USER MOD reduce.3.24.130724 H: found=0, std=0, add=701, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 700 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 440 HIS : no HD1:sc= -6.73! C(o=-5.9!,f=-11!) USER MOD Set 1.2: A 449 THR OG1 : rot -120:sc= 0.799 USER MOD Set 2.1: A 429 TYR OH : rot 165:sc= -0.13 USER MOD Set 2.2: A 466 LYS NZ :NH3+ 141:sc= -0.368 (180deg=-0.752) USER MOD Set 3.1: A 427 THR OG1 : rot 180:sc= 0 USER MOD Set 3.2: A 502 THR OG1 : rot 180:sc= 0 USER MOD Single : A 422 THR OG1 : rot 180:sc= 0.00688 USER MOD Single : A 424 ASN : amide:sc= -4.65! C(o=-4.6!,f=-5.3!) USER MOD Single : A 425 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 430 TYR OH : rot 67:sc= -0.675! USER MOD Single : A 431 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 432 LYS NZ :NH3+ 165:sc= 0.743 (180deg=0.586) USER MOD Single : A 435 ASN : amide:sc= -4.33! C(o=-4.3!,f=-14!) USER MOD Single : A 436 SER OG : rot 55:sc= 1.05 USER MOD Single : A 438 TYR OH : rot 180:sc= 0 USER MOD Single : A 441 TYR OH : rot 180:sc= 0 USER MOD Single : A 447 SER OG : rot 180:sc= 0 USER MOD Single : A 455 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 456 MET CE :methyl 157:sc= -5.77! (180deg=-8.18!) USER MOD Single : A 457 GLN : amide:sc= -2.41! K(o=-2.4!,f=-1.6) USER MOD Single : A 462 SER OG : rot 66:sc= 1.09 USER MOD Single : A 464 TYR OH : rot 180:sc= 0 USER MOD Single : A 468 THR OG1 : rot 180:sc= 0 USER MOD Single : A 473 SER OG : rot 180:sc= 0 USER MOD Single : A 475 SER OG : rot 180:sc= -0.0124 USER MOD Single : A 476 GLN : amide:sc= -0.814 K(o=-0.81,f=0) USER MOD Single : A 482 ASN : amide:sc= -6.17! C(o=-6.2!,f=-7.4!) USER MOD Single : A 485 ASN : amide:sc= -1.15 K(o=-1.2,f=-0.083) USER MOD Single : A 486 ASN : amide:sc= -0.408 K(o=-0.41,f=-3!) USER MOD Single : A 487 ASN : amide:sc= -4.89! K(o=-4.9!,f=-1.3) USER MOD Single : A 490 SER OG : rot 180:sc=-0.00144 USER MOD Single : A 491 ASN : amide:sc= 0.631 K(o=0.63,f=-0.34) USER MOD Single : A 492 ASN : amide:sc= -0.244 X(o=-0.24,f=-0.035) USER MOD Single : A 493 THR OG1 : rot -72:sc= 1.06 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 495 ASN : amide:sc= -3.38! C(o=-3.4!,f=-10!) USER MOD Single : A 496 TYR OH : rot -98:sc= 1.24 USER MOD Single : A 497 SER OG : rot 180:sc= 0 USER MOD Single : A 499 SER OG : rot 180:sc= 0 USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 503 SER OG : rot 137:sc= -0.146 USER MOD Single : A 504 THR OG1 : rot 111:sc= 0.00674 USER MOD Single : A 505 TYR OH : rot -165:sc= 0.11 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 509 ASN : amide:sc= -2.71! K(o=-2.7!,f=-1.5) USER MOD Single : A 510 SER OG : rot 180:sc= 0 USER MOD Single : A 512 ASN : amide:sc= -2.67! K(o=-2.7!,f=-0.21) USER MOD Single : A 515 THR OG1 : rot 48:sc= 0.565 USER MOD Single : A 517 THR OG1 : rot -176:sc= -1.69! USER MOD Single : A 518 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 420 -21.467 -5.542 10.111 1.00 0.00 N ATOM 2 CA GLY A 420 -21.758 -4.385 10.940 1.00 0.00 C ATOM 3 C GLY A 420 -20.598 -3.387 10.915 1.00 0.00 C ATOM 4 O GLY A 420 -20.105 -3.031 9.846 1.00 0.00 O ATOM 0 HA2 GLY A 420 -22.668 -3.900 10.587 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -21.945 -4.705 11.965 1.00 0.00 H new ATOM 8 N GLY A 421 -20.197 -2.965 12.105 1.00 0.00 N ATOM 9 CA GLY A 421 -19.105 -2.016 12.233 1.00 0.00 C ATOM 10 C GLY A 421 -17.808 -2.590 11.658 1.00 0.00 C ATOM 11 O GLY A 421 -17.823 -3.629 11.000 1.00 0.00 O ATOM 0 H GLY A 421 -20.609 -3.263 12.989 1.00 0.00 H new ATOM 0 HA2 GLY A 421 -19.359 -1.092 11.714 1.00 0.00 H new ATOM 0 HA3 GLY A 421 -18.960 -1.762 13.283 1.00 0.00 H new ATOM 15 N THR A 422 -16.717 -1.888 11.927 1.00 0.00 N ATOM 16 CA THR A 422 -15.415 -2.315 11.445 1.00 0.00 C ATOM 17 C THR A 422 -14.480 -2.608 12.620 1.00 0.00 C ATOM 18 O THR A 422 -14.561 -1.955 13.660 1.00 0.00 O ATOM 19 CB THR A 422 -14.883 -1.236 10.500 1.00 0.00 C ATOM 20 OG1 THR A 422 -15.041 -0.024 11.233 1.00 0.00 O ATOM 21 CG2 THR A 422 -15.772 -1.045 9.269 1.00 0.00 C ATOM 0 H THR A 422 -16.708 -1.026 12.473 1.00 0.00 H new ATOM 0 HA THR A 422 -15.487 -3.249 10.888 1.00 0.00 H new ATOM 0 HB THR A 422 -13.874 -1.498 10.182 1.00 0.00 H new ATOM 0 HG1 THR A 422 -14.719 0.729 10.694 1.00 0.00 H new ATOM 0 HG21 THR A 422 -15.349 -0.268 8.632 1.00 0.00 H new ATOM 0 HG22 THR A 422 -15.828 -1.980 8.712 1.00 0.00 H new ATOM 0 HG23 THR A 422 -16.773 -0.750 9.585 1.00 0.00 H new ATOM 29 N GLY A 423 -13.614 -3.589 12.416 1.00 0.00 N ATOM 30 CA GLY A 423 -12.665 -3.976 13.446 1.00 0.00 C ATOM 31 C GLY A 423 -11.438 -3.062 13.433 1.00 0.00 C ATOM 32 O GLY A 423 -11.494 -1.935 13.921 1.00 0.00 O ATOM 0 H GLY A 423 -13.549 -4.128 11.552 1.00 0.00 H new ATOM 0 HA2 GLY A 423 -13.146 -3.932 14.423 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -12.355 -5.009 13.290 1.00 0.00 H new ATOM 36 N ASN A 424 -10.358 -3.583 12.868 1.00 0.00 N ATOM 37 CA ASN A 424 -9.119 -2.828 12.785 1.00 0.00 C ATOM 38 C ASN A 424 -9.009 -2.188 11.400 1.00 0.00 C ATOM 39 O ASN A 424 -9.648 -2.640 10.451 1.00 0.00 O ATOM 40 CB ASN A 424 -7.905 -3.738 12.984 1.00 0.00 C ATOM 41 CG ASN A 424 -7.311 -3.561 14.383 1.00 0.00 C ATOM 42 OD1 ASN A 424 -6.868 -2.492 14.767 1.00 0.00 O ATOM 43 ND2 ASN A 424 -7.327 -4.668 15.120 1.00 0.00 N ATOM 0 H ASN A 424 -10.316 -4.518 12.464 1.00 0.00 H new ATOM 0 HA ASN A 424 -9.133 -2.070 13.568 1.00 0.00 H new ATOM 0 HB2 ASN A 424 -8.198 -4.778 12.838 1.00 0.00 H new ATOM 0 HB3 ASN A 424 -7.149 -3.511 12.232 1.00 0.00 H new ATOM 0 HD21 ASN A 424 -6.953 -4.654 16.069 1.00 0.00 H new ATOM 0 HD22 ASN A 424 -7.713 -5.531 14.736 1.00 0.00 H new ATOM 50 N LYS A 425 -8.193 -1.146 11.328 1.00 0.00 N ATOM 51 CA LYS A 425 -7.991 -0.440 10.074 1.00 0.00 C ATOM 52 C LYS A 425 -6.491 -0.290 9.814 1.00 0.00 C ATOM 53 O LYS A 425 -5.701 -0.191 10.752 1.00 0.00 O ATOM 54 CB LYS A 425 -8.750 0.889 10.080 1.00 0.00 C ATOM 55 CG LYS A 425 -8.768 1.516 8.684 1.00 0.00 C ATOM 56 CD LYS A 425 -10.189 1.915 8.281 1.00 0.00 C ATOM 57 CE LYS A 425 -10.467 3.379 8.628 1.00 0.00 C ATOM 58 NZ LYS A 425 -11.916 3.597 8.831 1.00 0.00 N ATOM 0 H LYS A 425 -7.665 -0.774 12.117 1.00 0.00 H new ATOM 0 HA LYS A 425 -8.403 -1.013 9.243 1.00 0.00 H new ATOM 0 HB2 LYS A 425 -9.772 0.727 10.423 1.00 0.00 H new ATOM 0 HB3 LYS A 425 -8.282 1.576 10.785 1.00 0.00 H new ATOM 0 HG2 LYS A 425 -8.121 2.393 8.667 1.00 0.00 H new ATOM 0 HG3 LYS A 425 -8.365 0.809 7.959 1.00 0.00 H new ATOM 0 HD2 LYS A 425 -10.325 1.759 7.211 1.00 0.00 H new ATOM 0 HD3 LYS A 425 -10.909 1.274 8.790 1.00 0.00 H new ATOM 0 HE2 LYS A 425 -9.922 3.655 9.531 1.00 0.00 H new ATOM 0 HE3 LYS A 425 -10.105 4.024 7.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 425 -12.087 4.596 9.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 425 -12.429 3.353 7.960 1.00 0.00 H new ATOM 0 HZ3 LYS A 425 -12.252 2.996 9.610 1.00 0.00 H new ATOM 71 N VAL A 426 -6.143 -0.280 8.536 1.00 0.00 N ATOM 72 CA VAL A 426 -4.751 -0.145 8.140 1.00 0.00 C ATOM 73 C VAL A 426 -4.644 0.880 7.009 1.00 0.00 C ATOM 74 O VAL A 426 -5.236 0.701 5.946 1.00 0.00 O ATOM 75 CB VAL A 426 -4.179 -1.513 7.763 1.00 0.00 C ATOM 76 CG1 VAL A 426 -2.652 -1.465 7.681 1.00 0.00 C ATOM 77 CG2 VAL A 426 -4.641 -2.590 8.746 1.00 0.00 C ATOM 0 H VAL A 426 -6.801 -0.363 7.761 1.00 0.00 H new ATOM 0 HA VAL A 426 -4.152 0.225 8.972 1.00 0.00 H new ATOM 0 HB VAL A 426 -4.560 -1.775 6.776 1.00 0.00 H new ATOM 0 HG11 VAL A 426 -2.271 -2.450 7.411 1.00 0.00 H new ATOM 0 HG12 VAL A 426 -2.351 -0.740 6.925 1.00 0.00 H new ATOM 0 HG13 VAL A 426 -2.245 -1.171 8.648 1.00 0.00 H new ATOM 0 HG21 VAL A 426 -4.220 -3.553 8.455 1.00 0.00 H new ATOM 0 HG22 VAL A 426 -4.303 -2.335 9.750 1.00 0.00 H new ATOM 0 HG23 VAL A 426 -5.729 -2.651 8.734 1.00 0.00 H new ATOM 87 N THR A 427 -3.885 1.933 7.278 1.00 0.00 N ATOM 88 CA THR A 427 -3.693 2.987 6.296 1.00 0.00 C ATOM 89 C THR A 427 -2.286 2.910 5.699 1.00 0.00 C ATOM 90 O THR A 427 -1.312 2.701 6.421 1.00 0.00 O ATOM 91 CB THR A 427 -3.992 4.325 6.974 1.00 0.00 C ATOM 92 OG1 THR A 427 -4.876 3.984 8.039 1.00 0.00 O ATOM 93 CG2 THR A 427 -4.818 5.259 6.088 1.00 0.00 C ATOM 0 H THR A 427 -3.396 2.079 8.161 1.00 0.00 H new ATOM 0 HA THR A 427 -4.376 2.872 5.454 1.00 0.00 H new ATOM 0 HB THR A 427 -3.055 4.814 7.241 1.00 0.00 H new ATOM 0 HG1 THR A 427 -5.120 4.794 8.534 1.00 0.00 H new ATOM 0 HG21 THR A 427 -5.002 6.194 6.617 1.00 0.00 H new ATOM 0 HG22 THR A 427 -4.272 5.464 5.167 1.00 0.00 H new ATOM 0 HG23 THR A 427 -5.770 4.785 5.847 1.00 0.00 H new ATOM 101 N ILE A 428 -2.225 3.082 4.387 1.00 0.00 N ATOM 102 CA ILE A 428 -0.953 3.034 3.684 1.00 0.00 C ATOM 103 C ILE A 428 -0.821 4.271 2.794 1.00 0.00 C ATOM 104 O ILE A 428 -1.695 4.548 1.975 1.00 0.00 O ATOM 105 CB ILE A 428 -0.810 1.713 2.926 1.00 0.00 C ATOM 106 CG1 ILE A 428 -0.356 0.590 3.861 1.00 0.00 C ATOM 107 CG2 ILE A 428 0.123 1.870 1.724 1.00 0.00 C ATOM 108 CD1 ILE A 428 -1.202 -0.668 3.659 1.00 0.00 C ATOM 0 H ILE A 428 -3.035 3.255 3.792 1.00 0.00 H new ATOM 0 HA ILE A 428 -0.125 3.060 4.392 1.00 0.00 H new ATOM 0 HB ILE A 428 -1.790 1.433 2.539 1.00 0.00 H new ATOM 0 HG12 ILE A 428 0.693 0.360 3.676 1.00 0.00 H new ATOM 0 HG13 ILE A 428 -0.432 0.921 4.897 1.00 0.00 H new ATOM 0 HG21 ILE A 428 0.208 0.917 1.202 1.00 0.00 H new ATOM 0 HG22 ILE A 428 -0.282 2.621 1.045 1.00 0.00 H new ATOM 0 HG23 ILE A 428 1.109 2.185 2.067 1.00 0.00 H new ATOM 0 HD11 ILE A 428 -0.858 -1.450 4.336 1.00 0.00 H new ATOM 0 HD12 ILE A 428 -2.247 -0.441 3.868 1.00 0.00 H new ATOM 0 HD13 ILE A 428 -1.104 -1.011 2.629 1.00 0.00 H new ATOM 120 N TYR A 429 0.280 4.983 2.986 1.00 0.00 N ATOM 121 CA TYR A 429 0.539 6.185 2.211 1.00 0.00 C ATOM 122 C TYR A 429 1.766 6.006 1.314 1.00 0.00 C ATOM 123 O TYR A 429 2.893 5.951 1.803 1.00 0.00 O ATOM 124 CB TYR A 429 0.823 7.290 3.230 1.00 0.00 C ATOM 125 CG TYR A 429 -0.408 7.743 4.017 1.00 0.00 C ATOM 126 CD1 TYR A 429 -1.119 6.830 