1.00 34.25 O ATOM 739 OE2 GLU A 388 15.053 -2.793 17.506 1.00 34.33 O ATOM 0 H GLU A 388 11.647 -0.097 14.657 1.00 1.12 H new ATOM 0 HA GLU A 388 12.307 -2.753 13.818 1.00 12.33 H new ATOM 0 HB2 GLU A 388 11.737 -1.653 16.575 1.00 55.01 H new ATOM 0 HB3 GLU A 388 12.381 -3.245 16.227 1.00 55.01 H new ATOM 0 HG2 GLU A 388 14.365 -2.177 15.151 1.00 73.33 H new ATOM 0 HG3 GLU A 388 13.727 -0.603 15.585 1.00 73.33 H new ATOM 746 N GLN A 389 9.309 -2.028 14.866 1.00 73.14 N ATOM 747 CA GLN A 389 7.957 -2.497 14.994 1.00 34.14 C ATOM 748 C GLN A 389 7.368 -2.946 13.679 1.00 73.45 C ATOM 749 O GLN A 389 6.383 -3.672 13.653 1.00 62.33 O ATOM 750 CB GLN A 389 7.086 -1.448 15.588 1.00 72.55 C ATOM 751 CG GLN A 389 7.540 -0.994 16.959 1.00 63.41 C ATOM 752 CD GLN A 389 6.426 -0.342 17.688 1.00 1.34 C ATOM 753 OE1 GLN A 389 6.371 -0.337 18.914 1.00 1.20 O ATOM 754 NE2 GLN A 389 5.500 0.160 16.956 1.00 33.31 N ATOM 0 H GLN A 389 9.417 -1.024 15.012 1.00 73.14 H new ATOM 0 HA GLN A 389 7.998 -3.363 15.655 1.00 34.14 H new ATOM 0 HB2 GLN A 389 7.059 -0.588 14.919 1.00 72.55 H new ATOM 0 HB3 GLN A 389 6.067 -1.829 15.659 1.00 72.55 H new ATOM 0 HG2 GLN A 389 7.904 -1.849 17.529 1.00 63.41 H new ATOM 0 HG3 GLN A 389 8.374 -0.299 16.860 1.00 63.41 H new ATOM 0 HE21 GLN A 389 5.584 0.136 15.940 1.00 33.31 H new ATOM 0 HE22 GLN A 389 4.680 0.583 17.390 1.00 33.31 H new ATOM 763 N SER A 390 7.959 -2.518 12.591 1.00 32.04 N ATOM 764 CA SER A 390 7.432 -2.850 11.305 1.00 15.54 C ATOM 765 C SER A 390 8.296 -3.829 10.538 1.00 1.22 C ATOM 766 O SER A 390 7.779 -4.651 9.783 1.00 75.10 O ATOM 767 CB SER A 390 7.199 -1.597 10.496 1.00 74.33 C ATOM 768 OG SER A 390 8.407 -0.878 10.312 1.00 50.50 O ATOM 0 H SER A 390 8.801 -1.942 12.577 1.00 32.04 H new ATOM 0 HA SER A 390 6.481 -3.354 11.478 1.00 15.54 H new ATOM 0 HB2 SER A 390 6.777 -1.860 9.526 1.00 74.33 H new ATOM 0 HB3 SER A 390 6.469 -0.965 11.001 1.00 74.33 H new ATOM 0 HG SER A 390 8.493 -0.199 11.013 1.00 50.50 H new ATOM 774 N ALA A 391 9.609 -3.756 10.740 1.00 31.33 N ATOM 775 CA ALA A 391 10.564 -4.583 9.999 1.00 62.41 C ATOM 776 C ALA A 391 10.291 -6.077 10.129 1.00 44.22 C ATOM 777 O ALA A 391 10.690 -6.850 9.269 1.00 35.43 O ATOM 778 CB ALA A 391 11.985 -4.261 10.410 1.00 44.23 C ATOM 0 H ALA A 391 10.041 -3.127 11.417 1.00 31.33 H new ATOM 0 HA ALA A 391 10.433 -4.335 8.946 1.00 62.41 H new ATOM 0 HB1 ALA A 391 12.677 -4.887 9.847 1.00 44.23 H new ATOM 0 HB2 ALA A 391 12.195 -3.211 10.203 1.00 44.23 H new ATOM 0 HB3 ALA A 391 12.108 -4.452 11.476 1.00 44.23 H new ATOM 784 N GLY A 392 9.604 -6.471 11.180 1.00 21.04 N ATOM 785 CA GLY A 392 9.288 -7.858 11.370 1.00 11.11 C ATOM 786 C GLY A 392 8.178 -8.322 10.459 1.00 11.53 C ATOM 787 O GLY A 392 8.300 -9.368 9.813 1.00 2.10 O ATOM 0 H GLY A 392 9.258 -5.848 11.910 1.00 21.04 H new ATOM 0 HA2 GLY A 392 10.179 -8.459 11.189 1.00 11.11 H new ATOM 0 HA3 GLY A 392 8.997 -8.023 12.407 1.00 11.11 H new ATOM 791 N TRP A 393 7.090 -7.562 10.390 1.00 3.22 N ATOM 792 CA TRP A 393 6.009 -7.936 9.513 1.00 74.23 C ATOM 793 C TRP A 393 6.376 -7.655 8.063 1.00 41.21 C ATOM 794 O TRP A 393 5.971 -8.391 7.153 1.00 2.52 O ATOM 795 CB TRP A 393 4.640 -7.338 9.919 1.00 25.12 C ATOM 796 CG TRP A 393 4.544 -5.849 9.932 1.00 44.23 C ATOM 797 CD1 TRP A 393 4.792 -5.031 10.975 1.00 43.10 C ATOM 798 CD2 TRP A 393 4.130 -5.012 8.852 1.00 15.11 C ATOM 799 NE1 TRP A 393 4.570 -3.720 10.613 1.00 13.33 N ATOM 800 CE2 TRP A 393 4.166 -3.683 9.306 1.00 4.34 C ATOM 801 CE3 TRP A 393 3.740 -5.267 7.549 1.00 30.04 C ATOM 802 CZ2 TRP A 393 3.825 -2.600 8.488 1.00 71.35 C ATOM 803 CZ3 TRP A 393 3.400 -4.205 6.734 1.00 14.35 C ATOM 804 CH2 TRP A 393 3.444 -2.888 7.196 1.00 74.32 C ATOM 0 H TRP A 393 6.943 -6.704 10.921 1.00 3.22 H new ATOM 0 HA TRP A 393 5.871 -9.012 9.619 1.00 74.23 H new ATOM 0 HB2 TRP A 393 3.883 -7.723 9.236 1.00 25.12 H new ATOM 0 HB3 TRP A 393 4.388 -7.705 10.914 1.00 25.12 H new ATOM 0 HD1 TRP A 393 5.117 -5.356 11.952 1.00 43.10 H new ATOM 0 HE1 TRP A 393 4.688 -2.909 11.220 1.00 13.33 H new ATOM 0 HE3 TRP A 393 3.702 -6.280 7.176 1.00 30.04 H new ATOM 0 HZ2 TRP A 393 3.859 -1.584 8.853 1.00 71.35 H new ATOM 0 HZ3 TRP A 393 3.093 -4.398 5.717 1.00 14.35 H new ATOM 0 HH2 TRP A 393 3.175 -2.082 6.529 1.00 74.32 H new ATOM 815 N LYS A 394 7.169 -6.594 7.848 1.00 71.12 N ATOM 816 CA LYS A 394 7.694 -6.288 6.539 1.00 3.42 C ATOM 817 C LYS A 394 8.631 -7.374 6.065 1.00 3.54 C ATOM 818 O LYS A 394 8.719 -7.639 4.861 1.00 53.51 O ATOM 819 CB LYS A 394 8.399 -4.947 6.541 1.00 12.31 C ATOM 820 CG LYS A 394 7.462 -3.806 6.787 1.00 74.31 C ATOM 821 CD LYS A 394 8.166 -2.474 6.754 1.00 51.24 C ATOM 822 CE LYS A 394 7.163 -1.361 6.879 1.00 22.12 C ATOM 823 NZ LYS A 394 7.787 -0.022 6.789 1.00 2.53 N ATOM 0 H LYS A 394 7.453 -5.940 8.578 1.00 71.12 H new ATOM 0 HA LYS A 394 6.854 -6.235 5.847 1.00 3.42 H new ATOM 0 HB2 LYS A 394 9.173 -4.949 7.308 1.00 12.31 H new ATOM 0 HB3 LYS A 394 8.899 -4.802 5.583 1.00 12.31 H new ATOM 0 HG2 LYS A 394 6.673 -3.817 6.035 1.00 74.31 H new ATOM 0 HG3 LYS A 394 6.980 -3.936 7.756 1.00 74.31 H new ATOM 0 HD2 LYS A 394 8.890 -2.415 7.567 1.00 51.24 H new ATOM 0 HD3 LYS A 394 8.723 -2.370 5.823 1.00 51.24 H new ATOM 0 HE2 LYS A 394 6.413 -1.462 6.094 1.00 22.12 H new ATOM 0 HE3 LYS A 394 6.641 -1.452 7.832 1.00 22.12 H new ATOM 0 HZ1 LYS A 394 7.054 0.710 6.881 1.00 2.53 H new ATOM 0 HZ2 LYS A 394 8.484 0.088 7.553 1.00 2.53 H new ATOM 0 HZ3 LYS A 394 8.263 0.078 5.870 1.00 2.53 H new ATOM 837 N ASN A 395 9.314 -8.017 7.017 1.00 22.52 N ATOM 838 CA ASN A 395 10.239 -9.110 6.700 1.00 33.11 C ATOM 839 C ASN A 395 9.515 -10.221 5.966 1.00 4.44 C ATOM 840 O ASN A 395 9.942 -10.641 4.884 1.00 22.44 O ATOM 841 CB ASN A 395 10.887 -9.673 7.974 1.00 52.53 C ATOM 842 CG ASN A 395 11.820 -10.840 7.699 1.00 71.23 C ATOM 843 OD1 ASN A 395 11.397 -11.996 7.676 1.00 55.11 O ATOM 844 ND2 ASN A 395 13.080 -10.559 7.512 1.00 63.21 N ATOM 0 H ASN A 395 9.244 -7.800 8.011 1.00 22.52 H new ATOM 0 HA ASN A 395 11.023 -8.706 6.059 1.00 33.11 H new ATOM 0 HB2 ASN A 395 11.444 -8.880 8.473 1.00 52.53 H new ATOM 0 HB3 ASN A 395 10.105 -9.995 8.661 1.00 52.53 H new ATOM 0 HD21 ASN A 395 13.750 -11.309 7.340 1.00 63.21 H new ATOM 0 HD22 ASN A 395 13.396 -9.589 7.538 1.00 63.21 H new ATOM 851 N SER A 396 8.406 -10.673 6.539 1.00 4.52 N ATOM 852 CA SER A 396 7.621 -11.735 