4.770 1.00 0.00 C ATOM 127 CD2 TYR A 429 -0.808 9.063 3.974 1.00 0.00 C ATOM 128 CE1 TYR A 429 -2.278 7.256 5.511 1.00 0.00 C ATOM 129 CE2 TYR A 429 -1.967 9.489 4.715 1.00 0.00 C ATOM 130 CZ TYR A 429 -2.645 8.564 5.447 1.00 0.00 C ATOM 131 OH TYR A 429 -3.739 8.966 6.147 1.00 0.00 O ATOM 0 H TYR A 429 1.003 4.751 3.667 1.00 0.00 H new ATOM 0 HA TYR A 429 -0.310 6.417 1.568 1.00 0.00 H new ATOM 0 HB2 TYR A 429 1.580 6.938 3.931 1.00 0.00 H new ATOM 0 HB3 TYR A 429 1.245 8.150 2.710 1.00 0.00 H new ATOM 0 HD1 TYR A 429 -0.806 5.797 4.803 1.00 0.00 H new ATOM 0 HD2 TYR A 429 -0.252 9.777 3.384 1.00 0.00 H new ATOM 0 HE1 TYR A 429 -2.843 6.552 6.104 1.00 0.00 H new ATOM 0 HE2 TYR A 429 -2.291 10.519 4.690 1.00 0.00 H new ATOM 0 HH TYR A 429 -3.747 9.944 6.208 1.00 0.00 H new ATOM 141 N TYR A 430 1.505 5.920 0.018 1.00 0.00 N ATOM 142 CA TYR A 430 2.573 5.748 -0.951 1.00 0.00 C ATOM 143 C TYR A 430 2.800 7.033 -1.751 1.00 0.00 C ATOM 144 O TYR A 430 1.844 7.696 -2.150 1.00 0.00 O ATOM 145 CB TYR A 430 2.107 4.645 -1.902 1.00 0.00 C ATOM 146 CG TYR A 430 2.919 4.553 -3.195 1.00 0.00 C ATOM 147 CD1 TYR A 430 4.294 4.452 -3.141 1.00 0.00 C ATOM 148 CD2 TYR A 430 2.276 4.571 -4.416 1.00 0.00 C ATOM 149 CE1 TYR A 430 5.059 4.366 -4.358 1.00 0.00 C ATOM 150 CE2 TYR A 430 3.041 4.485 -5.634 1.00 0.00 C ATOM 151 CZ TYR A 430 4.394 4.387 -5.544 1.00 0.00 C ATOM 152 OH TYR A 430 5.116 4.306 -6.694 1.00 0.00 O ATOM 0 H TYR A 430 0.569 5.966 -0.384 1.00 0.00 H new ATOM 0 HA TYR A 430 3.509 5.500 -0.450 1.00 0.00 H new ATOM 0 HB2 TYR A 430 2.159 3.687 -1.384 1.00 0.00 H new ATOM 0 HB3 TYR A 430 1.060 4.815 -2.154 1.00 0.00 H new ATOM 0 HD1 TYR A 430 4.797 4.437 -2.185 1.00 0.00 H new ATOM 0 HD2 TYR A 430 1.200 4.650 -4.459 1.00 0.00 H new ATOM 0 HE1 TYR A 430 6.136 4.287 -4.329 1.00 0.00 H new ATOM 0 HE2 TYR A 430 2.551 4.498 -6.596 1.00 0.00 H new ATOM 0 HH TYR A 430 5.530 3.420 -6.758 1.00 0.00 H new ATOM 162 N LYS A 431 4.070 7.344 -1.962 1.00 0.00 N ATOM 163 CA LYS A 431 4.434 8.537 -2.707 1.00 0.00 C ATOM 164 C LYS A 431 3.970 8.389 -4.157 1.00 0.00 C ATOM 165 O LYS A 431 4.066 7.308 -4.736 1.00 0.00 O ATOM 166 CB LYS A 431 5.931 8.821 -2.566 1.00 0.00 C ATOM 167 CG LYS A 431 6.390 9.866 -3.586 1.00 0.00 C ATOM 168 CD LYS A 431 7.200 9.216 -4.710 1.00 0.00 C ATOM 169 CE LYS A 431 8.661 9.667 -4.663 1.00 0.00 C ATOM 170 NZ LYS A 431 9.145 9.997 -6.022 1.00 0.00 N ATOM 0 H LYS A 431 4.860 6.791 -1.630 1.00 0.00 H new ATOM 0 HA LYS A 431 3.927 9.411 -2.298 1.00 0.00 H new ATOM 0 HB2 LYS A 431 6.144 9.174 -1.557 1.00 0.00 H new ATOM 0 HB3 LYS A 431 6.495 7.899 -2.706 1.00 0.00 H new ATOM 0 HG2 LYS A 431 5.523 10.375 -4.006 1.00 0.00 H new ATOM 0 HG3 LYS A 431 6.995 10.624 -3.088 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.147 8.131 -4.621 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.766 9.478 -5.675 1.00 0.00 H new ATOM 0 HE2 LYS A 431 8.758 10.538 -4.014 1.00 0.00 H new ATOM 0 HE3 LYS A 431 9.278 8.878 -4.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 10.138 10.301 -5.972 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.070 9.157 -6.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 8.567 10.765 -6.419 1.00 0.00 H new ATOM 183 N LYS A 432 3.478 9.491 -4.703 1.00 0.00 N ATOM 184 CA LYS A 432 2.999 9.497 -6.075 1.00 0.00 C ATOM 185 C LYS A 432 4.194 9.461 -7.029 1.00 0.00 C ATOM 186 O LYS A 432 4.941 10.433 -7.131 1.00 0.00 O ATOM 187 CB LYS A 432 2.061 10.683 -6.310 1.00 0.00 C ATOM 188 CG LYS A 432 1.111 10.409 -7.477 1.00 0.00 C ATOM 189 CD LYS A 432 -0.168 11.238 -7.350 1.00 0.00 C ATOM 190 CE LYS A 432 -1.287 10.425 -6.695 1.00 0.00 C ATOM 191 NZ LYS A 432 -2.374 10.164 -7.665 1.00 0.00 N ATOM 0 H LYS A 432 3.401 10.386 -4.220 1.00 0.00 H new ATOM 0 HA LYS A 432 2.405 8.605 -6.274 1.00 0.00 H new ATOM 0 HB2 LYS A 432 1.485 10.880 -5.406 1.00 0.00 H new ATOM 0 HB3 LYS A 432 2.647 11.579 -6.516 1.00 0.00 H new ATOM 0 HG2 LYS A 432 1.608 10.644 -8.418 1.00 0.00 H new ATOM 0 HG3 LYS A 432 0.860 9.349 -7.505 1.00 0.00 H new ATOM 0 HD2 LYS A 432 0.031 12.132 -6.758 1.00 0.00 H new ATOM 0 HD3 LYS A 432 -0.487 11.574 -8.337 1.00 0.00 H new ATOM 0 HE2 LYS A 432 -0.889 9.481 -6.323 1.00 0.00 H new ATOM 0 HE3 LYS A 432 -1.681 10.965 -5.835 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 -2.993 9.413 -7.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 -2.929 11.032 -7.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 -1.965 9.863 -8.572 1.00 0.00 H new ATOM 204 N GLY A 433 4.338 8.329 -7.703 1.00 0.00 N ATOM 205 CA GLY A 433 5.431 8.153 -8.645 1.00 0.00 C ATOM 206 C GLY A 433 4.902 7.946 -10.065 1.00 0.00 C ATOM 207 O GLY A 433 5.654 8.053 -11.033 1.00 0.00 O ATOM 0 H GLY A 433 3.716 7.525 -7.616 1.00 0.00 H new ATOM 0 HA2 GLY A 433 6.082 9.027 -8.619 1.00 0.00 H new ATOM 0 HA3 GLY A 433 6.036 7.296 -8.350 1.00 0.00 H new ATOM 211 N PHE A 434 3.613 7.651 -10.145 1.00 0.00 N ATOM 212 CA PHE A 434 2.975 7.427 -11.432 1.00 0.00 C ATOM 213 C PHE A 434 1.834 8.421 -11.658 1.00 0.00 C ATOM 214 O PHE A 434 1.918 9.278 -12.537 1.00 0.00 O ATOM 215 CB PHE A 434 2.402 6.009 -11.406 1.00 0.00 C ATOM 216 CG PHE A 434 3.051 5.057 -12.412 1.00 0.00 C ATOM 217 CD1 PHE A 434 4.266 4.508 -12.144 1.00 0.00 C ATOM 218 CD2 PHE A 434 2.413 4.760 -13.576 1.00 0.00 C ATOM 219 CE1 PHE A 434 4.869 3.625 -13.078 1.00 0.00 C ATOM 220 CE2 PHE A 434 3.016 3.876 -14.511 1.00 0.00 C ATOM 221 CZ PHE A 434 4.231 3.327 -14.242 1.00 0.00 C ATOM 0 H PHE A 434 2.993 7.562 -9.340 1.00 0.00 H new ATOM 0 HA PHE A 434 3.700 7.558 -12.235 1.00 0.00 H new ATOM 0 HB2 PHE A 434 2.521 5.598 -10.403 1.00 0.00 H new ATOM 0 HB3 PHE A 434 1.331 6.057 -11.605 1.00 0.00 H new ATOM 0 HD1 PHE A 434 4.773 4.744 -11.220 1.00 0.00 H new ATOM 0 HD2 PHE A 434 1.448 5.196 -13.790 1.00 0.00 H new ATOM 0 HE1 PHE A 434 5.834 3.190 -12.864 1.00 0.00 H new ATOM 0 HE2 PHE A 434 2.510 3.640 -15.435 1.00 0.00 H new ATOM 0 HZ PHE A 434 4.689 2.655 -14.952 1.00 0.00 H new ATOM 231 N ASN A 435 0.794 8.273 -10.851 1.00 0.00 N ATOM 232 CA ASN A 435 -0.362 9.147 -10.953 1.00 0.00 C ATOM 233 C ASN A 435 -1.608 8.395 -10.477 1.00 0.00 C ATOM 234 O ASN A 435 -2.516 8.993 -9.902 1.00 0.00 O ATOM 235 CB ASN A 435 -0.597 9.584 -12.400 1.00 0.00 C ATOM 236 CG ASN A 435 -0.356 8.424 -13.368 1.00 0.00 C ATOM 237 OD1 ASN A 435 -0.589 7.266 -13.062 1.00 0.00 O ATOM 238 ND2 ASN A 435 0.123 8.798 -14.551 1.00 0.00 N ATOM 0 H ASN A 435 0.728 7.561 -10.124 1.00 0.00 H new ATOM 0 HA ASN A 435 -0.175 10.027 -10.337 1.00 0.00 H new ATOM 0 HB2 ASN A 435 -1.618 9.950 -12.512 1.00 0.00 H new ATOM 0 HB3 ASN A 435 0.068 10.412 -12.646 1.00 0.00 H new ATOM 0 HD21 ASN A 435 0.318 8.098 -15.267 1.00 0.00 H new ATOM 0 HD22 ASN A 435 0.296 9.785 -14.742 1.00 0.00 H new ATOM 245 N SER A 436 -1.610 7.096 -10.736 1.00 0.00 N ATOM 246 CA SER A 436 -2.729 6.256 -10.343 1.00 0.00 C ATOM 247 C SER A 436 -2.275 4.799 -10.230 1.00 0.00 C ATOM 248 O SER A 436 -2.792 3.929 -10.929 1.00 0.00 O ATOM 249 CB SER A 436 -3.885 6.377 -11.338 1.00 0.00 C ATOM 250 OG SER A 436 -3.597 5.726 -12.572 1.00 0.00 O ATOM 0 H SER A 436 -0.855 6.604 -11.213 1.00 0.00 H new ATOM 0 HA SER A 436 -3.086 6.595 -9.371 1.00 0.00 H new ATOM 0 HB2 SER A 436 -4.786 5.945 -10.902 1.00 0.00 H new ATOM 0 HB3 SER A 436 -4.095 7.430 -11.524 1.00 0.00 H new ATOM 0 HG SER A 436 -3.354 4.792 -12.400 1.00 0.00 H new ATOM 256 N PRO A 437 -1.288 4.573 -9.322 1.00 0.00 N ATOM 257 CA PRO A 437 -0.760 3.236 -9.109 1.00 0.00 C ATOM 258 C PRO A 437 -1.741 2.380 -8.307 1.00 0.00 C ATOM 259 O PRO A 437 -2.627 2.908 -7.637 1.00 0.00 O ATOM 260 CB PRO A 437 0.566 3.447 -8.395 1.00 0.00 C ATOM 261 CG PRO A 437 0.512 4.854 -7.823 1.00 0.00 C ATOM 262 CD PRO A 437 -0.652 5.579 -8.478 1.00 0.00 C ATOM 0 HA PRO A 437 -0.614 2.688 -10.040 1.00 0.00 H new ATOM 0 HB2 PRO A 437 0.706 2.709 -7.605 1.00 0.00 H new ATOM 0 HB3 PRO A 437 1.403 3.338 -9.085 1.00 0.00 H new ATOM 0 HG2 PRO A 437 0.381 4.822 -6.741 1.00 0.00 H new ATOM 0 HG3 PRO A 437 1.447 5.381 -8.016 1.00 0.00 H new ATOM 0 HD2 PRO A 437 -1.346 5.967 -7.733 1.00 0.00 H new ATOM 0 HD3 PRO A 437 -0.308 6.429 -9.067 1.00 0.00 H new ATOM 270 N TYR A 438 -1.551 1.072 -8.403 1.00 0.00 N ATOM 271 CA TYR A 438 -2.409 0.137 -7.695 1.00 0.00 C ATOM 272 C TYR A 438 -1.672 -0.497 -6.513 1.00 0.00 C ATOM 273 O TYR A 438 -0.464 -0.721 -6.579 1.00 0.00 O ATOM 274 CB TYR A 438 -2.765 -0.956 -8.704 1.00 0.00 C ATOM 275 CG TYR A 438 -3.276 -0.423 -10.044 1.00 0.00 C ATOM 276 CD1 TYR A 438 -2.384 0.061 -10.980 1.00 0.00 C ATOM 277 CD2 TYR A 438 -4.629 -0.426 -10.318 1.00 0.00 C ATOM 278 CE1 TYR A 438 -2.865 0.563 -12.241 1.00 0.00 C ATOM 279 CE2 TYR A 438 -5.109 0.076 -11.579 1.00 0.00 C ATOM 280 CZ TYR A 438 -4.204 0.545 -12.478 1.00 0.00 C ATOM 281 OH TYR A 438 -4.658 1.019 -13.669 1.00 0.00 O ATOM 0 H TYR A 438 -0.815 0.638 -8.960 1.00 0.00 H new ATOM 0 HA TYR A 438 -3.289 0.646 -7.302 1.00 0.00 H new ATOM 0 HB2 TYR A 438 -1.884 -1.573 -8.882 1.00 0.00 H new ATOM 0 HB3 TYR A 438 -3.525 -1.604 -8.269 1.00 0.00 H new ATOM 0 HD1 TYR A 438 -1.325 0.063 -10.766 1.00 0.00 H new ATOM 0 HD2 TYR A 438 -5.327 -0.805 -9.586 1.00 0.00 H new ATOM 0 HE1 TYR A 438 -2.178 0.945 -12.982 1.00 0.00 H new ATOM 0 HE2 TYR A 438 -6.165 0.080 -11.806 1.00 0.00 H new ATOM 0 HH TYR A 438 -5.635 0.943 -13.700 1.00 0.00 H new ATOM 291 N ILE A 439 -2.429 -0.768 -5.461 1.00 0.00 N ATOM 292 CA ILE A 439 -1.863 -1.371 -4.266 1.00 0.00 C ATOM 293 C ILE A 439 -2.711 -2.577 -3.858 1.00 0.00 C ATOM 294 O ILE A 439 -3.898 -2.435 -3.567 1.00 0.00 O ATOM 295 CB ILE A 439 -1.708 -0.325 -3.160 1.00 0.00 C ATOM 296 CG1 ILE A 439 -0.875 -0.874 -2.000 1.00 0.00 C ATOM 297 CG2 ILE A 439 -3.072 0.187 -2.695 1.00 0.00 C ATOM 298 CD1 ILE A 439 0.594 -0.471 -2.140 1.00 0.00 C ATOM 0 H ILE A 439 -3.430 -0.581 -5.411 1.00 0.00 H new ATOM 0 HA ILE A 439 -0.857 -1.741 -4.466 1.00 0.00 H new ATOM 0 HB ILE A 439 -1.167 0.528 -3.569 1.00 0.00 H new ATOM 