5.944 1.00 41.45 C ATOM 853 C SER A 396 7.146 -11.325 4.576 1.00 2.54 C ATOM 854 O SER A 396 7.382 -12.048 3.621 1.00 34.53 O ATOM 855 CB SER A 396 6.444 -12.078 6.834 1.00 64.20 C ATOM 856 OG SER A 396 6.880 -12.384 8.158 1.00 53.42 O ATOM 0 H SER A 396 8.033 -10.316 7.419 1.00 4.52 H new ATOM 0 HA SER A 396 8.247 -12.621 5.842 1.00 41.45 H new ATOM 0 HB2 SER A 396 5.747 -11.241 6.861 1.00 64.20 H new ATOM 0 HB3 SER A 396 5.904 -12.929 6.419 1.00 64.20 H new ATOM 0 HG SER A 396 6.104 -12.601 8.716 1.00 53.42 H new ATOM 862 N ILE A 397 6.576 -10.105 4.467 1.00 71.30 N ATOM 863 CA ILE A 397 6.044 -9.617 3.192 1.00 64.32 C ATOM 864 C ILE A 397 7.116 -9.668 2.133 1.00 73.25 C ATOM 865 O ILE A 397 6.912 -10.261 1.088 1.00 24.21 O ATOM 866 CB ILE A 397 5.519 -8.144 3.294 1.00 33.41 C ATOM 867 CG1 ILE A 397 4.262 -8.068 4.146 1.00 24.24 C ATOM 868 CG2 ILE A 397 5.244 -7.548 1.903 1.00 31.33 C ATOM 869 CD1 ILE A 397 3.791 -6.670 4.410 1.00 43.23 C ATOM 0 H ILE A 397 6.477 -9.451 5.243 1.00 71.30 H new ATOM 0 HA ILE A 397 5.208 -10.265 2.929 1.00 64.32 H new ATOM 0 HB ILE A 397 6.303 -7.557 3.772 1.00 33.41 H new ATOM 0 HG12 ILE A 397 3.465 -8.622 3.650 1.00 24.24 H new ATOM 0 HG13 ILE A 397 4.450 -8.564 5.098 1.00 24.24 H new ATOM 0 HG21 ILE A 397 4.881 -6.526 2.010 1.00 31.33 H new ATOM 0 HG22 ILE A 397 6.164 -7.547 1.319 1.00 31.33 H new ATOM 0 HG23 ILE A 397 4.491 -8.148 1.392 1.00 31.33 H new ATOM 0 HD11 ILE A 397 2.891 -6.699 5.024 1.00 43.23 H new ATOM 0 HD12 ILE A 397 4.570 -6.117 4.935 1.00 43.23 H new ATOM 0 HD13 ILE A 397 3.569 -6.176 3.464 1.00 43.23 H new ATOM 881 N ARG A 398 8.278 -9.099 2.443 1.00 44.51 N ATOM 882 CA ARG A 398 9.363 -9.000 1.524 1.00 41.35 C ATOM 883 C ARG A 398 9.755 -10.404 1.001 1.00 35.43 C ATOM 884 O ARG A 398 9.993 -10.588 -0.194 1.00 50.25 O ATOM 885 CB ARG A 398 10.524 -8.354 2.253 1.00 54.24 C ATOM 886 CG ARG A 398 11.439 -7.510 1.399 1.00 12.54 C ATOM 887 CD ARG A 398 12.072 -8.269 0.251 1.00 74.23 C ATOM 888 NE ARG A 398 12.987 -7.433 -0.522 1.00 31.30 N ATOM 889 CZ ARG A 398 13.330 -7.637 -1.798 1.00 63.25 C ATOM 890 NH1 ARG A 398 12.843 -8.688 -2.473 1.00 73.24 N ATOM 891 NH2 ARG A 398 14.174 -6.796 -2.394 1.00 72.14 N ATOM 0 H ARG A 398 8.476 -8.694 3.358 1.00 44.51 H new ATOM 0 HA ARG A 398 9.080 -8.398 0.661 1.00 41.35 H new ATOM 0 HB2 ARG A 398 10.126 -7.731 3.054 1.00 54.24 H new ATOM 0 HB3 ARG A 398 11.116 -9.138 2.724 1.00 54.24 H new ATOM 0 HG2 ARG A 398 10.874 -6.668 0.999 1.00 12.54 H new ATOM 0 HG3 ARG A 398 12.227 -7.095 2.027 1.00 12.54 H new ATOM 0 HD2 ARG A 398 12.612 -9.132 0.641 1.00 74.23 H new ATOM 0 HD3 ARG A 398 11.290 -8.652 -0.405 1.00 74.23 H new ATOM 0 HE ARG A 398 13.398 -6.628 -0.050 1.00 31.30 H new ATOM 0 HH11 ARG A 398 12.206 -9.339 -2.013 1.00 73.24 H new ATOM 0 HH12 ARG A 398 13.109 -8.837 -3.446 1.00 73.24 H new ATOM 0 HH21 ARG A 398 14.554 -6.003 -1.877 1.00 72.14 H new ATOM 0 HH22 ARG A 398 14.440 -6.945 -3.367 1.00 72.14 H new ATOM 905 N HIS A 399 9.791 -11.383 1.896 1.00 70.12 N ATOM 906 CA HIS A 399 10.139 -12.745 1.502 1.00 22.14 C ATOM 907 C HIS A 399 9.012 -13.424 0.743 1.00 34.23 C ATOM 908 O HIS A 399 9.267 -14.152 -0.198 1.00 33.34 O ATOM 909 CB HIS A 399 10.621 -13.605 2.681 1.00 35.44 C ATOM 910 CG HIS A 399 11.963 -13.199 3.219 1.00 54.41 C ATOM 911 ND1 HIS A 399 13.125 -13.856 2.909 1.00 13.24 N ATOM 912 CD2 HIS A 399 12.323 -12.198 4.052 1.00 12.00 C ATOM 913 CE1 HIS A 399 14.127 -13.284 3.520 1.00 20.34 C ATOM 914 NE2 HIS A 399 13.671 -12.273 4.219 1.00 42.01 N ATOM 0 H HIS A 399 9.586 -11.264 2.888 1.00 70.12 H new ATOM 0 HA HIS A 399 10.985 -12.652 0.821 1.00 22.14 H new ATOM 0 HB2 HIS A 399 9.886 -13.549 3.484 1.00 35.44 H new ATOM 0 HB3 HIS A 399 10.667 -14.647 2.364 1.00 35.44 H new ATOM 0 HD2 HIS A 399 11.662 -11.472 4.502 1.00 12.00 H new ATOM 0 HE1 HIS A 399 15.160 -13.593 3.460 1.00 20.34 H new ATOM 0 HE2 HIS A 399 14.234 -11.646 4.793 1.00 42.01 H new ATOM 923 N ASN A 400 7.774 -13.159 1.151 1.00 24.41 N ATOM 924 CA ASN A 400 6.560 -13.704 0.487 1.00 51.31 C ATOM 925 C ASN A 400 6.536 -13.282 -0.972 1.00 55.34 C ATOM 926 O ASN A 400 6.172 -14.068 -1.856 1.00 75.21 O ATOM 927 CB ASN A 400 5.288 -13.156 1.167 1.00 52.51 C ATOM 928 CG ASN A 400 5.107 -13.564 2.624 1.00 41.22 C ATOM 929 OD1 ASN A 400 4.647 -12.797 3.413 1.00 0.32 O ATOM 930 ND2 ASN A 400 5.408 -14.770 2.961 1.00 73.54 N ATOM 0 H ASN A 400 7.568 -12.561 1.951 1.00 24.41 H new ATOM 0 HA ASN A 400 6.586 -14.791 0.567 1.00 51.31 H new ATOM 0 HB2 ASN A 400 5.304 -12.068 1.110 1.00 52.51 H new ATOM 0 HB3 ASN A 400 4.419 -13.492 0.601 1.00 52.51 H new ATOM 0 HD21 ASN A 400 5.254 -15.085 3.919 1.00 73.54 H new ATOM 0 HD22 ASN A 400 5.800 -15.410 2.270 1.00 73.54 H new ATOM 937 N LEU A 401 6.936 -12.039 -1.208 1.00 3.34 N ATOM 938 CA LEU A 401 6.967 -11.447 -2.542 1.00 13.20 C ATOM 939 C LEU A 401 7.917 -12.222 -3.443 1.00 13.54 C ATOM 940 O LEU A 401 7.579 -12.596 -4.559 1.00 0.25 O ATOM 941 CB LEU A 401 7.530 -10.034 -2.446 1.00 73.54 C ATOM 942 CG LEU A 401 6.871 -9.061 -1.481 1.00 23.13 C ATOM 943 CD1 LEU A 401 7.667 -7.813 -1.445 1.00 33.32 C ATOM 944 CD2 LEU A 401 5.448 -8.732 -1.864 1.00 44.22 C ATOM 0 H LEU A 401 7.251 -11.406 -0.473 1.00 3.34 H new ATOM 0 HA LEU A 401 5.953 -11.460 -2.943 1.00 13.20 H new ATOM 0 HB2 LEU A 401 8.582 -10.113 -2.172 1.00 73.54 H new ATOM 0 HB3 LEU A 401 7.492 -9.592 -3.442 1.00 73.54 H new ATOM 0 HG LEU A 401 6.839 -9.538 -0.502 1.00 23.13 H new ATOM 0 HD11 LEU A 401 7.205 -7.106 -0.756 1.00 33.32 H new ATOM 0 HD12 LEU A 401 8.680 -8.037 -1.110 1.00 33.32 H new ATOM 0 HD13 LEU A 401 7.704 -7.376 -2.443 1.00 33.32 H new ATOM 0 HD21 LEU A 401 5.028 -8.034 -1.140 1.00 44.22 H new ATOM 0 HD22 LEU A 401 5.433 -8.279 -2.855 1.00 44.22 H new ATOM 0 HD23 LEU A 401 4.853 -9.645 -1.874 1.00 44.22 H new ATOM 956 N SER A 402 9.091 -12.493 -2.923 1.00 15.04 N ATOM 957 CA SER A 402 10.141 -13.136 -3.678 1.00 74.20 C ATOM 958 C SER A 402 9.987 -14.668 -3.649 1.00 73.41 C ATOM 959 O SER A 402 10.711 -15.393 -4.321 1.00 71.00 O ATOM 960 CB SER A 402 11.486 -12.706 -3.094 1.00 11.33 C ATOM 961 OG SER A 402 11.577 -11.276 -3.056 1.00 4.13 O ATOM 0 H SER A 402 9.346 -12.273 -1.960 1.00 15.04 H new ATOM 0 HA SER A 402 10.081 -12.833 -4.723 1.00 74.20 H new ATOM 0 HB2 SER A 402 11.600 -13.111 -2.089 1.00 11.33 H new ATOM 0 HB3 SER A 402 12.298 -13.113 -3.696 1.00 11.33 