0 HG12 ILE A 439 -1.270 -0.500 -1.055 1.00 0.00 H new ATOM 0 HG13 ILE A 439 -0.956 -1.961 -1.972 1.00 0.00 H new ATOM 0 HG21 ILE A 439 -2.933 0.929 -1.909 1.00 0.00 H new ATOM 0 HG22 ILE A 439 -3.596 0.642 -3.536 1.00 0.00 H new ATOM 0 HG23 ILE A 439 -3.661 -0.645 -2.309 1.00 0.00 H new ATOM 0 HD11 ILE A 439 1.163 -0.874 -1.303 1.00 0.00 H new ATOM 0 HD12 ILE A 439 0.993 -0.867 -3.074 1.00 0.00 H new ATOM 0 HD13 ILE A 439 0.674 0.616 -2.143 1.00 0.00 H new ATOM 310 N HIS A 440 -2.070 -3.736 -3.849 1.00 0.00 N ATOM 311 CA HIS A 440 -2.751 -4.966 -3.482 1.00 0.00 C ATOM 312 C HIS A 440 -2.582 -5.217 -1.982 1.00 0.00 C ATOM 313 O HIS A 440 -1.465 -5.408 -1.503 1.00 0.00 O ATOM 314 CB HIS A 440 -2.260 -6.135 -4.338 1.00 0.00 C ATOM 315 CG HIS A 440 -3.339 -7.128 -4.698 1.00 0.00 C ATOM 316 ND1 HIS A 440 -3.214 -8.025 -5.744 1.00 0.00 N ATOM 317 CD2 HIS A 440 -4.563 -7.356 -4.139 1.00 0.00 C ATOM 318 CE1 HIS A 440 -4.319 -8.755 -5.804 1.00 0.00 C ATOM 319 NE2 HIS A 440 -5.154 -8.338 -4.809 1.00 0.00 N ATOM 0 H HIS A 440 -1.085 -3.850 -4.090 1.00 0.00 H new ATOM 0 HA HIS A 440 -3.818 -4.869 -3.681 1.00 0.00 H new ATOM 0 HB2 HIS A 440 -1.822 -5.741 -5.255 1.00 0.00 H new ATOM 0 HB3 HIS A 440 -1.466 -6.655 -3.803 1.00 0.00 H new ATOM 0 HD2 HIS A 440 -4.980 -6.827 -3.295 1.00 0.00 H new ATOM 0 HE1 HIS A 440 -4.522 -9.542 -6.516 1.00 0.00 H new ATOM 0 HE2 HIS A 440 -6.080 -8.718 -4.612 1.00 0.00 H new ATOM 327 N TYR A 441 -3.707 -5.210 -1.283 1.00 0.00 N ATOM 328 CA TYR A 441 -3.698 -5.435 0.152 1.00 0.00 C ATOM 329 C TYR A 441 -4.569 -6.636 0.525 1.00 0.00 C ATOM 330 O TYR A 441 -5.652 -6.818 -0.029 1.00 0.00 O ATOM 331 CB TYR A 441 -4.294 -4.174 0.780 1.00 0.00 C ATOM 332 CG TYR A 441 -5.736 -3.889 0.355 1.00 0.00 C ATOM 333 CD1 TYR A 441 -6.764 -4.679 0.828 1.00 0.00 C ATOM 334 CD2 TYR A 441 -6.009 -2.841 -0.501 1.00 0.00 C ATOM 335 CE1 TYR A 441 -8.121 -4.411 0.428 1.00 0.00 C ATOM 336 CE2 TYR A 441 -7.366 -2.573 -0.901 1.00 0.00 C ATOM 337 CZ TYR A 441 -8.355 -3.371 -0.417 1.00 0.00 C ATOM 338 OH TYR A 441 -9.637 -3.118 -0.795 1.00 0.00 O ATOM 0 H TYR A 441 -4.631 -5.052 -1.684 1.00 0.00 H new ATOM 0 HA TYR A 441 -2.686 -5.639 0.502 1.00 0.00 H new ATOM 0 HB2 TYR A 441 -4.258 -4.269 1.865 1.00 0.00 H new ATOM 0 HB3 TYR A 441 -3.672 -3.319 0.514 1.00 0.00 H new ATOM 0 HD1 TYR A 441 -6.551 -5.498 1.498 1.00 0.00 H new ATOM 0 HD2 TYR A 441 -5.205 -2.222 -0.871 1.00 0.00 H new ATOM 0 HE1 TYR A 441 -8.935 -5.022 0.791 1.00 0.00 H new ATOM 0 HE2 TYR A 441 -7.593 -1.757 -1.570 1.00 0.00 H new ATOM 0 HH TYR A 441 -9.654 -2.346 -1.399 1.00 0.00 H new ATOM 348 N ARG A 442 -4.064 -7.426 1.461 1.00 0.00 N ATOM 349 CA ARG A 442 -4.782 -8.605 1.913 1.00 0.00 C ATOM 350 C ARG A 442 -4.684 -8.735 3.435 1.00 0.00 C ATOM 351 O ARG A 442 -3.586 -8.781 3.988 1.00 0.00 O ATOM 352 CB ARG A 442 -4.224 -9.873 1.263 1.00 0.00 C ATOM 353 CG ARG A 442 -4.504 -11.102 2.130 1.00 0.00 C ATOM 354 CD ARG A 442 -3.507 -11.196 3.287 1.00 0.00 C ATOM 355 NE ARG A 442 -3.003 -12.582 3.409 1.00 0.00 N ATOM 356 CZ ARG A 442 -3.794 -13.665 3.561 1.00 0.00 C ATOM 357 NH1 ARG A 442 -5.137 -13.531 3.610 1.00 0.00 N ATOM 358 NH2 ARG A 442 -3.236 -14.857 3.660 1.00 0.00 N ATOM 0 H ARG A 442 -3.166 -7.272 1.919 1.00 0.00 H new ATOM 0 HA ARG A 442 -5.826 -8.490 1.621 1.00 0.00 H new ATOM 0 HB2 ARG A 442 -4.672 -10.008 0.278 1.00 0.00 H new ATOM 0 HB3 ARG A 442 -3.150 -9.766 1.113 1.00 0.00 H new ATOM 0 HG2 ARG A 442 -5.519 -11.050 2.523 1.00 0.00 H new ATOM 0 HG3 ARG A 442 -4.444 -12.003 1.520 1.00 0.00 H new ATOM 0 HD2 ARG A 442 -2.676 -10.511 3.118 1.00 0.00 H new ATOM 0 HD3 ARG A 442 -3.987 -10.891 4.217 1.00 0.00 H new ATOM 0 HE ARG A 442 -1.994 -12.728 3.376 1.00 0.00 H new ATOM 0 HH11 ARG A 442 -5.560 -12.606 3.532 1.00 0.00 H new ATOM 0 HH12 ARG A 442 -5.728 -14.354 3.725 1.00 0.00 H new ATOM 0 HH21 ARG A 442 -2.221 -14.950 3.621 1.00 0.00 H new ATOM 0 HH22 ARG A 442 -3.820 -15.685 3.775 1.00 0.00 H new ATOM 371 N PRO A 443 -5.877 -8.792 4.085 1.00 0.00 N ATOM 372 CA PRO A 443 -5.936 -8.916 5.531 1.00 0.00 C ATOM 373 C PRO A 443 -5.587 -10.338 5.975 1.00 0.00 C ATOM 374 O PRO A 443 -6.093 -11.309 5.414 1.00 0.00 O ATOM 375 CB PRO A 443 -7.352 -8.509 5.904 1.00 0.00 C ATOM 376 CG PRO A 443 -8.167 -8.620 4.625 1.00 0.00 C ATOM 377 CD PRO A 443 -7.196 -8.741 3.462 1.00 0.00 C ATOM 0 HA PRO A 443 -5.207 -8.283 6.037 1.00 0.00 H new ATOM 0 HB2 PRO A 443 -7.754 -9.159 6.681 1.00 0.00 H new ATOM 0 HB3 PRO A 443 -7.376 -7.492 6.296 1.00 0.00 H new ATOM 0 HG2 PRO A 443 -8.824 -9.489 4.665 1.00 0.00 H new ATOM 0 HG3 PRO A 443 -8.804 -7.744 4.501 1.00 0.00 H new ATOM 0 HD2 PRO A 443 -7.391 -9.638 2.874 1.00 0.00 H new ATOM 0 HD3 PRO A 443 -7.282 -7.891 2.785 1.00 0.00 H new ATOM 385 N ALA A 444 -4.724 -10.416 6.977 1.00 0.00 N ATOM 386 CA ALA A 444 -4.301 -11.703 7.502 1.00 0.00 C ATOM 387 C ALA A 444 -5.533 -12.511 7.914 1.00 0.00 C ATOM 388 O ALA A 444 -6.092 -12.292 8.988 1.00 0.00 O ATOM 389 CB ALA A 444 -3.330 -11.487 8.665 1.00 0.00 C ATOM 0 H ALA A 444 -4.306 -9.609 7.439 1.00 0.00 H new ATOM 0 HA ALA A 444 -3.773 -12.273 6.738 1.00 0.00 H new ATOM 0 HB1 ALA A 444 -3.013 -12.453 9.058 1.00 0.00 H new ATOM 0 HB2 ALA A 444 -2.459 -10.935 8.314 1.00 0.00 H new ATOM 0 HB3 ALA A 444 -3.826 -10.920 9.452 1.00 0.00 H new ATOM 395 N GLY A 445 -5.920 -13.428 7.040 1.00 0.00 N ATOM 396 CA GLY A 445 -7.076 -14.269 7.299 1.00 0.00 C ATOM 397 C GLY A 445 -8.224 -13.933 6.345 1.00 0.00 C ATOM 398 O GLY A 445 -9.302 -14.517 6.436 1.00 0.00 O ATOM 0 H GLY A 445 -5.453 -13.607 6.151 1.00 0.00 H new ATOM 0 HA2 GLY A 445 -6.800 -15.317 7.186 1.00 0.00 H new ATOM 0 HA3 GLY A 445 -7.404 -14.135 8.330 1.00 0.00 H new ATOM 402 N GLY A 446 -7.952 -12.993 5.452 1.00 0.00 N ATOM 403 CA GLY A 446 -8.949 -12.572 4.482 1.00 0.00 C ATOM 404 C GLY A 446 -8.510 -12.919 3.058 1.00 0.00 C ATOM 405 O GLY A 446 -7.683 -13.807 2.859 1.00 0.00 O ATOM 0 H GLY A 446 -7.056 -12.511 5.380 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -9.901 -13.055 4.701 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -9.111 -11.497 4.565 1.00 0.00 H new ATOM 409 N SER A 447 -9.084 -12.200 2.105 1.00 0.00 N ATOM 410 CA SER A 447 -8.762 -12.421 0.705 1.00 0.00 C ATOM 411 C SER A 447 -7.983 -11.227 0.152 1.00 0.00 C ATOM 412 O SER A 447 -7.898 -10.183 0.798 1.00 0.00 O ATOM 413 CB SER A 447 -10.029 -12.657 -0.121 1.00 0.00 C ATOM 414 OG SER A 447 -10.942 -13.529 0.539 1.00 0.00 O ATOM 0 H SER A 447 -9.770 -11.464 2.274 1.00 0.00 H new ATOM 0 HA SER A 447 -8.142 -13.315 0.634 1.00 0.00 H new ATOM 0 HB2 SER A 447 -10.517 -11.702 -0.317 1.00 0.00 H new ATOM 0 HB3 SER A 447 -9.758 -13.081 -1.088 1.00 0.00 H new ATOM 0 HG SER A 447 -11.738 -13.653 -0.019 1.00 0.00 H new ATOM 420 N TRP A 448 -7.432 -11.420 -1.038 1.00 0.00 N ATOM 421 CA TRP A 448 -6.662 -10.371 -1.684 1.00 0.00 C ATOM 422 C TRP A 448 -7.621 -9.534 -2.533 1.00 0.00 C ATOM 423 O TRP A 448 -8.663 -10.025 -2.964 1.00 0.00 O ATOM 424 CB TRP A 448 -5.506 -10.961 -2.495 1.00 0.00 C ATOM 425 CG TRP A 448 -4.276 -11.318 -1.658 1.00 0.00 C ATOM 426 CD1 TRP A 448 -4.036 -12.452 -0.986 1.00 0.00 C ATOM 427 CD2 TRP A 448 -3.121 -10.484 -1.429 1.00 0.00 C ATOM 428 NE1 TRP A 448 -2.816 -12.411 -0.344 1.00 0.00 N ATOM 429 CE2 TRP A 448 -2.241 -11.176 -0.621 1.00 0.00 C ATOM 430 CE3 TRP A 448 -2.828 -9.188 -1.888 1.00 0.00 C ATOM 431 CZ2 TRP A 448 -1.011 -10.654 -0.203 1.00 0.00 C ATOM 432 CZ3 TRP A 448 -1.595 -8.680 -1.462 1.00 0.00 C ATOM 433 CH2 TRP A 448 -0.699 -9.364 -0.649 1.00 0.00 C ATOM 0 H TRP A 448 -7.504 -12.287 -1.571 1.00 0.00 H new ATOM 0 HA TRP A 448 -6.197 -9.722 -0.942 1.00 0.00 H new ATOM 0 HB2 TRP A 448 -5.856 -11.857 -3.008 1.00 0.00 H new ATOM 0 HB3 TRP A 448 -5.214 -10.246 -3.265 1.00 0.00 H new ATOM 0 HD1 TRP A 448 -4.713 -13.293 -0.951 1.00 0.00 H new ATOM 0 HE1 TRP A 448 -2.410 -13.151 0.229 1.00 0.00 H new ATOM 0 HE3 TRP A 448 -3.501 -8.628 -2.520 1.00 0.00 H new ATOM 0 HZ2 TRP A 448 -0.339 -11.216 0.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 448 -1.321 -7.687 -1.788 1.00 0.00 H new ATOM 0 HH2 TRP A 448 0.234 -8.902 -0.362 1.00 0.00 H new ATOM 444 N THR A 449 -7.236 -8.285 -2.746 1.00 0.00 N ATOM 445 CA THR A 449 -8.049 -7.375 -3.535 1.00 0.00 C ATOM 446 C THR A 449 -8.067 -7.810 -5.001 1.00 0.00 C ATOM 447 O THR A 449 -7.492 -8.839 -5.354 1.00 0.00 O ATOM 448 CB THR A 449 -7.509 -5.958 -3.328 1.00 0.00 C ATOM 449 OG1 THR A 449 -6.993 -5.974 -2.000 1.00 0.00 O ATOM 450 CG2 THR A 449 -8.621 -4.909 -3.283 1.00 0.00 C ATOM 0 H THR A 449 -6.371 -7.881 -2.386 1.00 0.00 H new ATOM 0 HA THR A 449 -9.090 -7.393 -3.211 1.00 0.00 H new ATOM 0 HB THR A 449 -6.812 -5.714 -4.130 1.00 0.00 H new ATOM 0 HG1 THR A 449 -7.465 -5.308 -1.457 1.00 0.00 H new ATOM 0 HG21 THR A 449 -8.184 -3.922 -3.134 1.00 0.00 H new ATOM 0 HG22 THR A 449 -9.173 -4.924 -4.223 1.00 0.00 H new ATOM 0 HG23 THR A 449 -9.299 -5.133 -2.460 1.00 0.00 H new ATOM 458 N ALA A 450 -8.733 -7.005 -5.816 1.00 0.00 N ATOM 459 CA ALA A 450 -8.833 -7.295 -7.236 1.00 0.00 C ATOM 460 C ALA A 450 -7.626 -6.697 -7.961 1.00 0.00 C ATOM 461 O ALA A 450 -7.555 -5.486 -8.161 1.00 0.00 O ATOM 462 CB ALA A 450 -10.161 -6.757 -7.774 1.00 0.00 C ATOM 0 H ALA A 450 -9.208 -6.152 -5.520 1.00 0.00 H new ATOM 0 HA ALA A 450 -8.822 -8.371 -7.410 1.00 0.00 H new ATOM 0 HB1 ALA A 450 -10.237 -6.974 -8.839 1.00 0.00 H new ATOM 0 HB2 ALA A 450 -10.987 -7.234 -7.247 1.00 0.00 H new ATOM 0 HB3 ALA A 450 -10.206 -5.679 -7.619 1.00 0.00 H new ATOM 468 N ALA A 451 -6.706 -7.575 -8.335 1.00 0.00 N ATOM 469 CA ALA A 451 -5.505 -7.149 -9.033 1.00 0.00 C ATOM 470 C ALA A 451 -5.899 -6.392 -10.303 1.00 0.00 C ATOM 471 O ALA A 451 -6.829 -6.790 -11.003 1.00 0.00 O ATOM 472 CB ALA A 451 -4.627 -8.367 -9.328 1.00 0.00 C ATOM 0 H ALA A 451 -6.769 -8.579 -8.168 1.00 0.00 H new ATOM 0 HA ALA A 451 -4.921 -6.469 -8.413 1.00 0.00 H new ATOM 0 HB1 ALA A 451 -3.726 -8.048 -9.852 1.00 0.00 H new ATOM 0 HB2 