H new ATOM 0 HG SER A 402 12.424 -10.991 -3.459 1.00 4.13 H new ATOM 967 N LEU A 403 9.017 -15.130 -2.889 1.00 54.22 N ATOM 968 CA LEU A 403 8.745 -16.521 -2.723 1.00 71.30 C ATOM 969 C LEU A 403 7.820 -17.018 -3.833 1.00 50.24 C ATOM 970 O LEU A 403 7.706 -18.217 -4.078 1.00 10.53 O ATOM 971 CB LEU A 403 8.106 -16.718 -1.339 1.00 4.42 C ATOM 972 CG LEU A 403 7.609 -18.098 -0.999 1.00 3.45 C ATOM 973 CD1 LEU A 403 8.740 -19.125 -1.022 1.00 32.01 C ATOM 974 CD2 LEU A 403 6.884 -18.104 0.337 1.00 62.43 C ATOM 0 H LEU A 403 8.387 -14.525 -2.362 1.00 54.22 H new ATOM 0 HA LEU A 403 9.667 -17.100 -2.787 1.00 71.30 H new ATOM 0 HB2 LEU A 403 8.838 -16.428 -0.585 1.00 4.42 H new ATOM 0 HB3 LEU A 403 7.268 -16.027 -1.253 1.00 4.42 H new ATOM 0 HG LEU A 403 6.893 -18.388 -1.768 1.00 3.45 H new ATOM 0 HD11 LEU A 403 8.343 -20.109 -0.772 1.00 32.01 H new ATOM 0 HD12 LEU A 403 9.184 -19.155 -2.017 1.00 32.01 H new ATOM 0 HD13 LEU A 403 9.501 -18.845 -0.294 1.00 32.01 H new ATOM 0 HD21 LEU A 403 6.536 -19.113 0.557 1.00 62.43 H new ATOM 0 HD22 LEU A 403 7.565 -17.776 1.122 1.00 62.43 H new ATOM 0 HD23 LEU A 403 6.030 -17.428 0.291 1.00 62.43 H new ATOM 986 N HIS A 404 7.157 -16.101 -4.499 1.00 63.34 N ATOM 987 CA HIS A 404 6.226 -16.476 -5.540 1.00 24.13 C ATOM 988 C HIS A 404 6.619 -15.844 -6.860 1.00 15.24 C ATOM 989 O HIS A 404 6.858 -14.642 -6.933 1.00 1.32 O ATOM 990 CB HIS A 404 4.782 -16.107 -5.154 1.00 12.43 C ATOM 991 CG HIS A 404 4.303 -16.794 -3.901 1.00 13.24 C ATOM 992 ND1 HIS A 404 3.898 -16.119 -2.771 1.00 1.31 N ATOM 993 CD2 HIS A 404 4.152 -18.108 -3.615 1.00 34.43 C ATOM 994 CE1 HIS A 404 3.528 -16.985 -1.853 1.00 34.13 C ATOM 995 NE2 HIS A 404 3.672 -18.196 -2.335 1.00 13.22 N ATOM 0 H HIS A 404 7.243 -15.097 -4.341 1.00 63.34 H new ATOM 0 HA HIS A 404 6.267 -17.559 -5.658 1.00 24.13 H new ATOM 0 HB2 HIS A 404 4.715 -15.028 -5.016 1.00 12.43 H new ATOM 0 HB3 HIS A 404 4.116 -16.365 -5.978 1.00 12.43 H new ATOM 0 HD2 HIS A 404 4.370 -18.935 -4.274 1.00 34.43 H new ATOM 0 HE1 HIS A 404 3.166 -16.739 -0.866 1.00 34.13 H new ATOM 0 HE2 HIS A 404 3.461 -19.062 -1.838 1.00 13.22 H new ATOM 1004 N SER A 405 6.663 -16.646 -7.906 1.00 70.33 N ATOM 1005 CA SER A 405 7.076 -16.191 -9.228 1.00 13.23 C ATOM 1006 C SER A 405 5.900 -15.541 -9.968 1.00 20.34 C ATOM 1007 O SER A 405 5.938 -15.336 -11.183 1.00 50.41 O ATOM 1008 CB SER A 405 7.655 -17.368 -10.030 1.00 2.23 C ATOM 1009 OG SER A 405 8.199 -16.962 -11.278 1.00 40.33 O ATOM 0 H SER A 405 6.414 -17.634 -7.868 1.00 70.33 H new ATOM 0 HA SER A 405 7.854 -15.436 -9.116 1.00 13.23 H new ATOM 0 HB2 SER A 405 8.431 -17.858 -9.441 1.00 2.23 H new ATOM 0 HB3 SER A 405 6.872 -18.106 -10.202 1.00 2.23 H new ATOM 0 HG SER A 405 7.592 -16.323 -11.707 1.00 40.33 H new ATOM 1015 N ARG A 406 4.875 -15.168 -9.214 1.00 23.33 N ATOM 1016 CA ARG A 406 3.732 -14.472 -9.759 1.00 54.31 C ATOM 1017 C ARG A 406 4.040 -12.977 -9.781 1.00 22.44 C ATOM 1018 O ARG A 406 3.194 -12.140 -10.081 1.00 23.31 O ATOM 1019 CB ARG A 406 2.480 -14.754 -8.934 1.00 54.41 C ATOM 1020 CG ARG A 406 2.179 -16.230 -8.797 1.00 5.42 C ATOM 1021 CD ARG A 406 0.831 -16.473 -8.162 1.00 31.02 C ATOM 1022 NE ARG A 406 -0.279 -16.070 -9.040 1.00 61.40 N ATOM 1023 CZ ARG A 406 -1.502 -15.719 -8.633 1.00 1.03 C ATOM 1024 NH1 ARG A 406 -1.777 -15.597 -7.339 1.00 32.22 N ATOM 1025 NH2 ARG A 406 -2.443 -15.477 -9.530 1.00 10.34 N ATOM 0 H ARG A 406 4.818 -15.342 -8.211 1.00 23.33 H new ATOM 0 HA ARG A 406 3.539 -14.823 -10.773 1.00 54.31 H new ATOM 0 HB2 ARG A 406 2.601 -14.320 -7.941 1.00 54.41 H new ATOM 0 HB3 ARG A 406 1.628 -14.257 -9.397 1.00 54.41 H new ATOM 0 HG2 ARG A 406 2.207 -16.699 -9.781 1.00 5.42 H new ATOM 0 HG3 ARG A 406 2.954 -16.704 -8.196 1.00 5.42 H new ATOM 0 HD2 ARG A 406 0.732 -17.530 -7.917 1.00 31.02 H new ATOM 0 HD3 ARG A 406 0.769 -15.921 -7.224 1.00 31.02 H new ATOM 0 HE ARG A 406 -0.099 -16.058 -10.044 1.00 61.40 H new ATOM 0 HH11 ARG A 406 -1.051 -15.772 -6.645 1.00 32.22 H new ATOM 0 HH12 ARG A 406 -2.714 -15.328 -7.040 1.00 32.22 H new ATOM 0 HH21 ARG A 406 -2.233 -15.559 -10.525 1.00 10.34 H new ATOM 0 HH22 ARG A 406 -3.379 -15.209 -9.227 1.00 10.34 H new ATOM 1039 N PHE A 407 5.262 -12.678 -9.443 1.00 64.31 N ATOM 1040 CA PHE A 407 5.813 -11.359 -9.424 1.00 24.33 C ATOM 1041 C PHE A 407 6.839 -11.211 -10.534 1.00 32.30 C ATOM 1042 O PHE A 407 7.633 -12.115 -10.766 1.00 44.22 O ATOM 1043 CB PHE A 407 6.460 -11.109 -8.041 1.00 50.10 C ATOM 1044 CG PHE A 407 7.440 -9.963 -7.988 1.00 44.13 C ATOM 1045 CD1 PHE A 407 7.068 -8.680 -8.334 1.00 12.51 C ATOM 1046 CD2 PHE A 407 8.754 -10.191 -7.606 1.00 3.42 C ATOM 1047 CE1 PHE A 407 7.982 -7.649 -8.298 1.00 25.13 C ATOM 1048 CE2 PHE A 407 9.668 -9.165 -7.569 1.00 45.41 C ATOM 1049 CZ PHE A 407 9.280 -7.892 -7.915 1.00 71.22 C ATOM 0 H PHE A 407 5.935 -13.390 -9.158 1.00 64.31 H new ATOM 0 HA PHE A 407 5.027 -10.622 -9.590 1.00 24.33 H new ATOM 0 HB2 PHE A 407 5.668 -10.923 -7.316 1.00 50.10 H new ATOM 0 HB3 PHE A 407 6.972 -12.019 -7.727 1.00 50.10 H new ATOM 0 HD1 PHE A 407 6.050 -8.482 -8.636 1.00 12.51 H new ATOM 0 HD2 PHE A 407 9.063 -11.189 -7.334 1.00 3.42 H new ATOM 0 HE1 PHE A 407 7.678 -6.649 -8.571 1.00 25.13 H new ATOM 0 HE2 PHE A 407 10.687 -9.358 -7.269 1.00 45.41 H new ATOM 0 HZ PHE A 407 9.995 -7.083 -7.886 1.00 71.22 H new ATOM 1059 N MET A 408 6.797 -10.094 -11.215 1.00 24.53 N ATOM 1060 CA MET A 408 7.772 -9.771 -12.231 1.00 13.21 C ATOM 1061 C MET A 408 8.403 -8.441 -11.866 1.00 3.11 C ATOM 1062 O MET A 408 7.700 -7.466 -11.603 1.00 41.34 O ATOM 1063 CB MET A 408 7.152 -9.749 -13.645 1.00 51.25 C ATOM 1064 CG MET A 408 6.001 -8.775 -13.833 1.00 34.42 C ATOM 1065 SD MET A 408 5.360 -8.773 -15.521 1.00 52.43 S ATOM 1066 CE MET A 408 6.813 -8.241 -16.435 1.00 72.30 C ATOM 0 H MET A 408 6.083 -9.378 -11.081 1.00 24.53 H new ATOM 0 HA MET A 408 8.538 -10.546 -12.264 1.00 13.21 H new ATOM 0 HB2 MET A 408 7.934 -9.505 -14.363 1.00 51.25 H new ATOM 0 HB3 MET A 408 6.801 -10.752 -13.886 1.00 51.25 H new ATOM 0 HG2 MET A 408 5.197 -9.032 -13.143 1.00 34.42 H new ATOM 0 HG3 MET A 408 6.335 -7.770 -13.574 1.00 34.42 H new ATOM 0 HE1 MET A 408 6.513 -7.885 -17.420 1.00 72.30 H new ATOM 0 HE2 MET A 408 7.309 -7.435 -15.894 1.00 72.30 H new ATOM 0 HE3 MET A 408 7.500 -9.080 -16.546 1.00 72.30 H new ATOM 1076 N ARG A 409 9.705 -8.408 -11.803 1.00 13.21 N ATOM 1077 