ALA A 451 -4.350 -8.851 -8.392 1.00 0.00 H new ATOM 0 HB3 ALA A 451 -5.179 -9.071 -9.951 1.00 0.00 H new ATOM 478 N PRO A 452 -5.153 -5.287 -10.569 1.00 0.00 N ATOM 479 CA PRO A 452 -4.069 -4.886 -9.688 1.00 0.00 C ATOM 480 C PRO A 452 -4.611 -4.254 -8.404 1.00 0.00 C ATOM 481 O PRO A 452 -5.321 -3.250 -8.454 1.00 0.00 O ATOM 482 CB PRO A 452 -3.226 -3.927 -10.512 1.00 0.00 C ATOM 483 CG PRO A 452 -4.116 -3.467 -11.655 1.00 0.00 C ATOM 484 CD PRO A 452 -5.320 -4.393 -11.711 1.00 0.00 C ATOM 0 HA PRO A 452 -3.470 -5.730 -9.348 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -2.895 -3.081 -9.910 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.330 -4.420 -10.889 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -4.434 -2.436 -11.500 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -3.570 -3.493 -12.598 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -6.253 -3.834 -11.643 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -5.349 -4.949 -12.648 1.00 0.00 H new ATOM 492 N GLY A 453 -4.257 -4.867 -7.285 1.00 0.00 N ATOM 493 CA GLY A 453 -4.699 -4.377 -5.990 1.00 0.00 C ATOM 494 C GLY A 453 -5.832 -3.361 -6.147 1.00 0.00 C ATOM 495 O GLY A 453 -6.830 -3.635 -6.812 1.00 0.00 O ATOM 0 H GLY A 453 -3.669 -5.699 -7.248 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -5.037 -5.212 -5.377 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -3.862 -3.916 -5.466 1.00 0.00 H new ATOM 499 N VAL A 454 -5.640 -2.208 -5.523 1.00 0.00 N ATOM 500 CA VAL A 454 -6.633 -1.149 -5.584 1.00 0.00 C ATOM 501 C VAL A 454 -5.938 0.180 -5.887 1.00 0.00 C ATOM 502 O VAL A 454 -4.846 0.442 -5.385 1.00 0.00 O ATOM 503 CB VAL A 454 -7.445 -1.117 -4.288 1.00 0.00 C ATOM 504 CG1 VAL A 454 -6.923 -0.034 -3.341 1.00 0.00 C ATOM 505 CG2 VAL A 454 -8.934 -0.921 -4.578 1.00 0.00 C ATOM 0 H VAL A 454 -4.811 -1.984 -4.972 1.00 0.00 H new ATOM 0 HA VAL A 454 -7.341 -1.337 -6.391 1.00 0.00 H new ATOM 0 HB VAL A 454 -7.325 -2.081 -3.794 1.00 0.00 H new ATOM 0 HG11 VAL A 454 -7.517 -0.032 -2.427 1.00 0.00 H new ATOM 0 HG12 VAL A 454 -5.881 -0.237 -3.095 1.00 0.00 H new ATOM 0 HG13 VAL A 454 -6.999 0.940 -3.825 1.00 0.00 H new ATOM 0 HG21 VAL A 454 -9.488 -0.902 -3.640 1.00 0.00 H new ATOM 0 HG22 VAL A 454 -9.081 0.022 -5.105 1.00 0.00 H new ATOM 0 HG23 VAL A 454 -9.296 -1.743 -5.196 1.00 0.00 H new ATOM 515 N LYS A 455 -6.599 0.984 -6.707 1.00 0.00 N ATOM 516 CA LYS A 455 -6.058 2.279 -7.083 1.00 0.00 C ATOM 517 C LYS A 455 -5.871 3.133 -5.828 1.00 0.00 C ATOM 518 O LYS A 455 -6.844 3.482 -5.160 1.00 0.00 O ATOM 519 CB LYS A 455 -6.935 2.937 -8.150 1.00 0.00 C ATOM 520 CG LYS A 455 -6.174 4.047 -8.878 1.00 0.00 C ATOM 521 CD LYS A 455 -7.140 5.018 -9.560 1.00 0.00 C ATOM 522 CE LYS A 455 -7.593 4.477 -10.917 1.00 0.00 C ATOM 523 NZ LYS A 455 -8.888 5.077 -11.308 1.00 0.00 N ATOM 0 H LYS A 455 -7.504 0.763 -7.122 1.00 0.00 H new ATOM 0 HA LYS A 455 -5.075 2.163 -7.539 1.00 0.00 H new ATOM 0 HB2 LYS A 455 -7.265 2.186 -8.868 1.00 0.00 H new ATOM 0 HB3 LYS A 455 -7.831 3.350 -7.686 1.00 0.00 H new ATOM 0 HG2 LYS A 455 -5.548 4.589 -8.169 1.00 0.00 H new ATOM 0 HG3 LYS A 455 -5.508 3.609 -9.621 1.00 0.00 H new ATOM 0 HD2 LYS A 455 -8.008 5.182 -8.921 1.00 0.00 H new ATOM 0 HD3 LYS A 455 -6.655 5.985 -9.693 1.00 0.00 H new ATOM 0 HE2 LYS A 455 -6.840 4.698 -11.673 1.00 0.00 H new ATOM 0 HE3 LYS A 455 -7.688 3.392 -10.869 1.00 0.00 H new ATOM 0 HZ1 LYS A 455 -9.181 4.699 -12.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 455 -9.608 4.844 -10.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 455 -8.786 6.110 -11.373 1.00 0.00 H new ATOM 536 N MET A 456 -4.615 3.444 -5.544 1.00 0.00 N ATOM 537 CA MET A 456 -4.289 4.251 -4.380 1.00 0.00 C ATOM 538 C MET A 456 -4.824 5.676 -4.533 1.00 0.00 C ATOM 539 O MET A 456 -4.476 6.375 -5.483 1.00 0.00 O ATOM 540 CB MET A 456 -2.771 4.292 -4.196 1.00 0.00 C ATOM 541 CG MET A 456 -2.278 3.066 -3.424 1.00 0.00 C ATOM 542 SD MET A 456 -0.499 3.101 -3.294 1.00 0.00 S ATOM 543 CE MET A 456 -0.313 2.899 -1.530 1.00 0.00 C ATOM 0 H MET A 456 -3.811 3.152 -6.099 1.00 0.00 H new ATOM 0 HA MET A 456 -4.758 3.799 -3.506 1.00 0.00 H new ATOM 0 HB2 MET A 456 -2.284 4.332 -5.170 1.00 0.00 H new ATOM 0 HB3 MET A 456 -2.490 5.200 -3.662 1.00 0.00 H new ATOM 0 HG2 MET A 456 -2.723 3.049 -2.429 1.00 0.00 H new ATOM 0 HG3 MET A 456 -2.596 2.155 -3.931 1.00 0.00 H new ATOM 0 HE1 MET A 456 0.676 2.497 -1.312 1.00 0.00 H new ATOM 0 HE2 MET A 456 -0.428 3.865 -1.039 1.00 0.00 H new ATOM 0 HE3 MET A 456 -1.074 2.211 -1.160 1.00 0.00 H new ATOM 553 N GLN A 457 -5.661 6.065 -3.583 1.00 0.00 N ATOM 554 CA GLN A 457 -6.248 7.394 -3.600 1.00 0.00 C ATOM 555 C GLN A 457 -5.152 8.457 -3.705 1.00 0.00 C ATOM 556 O GLN A 457 -3.965 8.134 -3.681 1.00 0.00 O ATOM 557 CB GLN A 457 -7.119 7.625 -2.364 1.00 0.00 C ATOM 558 CG GLN A 457 -8.067 6.446 -2.133 1.00 0.00 C ATOM 559 CD GLN A 457 -8.655 5.948 -3.455 1.00 0.00 C ATOM 560 OE1 GLN A 457 -9.241 6.693 -4.223 1.00 0.00 O ATOM 561 NE2 GLN A 457 -8.466 4.650 -3.676 1.00 0.00 N ATOM 0 H GLN A 457 -5.947 5.483 -2.796 1.00 0.00 H new ATOM 0 HA GLN A 457 -6.891 7.475 -4.477 1.00 0.00 H new ATOM 0 HB2 GLN A 457 -6.485 7.763 -1.488 1.00 0.00 H new ATOM 0 HB3 GLN A 457 -7.696 8.541 -2.487 1.00 0.00 H new ATOM 0 HG2 GLN A 457 -7.531 5.635 -1.641 1.00 0.00 H new ATOM 0 HG3 GLN A 457 -8.872 6.748 -1.464 1.00 0.00 H new ATOM 0 HE21 GLN A 457 -7.966 4.083 -2.991 1.00 0.00 H new ATOM 0 HE22 GLN A 457 -8.821 4.221 -4.531 1.00 0.00 H new ATOM 570 N ASP A 458 -5.589 9.703 -3.817 1.00 0.00 N ATOM 571 CA ASP A 458 -4.660 10.814 -3.926 1.00 0.00 C ATOM 572 C ASP A 458 -4.444 11.430 -2.542 1.00 0.00 C ATOM 573 O ASP A 458 -5.404 11.696 -1.821 1.00 0.00 O ATOM 574 CB ASP A 458 -5.210 11.904 -4.848 1.00 0.00 C ATOM 575 CG ASP A 458 -6.478 11.523 -5.615 1.00 0.00 C ATOM 576 OD1 ASP A 458 -7.602 11.731 -5.135 1.00 0.00 O ATOM 577 OD2 ASP A 458 -6.275 10.982 -6.769 1.00 0.00 O ATOM 0 H ASP A 458 -6.574 9.967 -3.835 1.00 0.00 H new ATOM 0 HA ASP A 458 -3.725 10.433 -4.337 1.00 0.00 H new ATOM 0 HB2 ASP A 458 -5.417 12.793 -4.252 1.00 0.00 H new ATOM 0 HB3 ASP A 458 -4.437 12.175 -5.566 1.00 0.00 H new ATOM 583 N ALA A 459 -3.178 11.639 -2.213 1.00 0.00 N ATOM 584 CA ALA A 459 -2.824 12.219 -0.928 1.00 0.00 C ATOM 585 C ALA A 459 -2.402 13.675 -1.130 1.00 0.00 C ATOM 586 O ALA A 459 -1.318 13.946 -1.643 1.00 0.00 O ATOM 587 CB ALA A 459 -1.725 11.378 -0.274 1.00 0.00 C ATOM 0 H ALA A 459 -2.384 11.417 -2.814 1.00 0.00 H new ATOM 0 HA ALA A 459 -3.682 12.215 -0.255 1.00 0.00 H new ATOM 0 HB1 ALA A 459 -1.459 11.813 0.690 1.00 0.00 H new ATOM 0 HB2 ALA A 459 -2.085 10.360 -0.126 1.00 0.00 H new ATOM 0 HB3 ALA A 459 -0.847 11.362 -0.919 1.00 0.00 H new ATOM 593 N GLU A 460 -3.281 14.576 -0.714 1.00 0.00 N ATOM 594 CA GLU A 460 -3.014 15.998 -0.843 1.00 0.00 C ATOM 595 C GLU A 460 -1.697 16.355 -0.150 1.00 0.00 C ATOM 596 O GLU A 460 -1.133 17.421 -0.393 1.00 0.00 O ATOM 597 CB GLU A 460 -4.171 16.826 -0.281 1.00 0.00 C ATOM 598 CG GLU A 460 -4.204 16.757 1.247 1.00 0.00 C ATOM 599 CD GLU A 460 -5.433 17.481 1.802 1.00 0.00 C ATOM 600 OE1 GLU A 460 -5.664 18.653 1.471 1.00 0.00 O ATOM 601 OE2 GLU A 460 -6.162 16.781 2.604 1.00 0.00 O ATOM 0 H GLU A 460 -4.179 14.348 -0.287 1.00 0.00 H new ATOM 0 HA GLU A 460 -2.921 16.236 -1.903 1.00 0.00 H new ATOM 0 HB2 GLU A 460 -4.069 17.863 -0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 460 -5.115 16.460 -0.685 1.00 0.00 H new ATOM 0 HG2 GLU A 460 -4.216 15.715 1.567 1.00 0.00 H new ATOM 0 HG3 GLU A 460 -3.298 17.206 1.655 1.00 0.00 H new ATOM 609 N ILE A 461 -1.246 15.443 0.699 1.00 0.00 N ATOM 610 CA ILE A 461 -0.006 15.649 1.428 1.00 0.00 C ATOM 611 C ILE A 461 0.959 16.465 0.566 1.00 0.00 C ATOM 612 O ILE A 461 1.582 17.410 1.050 1.00 0.00 O ATOM 613 CB ILE A 461 0.569 14.310 1.896 1.00 0.00 C ATOM 614 CG1 ILE A 461 -0.097 13.851 3.195 1.00 0.00 C ATOM 615 CG2 ILE A 461 2.091 14.383 2.026 1.00 0.00 C ATOM 616 CD1 ILE A 461 -0.683 12.446 3.044 1.00 0.00 C ATOM 0 H ILE A 461 -1.717 14.560 0.898 1.00 0.00 H new ATOM 0 HA ILE A 461 -0.189 16.226 2.335 1.00 0.00 H new ATOM 0 HB ILE A 461 0.347 13.559 1.138 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.633 13.859 4.005 1.00 0.00 H new ATOM 0 HG13 ILE A 461 -0.886 14.551 3.470 1.00 0.00 H new ATOM 0 HG21 ILE A 461 2.474 13.419 2.360 1.00 0.00 H new ATOM 0 HG22 ILE A 461 2.527 14.632 1.059 1.00 0.00 H new ATOM 0 HG23 ILE A 461 2.358 15.151 2.752 1.00 0.00 H new ATOM 0 HD11 ILE A 461 -1.150 12.144 3.981 1.00 0.00 H new ATOM 0 HD12 ILE A 461 -1.430 12.447 2.250 1.00 0.00 H new ATOM 0 HD13 ILE A 461 0.113 11.745 2.793 1.00 0.00 H new ATOM 628 N SER A 462 1.052 16.072 -0.695 1.00 0.00 N ATOM 629 CA SER A 462 1.931 16.755 -1.629 1.00 0.00 C ATOM 630 C SER A 462 2.289 15.823 -2.789 1.00 0.00 C ATOM 631 O SER A 462 3.465 15.581 -3.055 1.00 0.00 O ATOM 632 CB SER A 462 3.201 17.246 -0.932 1.00 0.00 C ATOM 633 OG SER A 462 3.074 18.590 -0.475 1.00 0.00 O ATOM 0 H SER A 462 0.533 15.289 -1.092 1.00 0.00 H new ATOM 0 HA SER A 462 1.404 17.625 -2.020 1.00 0.00 H new ATOM 0 HB2 SER A 462 3.425 16.595 -0.087 1.00 0.00 H new ATOM 0 HB3 SER A 462 4.043 17.175 -1.621 1.00 0.00 H new ATOM 0 HG SER A 462 2.391 18.634 0.226 1.00 0.00 H new ATOM 639 N GLY A 463 1.253 15.325 -3.447 1.00 0.00 N ATOM 640 CA GLY A 463 1.443 14.425 -4.571 1.00 0.00 C ATOM 641 C GLY A 463 1.768 13.009 -4.091 1.00 0.00 C ATOM 642 O GLY A 463 2.757 12.416 -4.519 1.00 0.00 O ATOM 0 H GLY A 463 0.279 15.528 -3.223 1.00 0.00 H new ATOM 0 HA2 GLY A 463 0.542 14.407 -5.184 1.00 0.00 H new ATOM 0 HA3 GLY A 463 2.251 14.793 -5.203 1.00 0.00 H new ATOM 646 N TYR A 464 0.917 12.508 -3.208 1.00 0.00 N ATOM 647 CA TYR A 464 1.101 11.173 -2.665 1.00 0.00 C ATOM 648 C TYR A 464 -0.126 10.299 -2.929 1.00 0.00 C ATOM 649 O TYR A 464 -1.043 10.708 -3.641 1.00 0.00 O ATOM 650 CB TYR A 464 1.269 11.352 -1.155 1.00 0.00 C ATOM 651 CG TYR A 464 2.716 11.240 -0.672 1.00 0.00 C ATOM 652 CD1 TYR A 464 3.634 12.214 -1.009 1.00 0.00 C ATOM 653 CD2 TYR A 464 3.104 10.164 0.101 1.00 0.00 C ATOM 654 CE1 TYR A 464 4.996 12.108 -0.555 1.00 0.00 C ATOM 655 CE2 TYR A 464 4.467 10.059 0.556 1.00 0.00 C ATOM 656 CZ TYR A 464 5.345 11.036 0.205 1.00 0.00 C ATOM 657 OH TYR A 464 6.632 10.936 0.635 1.00 0.00 O ATOM 0 H TYR A 464 0.098 13.003 -2.855 1.00 0.00 H new ATOM 0 HA TYR A 464 1.960 10.686 -3.127 1.00 0.00 H new ATOM 0 HB2 TYR A 464 0.876 12.328 -0.869 1.00 0.00 H new ATOM 0 HB3 TYR A 464 0.666 10.603 -0.641 1.00 0.00 H new ATOM 0 HD1 TYR A 464 3.330 13.056 -1.613 1.00 0.00 H new ATOM 0 HD2 TYR A 464 2.386 9.401 0.365 1.00 0.00 H new ATOM 0 HE1 TYR A 464 5.724 12.863 -0.812 1.00 0.00 H new ATOM 0 HE2 TYR A 464 4.784 9.223 1.162 1.00 0.00 H new ATOM 0 HH TYR A 464 6.736 10.121 1.168 1.00 0.00 H new ATOM 667 N ALA A 465 -0.105 9.111 -2.342 1.00 0.00 N ATOM 668 CA ALA A 465 -1.205 8.176 -2.506 1.00 0.00 C ATOM 669 C ALA A 465 -1.672 7.698 -1.129 1.00 0.00 C ATOM 670 O ALA A 465 -0.858 7.500 -0.229 1.00 0.00 O ATOM 671 CB ALA A 465 -0.762 7.020 -3.405 1.00 0.00 C ATOM 0 H ALA A 465 0.656 8.775 -1.752 1.00 0.00 H new ATOM 0 HA ALA A 465 -2.052 8.661 -2.991 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -1.587 6.318 -3.528 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -0.468 7.409 -4.380 1.00 0.00 H new ATOM 0 HB3 ALA A 465 0.085 6.508 -2.948 1.00 0.00 H new ATOM 677 N LYS A 466 -2.980 7.527 -1.010 1.00 0.00 N ATOM 678 CA LYS A 466 -3.565 7.077 0.241 1.00 0.00 C ATOM 679 C LYS A 466 -4.408 5.826 -0.015 1.00 0.00 C ATOM 680 O LYS A 466 -5.053 5.711 -1.057 1.00 0.00 O ATOM 681 CB LYS A 466 -4.339 8.214 0.911 1.00 0.00 C ATOM 682 CG LYS A 466 -3.650 8.662 2.201 1.00 0.00 C ATOM 683 CD LYS A 466 -4.510 9.675 2.959 1.00 0.00 C ATOM 684 CE LYS A 466 -5.958 9.193 3.068 1.00 0.00 C ATOM 685 NZ LYS A 466 -6.004 7.804 3.579 1.00 0.00 N ATOM 0 H LYS A 466 -3.652 7.692 -1.760 1.00 0.00 H new ATOM 0 HA LYS A 466 -2.783 6.796 0.947 1.00 0.00 H new ATOM 0 HB2 LYS A 466 -4.419 9.058 0.225 1.00 0.00 H new ATOM 0 HB3 LYS A 466 -5.355 7.886 1.132 1.00 0.00 H new ATOM 0 HG2 LYS A 466 -3.458 7.796 2.835 1.00 0.00 H new ATOM 0 HG3 LYS A 466 -2.682 9.105 1.966 1.00 0.00 H new ATOM 0 HD2 LYS A 466 -4.099 9.832 3.956 1.00 0.00 H new ATOM 0 HD3 LYS A 466 -4.481 10.637 2.447 1.00 0.00 H new ATOM 0 HE2 LYS A 466 -6.517 9.850 3.733 1.00 0.00 H new ATOM 0 HE3 LYS A 466 -6.439 9.244 2.091 1.00 0.00 H new ATOM 0 HZ1 LYS A 466 -6.803 7.702 4.237 1.00 0.00 H new ATOM 0 HZ2 LYS A 466 -6.125 7.145 2.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 466 -5.117 7.587 4.076 1.00 0.00 H new ATOM 698 N ILE A 467 -4.377 4.921 0.952 1.00 0.00 N ATOM 699 CA ILE A 467 -5.130 3.683 0.843 1.00 0.00 C ATOM 700 C ILE A 467 -5.462 3.169 2.245 1.00 0.00 C ATOM 701 O ILE A 467 -4.576 3.039 3.089 1.00 0.00 O ATOM 702 CB ILE A 467 -4.375 2.671 -0.020 1.00 0.00 C ATOM 703 CG1 ILE A 467 -5.345 1.733 -0.741 1.00 0.00 C ATOM 704 CG2 ILE A 467 -3.344 1.902 0.810 1.00 0.00 C ATOM 705 CD1 ILE A 467 -5.964 2.416 -1.962 1.00 0.00 C ATOM 0 H ILE A 467 -3.842 5.020 1.815 1.00 0.00 H new ATOM 0 HA ILE A 467 -6.078 3.857 0.334 1.00 0.00 H new ATOM 0 HB ILE A 467 -3.827 3.219 -0.787 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -4.819 0.830 -1.052 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -6.133 1.422 -0.055 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -2.822 1.189 0.172 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -2.625 2.602 1.237 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -3.850 1.367 1.613 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -6.649 1.727 -2.456 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -6.509 3.305 -1.644 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -5.175 2.703 -2.657 1.00 0.00 H new ATOM 717 N THR A 468 -6.741 2.891 2.451 1.00 0.00 N ATOM 718 CA THR A 468 -7.201 2.394 3.736 1.00 0.00 C ATOM 719 C THR A 468 -7.846 1.015 3.576 1.00 0.00 C ATOM 720 O THR A 468 -8.837 0.869 2.863 1.00 0.00 O ATOM 721 CB THR A 468 -8.144 3.439 4.337 1.00 0.00 C ATOM 722 OG1 THR A 468 -7.542 4.685 3.998 1.00 0.00 O ATOM 723 CG2 THR A 468 -8.135 3.425 5.867 1.00 0.00 C ATOM 0 H THR A 468 -7.473 3.001 1.749 1.00 0.00 H new ATOM 0 HA THR A 468 -6.369 2.251 4.425 1.00 0.00 H new ATOM 0 HB THR A 468 -9.158 3.262 3.978 1.00 0.00 H new ATOM 0 HG1 THR A 468 -8.089 5.419 4.348 1.00 0.00 H new ATOM 0 HG21 THR A 468 -8.821 4.185 6.242 1.00 0.00 H new ATOM 0 HG22 THR A 468 -8.450 2.444 6.224 1.00 0.00 H new ATOM 0 HG23 THR A 468 -7.128 3.636 6.227 1.00 0.00 H new ATOM 731 N VAL A 469 -7.255 0.040 4.250 1.00 0.00 N ATOM 732 CA VAL A 469 -7.759 -1.322 4.191 1.00 0.00 C ATOM 733 C VAL A 469 -8.048 -1.817 5.610 1.00 0.00 C ATOM 734 O VAL A 469 -7.193 -1.724 6.489 1.00 0.00 O ATOM 735 CB VAL A 469 -6.770 -2.214 3.437 1.00 0.00 C ATOM 736 CG1 VAL A 469 -7.271 -3.658 3.374 1.00 0.00 C ATOM 737 CG2 VAL A 469 -6.497 -1.666 2.035 1.00 0.00 C ATOM 0 H VAL A 469 -6.432 0.165 4.840 1.00 0.00 H new ATOM 0 HA VAL A 469 -8.697 -1.358 3.637 1.00 0.00 H new ATOM 0 HB VAL A 469 -5.829 -2.211 3.987 1.00 0.00 H new ATOM 0 HG11 VAL A 469 -6.549 -4.270 2.833 1.00 0.00 H new ATOM 0 HG12 VAL A 469 -7.390 -4.046 4.386 1.00 0.00 H new ATOM 0 HG13 VAL A 469 -8.231 -3.688 2.859 1.00 0.00 H new ATOM 0 HG21 VAL A 469 -5.791 -2.318 1.520 1.00 0.00 H new ATOM 0 HG22 VAL A 469 -7.430 -1.625 1.472 1.00 0.00 H new ATOM 0 HG23 VAL A 469 -6.075 -0.664 2.112 1.00 0.00 H new ATOM 747 N ASP A 470 -9.256 -2.331 5.788 1.00 0.00 N ATOM 748 CA ASP A 470 -9.668 -2.840 7.085 1.00 0.00 C ATOM 749 C ASP A 470 -9.217 -4.295 7.224 1.00 0.00 C ATOM 750 O ASP A 470 -9.183 -5.035 6.242 1.00 0.00 O ATOM 751 CB ASP A 470 -11.191 -2.800 7.233 1.00 0.00 C ATOM 752 CG ASP A 470 -11.742 -3.560 8.441 1.00 0.00 C ATOM 753 OD1 ASP A 470 -12.029 -2.967 9.492 1.00 0.00 O ATOM 754 OD2 ASP A 470 -11.877 -4.831 8.271 1.00 0.00 O ATOM 0 H ASP A 470 -9.962 -2.406 5.056 1.00 0.00 H new ATOM 0 HA ASP A 470 -9.214 -2.214 7.853 1.00 0.00 H new ATOM 0 HB2 ASP A 470 -11.507 -1.759 7.302 1.00 0.00 H new ATOM 0 HB3 ASP A 470 -11.640 -3.210 6.329 1.00 0.00 H new ATOM 760 N ILE A 471 -8.882 -4.662 8.453 1.00 0.00 N ATOM 761 CA ILE A 471 -8.434 -6.016 8.733 1.00 0.00 C ATOM 762 C ILE A 471 -9.405 -6.677 9.712 1.00 0.00 C ATOM 763 O ILE A 471 -9.325 -7.881 9.954 1.00 0.00 O ATOM 764 CB ILE A 471 -6.982 -6.010 9.216 1.00 0.00 C ATOM 765 CG1 ILE A 471 -6.843 -5.233 10.527 1.00 0.00 C ATOM 766 CG2 ILE A 471 -6.045 -5.476 8.131 1.00 0.00 C ATOM 767 CD1 ILE A 471 -5.372 -5.066 10.912 1.00 0.00 C ATOM 0 H ILE A 471 -8.912 -4.046 9.265 1.00 0.00 H new ATOM 0 HA ILE A 471 -8.441 -6.616 7.823 1.00 0.00 H new ATOM 0 HB ILE A 471 -6.686 -7.039 9.419 1.00 0.00 H new ATOM 0 HG12 ILE A 471 -7.309 -4.253 10.424 1.00 0.00 H new ATOM 0 HG13 ILE A 471 -7.374 -5.757 11.322 1.00 0.00 H new ATOM 0 HG21 ILE A 471 -5.020 -5.482 8.500 1.00 0.00 H new ATOM 0 HG22 ILE A 471 -6.116 -6.108 7.246 1.00 0.00 H new ATOM 0 HG23 ILE A 471 -6.331 -4.456 7.873 1.00 0.00 H new ATOM 0 HD11 ILE A 471 -5.301 -4.510 11.847 1.00 0.00 H new ATOM 0 HD12 ILE A 471 -4.915 -6.048 11.038 1.00 0.00 H new ATOM 0 HD13 ILE A 471 -4.850 -4.521 10.126 1.00 0.00 H new ATOM 779 N GLY A 472 -10.301 -5.862 10.250 1.00 0.00 N ATOM 780 CA GLY A 472 -11.287 -6.353 11.198 1.00 0.00 C ATOM 781 C GLY A 472 -10.612 -6.882 12.465 1.00 0.00 C ATOM 782 O GLY A 472 -10.415 -6.138 13.424 1.00 0.00 O ATOM 0 H GLY A 472 -10.365 -4.864 10.047 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -11.978 -5.551 11.457 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -11.877 -7.146 10.737 1.00 0.00 H new ATOM 786 N SER A 473 -10.277 -8.163 12.428 1.00 0.00 N ATOM 787 CA SER A 473 -9.629 -8.800 13.562 1.00 0.00 C ATOM 788 C SER A 473 -8.171 -9.114 13.223 1.00 0.00 C ATOM 789 O SER A 473 -7.351 -9.313 14.118 1.00 0.00 O ATOM 790 CB SER A 473 -10.366 -10.078 13.971 1.00 0.00 C ATOM 791 OG SER A 473 -10.935 -9.972 15.273 1.00 0.00 O ATOM 0 H SER A 473 -10.442 -8.777 11.631 1.00 0.00 H new ATOM 0 HA SER A 473 -9.659 -8.110 14.405 1.00 0.00 H new ATOM 0 HB2 SER A 473 -11.153 -10.290 13.247 1.00 0.00 H new ATOM 0 HB3 SER A 473 -9.674 -10.920 13.945 1.00 0.00 H new ATOM 0 HG SER A 473 -11.398 -10.806 15.497 1.00 0.00 H new ATOM 797 N ALA A 474 -7.892 -9.149 11.928 1.00 0.00 N ATOM 798 CA ALA A 474 -6.546 -9.436 11.460 1.00 0.00 C ATOM 799 C ALA A 474 -5.550 -8.553 12.214 1.00 0.00 C ATOM 800 O ALA A 474 -5.640 -7.327 12.164 1.00 0.00 O ATOM 801 CB ALA A 474 -6.478 -9.230 9.945 1.00 0.00 C ATOM 0 H ALA A 474 -8.575 -8.983 11.188 1.00 0.00 H new ATOM 0 HA ALA A 474 -6.283 -10.475 11.660 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -5.469 -9.445 9.593 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -7.184 -9.901 9.455 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -6.733 -8.197 9.706 1.00 0.00 H new ATOM 807 N SER A 475 -4.623 -9.210 12.895 1.00 0.00 N ATOM 808 CA SER A 475 -3.611 -8.500 13.658 1.00 0.00 C ATOM 809 C SER A 475 -2.616 -7.828 12.710 1.00 0.00 C ATOM 810 O SER A 475 -1.831 -6.978 13.129 1.00 0.00 O ATOM 811 CB SER A 475 -2.878 -9.445 14.613 1.00 0.00 C ATOM 812 OG SER A 475 -1.490 -9.136 14.709 1.00 0.00 O ATOM 0 H SER A 475 -4.552 -10.227 12.934 1.00 0.00 H new ATOM 0 HA SER A 475 -4.107 -7.735 14.255 1.00 0.00 H new ATOM 0 HB2 SER A 475 -3.332 -9.385 15.602 1.00 0.00 H new ATOM 0 HB3 SER A 475 -2.998 -10.472 14.269 1.00 0.00 H new ATOM 0 HG SER A 475 -1.058 -9.760 15.329 1.00 0.00 H new ATOM 818 N GLN A 476 -2.681 -8.233 11.450 1.00 0.00 N ATOM 819 CA GLN A 476 -1.795 -7.681 10.440 1.00 0.00 C ATOM 820 C GLN A 476 -2.430 -7.804 9.053 1.00 0.00 C ATOM 821 O GLN A 476 -3.371 -8.574 8.863 1.00 0.00 O ATOM 822 CB GLN A 476 -0.426 -8.363 10.478 1.00 0.00 C ATOM 823 CG GLN A 476 0.593 -7.503 11.228 1.00 0.00 C ATOM 824 CD GLN A 476 2.023 -7.951 10.917 1.00 0.00 C ATOM 825 OE1 GLN A 476 2.953 -7.163 