CA ARG A 409 10.391 -7.249 -11.336 1.00 14.55 C ATOM 1078 C ARG A 409 10.776 -6.304 -12.456 1.00 63.21 C ATOM 1079 O ARG A 409 11.407 -6.701 -13.441 1.00 60.45 O ATOM 1080 CB ARG A 409 11.649 -7.660 -10.585 1.00 11.12 C ATOM 1081 CG ARG A 409 12.323 -6.510 -9.881 1.00 35.23 C ATOM 1082 CD ARG A 409 13.616 -6.929 -9.204 1.00 20.55 C ATOM 1083 NE ARG A 409 14.636 -7.340 -10.179 1.00 52.42 N ATOM 1084 CZ ARG A 409 15.721 -8.070 -9.904 1.00 61.23 C ATOM 1085 NH1 ARG A 409 15.898 -8.595 -8.692 1.00 63.24 N ATOM 1086 NH2 ARG A 409 16.608 -8.303 -10.859 1.00 31.55 N ATOM 0 H ARG A 409 10.312 -9.182 -12.073 1.00 13.21 H new ATOM 0 HA ARG A 409 9.702 -6.721 -10.677 1.00 14.55 H new ATOM 0 HB2 ARG A 409 11.393 -8.426 -9.853 1.00 11.12 H new ATOM 0 HB3 ARG A 409 12.352 -8.111 -11.286 1.00 11.12 H new ATOM 0 HG2 ARG A 409 12.532 -5.718 -10.600 1.00 35.23 H new ATOM 0 HG3 ARG A 409 11.644 -6.094 -9.137 1.00 35.23 H new ATOM 0 HD2 ARG A 409 13.998 -6.101 -8.606 1.00 20.55 H new ATOM 0 HD3 ARG A 409 13.417 -7.752 -8.518 1.00 20.55 H new ATOM 0 HE ARG A 409 14.505 -7.043 -11.146 1.00 52.42 H new ATOM 0 HH11 ARG A 409 15.201 -8.441 -7.963 1.00 63.24 H new ATOM 0 HH12 ARG A 409 16.730 -9.151 -8.493 1.00 63.24 H new ATOM 0 HH21 ARG A 409 16.460 -7.926 -11.795 1.00 31.55 H new ATOM 0 HH22 ARG A 409 17.439 -8.859 -10.658 1.00 31.55 H new ATOM 1100 N ILE A 410 10.389 -5.069 -12.298 1.00 44.23 N ATOM 1101 CA ILE A 410 10.814 -4.016 -13.127 1.00 74.12 C ATOM 1102 C ILE A 410 11.300 -2.893 -12.227 1.00 72.51 C ATOM 1103 O ILE A 410 10.644 -2.534 -11.243 1.00 3.31 O ATOM 1104 CB ILE A 410 9.707 -3.519 -14.113 1.00 50.53 C ATOM 1105 CG1 ILE A 410 10.223 -2.319 -14.900 1.00 52.02 C ATOM 1106 CG2 ILE A 410 8.448 -3.151 -13.375 1.00 21.14 C ATOM 1107 CD1 ILE A 410 9.297 -1.829 -15.993 1.00 1.52 C ATOM 0 H ILE A 410 9.749 -4.776 -11.560 1.00 44.23 H new ATOM 0 HA ILE A 410 11.618 -4.375 -13.769 1.00 74.12 H new ATOM 0 HB ILE A 410 9.468 -4.330 -14.801 1.00 50.53 H new ATOM 0 HG12 ILE A 410 10.408 -1.499 -14.206 1.00 52.02 H new ATOM 0 HG13 ILE A 410 11.182 -2.581 -15.347 1.00 52.02 H new ATOM 0 HG21 ILE A 410 7.696 -2.809 -14.086 1.00 21.14 H new ATOM 0 HG22 ILE A 410 8.072 -4.023 -12.840 1.00 21.14 H new ATOM 0 HG23 ILE A 410 8.663 -2.354 -12.663 1.00 21.14 H new ATOM 0 HD11 ILE A 410 9.749 -0.974 -16.496 1.00 1.52 H new ATOM 0 HD12 ILE A 410 9.131 -2.629 -16.715 1.00 1.52 H new ATOM 0 HD13 ILE A 410 8.344 -1.531 -15.556 1.00 1.52 H new ATOM 1119 N GLN A 411 12.454 -2.410 -12.502 1.00 32.10 N ATOM 1120 CA GLN A 411 13.008 -1.343 -11.743 1.00 65.44 C ATOM 1121 C GLN A 411 13.202 -0.163 -12.646 1.00 11.15 C ATOM 1122 O GLN A 411 13.645 -0.327 -13.785 1.00 72.41 O ATOM 1123 CB GLN A 411 14.336 -1.777 -11.093 1.00 75.41 C ATOM 1124 CG GLN A 411 15.054 -0.679 -10.316 1.00 33.01 C ATOM 1125 CD GLN A 411 16.314 -1.170 -9.627 1.00 15.21 C ATOM 1126 OE1 GLN A 411 16.411 -2.331 -9.216 1.00 51.41 O ATOM 1127 NE2 GLN A 411 17.297 -0.307 -9.521 1.00 22.14 N ATOM 0 H GLN A 411 13.047 -2.742 -13.263 1.00 32.10 H new ATOM 0 HA GLN A 411 12.329 -1.067 -10.936 1.00 65.44 H new ATOM 0 HB2 GLN A 411 14.139 -2.611 -10.419 1.00 75.41 H new ATOM 0 HB3 GLN A 411 15.002 -2.147 -11.872 1.00 75.41 H new ATOM 0 HG2 GLN A 411 15.311 0.132 -10.997 1.00 33.01 H new ATOM 0 HG3 GLN A 411 14.375 -0.266 -9.570 1.00 33.01 H new ATOM 0 HE21 GLN A 411 17.181 0.644 -9.872 1.00 22.14 H new ATOM 0 HE22 GLN A 411 18.177 -0.587 -9.088 1.00 22.14 H new ATOM 1136 N ASN A 412 12.803 0.995 -12.170 1.00 72.35 N ATOM 1137 CA ASN A 412 12.999 2.257 -12.880 1.00 73.41 C ATOM 1138 C ASN A 412 14.450 2.393 -13.258 1.00 73.51 C ATOM 1139 O ASN A 412 15.318 2.451 -12.393 1.00 43.40 O ATOM 1140 CB ASN A 412 12.621 3.432 -11.993 1.00 14.40 C ATOM 1141 CG ASN A 412 12.797 4.772 -12.679 1.00 71.42 C ATOM 1142 OD1 ASN A 412 12.647 4.886 -13.884 1.00 34.33 O ATOM 1143 ND2 ASN A 412 13.123 5.787 -11.919 1.00 50.13 N ATOM 0 H ASN A 412 12.329 1.097 -11.273 1.00 72.35 H new ATOM 0 HA ASN A 412 12.368 2.257 -13.769 1.00 73.41 H new ATOM 0 HB2 ASN A 412 11.583 3.324 -11.679 1.00 14.40 H new ATOM 0 HB3 ASN A 412 13.231 3.409 -11.090 1.00 14.40 H new ATOM 0 HD21 ASN A 412 13.260 6.710 -12.332 1.00 50.13 H new ATOM 0 HD22 ASN A 412 13.240 5.655 -10.914 1.00 50.13 H new ATOM 1150 N GLU A 413 14.703 2.427 -14.518 1.00 31.41 N ATOM 1151 CA GLU A 413 16.036 2.484 -15.019 1.00 54.33 C ATOM 1152 C GLU A 413 16.525 3.923 -15.010 1.00 3.25 C ATOM 1153 O GLU A 413 16.110 4.744 -15.831 1.00 22.40 O ATOM 1154 CB GLU A 413 16.088 1.864 -16.411 1.00 24.12 C ATOM 1155 CG GLU A 413 17.467 1.765 -17.008 1.00 41.10 C ATOM 1156 CD GLU A 413 17.455 1.063 -18.328 1.00 41.45 C ATOM 1157 OE1 GLU A 413 17.539 -0.175 -18.346 1.00 73.11 O ATOM 1158 OE2 GLU A 413 17.357 1.733 -19.370 1.00 51.12 O ATOM 0 H GLU A 413 13.984 2.416 -15.241 1.00 31.41 H new ATOM 0 HA GLU A 413 16.704 1.908 -14.379 1.00 54.33 H new ATOM 0 HB2 GLU A 413 15.655 0.865 -16.365 1.00 24.12 H new ATOM 0 HB3 GLU A 413 15.460 2.453 -17.079 1.00 24.12 H new ATOM 0 HG2 GLU A 413 17.881 2.766 -17.133 1.00 41.10 H new ATOM 0 HG3 GLU A 413 18.123 1.232 -16.320 1.00 41.10 H new ATOM 1165 N GLY A 414 17.362 4.220 -14.056 1.00 60.34 N ATOM 1166 CA GLY A 414 17.877 5.539 -13.888 1.00 64.32 C ATOM 1167 C GLY A 414 18.531 5.668 -12.544 1.00 1.31 C ATOM 1168 O GLY A 414 18.767 4.646 -11.873 1.00 74.22 O ATOM 0 H GLY A 414 17.705 3.546 -13.372 1.00 60.34 H new ATOM 0 HA2 GLY A 414 18.598 5.759 -14.675 1.00 64.32 H new ATOM 0 HA3 GLY A 414 17.071 6.267 -13.981 1.00 64.32 H new ATOM 1172 N ALA A 415 18.799 6.883 -12.129 1.00 1.43 N ATOM 1173 CA ALA A 415 19.460 7.135 -10.858 1.00 40.21 C ATOM 1174 C ALA A 415 18.517 6.883 -9.684 1.00 35.10 C ATOM 1175 O ALA A 415 18.952 6.489 -8.592 1.00 25.20 O ATOM 1176 CB ALA A 415 20.003 8.558 -10.814 1.00 54.42 C ATOM 0 H ALA A 415 18.569 7.726 -12.656 1.00 1.43 H new ATOM 0 HA ALA A 415 20.295 6.440 -10.769 1.00 40.21 H new ATOM 0 HB1 ALA A 415 20.495 8.730 -9.857 1.00 54.42 H new ATOM 0 HB2 ALA A 415 20.722 8.698 -11.621 1.00 54.42 H new ATOM 0 HB3 ALA A 415 19.182 9.265 -10.933 1.00 54.42 H new ATOM 1182 N GLY A 416 17.241 7.106 -9.910 1.00 5.45 N ATOM 1183 CA GLY A 416 16.247 6.884 -8.892 1.00 33.10 C ATOM 1184 C GLY A 416 15.914 5.416 -8.773 1.00 20.21 C ATOM 1185 O GLY A 416 15.420 4.800 -9.733 1.00 3.15 O ATOM 0 H GLY A 416 16.869 7.443 -10.798 1.00 5.45 H