10.879 1.00 0.00 O ATOM 826 NE2 GLN A 476 2.145 -9.257 10.697 1.00 0.00 N ATOM 0 H GLN A 476 -3.334 -8.937 11.106 1.00 0.00 H new ATOM 0 HA GLN A 476 -1.643 -6.624 10.657 1.00 0.00 H new ATOM 0 HB2 GLN A 476 -0.513 -9.336 10.962 1.00 0.00 H new ATOM 0 HB3 GLN A 476 -0.077 -8.543 9.461 1.00 0.00 H new ATOM 0 HG2 GLN A 476 0.467 -6.457 10.949 1.00 0.00 H new ATOM 0 HG3 GLN A 476 0.412 -7.571 12.301 1.00 0.00 H new ATOM 0 HE21 GLN A 476 1.324 -9.861 10.744 1.00 0.00 H new ATOM 0 HE22 GLN A 476 3.059 -9.655 10.481 1.00 0.00 H new ATOM 835 N LEU A 477 -1.891 -7.034 8.119 1.00 0.00 N ATOM 836 CA LEU A 477 -2.393 -7.048 6.756 1.00 0.00 C ATOM 837 C LEU A 477 -1.222 -6.885 5.784 1.00 0.00 C ATOM 838 O LEU A 477 -0.266 -6.168 6.074 1.00 0.00 O ATOM 839 CB LEU A 477 -3.490 -5.996 6.579 1.00 0.00 C ATOM 840 CG LEU A 477 -3.482 -5.236 5.251 1.00 0.00 C ATOM 841 CD1 LEU A 477 -4.292 -5.981 4.188 1.00 0.00 C ATOM 842 CD2 LEU A 477 -3.971 -3.798 5.440 1.00 0.00 C ATOM 0 H LEU A 477 -1.111 -6.396 8.280 1.00 0.00 H new ATOM 0 HA LEU A 477 -2.862 -8.006 6.532 1.00 0.00 H new ATOM 0 HB2 LEU A 477 -4.457 -6.486 6.688 1.00 0.00 H new ATOM 0 HB3 LEU A 477 -3.406 -5.272 7.390 1.00 0.00 H new ATOM 0 HG LEU A 477 -2.454 -5.183 4.894 1.00 0.00 H new ATOM 0 HD11 LEU A 477 -4.270 -5.419 3.254 1.00 0.00 H new ATOM 0 HD12 LEU A 477 -3.860 -6.969 4.028 1.00 0.00 H new ATOM 0 HD13 LEU A 477 -5.324 -6.086 4.524 1.00 0.00 H new ATOM 0 HD21 LEU A 477 -3.956 -3.280 4.481 1.00 0.00 H new ATOM 0 HD22 LEU A 477 -4.988 -3.808 5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 477 -3.318 -3.281 6.143 1.00 0.00 H new ATOM 854 N GLU A 478 -1.337 -7.562 4.651 1.00 0.00 N ATOM 855 CA GLU A 478 -0.300 -7.502 3.635 1.00 0.00 C ATOM 856 C GLU A 478 -0.656 -6.459 2.574 1.00 0.00 C ATOM 857 O GLU A 478 -1.832 -6.235 2.289 1.00 0.00 O ATOM 858 CB GLU A 478 -0.074 -8.875 3.000 1.00 0.00 C ATOM 859 CG GLU A 478 0.655 -9.812 3.966 1.00 0.00 C ATOM 860 CD GLU A 478 -0.108 -11.128 4.132 1.00 0.00 C ATOM 861 OE1 GLU A 478 -1.041 -11.205 4.946 1.00 0.00 O ATOM 862 OE2 GLU A 478 0.298 -12.093 3.379 1.00 0.00 O ATOM 0 H GLU A 478 -2.132 -8.155 4.414 1.00 0.00 H new ATOM 0 HA GLU A 478 0.632 -7.202 4.113 1.00 0.00 H new ATOM 0 HB2 GLU A 478 -1.032 -9.311 2.718 1.00 0.00 H new ATOM 0 HB3 GLU A 478 0.508 -8.765 2.085 1.00 0.00 H new ATOM 0 HG2 GLU A 478 1.660 -10.014 3.594 1.00 0.00 H new ATOM 0 HG3 GLU A 478 0.766 -9.327 4.936 1.00 0.00 H new ATOM 870 N ALA A 479 0.380 -5.849 2.018 1.00 0.00 N ATOM 871 CA ALA A 479 0.191 -4.835 0.995 1.00 0.00 C ATOM 872 C ALA A 479 1.198 -5.062 -0.134 1.00 0.00 C ATOM 873 O ALA A 479 2.242 -5.678 0.074 1.00 0.00 O ATOM 874 CB ALA A 479 0.321 -3.446 1.622 1.00 0.00 C ATOM 0 H ALA A 479 1.354 -6.038 2.257 1.00 0.00 H new ATOM 0 HA ALA A 479 -0.808 -4.906 0.565 1.00 0.00 H new ATOM 0 HB1 ALA A 479 0.179 -2.685 0.854 1.00 0.00 H new ATOM 0 HB2 ALA A 479 -0.436 -3.324 2.397 1.00 0.00 H new ATOM 0 HB3 ALA A 479 1.312 -3.337 2.062 1.00 0.00 H new ATOM 880 N ALA A 480 0.850 -4.550 -1.306 1.00 0.00 N ATOM 881 CA ALA A 480 1.711 -4.690 -2.469 1.00 0.00 C ATOM 882 C ALA A 480 1.574 -3.447 -3.351 1.00 0.00 C ATOM 883 O ALA A 480 0.541 -2.780 -3.334 1.00 0.00 O ATOM 884 CB ALA A 480 1.356 -5.977 -3.215 1.00 0.00 C ATOM 0 H ALA A 480 -0.016 -4.038 -1.475 1.00 0.00 H new ATOM 0 HA ALA A 480 2.756 -4.767 -2.167 1.00 0.00 H new ATOM 0 HB1 ALA A 480 2.002 -6.082 -4.087 1.00 0.00 H new ATOM 0 HB2 ALA A 480 1.498 -6.832 -2.554 1.00 0.00 H new ATOM 0 HB3 ALA A 480 0.315 -5.936 -3.537 1.00 0.00 H new ATOM 890 N PHE A 481 2.632 -3.174 -4.101 1.00 0.00 N ATOM 891 CA PHE A 481 2.643 -2.023 -4.988 1.00 0.00 C ATOM 892 C PHE A 481 2.644 -2.461 -6.454 1.00 0.00 C ATOM 893 O PHE A 481 3.199 -3.504 -6.793 1.00 0.00 O ATOM 894 CB PHE A 481 3.930 -1.248 -4.698 1.00 0.00 C ATOM 895 CG PHE A 481 4.210 -0.114 -5.687 1.00 0.00 C ATOM 896 CD1 PHE A 481 3.191 0.672 -6.125 1.00 0.00 C ATOM 897 CD2 PHE A 481 5.477 0.106 -6.129 1.00 0.00 C ATOM 898 CE1 PHE A 481 3.450 1.725 -7.043 1.00 0.00 C ATOM 899 CE2 PHE A 481 5.736 1.158 -7.046 1.00 0.00 C ATOM 900 CZ PHE A 481 4.717 1.945 -7.484 1.00 0.00 C ATOM 0 H PHE A 481 3.487 -3.730 -4.113 1.00 0.00 H new ATOM 0 HA PHE A 481 1.755 -1.414 -4.820 1.00 0.00 H new ATOM 0 HB2 PHE A 481 3.873 -0.833 -3.692 1.00 0.00 H new ATOM 0 HB3 PHE A 481 4.770 -1.942 -4.709 1.00 0.00 H new ATOM 0 HD1 PHE A 481 2.185 0.496 -5.775 1.00 0.00 H new ATOM 0 HD2 PHE A 481 6.286 -0.520 -5.782 1.00 0.00 H new ATOM 0 HE1 PHE A 481 2.641 2.350 -7.390 1.00 0.00 H new ATOM 0 HE2 PHE A 481 6.743 1.334 -7.396 1.00 0.00 H new ATOM 0 HZ PHE A 481 4.914 2.745 -8.182 1.00 0.00 H new ATOM 910 N ASN A 482 2.015 -1.640 -7.283 1.00 0.00 N ATOM 911 CA ASN A 482 1.936 -1.930 -8.705 1.00 0.00 C ATOM 912 C ASN A 482 1.737 -0.624 -9.476 1.00 0.00 C ATOM 913 O ASN A 482 1.190 0.340 -8.942 1.00 0.00 O ATOM 914 CB ASN A 482 0.752 -2.848 -9.015 1.00 0.00 C ATOM 915 CG ASN A 482 0.322 -3.627 -7.770 1.00 0.00 C ATOM 916 OD1 ASN A 482 -0.283 -3.097 -6.853 1.00 0.00 O ATOM 917 ND2 ASN A 482 0.666 -4.911 -7.791 1.00 0.00 N ATOM 0 H ASN A 482 1.556 -0.775 -6.997 1.00 0.00 H new ATOM 0 HA ASN A 482 2.862 -2.424 -9.001 1.00 0.00 H new ATOM 0 HB2 ASN A 482 -0.085 -2.256 -9.385 1.00 0.00 H new ATOM 0 HB3 ASN A 482 1.025 -3.544 -9.808 1.00 0.00 H new ATOM 0 HD21 ASN A 482 0.424 -5.517 -7.007 1.00 0.00 H new ATOM 0 HD22 ASN A 482 1.172 -5.290 -8.591 1.00 0.00 H new ATOM 924 N ASP A 483 2.191 -0.634 -10.721 1.00 0.00 N ATOM 925 CA ASP A 483 2.070 0.538 -11.572 1.00 0.00 C ATOM 926 C ASP A 483 1.555 0.113 -12.948 1.00 0.00 C ATOM 927 O ASP A 483 2.209 0.353 -13.961 1.00 0.00 O ATOM 928 CB ASP A 483 3.425 1.221 -11.764 1.00 0.00 C ATOM 929 CG ASP A 483 4.627 0.275 -11.800 1.00 0.00 C ATOM 930 OD1 ASP A 483 5.347 0.195 -12.806 1.00 0.00 O ATOM 931 OD2 ASP A 483 4.815 -0.409 -10.722 1.00 0.00 O ATOM 0 H ASP A 483 2.643 -1.435 -11.161 1.00 0.00 H new ATOM 0 HA ASP A 483 1.381 1.233 -11.093 1.00 0.00 H new ATOM 0 HB2 ASP A 483 3.400 1.788 -12.694 1.00 0.00 H new ATOM 0 HB3 ASP A 483 3.571 1.939 -10.957 1.00 0.00 H new ATOM 937 N GLY A 484 0.386 -0.512 -12.940 1.00 0.00 N ATOM 938 CA GLY A 484 -0.224 -0.973 -14.175 1.00 0.00 C ATOM 939 C GLY A 484 -0.794 -2.384 -14.012 1.00 0.00 C ATOM 940 O GLY A 484 -2.009 -2.565 -13.965 1.00 0.00 O ATOM 0 H GLY A 484 -0.154 -0.710 -12.098 1.00 0.00 H new ATOM 0 HA2 GLY A 484 -1.019 -0.288 -14.470 1.00 0.00 H new ATOM 0 HA3 GLY A 484 0.516 -0.966 -14.975 1.00 0.00 H new ATOM 944 N ASN A 485 0.112 -3.347 -13.930 1.00 0.00 N ATOM 945 CA ASN A 485 -0.284 -4.736 -13.774 1.00 0.00 C ATOM 946 C ASN A 485 0.966 -5.618 -13.738 1.00 0.00 C ATOM 947 O ASN A 485 1.274 -6.222 -12.712 1.00 0.00 O ATOM 948 CB ASN A 485 -1.154 -5.196 -14.946 1.00 0.00 C ATOM 949 CG ASN A 485 -2.086 -6.334 -14.524 1.00 0.00 C ATOM 950 OD1 ASN A 485 -2.144 -7.385 -15.141 1.00 0.00 O ATOM 951 ND2 ASN A 485 -2.809 -6.067 -13.440 1.00 0.00 N ATOM 0 H ASN A 485 1.120 -3.193 -13.969 1.00 0.00 H new ATOM 0 HA ASN A 485 -0.852 -4.822 -12.848 1.00 0.00 H new ATOM 0 HB2 ASN A 485 -1.743 -4.357 -15.317 1.00 0.00 H new ATOM 0 HB3 ASN A 485 -0.518 -5.527 -15.767 1.00 0.00 H new ATOM 0 HD21 ASN A 485 -3.461 -6.763 -13.078 1.00 0.00 H new ATOM 0 HD22 ASN A 485 -2.712 -5.166 -12.971 1.00 0.00 H new ATOM 958 N ASN A 486 1.651 -5.664 -14.871 1.00 0.00 N ATOM 959 CA ASN A 486 2.860 -6.462 -14.983 1.00 0.00 C ATOM 960 C ASN A 486 3.937 -5.880 -14.066 1.00 0.00 C ATOM 961 O ASN A 486 4.915 -6.553 -13.745 1.00 0.00 O ATOM 962 CB ASN A 486 3.399 -6.448 -16.414 1.00 0.00 C ATOM 963 CG ASN A 486 3.289 -7.833 -17.056 1.00 0.00 C ATOM 964 OD1 ASN A 486 2.968 -8.819 -16.414 1.00 0.00 O ATOM 965 ND2 ASN A 486 3.573 -7.851 -18.355 1.00 0.00 N ATOM 0 H ASN A 486 1.392 -5.161 -15.720 1.00 0.00 H new ATOM 0 HA ASN A 486 2.615 -7.486 -14.700 1.00 0.00 H new ATOM 0 HB2 ASN A 486 2.843 -5.723 -17.008 1.00 0.00 H new ATOM 0 HB3 ASN A 486 4.441 -6.127 -16.411 1.00 0.00 H new ATOM 0 HD21 ASN A 486 3.529 -8.728 -18.875 1.00 0.00 H new ATOM 0 HD22 ASN A 486 3.835 -6.988 -18.832 1.00 0.00 H new ATOM 972 N ASN A 487 3.721 -4.634 -13.669 1.00 0.00 N ATOM 973 CA ASN A 487 4.661 -3.953 -12.796 1.00 0.00 C ATOM 974 C ASN A 487 4.232 -4.147 -11.341 1.00 0.00 C ATOM 975 O ASN A 487 3.377 -3.418 -10.839 1.00 0.00 O ATOM 976 CB ASN A 487 4.691 -2.450 -13.083 1.00 0.00 C ATOM 977 CG ASN A 487 4.230 -2.156 -14.512 1.00 0.00 C ATOM 978 OD1 ASN A 487 5.004 -2.162 -15.455 1.00 0.00 O ATOM 979 ND2 ASN A 487 2.929 -1.899 -14.619 1.00 0.00 N ATOM 0 H ASN A 487 2.908 -4.079 -13.936 1.00 0.00 H new ATOM 0 HA ASN A 487 5.651 -4.374 -12.973 1.00 0.00 H new ATOM 0 HB2 ASN A 487 4.048 -1.928 -12.375 1.00 0.00 H new ATOM 0 HB3 ASN A 487 5.701 -2.068 -12.937 1.00 0.00 H new ATOM 0 HD21 ASN A 487 2.524 -1.691 -15.532 1.00 0.00 H new ATOM 0 HD22 ASN A 487 2.337 -1.910 -13.789 1.00 0.00 H new ATOM 986 N TRP A 488 4.844 -5.135 -10.703 1.00 0.00 N ATOM 987 CA TRP A 488 4.535 -5.434 -9.315 1.00 0.00 C ATOM 988 C TRP A 488 5.674 -4.892 -8.450 1.00 0.00 C ATOM 989 O TRP A 488 6.748 -4.577 -8.958 1.00 0.00 O ATOM 990 CB TRP A 488 4.295 -6.933 -9.118 1.00 0.00 C ATOM 991 CG TRP A 488 3.049 -7.462 -9.830 1.00 0.00 C ATOM 992 CD1 TRP A 488 2.922 -7.819 -11.116 1.00 0.00 C ATOM 993 CD2 TRP A 488 1.750 -7.682 -9.241 1.00 0.00 C ATOM 994 NE1 TRP A 488 1.642 -8.251 -11.397 1.00 0.00 N ATOM 995 CE2 TRP A 488 0.907 -8.165 -10.220 1.00 0.00 C ATOM 996 CE3 TRP A 488 1.303 -7.480 -7.923 1.00 0.00 C ATOM 997 CZ2 TRP A 488 -0.436 -8.486 -9.986 1.00 0.00 C ATOM 998 CZ3 TRP A 488 -0.041 -7.805 -7.705 1.00 0.00 C ATOM 999 CH2 TRP A 488 -0.903 -8.293 -8.681 1.00 0.00 C ATOM 0 H TRP A 488 5.552 -5.738 -11.122 1.00 0.00 H new ATOM 0 HA TRP A 488 3.607 -4.948 -9.013 1.00 0.00 H new ATOM 0 HB2 TRP A 488 5.166 -7.480 -9.477 1.00 0.00 H new ATOM 0 HB3 TRP A 488 4.207 -7.139 -8.051 1.00 0.00 H new ATOM 0 HD1 TRP A 488 3.721 -7.774 -11.841 1.00 0.00 H new ATOM 0 HE1 TRP A 488 1.298 -8.574 -12.301 1.00 0.00 H new ATOM 0 HE3 TRP A 488 1.946 -7.104 -7.141 1.00 0.00 H new ATOM 0 HZ2 TRP A 488 -1.076 -8.862 -10.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 488 -0.436 -7.667 -6.709 1.00 0.00 H new ATOM 0 HH2 TRP A 488 -1.929 -8.522 -8.433 1.00 0.00 H new ATOM 1010 N ASP A 489 5.400 -4.801 -7.157 1.00 0.00 N ATOM 1011 CA ASP A 489 6.388 -4.302 -6.216 1.00 0.00 C ATOM 1012 C ASP A 489 5.981 -4.701 -4.796 1.00 0.00 C ATOM 1013 O ASP A 489 5.483 -3.874 -4.033 1.00 0.00 O ATOM 1014 CB ASP A 489 6.479 -2.775 -6.270 1.00 0.00 C ATOM 1015 CG ASP A 489 7.500 -2.224 -7.267 1.00 0.00 C ATOM 1016 OD1 ASP A 489 8.717 -2.300 -7.043 1.00 0.00 O ATOM 1017 OD2 ASP A 489 6.994 -1.690 -8.327 1.00 0.00 O ATOM 0 H ASP A 489 4.508 -5.064 -6.739 1.00 0.00 H new ATOM 0 HA ASP A 489 7.354 -4.731 -6.483 1.00 0.00 H new ATOM 0 HB2 ASP A 489 5.496 -2.376 -6.521 1.00 0.00 H new ATOM 0 HB3 ASP A 489 6.728 -2.405 -5.275 1.00 0.00 H new ATOM 1023 N SER A 490 6.208 -5.968 -4.483 1.00 0.00 N ATOM 1024 CA SER A 490 5.871 -6.487 -3.168 1.00 0.00 C ATOM 1025 C SER A 490 7.073 -7.221 -2.572 1.00 0.00 C ATOM 1026 O SER A 490 7.573 -8.180 -3.158 1.00 0.00 O ATOM 1027 CB SER A 490 4.660 -7.420 -3.238 1.00 0.00 C ATOM 1028 OG SER A 490 4.099 -7.469 -4.547 1.00 0.00 O ATOM 0 H SER A 490 6.621 -6.651 -5.118 1.00 0.00 H new ATOM 0 HA SER A 490 5.611 -5.647 -2.524 1.00 0.00 H new ATOM 0 HB2 SER A 490 4.957 -8.423 -2.933 1.00 0.00 H new ATOM 0 HB3 SER A 490 3.902 -7.084 -2.531 1.00 0.00 H new ATOM 0 HG SER A 490 3.330 -8.076 -4.551 1.00 0.00 H new ATOM 1034 N ASN A 491 7.502 -6.743 -1.413 1.00 0.00 N ATOM 1035 CA ASN A 491 8.636 -7.342 -0.730 1.00 0.00 C ATOM 1036 C ASN A 491 9.664 -7.804 -1.766 1.00 0.00 C ATOM 1037 O ASN A 491 10.289 -8.850 -1.601 1.00 0.00 O ATOM 1038 CB ASN A 491 8.207 -8.562 0.086 1.00 0.00 C ATOM 1039 CG ASN A 491 9.107 -8.750 1.309 1.00 0.00 C ATOM 1040 OD1 ASN A 491 8.664 -8.744 2.445 1.00 0.00 O ATOM 1041 ND2 ASN A 491 10.393 -8.915 1.013 1.00 0.00 N ATOM 0 H ASN A 491 7.085 -5.948 -0.930 1.00 0.00 H new ATOM 0 HA ASN A 491 9.060 -6.593 -0.062 1.00 0.00 H new ATOM 0 HB2 ASN A 491 7.172 -8.443 0.407 1.00 0.00 H new ATOM 0 HB3 ASN A 491 8.247 -9.454 -0.539 1.00 0.00 H new ATOM 0 HD21 ASN A 491 11.075 -9.047 1.760 1.00 0.00 H new ATOM 0 HD22 ASN A 491 10.697 -8.910 0.039 1.00 0.00 H new ATOM 1048 N ASN A 492 9.806 -7.001 -2.810 1.00 0.00 N ATOM 1049 CA ASN A 492 10.746 -7.314 -3.873 1.00 0.00 C ATOM 1050 C ASN A 492 10.055 -8.194 -4.916 1.00 0.00 C ATOM 1051 O ASN A 492 10.245 -8.005 -6.117 1.00 0.00 O ATOM 1052 CB ASN A 492 11.953 -8.082 -3.331 1.00 0.00 C ATOM 1053 CG ASN A 492 13.167 -7.912 -4.247 1.00 0.00 C ATOM 1054 OD1 ASN A 492 13.677 -6.822 -4.448 1.00 0.00 O ATOM 1055 ND2 ASN A 492 13.599 -9.047 -4.789 1.00 0.00 N ATOM 0 H ASN A 492 9.286 -6.134 -2.943 1.00 0.00 H new ATOM 0 HA ASN A 492 11.083 -6.375 -4.313 1.00 0.00 H new ATOM 0 HB2 ASN A 492 12.196 -7.726 -2.330 1.00 0.00 H new ATOM 0 HB3 ASN A 492 11.705 -9.140 -3.242 1.00 0.00 H new ATOM 0 HD21 ASN A 492 14.404 -9.039 -5.415 1.00 0.00 H new ATOM 0 HD22 ASN A 492 13.125 -9.925 -4.578 1.00 0.00 H new ATOM 1062 N THR A 493 9.268 -9.138 -4.420 1.00 0.00 N ATOM 1063 CA THR A 493 8.548 -10.048 -5.295 1.00 0.00 C ATOM 1064 C THR A 493 7.838 -11.127 -4.474 1.00 0.00 C ATOM 1065 O THR A 493 7.912 -12.310 -4.802 1.00 0.00 O ATOM 1066 CB THR A 493 9.542 -10.613 -6.311 1.00 0.00 C ATOM 1067 OG1 THR A 493 8.847 -11.705 -6.907 1.00 0.00 O ATOM 1068 CG2 THR A 493 10.755 -11.264 -5.643 1.00 0.00 C ATOM 0 H THR A 493 9.113 -9.292 -3.424 1.00 0.00 H new ATOM 0 HA THR A 493 7.761 -9.530 -5.843 1.00 0.00 H new ATOM 0 HB THR A 493 9.877 -9.815 -6.974 1.00 0.00 H new ATOM 0 HG1 THR A 493 8.785 -12.443 -6.265 1.00 0.00 H new ATOM 0 HG21 THR A 493 11.429 -11.649 -6.408 1.00 0.00 H new ATOM 0 HG22 THR A 493 11.278 -10.524 -5.038 1.00 0.00 H new ATOM 0 HG23 THR A 493 10.423 -12.084 -5.006 1.00 0.00 H new ATOM 1076 N LYS A 494 7.168 -10.680 -3.422 1.00 0.00 N ATOM 1077 CA LYS A 494 6.446 -11.592 -2.552 1.00 0.00 C ATOM 1078 C LYS A 494 5.198 -10.893 -2.010 1.00 0.00 C ATOM 1079 O LYS A 494 4.080 -11.208 -2.415 1.00 0.00 O ATOM 1080 CB LYS A 494 7.370 -12.135 -1.460 1.00 0.00 C ATOM 1081 CG LYS A 494 8.645 -12.727 -2.065 1.00 0.00 C ATOM 1082 CD LYS A 494 9.399 -13.572 -1.036 1.00 0.00 C ATOM 1083 CE LYS A 494 10.858 -13.770 -1.452 1.00 0.00 C ATOM 1084 NZ LYS A 494 11.134 -15.202 -1.706 1.00 0.00 N ATOM 0 H LYS A 494 7.110 -9.698 -3.153 1.00 0.00 H new ATOM 0 HA LYS A 494 6.106 -12.463 -3.112 1.00 0.00 H new ATOM 0 HB2 LYS A 494 7.630 -11.335 -0.767 1.00 0.00 H new ATOM 0 HB3 LYS A 494 6.848 -12.899 -0.884 1.00 0.00 H new ATOM 0 HG2 LYS A 494 8.391 -13.341 -2.929 1.00 0.00 H new ATOM 0 HG3 LYS A 494 9.289 -11.924 -2.423 1.00 0.00 H new ATOM 0 HD2 LYS A 494 9.358 -13.086 -0.061 1.00 0.00 H new ATOM 0 HD3 LYS A 494 8.913 -14.542 -0.930 1.00 0.00 H new ATOM 0 HE2 LYS A 494 11.069 -13.188 -2.349 1.00 0.00 H new ATOM 0 HE3 LYS A 494 11.519 -13.399 -0.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 12.128 -15.319 -1.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 10.952 -15.749 -0.841 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 10.516 -15.545 -2.469 1.00 0.00 H new ATOM 1097 N ASN A 495 5.430 -9.958 -1.100 1.00 0.00 N ATOM 1098 CA ASN A 495 4.339 -9.212 -0.498 1.00 0.00 C ATOM 1099 C ASN A 495 4.804 -8.623 0.835 1.00 0.00 C ATOM 1100 O ASN A 495 5.530 -9.274 1.586 1.00 0.00 O ATOM 1101 CB ASN A 495 3.138 -10.119 -0.221 1.00 0.00 C ATOM 1102 CG ASN A 495 3.565 -11.378 0.536 1.00 0.00 C ATOM 1103 OD1 ASN A 495 4.426 -12.130 0.108 1.00 0.00 O ATOM 1104 ND2 ASN A 495 2.918 -11.565 1.683 1.00 0.00 N ATOM 0 H ASN A 495 6.358 -9.700 -0.765 1.00 0.00 H new ATOM 0 HA ASN A 495 4.044 -8.426 -1.193 1.00 0.00 H new ATOM 0 HB2 ASN A 495 2.394 -9.575 0.361 1.00 0.00 H new ATOM 0 HB3 ASN A 495 2.665 -10.399 -1.162 1.00 0.00 H new ATOM 0 HD21 ASN A 495 3.132 -12.377 2.263 1.00 0.00 H new ATOM 0 HD22 ASN A 495 2.208 -10.897 1.983 1.00 0.00 H new ATOM 1111 N TYR A 496 4.366 -7.399 1.090 1.00 0.00 N ATOM 1112 CA TYR A 496 4.729 -6.715 2.320 1.00 0.00 C ATOM 1113 C TYR A 496 3.704 -6.990 3.422 1.00 0.00 C ATOM 1114 O TYR A 496 2.588 -7.426 3.143 1.00 0.00 O ATOM 1115 CB TYR A 496 4.718 -5.221 1.991 1.00 0.00 C ATOM 1116 CG TYR A 496 6.007 -4.719 1.338 1.00 0.00 C ATOM 1117 CD1 TYR A 496 7.231 -5.164 1.795 1.00 0.00 C ATOM 1118 CD2 TYR A 496 5.946 -3.821 0.292 1.00 0.00 C ATOM 1119 CE1 TYR A 496 8.444 -4.691 1.180 1.00 0.00 C ATOM 1120 CE2 TYR A 496 7.160 -3.348 -0.323 1.00 0.00 C ATOM 1121 CZ TYR A 496 8.349 -3.806 0.151 1.00 0.00 C ATOM 1122 OH TYR A 496 9.495 -3.360 -0.429 1.00 0.00 O ATOM 0 H TYR A 496 3.763 -6.863 0.466 1.00 0.00 H new ATOM 0 HA TYR A 496 5.700 -7.057 2.677 1.00 0.00 H new ATOM 0 HB2 TYR A 496 3.880 -5.012 1.326 1.00 0.00 H new ATOM 0 HB3 TYR A 496 4.544 -4.659 2.908 1.00 0.00 H new ATOM 0 HD1 TYR A 496 7.279 -5.867 2.614 1.00 0.00 H new ATOM 0 HD2 TYR A 496 4.988 -3.473 -0.066 1.00 0.00 H new ATOM 0 HE1 TYR A 496 9.408 -5.031 1.528 1.00 0.00 H new ATOM 0 HE2 TYR A 496 7.126 -2.645 -1.142 1.00 0.00 H new ATOM 0 HH TYR A 496 9.733 -2.487 -0.053 1.00 0.00 H new ATOM 1132 N SER A 497 4.119 -6.723 4.652 1.00 0.00 N ATOM 1133 CA SER A 497 3.251 -6.936 5.798 1.00 0.00 C ATOM 1134 C SER A 497 3.169 -5.659 6.636 1.00 0.00 C ATOM 1135 O SER A 497 4.173 -4.976 6.834 1.00 0.00 O ATOM 1136 CB SER A 497 3.747 -8.102 6.655 1.00 0.00 C ATOM 1137 OG SER A 497 3.150 -8.106 7.948 1.00 0.00 O ATOM 0 H SER A 497 5.045 -6.361 4.880 1.00 0.00 H new ATOM 0 HA SER A 497 2.256 -7.187 5.432 1.00 0.00 H new ATOM 0 HB2 SER A 497 3.525 -9.043 6.151 1.00 0.00 H new ATOM 0 HB3 SER A 497 4.831 -8.042 6.756 1.00 0.00 H new ATOM 0 HG SER A 497 3.491 -8.866 8.464 1.00 0.00 H new ATOM 1143 N PHE A 498 1.963 -5.375 7.107 1.00 0.00 N ATOM 1144 CA PHE A 498 1.737 -4.191 7.919 1.00 0.00 C ATOM 1145 C PHE A 498 0.819 -4.506 9.102 1.00 0.00 C ATOM 1146 O PHE A 498 0.048 -5.464 9.057 1.00 0.00 O ATOM 1147 CB PHE A 498 1.056 -3.156 7.021 1.00 0.00 C ATOM 1148 CG PHE A 498 1.773 -2.919 5.690 1.00 0.00 C ATOM 1149 CD1 PHE A 498 1.776 -3.890 4.738 1.00 0.00 C ATOM 1150 CD2 PHE A 498 2.406 -1.738 5.460 1.00 0.00 C ATOM 1151 CE1 PHE A 498 2.441 -3.670 3.503 1.00 0.00 C ATOM 1152 CE2 PHE A 498 3.071 -1.519 4.225 1.00 0.00 C ATOM 1153 CZ PHE A 498 3.075 -2.489 3.272 1.00 0.00 C ATOM 0 H PHE A 498 1.133 -5.944 6.942 1.00 0.00 H new ATOM 0 HA PHE A 498 2.684 -3.825 8.316 1.00 0.00 H new ATOM 0 HB2 PHE A 498 0.035 -3.481 6.819 1.00 0.00 H new ATOM 0 HB3 PHE A 498 0.989 -2.211 7.559 1.00 0.00 H new ATOM 0 HD1 PHE A 498 1.273 -4.828 4.921 1.00 0.00 H new ATOM 0 HD2 PHE A 498 2.403 -0.967 6.216 1.00 0.00 H new ATOM 0 HE1 PHE A 498 2.443 -4.441 2.747 1.00 0.00 H new ATOM 0 HE2 PHE A 498 3.574 -0.581 4.042 1.00 0.00 H new ATOM 0 HZ PHE A 498 3.581 -2.322 2.333 1.00 0.00 H new ATOM 1163 N SER A 499 0.931 -3.681 10.133 1.00 0.00 N ATOM 1164 CA SER A 499 0.121 -3.860 11.325 1.00 0.00 C ATOM 1165 C SER A 499 -0.814 -2.662 11.507 1.00 0.00 C ATOM 1166 O SER A 499 -0.501 -1.555 11.073 1.00 0.00 O ATOM 1167 CB SER A 499 0.998 -4.041 12.565 1.00 0.00 C ATOM 1168 OG SER A 499 2.338 -3.610 12.339 1.00 0.00 O ATOM 0 H SER A 499 1.571 -2.887 10.167 1.00 0.00 H new ATOM 0 HA SER A 499 -0.476 -4.764 11.200 1.00 0.00 H new ATOM 0 HB2 SER A 499 0.572 -3.479 13.396 1.00 0.00 H new ATOM 0 HB3 SER A 499 0.999 -5.091 12.858 1.00 0.00 H new ATOM 0 HG SER A 499 2.865 -3.740 13.155 1.00 0.00 H new ATOM 1174 N THR A 500 -1.942 -2.925 12.150 1.00 0.00 N ATOM 1175 CA THR A 500 -2.924 -1.882 12.395 1.00 0.00 C ATOM 1176 C THR A 500 -2.235 -0.524 12.540 1.00 0.00 C ATOM 1177 O THR A 500 -1.144 -0.434 13.100 1.00 0.00 O ATOM 1178 CB THR A 500 -3.743 -2.282 13.624 1.00 0.00 C ATOM 1179 OG1 THR A 500 -2.761 -2.626 14.598 1.00 0.00 O ATOM 1180 CG2 THR A 500 -4.525 -3.580 13.409 1.00 0.00 C ATOM 0 H THR A 500 -2.198 -3.845 12.509 1.00 