new ATOM 0 HA2 GLY A 416 16.612 7.257 -7.935 1.00 33.10 H new ATOM 0 HA3 GLY A 416 15.345 7.447 -9.130 1.00 33.10 H new ATOM 1189 N LYS A 417 16.167 4.845 -7.616 1.00 74.54 N ATOM 1190 CA LYS A 417 15.941 3.440 -7.410 1.00 34.31 C ATOM 1191 C LYS A 417 14.505 3.189 -7.025 1.00 71.14 C ATOM 1192 O LYS A 417 14.166 3.011 -5.846 1.00 64.22 O ATOM 1193 CB LYS A 417 16.891 2.834 -6.381 1.00 30.21 C ATOM 1194 CG LYS A 417 18.375 3.011 -6.697 1.00 40.33 C ATOM 1195 CD LYS A 417 18.718 2.471 -8.072 1.00 23.41 C ATOM 1196 CE LYS A 417 20.199 2.581 -8.365 1.00 52.31 C ATOM 1197 NZ LYS A 417 21.009 1.763 -7.440 1.00 60.44 N ATOM 0 H LYS A 417 16.531 5.340 -6.802 1.00 74.54 H new ATOM 0 HA LYS A 417 16.149 2.942 -8.357 1.00 34.31 H new ATOM 0 HB2 LYS A 417 16.685 3.282 -5.409 1.00 30.21 H new ATOM 0 HB3 LYS A 417 16.677 1.769 -6.293 1.00 30.21 H new ATOM 0 HG2 LYS A 417 18.636 4.068 -6.644 1.00 40.33 H new ATOM 0 HG3 LYS A 417 18.972 2.497 -5.944 1.00 40.33 H new ATOM 0 HD2 LYS A 417 18.410 1.427 -8.140 1.00 23.41 H new ATOM 0 HD3 LYS A 417 18.156 3.019 -8.828 1.00 23.41 H new ATOM 0 HE2 LYS A 417 20.390 2.265 -9.390 1.00 52.31 H new ATOM 0 HE3 LYS A 417 20.507 3.624 -8.291 1.00 52.31 H new ATOM 0 HZ1 LYS A 417 21.972 1.660 -7.820 1.00 60.44 H new ATOM 0 HZ2 LYS A 417 21.051 2.228 -6.511 1.00 60.44 H new ATOM 0 HZ3 LYS A 417 20.575 0.823 -7.337 1.00 60.44 H new ATOM 1211 N SER A 418 13.680 3.257 -8.001 1.00 31.13 N ATOM 1212 CA SER A 418 12.286 3.027 -7.851 1.00 13.32 C ATOM 1213 C SER A 418 11.964 1.642 -8.372 1.00 73.40 C ATOM 1214 O SER A 418 11.967 1.398 -9.585 1.00 15.31 O ATOM 1215 CB SER A 418 11.490 4.117 -8.605 1.00 22.11 C ATOM 1216 OG SER A 418 10.080 3.916 -8.536 1.00 4.25 O ATOM 0 H SER A 418 13.960 3.480 -8.956 1.00 31.13 H new ATOM 0 HA SER A 418 12.002 3.080 -6.800 1.00 13.32 H new ATOM 0 HB2 SER A 418 11.734 5.094 -8.187 1.00 22.11 H new ATOM 0 HB3 SER A 418 11.800 4.130 -9.650 1.00 22.11 H new ATOM 0 HG SER A 418 9.677 4.128 -9.404 1.00 4.25 H new ATOM 1222 N SER A 419 11.755 0.733 -7.474 1.00 73.32 N ATOM 1223 CA SER A 419 11.405 -0.592 -7.837 1.00 61.45 C ATOM 1224 C SER A 419 9.899 -0.642 -7.972 1.00 71.14 C ATOM 1225 O SER A 419 9.180 0.011 -7.209 1.00 2.34 O ATOM 1226 CB SER A 419 11.899 -1.584 -6.762 1.00 42.23 C ATOM 1227 OG SER A 419 11.645 -2.939 -7.130 1.00 14.01 O ATOM 0 H SER A 419 11.824 0.894 -6.469 1.00 73.32 H new ATOM 0 HA SER A 419 11.873 -0.875 -8.780 1.00 61.45 H new ATOM 0 HB2 SER A 419 12.969 -1.445 -6.604 1.00 42.23 H new ATOM 0 HB3 SER A 419 11.406 -1.367 -5.814 1.00 42.23 H new ATOM 0 HG SER A 419 11.973 -3.536 -6.426 1.00 14.01 H new ATOM 1233 N TRP A 420 9.414 -1.384 -8.922 1.00 61.25 N ATOM 1234 CA TRP A 420 8.002 -1.481 -9.114 1.00 63.22 C ATOM 1235 C TRP A 420 7.648 -2.884 -8.786 1.00 71.41 C ATOM 1236 O TRP A 420 8.308 -3.823 -9.256 1.00 13.23 O ATOM 1237 CB TRP A 420 7.594 -1.271 -10.583 1.00 62.34 C ATOM 1238 CG TRP A 420 8.082 -0.019 -11.296 1.00 2.20 C ATOM 1239 CD1 TRP A 420 9.044 0.861 -10.899 1.00 53.43 C ATOM 1240 CD2 TRP A 420 7.632 0.445 -12.581 1.00 10.41 C ATOM 1241 NE1 TRP A 420 9.205 1.836 -11.844 1.00 64.10 N ATOM 1242 CE2 TRP A 420 8.355 1.605 -12.883 1.00 10.52 C ATOM 1243 CE3 TRP A 420 6.682 -0.014 -13.500 1.00 42.11 C ATOM 1244 CZ2 TRP A 420 8.161 2.320 -14.062 1.00 32.42 C ATOM 1245 CZ3 TRP A 420 6.492 0.693 -14.668 1.00 42.24 C ATOM 1246 CH2 TRP A 420 7.230 1.848 -14.941 1.00 42.41 C ATOM 0 H TRP A 420 9.976 -1.930 -9.575 1.00 61.25 H new ATOM 0 HA TRP A 420 7.508 -0.725 -8.503 1.00 63.22 H new ATOM 0 HB2 TRP A 420 7.942 -2.134 -11.151 1.00 62.34 H new ATOM 0 HB3 TRP A 420 6.505 -1.277 -10.629 1.00 62.34 H new ATOM 0 HD1 TRP A 420 9.598 0.798 -9.974 1.00 53.43 H new ATOM 0 HE1 TRP A 420 9.860 2.615 -11.781 1.00 64.10 H new ATOM 0 HE3 TRP A 420 6.108 -0.906 -13.298 1.00 42.11 H new ATOM 0 HZ2 TRP A 420 8.727 3.215 -14.273 1.00 32.42 H new ATOM 0 HZ3 TRP A 420 5.761 0.349 -15.384 1.00 42.24 H new ATOM 0 HH2 TRP A 420 7.060 2.378 -15.867 1.00 42.41 H new ATOM 1257 N TRP A 421 6.660 -3.056 -7.999 1.00 10.00 N ATOM 1258 CA TRP A 421 6.248 -4.341 -7.668 1.00 62.30 C ATOM 1259 C TRP A 421 4.944 -4.553 -8.407 1.00 54.43 C ATOM 1260 O TRP A 421 3.981 -3.809 -8.205 1.00 31.03 O ATOM 1261 CB TRP A 421 6.054 -4.460 -6.144 1.00 5.02 C ATOM 1262 CG TRP A 421 6.252 -5.819 -5.657 1.00 52.22 C ATOM 1263 CD1 TRP A 421 7.382 -6.266 -5.084 1.00 60.24 C ATOM 1264 CD2 TRP A 421 5.333 -6.919 -5.691 1.00 2.25 C ATOM 1265 NE1 TRP A 421 7.256 -7.575 -4.764 1.00 25.04 N ATOM 1266 CE2 TRP A 421 5.990 -8.006 -5.125 1.00 12.13 C ATOM 1267 CE3 TRP A 421 4.024 -7.086 -6.144 1.00 42.31 C ATOM 1268 CZ2 TRP A 421 5.381 -9.258 -4.997 1.00 70.33 C ATOM 1269 CZ3 TRP A 421 3.421 -8.320 -6.008 1.00 71.24 C ATOM 1270 CH2 TRP A 421 4.105 -9.392 -5.437 1.00 72.53 C ATOM 0 H TRP A 421 6.120 -2.304 -7.571 1.00 10.00 H new ATOM 0 HA TRP A 421 6.984 -5.095 -7.948 1.00 62.30 H new ATOM 0 HB2 TRP A 421 6.752 -3.792 -5.640 1.00 5.02 H new ATOM 0 HB3 TRP A 421 5.049 -4.127 -5.883 1.00 5.02 H new ATOM 0 HD1 TRP A 421 8.263 -5.668 -4.905 1.00 60.24 H new ATOM 0 HE1 TRP A 421 7.976 -8.151 -4.328 1.00 25.04 H new ATOM 0 HE3 TRP A 421 3.491 -6.262 -6.594 1.00 42.31 H new ATOM 0 HZ2 TRP A 421 5.910 -10.093 -4.561 1.00 70.33 H new ATOM 0 HZ3 TRP A 421 2.405 -8.457 -6.349 1.00 71.24 H new ATOM 0 HH2 TRP A 421 3.610 -10.347 -5.343 1.00 72.53 H new ATOM 1281 N VAL A 422 4.927 -5.521 -9.292 1.00 25.14 N ATOM 1282 CA VAL A 422 3.763 -5.792 -10.109 1.00 4.23 C ATOM 1283 C VAL A 422 3.556 -7.280 -10.263 1.00 20.32 C ATOM 1284 O VAL A 422 4.508 -8.074 -10.159 1.00 74.12 O ATOM 1285 CB VAL A 422 3.840 -5.124 -11.532 1.00 3.31 C ATOM 1286 CG1 VAL A 422 3.828 -3.606 -11.443 1.00 43.44 C ATOM 1287 CG2 VAL A 422 5.074 -5.590 -12.293 1.00 55.35 C ATOM 0 H VAL A 422 5.716 -6.143 -9.468 1.00 25.14 H new ATOM 0 HA VAL A 422 2.915 -5.350 -9.586 1.00 4.23 H new ATOM 0 HB VAL A 422 2.951 -5.440 -12.078 1.00 3.31 H new ATOM 0 HG11 VAL A 422 3.883 -3.182 -12.446 1.00 43.44 H new ATOM 0 HG12 VAL A 422 2.908 -3.277 -10.960 1.00 43.44 H new ATOM 0 HG13 VAL A 422 4.685 -3.269 -10.860 1.00 43.44 H new ATOM 0 HG21 VAL A 422 5.100 -5.112 -13.272 1.00 55.35 H new ATOM 0 HG22 VAL A 422 5.970 -5.320 -11.734 1.00 55.35 H new ATOM 0 HG23 VAL A 422 5.037 -6.672 -12.419 1.00 55.35 H new ATOM 1297 N ILE A 423 2.335 -7.660 -10.508 1.00 13.53 N ATOM 1298 CA ILE A 423 2.003 -9.043 -10.657 1.00 23.44 C ATOM 1299 C ILE A 423 2.113 -9.464 -12.114 1.00 33.25 C ATOM 1300 O ILE A 423 1.651 -8.765 -13.014 1.00 1.40 O ATOM 1301 CB ILE A 423 0.603 -9.365 -10.064 1.00 34.01 C ATOM 1302 CG1 ILE A 423 0.604 -9.031 -8.558 1.00 12.43 C ATOM 1303 CG2 ILE A 423 0.217 -10.827 -10.304 1.00 44.32 C ATOM 1304 CD1 ILE A 423 -0.676 -9.373 -7.832 1.00 22.33 C ATOM 0 H ILE A 423 1.546 -7.021 -10.609 1.00 13.53 H new ATOM 0 HA ILE A 423 2.724 -9.627 -10.086 1.00 23.44 H new ATOM 0 HB ILE A 423 -0.145 -8.753 -10.568 1.00 34.01 H new ATOM 0 HG12 ILE A 423 1.428 -9.563 -8.083 1.00 12.43 H new ATOM 0 HG13 ILE A 423 0.800 -7.966 -8.437 1.00 12.43 H new ATOM 0 HG21 ILE A 423 -0.767 -11.018 -9.877 1.00 44.32 H new ATOM 0 HG22 ILE A 423 0.192 -11.026 -11.375 1.00 44.32 H new ATOM 0 HG23 ILE A 423 0.951 -11.479 -9.831 1.00 44.32 H new ATOM 0 HD11 ILE A 423 -0.581 -9.103 -6.780 1.00 22.33 H new ATOM 0 HD12 ILE A 423 -1.504 -8.821 -8.275 1.00 22.33 H new ATOM 0 HD13 ILE A 423 -0.867 -10.443 -7.916 1.00 22.33 H new ATOM 1316 N ASN A 424 2.747 -10.583 -12.314 1.00 74.04 N ATOM 1317 CA ASN A 424 2.998 -11.159 -13.617 1.00 61.03 C ATOM 1318 C ASN A 424 1.690 -11.602 -14.293 1.00 31.02 C ATOM 1319 O ASN A 424 0.939 -12.395 -13.733 1.00 42.44 O ATOM 1320 CB ASN A 424 3.969 -12.346 -13.436 1.00 2.32 C ATOM 1321 CG ASN A 424 4.220 -13.166 -14.687 1.00 71.41 C ATOM 1322 OD1 ASN A 424 4.143 -12.670 -15.801 1.00 65.43 O ATOM 1323 ND2 ASN A 424 4.542 -14.425 -14.501 1.00 21.40 N ATOM 0 H ASN A 424 3.120 -11.146 -11.549 1.00 74.04 H new ATOM 0 HA ASN A 424 3.446 -10.412 -14.273 1.00 61.03 H new ATOM 0 HB2 ASN A 424 4.923 -11.963 -13.073 1.00 2.32 H new ATOM 0 HB3 ASN A 424 3.574 -13.004 -12.662 1.00 2.32 H new ATOM 0 HD21 ASN A 424 4.738 -15.025 -15.302 1.00 21.40 H new ATOM 0 HD22 ASN A 424 4.596 -14.803 -13.555 1.00 21.40 H new ATOM 1330 N PRO A 425 1.396 -11.087 -15.512 1.00 42.42 N ATOM 1331 CA PRO A 425 0.177 -11.446 -16.258 1.00 23.35 C ATOM 1332 C PRO A 425 0.174 -12.918 -16.686 1.00 64.01 C ATOM 1333 O PRO A 425 -0.867 -13.489 -16.993 1.00 54.32 O ATOM 1334 CB PRO A 425 0.215 -10.527 -17.490 1.00 40.53 C ATOM 1335 CG PRO A 425 1.645 -10.144 -17.638 1.00 71.10 C ATOM 1336 CD PRO A 425 2.210 -10.094 -16.248 1.00 22.23 C ATOM 0 HA PRO A 425 -0.720 -11.321 -15.652 1.00 23.35 H new ATOM 0 HB2 PRO A 425 -0.150 -11.042 -18.379 1.00 40.53 H new ATOM 0 HB3 PRO A 425 -0.416 -9.650 -17.348 1.00 40.53 H new ATOM 0 HG2 PRO A 425 2.181 -10.869 -18.250 1.00 71.10 H new ATOM 0 HG3 PRO A 425 1.740 -9.177 -18.132 1.00 71.10 H new ATOM 0 HD2 PRO A 425 3.269 -10.353 -16.235 1.00 22.23 H new ATOM 0 HD3 PRO A 425 2.120 -9.099 -15.813 1.00 22.23 H new ATOM 1344 N ASP A 426 1.350 -13.528 -16.683 1.00 64.14 N ATOM 1345 CA ASP A 426 1.501 -14.939 -17.034 1.00 34.25 C ATOM 1346 C ASP A 426 1.285 -15.815 -15.816 1.00 14.43 C ATOM 1347 O ASP A 426 1.417 -17.039 -15.882 1.00 1.43 O ATOM 1348 CB ASP A 426 2.886 -15.222 -17.623 1.00 43.44 C ATOM 1349 CG ASP A 426 3.127 -14.552 -18.947 1.00 11.23 C ATOM 1350 OD1 ASP A 426 2.726 -15.125 -19.985 1.00 1.13 O ATOM 1351 OD2 ASP A 426 3.737 -13.451 -18.983 1.00 33.23 O ATOM 0 H ASP A 426 2.225 -13.064 -16.439 1.00 64.14 H new ATOM 0 HA ASP A 426 0.748 -15.171 -17.787 1.00 34.25 H new ATOM 0 HB2 ASP A 426 3.647 -14.893 -16.915 1.00 43.44 H new ATOM 0 HB3 ASP A 426 3.007 -16.299 -17.743 1.00 43.44 H new ATOM 1356 N ALA A 427 0.951 -15.188 -14.710 1.00 5.41 N ATOM 1357 CA ALA A 427 0.726 -15.880 -13.462 1.00 41.42 C ATOM 1358 C ALA A 427 -0.755 -15.858 -13.110 1.00 5.33 C ATOM 1359 O ALA A 427 -1.141 -15.972 -11.938 1.00 53.11 O ATOM 1360 CB ALA A 427 1.536 -15.219 -12.374 1.00 73.14 C ATOM 0 H ALA A 427 0.827 -14.177 -14.652 1.00 5.41 H new ATOM 0 HA ALA A 427 1.039 -16.920 -13.561 1.00 41.42 H new ATOM 0 HB1 ALA A 427 1.369 -15.738 -11.430 1.00 73.14 H new ATOM 0 HB2 ALA A 427 2.594 -15.263 -12.631 1.00 73.14 H new ATOM 0 HB3 ALA A 427 1.230 -14.178 -12.274 1.00 73.14 H new ATOM 1366 N LYS A 428 -1.574 -15.733 -14.119 1.00 11.22 N ATOM 1367 CA LYS A 428 -3.004 -15.710 -13.954 1.00 63.42 C ATOM 1368 C LYS A 428 -3.598 -17.080 -14.246 1.00 13.51 C ATOM 1369 O LYS A 428 -3.395 -17.626 -15.320 1.00 61.31 O ATOM 1370 CB LYS A 428 -3.641 -14.665 -14.884 1.00 32.10 C ATOM 1371 CG LYS A 428 -3.333 -13.245 -14.558 1.00 41.13 C ATOM 1372 CD LYS A 428 -3.959 -12.864 -13.253 1.00 55.52 C ATOM 1373 CE LYS A 428 -3.748 -11.404 -12.938 1.00 43.42 C ATOM 1374 NZ LYS A 428 -4.428 -11.017 -11.686 1.00 41.11 N ATOM 0 H LYS A 428 -1.266 -15.643 -15.087 1.00 11.22 H new ATOM 0 HA LYS A 428 -3.218 -15.442 -12.919 1.00 63.42 H new ATOM 0 HB2 LYS A 428 -3.314 -14.865 -15.904 1.00 32.10 H new ATOM 0 HB3 LYS A 428 -4.723 -14.798 -14.864 1.00 32.10 H new ATOM 0 HG2 LYS A 428 -2.254 -13.102 -14.507 1.00 41.13 H new ATOM 0 HG3 LYS A 428 -3.703 -12.594 -15.350 1.00 41.13 H new ATOM 0 HD2 LYS A 428 -5.027 -13.079 -13.285 1.00 55.52 H new ATOM 0 HD3 LYS A 428 -3.536 -13.473 -12.455 1.00 55.52 H new ATOM 0 HE2 LYS A 428 -2.681 -11.200 -12.852 1.00 43.42 H new ATOM 0 HE3 LYS A 428 -4.124 -10.795 -13.760 1.00 43.42 H new ATOM 0 HZ1 LYS A 428 -4.180 -10.036 -11.445 1.00 41.11 H new ATOM 0 HZ2 LYS A 428 -5.458 -11.093 -11.812 1.00 41.11 H new ATOM 0 HZ3 LYS A 428 -4.126 -11.649 -10.917 1.00 41.11 H new ATOM 1388 N PRO A 429 -4.306 -17.675 -13.289 1.00 61.01 N ATOM 1389 CA PRO A 429 -5.017 -18.911 -13.533 1.00 64.12 C ATOM 1390 C PRO A 429 -6.184 -18.643 -14.486 1.00 64.42 C ATOM 1391 O PRO A 429 -6.920 -17.660 -14.324 1.00 44.15 O ATOM 1392 CB PRO A 429 -5.524 -19.332 -12.146 1.00 44.12 C ATOM 1393 CG PRO A 429 -5.545 -18.078 -11.348 1.00 0.43 C ATOM 1394 CD PRO A 429 -4.449 -17.211 -11.899 1.00 2.12 C ATOM 0 HA PRO A 429 -4.402 -19.684 -13.993 1.00 64.12 H new ATOM 0 HB2 PRO A 429 -6.517 -19.778 -12.207 1.00 44.12 H new ATOM 0 HB3 PRO A 429 -4.868 -20.076 -11.695 1.00 44.12 H new ATOM 0 HG2 PRO A 429 -6.512 -17.581 -11.429 1.00 0.43 H new ATOM 0 HG3 PRO A 429 -5.382 -18.287 -10.291 1.00 0.43 H new ATOM 0 HD2 PRO A 429 -4.713 -16.154 -11.854 1.00 2.12 H new ATOM 0 HD3 PRO A 429 -3.522 -17.332 -11.339 1.00 2.12 H new ATOM 1402 N GLY A 430 -6.324 -19.466 -15.481 1.00 41.20 N ATOM 1403 CA GLY A 430 -7.371 -19.279 -16.450 1.00 51.24 C ATOM 1404 C GLY A 430 -6.797 -18.853 -17.776 1.00 71.02 C ATOM 1405 O GLY A 430 -7.046 -19.481 -18.807 1.00 40.14 O ATOM 0 H GLY A 430 -5.727 -20.276 -15.647 1.00 41.20 H new ATOM 0 HA2 GLY A 430 -7.931 -20.206 -16.571 1.00 51.24 H new ATOM 0 HA3 GLY A 430 -8.074 -18.526 -16.093 1.00 51.24 H new ATOM 1409 N ARG A 431 -6.000 -17.810 -17.750 1.00 43.23 N ATOM 1410 CA ARG A 431 -5.350 -17.316 -18.940 1.00 64.14 C ATOM 1411 C ARG A 431 -3.842 -17.363 -18.751 1.00 21.02 C ATOM 1412 O ARG A 431 -3.292 -16.591 -17.966 1.00 44.14 O ATOM 1413 CB ARG A 431 -5.801 -15.896 -19.280 1.00 45.30 C ATOM 1414 CG ARG A 431 -5.160 -15.360 -20.544 1.00 40.44 C ATOM 1415 CD ARG A 431 -5.596 -13.948 -20.847 1.00 12.21 C ATOM 1416 NE ARG A 431 -4.932 -13.438 -22.048 1.00 14.41 N ATOM 1417 CZ ARG A 431 -5.045 -12.196 -22.524 1.00 22.22 C ATOM 1418 NH1 ARG A 431 -5.828 -11.314 -21.923 1.00 61.13 N ATOM 1419 NH2 ARG A 431 -4.368 -11.847 -23.609 1.00 73.34 N ATOM 0 H ARG A 431 -5.785 -17.281 -16.905 1.00 43.23 H new ATOM 0 HA ARG A 431 -5.633 -17.956 -19.776 1.00 64.14 H new ATOM 0 HB2 ARG A 431 -6.885 -15.882 -19.394 1.00 45.30 H new ATOM 0 HB3 ARG A 431 -5.560 -15.235 -18.448 1.00 45.30 H new ATOM 0 HG2 ARG A 431 -4.075 -15.390 -20.440 1.00 40.44 H new ATOM 0 HG3 ARG A 431 -5.418 -16.006 -21.383 1.00 40.44 H new ATOM 0 HD2 ARG A 431 -6.677 -13.920 -20.985 1.00 12.21 H new ATOM 0 HD3 ARG A 431 -5.366 -13.303 -19.999 1.00 12.21 H new ATOM 0 HE ARG A 431 -4.334 -14.084 -22.563 1.00 14.41 H new ATOM 0 HH11 ARG A 431 -6.351 -11.581 -21.089 1.00 61.13 H new ATOM 0 HH12 ARG A 431 -5.908 -10.367 -22.294 1.00 61.13 H new ATOM 0 HH21 ARG A 431 -3.766 -12.526 -24.075 1.00 73.34 H new ATOM 0 HH22 ARG A 431 -4.450 -10.900 -23.978 1.00 73.34 H new ATOM 1433 N ASN A 432 -3.198 -18.254 -19.506 1.00 74.20 N ATOM 1434 CA ASN A 432 -1.756 -18.561 -19.414 1.00 54.04 C ATOM 1435 C ASN A 432 -1.489 -19.474 -18.239 1.00 62.21 C ATOM 1436 O ASN A 432 -1.597 -19.067 -17.085 1.00 65.34 O ATOM 1437 CB ASN A 432 -0.828 -17.314 -19.387 1.00 24.44 C ATOM 1438 CG ASN A 432 -0.850 -16.509 -20.679 1.00 51.34 C ATOM 1439 OD1 ASN A 432 -1.849 -16.465 -21.394 1.00 24.12 O ATOM 1440 ND2 ASN A 432 0.244 -15.872 -20.994 1.00 14.42 N ATOM 0 H ASN A 432 -3.673 -18.803 -20.223 1.00 74.20 H new ATOM 0 HA ASN A 432 -1.500 -19.075 -20.341 1.00 54.04 H new ATOM 0 HB2 ASN A 432 -1.126 -16.668 -18.561 1.00 24.44 H new ATOM 0 HB3 ASN A 432 0.194 -17.636 -19.187 1.00 24.44 H new ATOM 0 HD21 ASN A 432 0.284 -15.321 -21.851 1.00 14.42 H new ATOM 0 HD22 ASN A 432 1.059 -15.925 -20.383 1.00 14.42 H new ATOM 1447 N PRO A 433 -1.184 -20.751 -18.506 1.00 3.20 N ATOM 1448 CA PRO A 433 -0.938 -21.728 -17.456 1.00 70.13 C ATOM 1449 C PRO A 433 0.349 -21.436 -16.711 1.00 33.31 C ATOM 1450 O PRO A 433 1.239 -20.734 -17.227 1.00 64.11 O ATOM 1451 CB PRO A 433 -0.823 -23.051 -18.215 1.00 14.33 C ATOM 1452 CG PRO A 433 -0.387 -22.660 -19.581 1.00 24.40 C ATOM 1453 CD PRO A 433 -1.041 -21.341 -19.854 1.00 72.53 C ATOM 0 HA PRO A 433 -1.724 -21.727 -16.701 1.00 70.13 H new ATOM 0 HB2 PRO A 433 -0.101 -23.718 -17.744 1.00 14.33 H new ATOM 0 HB3 PRO A 433 -1.776 -23.579 -18.239 1.00 14.33 H new ATOM 0 HG2 PRO A 433 0.698 -22.578 -19.637 1.00 24.40 H new ATOM 0 HG3 PRO A 433 -0.688 -23.406 -20.317 1.00 24.40 H new ATOM 0 HD2 PRO A 433 -0.430 -20.715 -20.505 1.00 72.53 H new ATOM 0 HD3 PRO A 433 -2.007 -21.464 -20.345 1.00 72.53 H new ATOM 1461 N ARG A 434 0.439 -21.950 -15.503 1.00 45.33 N ATOM 1462 CA ARG A 434 1.614 -21.776 -14.696 1.00 41.13 C ATOM 1463 C ARG A 434 2.786 -22.461 -15.358 1.00 35.43 C ATOM 1464 O ARG A 434 2.860 -23.693 -15.395 1.00 74.04 O ATOM 1465 CB ARG A 434 1.409 -22.347 -13.293 1.00 11.52 C ATOM 1466 CG ARG A 434 2.609 -22.150 -12.382 1.00 52.24 C ATOM 1467 CD ARG A 434 2.411 -22.818 -11.040 1.00 62.23 C ATOM 1468 NE ARG A 434 1.229 -22.324 -10.329 1.00 54.54 N ATOM 1469 CZ ARG A 434 1.109 -22.277 -8.998 1.00 13.42 C ATOM 1470 NH1 ARG A 434 2.161 -22.561 -8.215 1.00 33.44 N ATOM 1471 NH2 ARG A 434 -0.044 -21.903 -8.453 1.00 55.33 N ATOM 0 H ARG A 434 -0.300 -22.497 -15.060 1.00 45.33 H new ATOM 0 HA ARG A 434 1.813 -20.708 -14.603 1.00 41.13 H new ATOM 0 HB2 ARG A 434 0.537 -21.875 -12.840 1.00 11.52 H new ATOM 0 HB3 ARG A 434 1.191 -23.412 -13.370 1.00 11.52 H new ATOM 0 HG2 ARG A 434 3.500 -22.555 -12.862 1.00 52.24 H new ATOM 0 HG3 ARG A 434 2.783 -21.084 -12.235 1.00 52.24 H new ATOM 0 HD2 ARG A 434 2.319 -23.894 -11.185 1.00 62.23 H new ATOM 0 HD3 ARG A 434 3.295 -22.654 -10.424 1.00 62.23 H new ATOM 0 HE ARG A 434 0.443 -21.993 -10.888 1.00 54.54 H new ATOM 0 HH11 ARG A 434 3.056 -22.814 -8.635 1.00 33.44 H new ATOM 0 HH12 ARG A 434 2.066 -22.524 -7.200 1.00 33.44 H new ATOM 0 HH21 ARG A 434 -0.833 -21.653 -9.050 1.00 55.33 H new ATOM 0 HH22 ARG A 434 -0.140 -21.866 -7.438 1.00 55.33 H new ATOM 1485 N ARG A 435 3.659 -21.676 -15.907 1.00 70.01 N ATOM 1486 CA ARG A 435 4.826 -22.167 -16.556 1.00 42.22 C ATOM 1487 C ARG A 435 6.015 -21.378 -16.063 1.00 41.34 C ATOM 1488 O ARG A 435 6.343 -20.302 -16.586 1.00 10.14 O ATOM 1489 CB ARG A 435 4.675 -22.085 -18.088 1.00 4.44 C ATOM 1490 CG ARG A 435 5.871 -22.583 -18.892 1.00 33.43 C ATOM 1491 CD ARG A 435 6.192 -24.049 -18.622 1.00 3.40 C ATOM 1492 NE ARG A 435 7.320 -24.499 -19.447 1.00 15.14 N ATOM 1493 CZ ARG A 435 8.067 -25.589 -19.229 1.00 20.53 C ATOM 1494 NH1 ARG A 435 7.824 -26.366 -18.186 1.00 62.24 N ATOM 1495 NH2 ARG A 435 9.053 -25.895 -20.069 1.00 15.50 N ATOM 0 H ARG A 435 3.576 -20.659 -15.915 1.00 70.01 H new ATOM 0 HA ARG A 435 4.975 -23.219 -16.315 1.00 42.22 H new ATOM 0 HB2 ARG A 435 3.797 -22.661 -18.381 1.00 4.44 H new ATOM 0 HB3 ARG A 435 4.481 -21.048 -18.362 1.00 4.44 H new ATOM 0 HG2 ARG A 435 5.670 -22.449 -19.955 1.00 33.43 H new ATOM 0 HG3 ARG A 435 6.743 -21.974 -18.653 1.00 33.43 H new ATOM 0 HD2 ARG A 435 6.431 -24.185 -17.567 1.00 3.40 H new ATOM 0 HD3 ARG A 435 5.315 -24.662 -18.832 1.00 3.40 H new ATOM 0 HE ARG A 435 7.556 -23.930 -20.260 1.00 15.14 H new ATOM 0 HH11 ARG A 435 7.065 -26.136 -17.544 1.00 62.24 H new ATOM 0 HH12 ARG A 435 8.395 -27.195 -18.024 1.00 62.24 H new ATOM 0 HH21 ARG A 435 9.238 -25.300 -20.876 1.00 15.50 H new ATOM 0 HH22 ARG A 435 9.623 -26.725 -19.905 1.00 15.50 H new ATOM 1509 N GLN A 436 6.611 -21.873 -15.021 1.00 74.52 N ATOM 1510 CA GLN A 436 7.722 -21.224 -14.401 1.00 43.41 C ATOM 1511 C GLN A 436 9.006 -21.738 -15.030 1.00 32.35 C ATOM 1512 O GLN A 436 9.379 -22.896 -14.853 1.00 33.43 O ATOM 1513 CB GLN A 436 7.691 -21.500 -12.894 1.00 23.13 C ATOM 1514 CG GLN A 436 8.728 -20.755 -12.081 1.00 54.03 C ATOM 1515 CD GLN A 436 8.624 -21.074 -10.598 1.00 3.22 C ATOM 1516 OE1 GLN A 436 7.901 -20.413 -9.851 1.00 51.31 O ATOM 1517 NE2 GLN A 436 9.337 -22.070 -10.166 1.00 52.03 N ATOM 0 H GLN A 436 6.336 -22.748 -14.574 1.00 74.52 H new ATOM 0 HA GLN A 436 7.670 -20.146 -14.551 1.00 43.41 H new ATOM 0 HB2 GLN A 436 6.702 -21.244 -12.514 1.00 23.13 H new ATOM 0 HB3 GLN A 436 7.827 -22.570 -12.734 1.00 23.13 H new ATOM 0 HG2 GLN A 436 9.724 -21.014 -12.439 1.00 54.03 H new ATOM 0 HG3 GLN A 436 8.605 -19.682 -12.231 1.00 54.03 H new ATOM 0 HE21 GLN A 436 9.925 -22.595 -10.813 1.00 52.03 H new ATOM 0 HE22 GLN A 436 9.309 -22.327 -9.179 1.00 52.03 H new ATOM 1526 N ARG A 437 9.649 -20.900 -15.808 1.00 14.41 N ATOM 1527 CA ARG A 437 10.879 -21.296 -16.465 1.00 32.32 C ATOM 1528 C ARG A 437 12.071 -20.870 -15.634 1.00 75.13 C ATOM 1529 O ARG A 437 13.149 -21.478 -15.715 1.00 31.43 O ATOM 1530 CB ARG A 437 10.958 -20.737 -17.900 1.00 53.44 C ATOM 1531 CG ARG A 437 10.921 -19.222 -17.996 1.00 14.00 C ATOM 1532 CD ARG A 437 10.931 -18.749 -19.438 1.00 61.01 C ATOM 1533 NE ARG A 437 12.132 -19.162 -20.175 1.00 65.44 N ATOM 1534 CZ ARG A 437 12.390 -18.816 -21.446 1.00 52.44 C ATOM 1535 NH1 ARG A 437 11.532 -18.049 -22.123 1.00 63.31 N ATOM 1536 NH2 ARG A 437 13.498 -19.233 -22.036 1.00 0.21 N ATOM 0 H ARG A 437 9.347 -19.946 -16.003 1.00 14.41 H new ATOM 0 HA ARG A 437 10.891 -22.383 -16.550 1.00 32.32 H new ATOM 0 HB2 ARG A 437 11.877 -21.094 -18.364 1.00 53.44 H new ATOM 0 HB3 ARG A 437 10.130 -21.144 -18.480 1.00 53.44 H new ATOM 0 HG2 ARG A 437 10.027 -18.848 -17.497 1.00 14.00 H new ATOM 0 HG3 ARG A 437 11.779 -18.803 -17.470 1.00 14.00 H new ATOM 0 HD2 ARG A 437 10.049 -19.138 -19.947 1.00 61.01 H new ATOM 0 HD3 ARG A 437 10.857 -17.662 -19.457 1.00 61.01 H new ATOM 0 HE ARG A 437 12.812 -19.748 -19.691 1.00 65.44 H new ATOM 0 HH11 ARG A 437 10.676 -17.723 -21.675 1.00 63.31 H new ATOM 0 HH12 ARG A 437 11.733 -17.789 -23.089 1.00 63.31 H new ATOM 0 HH21 ARG A 437 14.158 -19.819 -21.525 1.00 0.21 H new ATOM 0 HH22 ARG A 437 13.692 -18.969 -23.002 1.00 0.21 H new ATOM 1550 N SER A 438 11.854 -19.830 -14.823 1.00 43.12 N ATOM 1551 CA SER A 438 12.856 -19.288 -13.927 1.00 53.33 C ATOM 1552 C SER A 438 14.085 -18.785 -14.732 1.00 5.41 C ATOM 1553 O SER A 438 13.993 -18.490 -15.941 1.00 2.42 O ATOM 1554 CB SER A 438 13.241 -20.370 -12.874 1.00 64.32 C ATOM 1555 OG SER A 438 14.129 -19.863 -11.879 1.00 61.54 O ATOM 0 H SER A 438 10.961 -19.340 -14.777 1.00 43.12 H new ATOM 0 HA SER A 438 12.454 -18.426 -13.394 1.00 53.33 H new ATOM 0 HB2 SER A 438 12.337 -20.745 -12.394 1.00 64.32 H new ATOM 0 HB3 SER A 438 13.709 -21.215 -13.379 1.00 64.32 H new ATOM 0 HG SER A 438 14.343 -20.573 -11.239 1.00 61.54 H new ATOM 1561 N ALA A 439 15.201 -18.662 -14.062 1.00 12.21 N ATOM 1562 CA ALA A 439 16.439 -18.230 -14.672 1.00 55.30 C ATOM 1563 C ALA A 439 17.282 -19.450 -15.021 1.00 72.51 C ATOM 1564 O ALA A 439 18.481 -19.347 -15.249 1.00 54.35 O ATOM 1565 CB ALA A 439 17.190 -17.316 -13.715 1.00 20.22 C ATOM 0 H ALA A 439 15.280 -18.861 -13.065 1.00 12.21 H new ATOM 0 HA ALA A 439 16.227 -17.675 -15.586 1.00 55.30 H new ATOM 0 HB1 ALA A 439 18.122 -16.992 -14.177 1.00 20.22 H new ATOM 0 HB2 ALA A 439 16.576 -16.445 -13.487 1.00 20.22 H new ATOM 0 HB3 ALA A 439 17.410 -17.856 -12.794 1.00 20.22 H new ATOM 1571 N THR A 440 16.627 -20.592 -15.091 1.00 10.31 N ATOM 1572 CA THR A 440 17.268 -21.849 -15.356 1.00 22.51 C ATOM 1573 C THR A 440 17.776 -21.936 -16.810 1.00 63.13 C ATOM 1574 O THR A 440 16.990 -22.150 -17.752 1.00 30.30 O ATOM 1575 CB THR A 440 16.289 -22.999 -15.081 1.00 71.33 C ATOM 1576 OG1 THR A 440 15.752 -22.848 -13.757 1.00 72.11 O ATOM 1577 CG2 THR A 440 16.979 -24.352 -15.190 1.00 12.04 C ATOM 0 H THR A 440 15.618 -20.666 -14.962 1.00 10.31 H new ATOM 0 HA THR A 440 18.131 -21.929 -14.695 1.00 22.51 H new ATOM 0 HB THR A 440 15.493 -22.961 -15.825 1.00 71.33 H new ATOM 0 HG1 THR A 440 15.124 -23.578 -13.573 1.00 72.11 H new ATOM 0 HG21 THR A 440 16.259 -25.145 -14.990 1.00 12.04 H new ATOM 0 HG22 THR A 440 17.383 -24.474 -16.195 1.00 12.04 H new ATOM 0 HG23 THR A 440 17.790 -24.406 -14.464 1.00 12.04 H new ATOM 1585 N LEU A 441 19.059 -21.712 -16.977 1.00 1.22 N ATOM 1586 CA LEU A 441 19.713 -21.840 -18.259 1.00 70.13 C ATOM 1587 C LEU A 441 20.572 -23.094 -18.231 1.00 15.24 C ATOM 1588 O LEU A 441 20.320 -24.048 -18.971 1.00 52.21 O ATOM 1589 CB LEU A 441 20.553 -20.595 -18.557 1.00 42.00 C ATOM 1590 CG LEU A 441 19.788 -19.265 -18.637 1.00 71.33 C ATOM 1591 CD1 LEU A 441 20.738 -18.116 -18.905 1.00 53.11 C ATOM 1592 CD2 LEU A 441 18.712 -19.322 -19.710 1.00 5.45 C ATOM 0 H LEU A 441 19.684 -21.433 -16.220 1.00 1.22 H new ATOM 0 HA LEU A 441 18.973 -21.926 -19.055 1.00 70.13 H new ATOM 0 HB2 LEU A 441 21.318 -20.505 -17.786 1.00 42.00 H new ATOM 0 HB3 LEU A 441 21.071 -20.750 -19.503 1.00 42.00 H new ATOM 0 HG LEU A 441 19.304 -19.097 -17.675 1.00 71.33 H new ATOM 0 HD11 LEU A 441 20.176 -17.184 -18.958 1.00 53.11 H new ATOM 0 HD12 LEU A 441 21.470 -18.053 -18.099 1.00 53.11 H new ATOM 0 HD13 LEU A 441 21.253 -18.283 -19.851 1.00 53.11 H new ATOM 0 HD21 LEU A 441 18.184 -18.369 -19.747 1.00 5.45 H new ATOM 0 HD22 LEU A 441 19.173 -19.520 -20.678 1.00 5.45 H new ATOM 0 HD23 LEU A 441 18.006 -20.119 -19.475 1.00 5.45 H new ATOM 1604 N GLU A 442 21.575 -23.090 -17.369 1.00 63.32 N ATOM 1605 CA GLU A 442 22.364 -24.272 -17.118 1.00 10.52 C ATOM 1606 C GLU A 442 22.177 -24.635 -15.660 1.00 3.24 C ATOM 1607 O GLU A 442 23.014 -24.233 -14.816 1.00 37.55 O ATOM 1608 CB GLU A 442 23.881 -24.103 -17.417 1.00 12.42 C ATOM 1609 CG GLU A 442 24.291 -23.831 -18.871 1.00 4.31 C ATOM 1610 CD GLU A 442 23.931 -22.455 -19.377 1.00 44.44 C ATOM 1611 OE1 GLU A 442 24.582 -21.470 -18.960 1.00 31.24 O ATOM 1612 OE2 GLU A 442 23.055 -22.332 -20.240 1.00 51.14 O ATOM 1613 OXT GLU A 442 21.150 -25.258 -15.330 1.00 37.55 O ATOM 0 H GLU A 442 21.859 -22.272 -16.830 1.00 63.32 H new ATOM 0 HA GLU A 442 22.018 -25.053 -17.795 1.00 10.52 H new ATOM 0 HB2 GLU A 442 24.256 -23.284 -16.803 1.00 12.42 H new ATOM 0 HB3 GLU A 442 24.392 -25.008 -17.087 1.00 12.42 H new ATOM 0 HG2 GLU A 442 25.369 -23.967 -18.963 1.00 4.31 H new ATOM 0 HG3 GLU A 442 23.820 -24.575 -19.513 1.00 4.31 H new TER 1620 GLU A 442