0.00 H new ATOM 0 HA THR A 500 -3.607 -1.776 11.552 1.00 0.00 H new ATOM 0 HB THR A 500 -4.435 -1.479 13.877 1.00 0.00 H new ATOM 0 HG1 THR A 500 -3.205 -2.896 15.429 1.00 0.00 H new ATOM 0 HG21 THR A 500 -5.089 -3.819 14.311 1.00 0.00 H new ATOM 0 HG22 THR A 500 -5.213 -3.456 12.573 1.00 0.00 H new ATOM 0 HG23 THR A 500 -3.831 -4.391 13.190 1.00 0.00 H new ATOM 1188 N GLY A 501 -2.901 0.500 12.025 1.00 0.00 N ATOM 1189 CA GLY A 501 -2.367 1.849 12.090 1.00 0.00 C ATOM 1190 C GLY A 501 -2.134 2.415 10.687 1.00 0.00 C ATOM 1191 O GLY A 501 -2.858 2.079 9.751 1.00 0.00 O ATOM 0 H GLY A 501 -3.806 0.422 11.561 1.00 0.00 H new ATOM 0 HA2 GLY A 501 -3.058 2.492 12.635 1.00 0.00 H new ATOM 0 HA3 GLY A 501 -1.429 1.846 12.645 1.00 0.00 H new ATOM 1195 N THR A 502 -1.122 3.263 10.586 1.00 0.00 N ATOM 1196 CA THR A 502 -0.785 3.879 9.313 1.00 0.00 C ATOM 1197 C THR A 502 0.684 3.626 8.971 1.00 0.00 C ATOM 1198 O THR A 502 1.548 3.683 9.845 1.00 0.00 O ATOM 1199 CB THR A 502 -1.143 5.364 9.397 1.00 0.00 C ATOM 1200 OG1 THR A 502 -2.509 5.369 9.804 1.00 0.00 O ATOM 1201 CG2 THR A 502 -1.160 6.041 8.025 1.00 0.00 C ATOM 0 H THR A 502 -0.524 3.539 11.365 1.00 0.00 H new ATOM 0 HA THR A 502 -1.357 3.438 8.496 1.00 0.00 H new ATOM 0 HB THR A 502 -0.429 5.874 10.044 1.00 0.00 H new ATOM 0 HG1 THR A 502 -2.823 6.294 9.885 1.00 0.00 H new ATOM 0 HG21 THR A 502 -1.420 7.093 8.142 1.00 0.00 H new ATOM 0 HG22 THR A 502 -0.174 5.959 7.567 1.00 0.00 H new ATOM 0 HG23 THR A 502 -1.898 5.554 7.388 1.00 0.00 H new ATOM 1209 N SER A 503 0.923 3.352 7.697 1.00 0.00 N ATOM 1210 CA SER A 503 2.273 3.090 7.228 1.00 0.00 C ATOM 1211 C SER A 503 2.544 3.880 5.946 1.00 0.00 C ATOM 1212 O SER A 503 1.641 4.084 5.136 1.00 0.00 O ATOM 1213 CB SER A 503 2.492 1.595 6.987 1.00 0.00 C ATOM 1214 OG SER A 503 1.376 0.989 6.341 1.00 0.00 O ATOM 0 H SER A 503 0.204 3.306 6.975 1.00 0.00 H new ATOM 0 HA SER A 503 2.972 3.412 8.000 1.00 0.00 H new ATOM 0 HB2 SER A 503 3.385 1.453 6.378 1.00 0.00 H new ATOM 0 HB3 SER A 503 2.674 1.097 7.939 1.00 0.00 H new ATOM 0 HG SER A 503 1.694 0.379 5.643 1.00 0.00 H new ATOM 1220 N THR A 504 3.792 4.302 5.801 1.00 0.00 N ATOM 1221 CA THR A 504 4.193 5.065 4.632 1.00 0.00 C ATOM 1222 C THR A 504 5.066 4.210 3.711 1.00 0.00 C ATOM 1223 O THR A 504 5.915 3.454 4.181 1.00 0.00 O ATOM 1224 CB THR A 504 4.886 6.341 5.114 1.00 0.00 C ATOM 1225 OG1 THR A 504 3.813 7.235 5.393 1.00 0.00 O ATOM 1226 CG2 THR A 504 5.672 7.037 4.001 1.00 0.00 C ATOM 0 H THR A 504 4.539 4.130 6.474 1.00 0.00 H new ATOM 0 HA THR A 504 3.329 5.354 4.033 1.00 0.00 H new ATOM 0 HB THR A 504 5.559 6.099 5.937 1.00 0.00 H new ATOM 0 HG1 THR A 504 3.755 7.384 6.360 1.00 0.00 H new ATOM 0 HG21 THR A 504 6.144 7.936 4.397 1.00 0.00 H new ATOM 0 HG22 THR A 504 6.439 6.362 3.620 1.00 0.00 H new ATOM 0 HG23 THR A 504 4.994 7.309 3.192 1.00 0.00 H new ATOM 1234 N TYR A 505 4.827 4.358 2.416 1.00 0.00 N ATOM 1235 CA TYR A 505 5.581 3.609 1.426 1.00 0.00 C ATOM 1236 C TYR A 505 6.267 4.549 0.433 1.00 0.00 C ATOM 1237 O TYR A 505 5.623 5.418 -0.153 1.00 0.00 O ATOM 1238 CB TYR A 505 4.557 2.754 0.676 1.00 0.00 C ATOM 1239 CG TYR A 505 5.176 1.791 -0.341 1.00 0.00 C ATOM 1240 CD1 TYR A 505 6.184 0.932 0.047 1.00 0.00 C ATOM 1241 CD2 TYR A 505 4.726 1.783 -1.645 1.00 0.00 C ATOM 1242 CE1 TYR A 505 6.766 0.027 -0.909 1.00 0.00 C ATOM 1243 CE2 TYR A 505 5.308 0.877 -2.601 1.00 0.00 C ATOM 1244 CZ TYR A 505 6.299 0.044 -2.186 1.00 0.00 C ATOM 1245 OH TYR A 505 6.849 -0.812 -3.089 1.00 0.00 O ATOM 0 H TYR A 505 4.122 4.986 2.030 1.00 0.00 H new ATOM 0 HA TYR A 505 6.356 3.011 1.905 1.00 0.00 H new ATOM 0 HB2 TYR A 505 3.979 2.180 1.400 1.00 0.00 H new ATOM 0 HB3 TYR A 505 3.858 3.412 0.159 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.536 0.939 1.068 1.00 0.00 H new ATOM 0 HD2 TYR A 505 3.938 2.456 -1.949 1.00 0.00 H new ATOM 0 HE1 TYR A 505 7.556 -0.650 -0.619 1.00 0.00 H new ATOM 0 HE2 TYR A 505 4.965 0.860 -3.625 1.00 0.00 H new ATOM 0 HH TYR A 505 6.599 -0.536 -3.996 1.00 0.00 H new ATOM 1255 N THR A 506 7.567 4.343 0.274 1.00 0.00 N ATOM 1256 CA THR A 506 8.348 5.162 -0.638 1.00 0.00 C ATOM 1257 C THR A 506 9.300 4.288 -1.456 1.00 0.00 C ATOM 1258 O THR A 506 9.810 3.285 -0.959 1.00 0.00 O ATOM 1259 CB THR A 506 9.064 6.234 0.186 1.00 0.00 C ATOM 1260 OG1 THR A 506 8.041 7.180 0.487 1.00 0.00 O ATOM 1261 CG2 THR A 506 10.075 7.030 -0.642 1.00 0.00 C ATOM 0 H THR A 506 8.098 3.621 0.761 1.00 0.00 H new ATOM 0 HA THR A 506 7.710 5.663 -1.366 1.00 0.00 H new ATOM 0 HB THR A 506 9.573 5.765 1.028 1.00 0.00 H new ATOM 0 HG1 THR A 506 8.417 7.910 1.022 1.00 0.00 H new ATOM 0 HG21 THR A 506 10.555 7.777 -0.010 1.00 0.00 H new ATOM 0 HG22 THR A 506 10.831 6.354 -1.042 1.00 0.00 H new ATOM 0 HG23 THR A 506 9.561 7.527 -1.465 1.00 0.00 H new ATOM 1269 N PRO A 507 9.517 4.712 -2.730 1.00 0.00 N ATOM 1270 CA PRO A 507 10.399 3.979 -3.623 1.00 0.00 C ATOM 1271 C PRO A 507 11.867 4.214 -3.258 1.00 0.00 C ATOM 1272 O PRO A 507 12.233 5.300 -2.812 1.00 0.00 O ATOM 1273 CB PRO A 507 10.047 4.473 -5.016 1.00 0.00 C ATOM 1274 CG PRO A 507 9.315 5.790 -4.819 1.00 0.00 C ATOM 1275 CD PRO A 507 8.931 5.895 -3.353 1.00 0.00 C ATOM 0 HA PRO A 507 10.267 2.899 -3.553 1.00 0.00 H new ATOM 0 HB2 PRO A 507 10.944 4.611 -5.619 1.00 0.00 H new ATOM 0 HB3 PRO A 507 9.419 3.752 -5.539 1.00 0.00 H new ATOM 0 HG2 PRO A 507 9.951 6.627 -5.108 1.00 0.00 H new ATOM 0 HG3 PRO A 507 8.427 5.831 -5.450 1.00 0.00 H new ATOM 0 HD2 PRO A 507 9.319 6.811 -2.907 1.00 0.00 H new ATOM 0 HD3 PRO A 507 7.848 5.913 -3.228 1.00 0.00 H new ATOM 1283 N GLY A 508 12.667 3.178 -3.461 1.00 0.00 N ATOM 1284 CA GLY A 508 14.086 3.257 -3.159 1.00 0.00 C ATOM 1285 C GLY A 508 14.919 3.288 -4.442 1.00 0.00 C ATOM 1286 O GLY A 508 14.525 3.911 -5.427 1.00 0.00 O ATOM 0 H GLY A 508 12.359 2.279 -3.831 1.00 0.00 H new ATOM 0 HA2 GLY A 508 14.287 4.151 -2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 508 14.380 2.402 -2.551 1.00 0.00 H new ATOM 1290 N ASN A 509 16.055 2.609 -4.388 1.00 0.00 N ATOM 1291 CA ASN A 509 16.947 2.551 -5.534 1.00 0.00 C ATOM 1292 C ASN A 509 18.370 2.259 -5.052 1.00 0.00 C ATOM 1293 O ASN A 509 18.742 2.633 -3.942 1.00 0.00 O ATOM 1294 CB ASN A 509 16.966 3.884 -6.284 1.00 0.00 C ATOM 1295 CG ASN A 509 16.256 3.763 -7.634 1.00 0.00 C ATOM 1296 OD1 ASN A 509 16.664 4.334 -8.633 1.00 0.00 O ATOM 1297 ND2 ASN A 509 15.173 2.991 -7.609 1.00 0.00 N ATOM 0 H ASN A 509 16.379 2.094 -3.569 1.00 0.00 H new ATOM 0 HA ASN A 509 16.590 1.767 -6.201 1.00 0.00 H new ATOM 0 HB2 ASN A 509 16.481 4.652 -5.681 1.00 0.00 H new ATOM 0 HB3 ASN A 509 17.996 4.204 -6.438 1.00 0.00 H new ATOM 0 HD21 ASN A 509 14.629 2.848 -8.460 1.00 0.00 H new ATOM 0 HD22 ASN A 509 14.887 2.542 -6.739 1.00 0.00 H new ATOM 1304 N SER A 510 19.126 1.592 -5.912 1.00 0.00 N ATOM 1305 CA SER A 510 20.499 1.245 -5.589 1.00 0.00 C ATOM 1306 C SER A 510 20.525 0.188 -4.482 1.00 0.00 C ATOM 1307 O SER A 510 20.557 -1.009 -4.763 1.00 0.00 O ATOM 1308 CB SER A 510 21.293 2.480 -5.161 1.00 0.00 C ATOM 1309 OG SER A 510 22.193 2.915 -6.177 1.00 0.00 O ATOM 0 H SER A 510 18.813 1.283 -6.832 1.00 0.00 H new ATOM 0 HA SER A 510 20.968 0.837 -6.484 1.00 0.00 H new ATOM 0 HB2 SER A 510 20.603 3.288 -4.918 1.00 0.00 H new ATOM 0 HB3 SER A 510 21.853 2.254 -4.253 1.00 0.00 H new ATOM 0 HG SER A 510 22.680 3.707 -5.866 1.00 0.00 H new ATOM 1315 N GLY A 511 20.509 0.669 -3.248 1.00 0.00 N ATOM 1316 CA GLY A 511 20.531 -0.219 -2.098 1.00 0.00 C ATOM 1317 C GLY A 511 19.141 -0.335 -1.468 1.00 0.00 C ATOM 1318 O GLY A 511 18.863 -1.287 -0.741 1.00 0.00 O ATOM 0 H GLY A 511 20.481 1.663 -3.019 1.00 0.00 H new ATOM 0 HA2 GLY A 511 20.880 -1.206 -2.403 1.00 0.00 H new ATOM 0 HA3 GLY A 511 21.239 0.155 -1.359 1.00 0.00 H new ATOM 1322 N ASN A 512 18.306 0.648 -1.770 1.00 0.00 N ATOM 1323 CA ASN A 512 16.953 0.669 -1.242 1.00 0.00 C ATOM 1324 C ASN A 512 16.000 0.052 -2.268 1.00 0.00 C ATOM 1325 O ASN A 512 16.320 -0.018 -3.454 1.00 0.00 O ATOM 1326 CB ASN A 512 16.490 2.102 -0.970 1.00 0.00 C ATOM 1327 CG ASN A 512 17.129 2.652 0.307 1.00 0.00 C ATOM 1328 OD1 ASN A 512 16.485 3.272 1.136 1.00 0.00 O ATOM 1329 ND2 ASN A 512 18.428 2.390 0.417 1.00 0.00 N ATOM 0 H ASN A 512 18.540 1.436 -2.374 1.00 0.00 H new ATOM 0 HA ASN A 512 16.946 0.104 -0.310 1.00 0.00 H new ATOM 0 HB2 ASN A 512 16.751 2.739 -1.815 1.00 0.00 H new ATOM 0 HB3 ASN A 512 15.404 2.126 -0.877 1.00 0.00 H new ATOM 0 HD21 ASN A 512 18.946 2.714 1.234 1.00 0.00 H new ATOM 0 HD22 ASN A 512 18.906 1.865 -0.315 1.00 0.00 H new ATOM 1336 N ALA A 513 14.849 -0.381 -1.774 1.00 0.00 N ATOM 1337 CA ALA A 513 13.848 -0.991 -2.633 1.00 0.00 C ATOM 1338 C ALA A 513 12.535 -1.128 -1.860 1.00 0.00 C ATOM 1339 O ALA A 513 12.387 -2.029 -1.035 1.00 0.00 O ATOM 1340 CB ALA A 513 14.367 -2.336 -3.145 1.00 0.00 C ATOM 0 H ALA A 513 14.587 -0.321 -0.790 1.00 0.00 H new ATOM 0 HA ALA A 513 13.654 -0.364 -3.503 1.00 0.00 H new ATOM 0 HB1 ALA A 513 13.617 -2.794 -3.789 1.00 0.00 H new ATOM 0 HB2 ALA A 513 15.285 -2.180 -3.711 1.00 0.00 H new ATOM 0 HB3 ALA A 513 14.569 -2.994 -2.300 1.00 0.00 H new ATOM 1346 N GLY A 514 11.615 -0.222 -2.154 1.00 0.00 N ATOM 1347 CA GLY A 514 10.319 -0.230 -1.497 1.00 0.00 C ATOM 1348 C GLY A 514 10.472 -0.100 0.019 1.00 0.00 C ATOM 1349 O GLY A 514 10.513 -1.102 0.731 1.00 0.00 O ATOM 0 H GLY A 514 11.741 0.523 -2.839 1.00 0.00 H new ATOM 0 HA2 GLY A 514 9.710 0.591 -1.876 1.00 0.00 H new ATOM 0 HA3 GLY A 514 9.792 -1.154 -1.735 1.00 0.00 H new ATOM 1353 N THR A 515 10.554 1.144 0.469 1.00 0.00 N ATOM 1354 CA THR A 515 10.702 1.418 1.888 1.00 0.00 C ATOM 1355 C THR A 515 9.332 1.614 2.540 1.00 0.00 C ATOM 1356 O THR A 515 8.459 2.270 1.973 1.00 0.00 O ATOM 1357 CB THR A 515 11.627 2.628 2.042 1.00 0.00 C ATOM 1358 OG1 THR A 515 11.413 3.381 0.851 1.00 0.00 O ATOM 1359 CG2 THR A 515 13.107 2.245 1.980 1.00 0.00 C ATOM 0 H THR A 515 10.521 1.973 -0.124 1.00 0.00 H new ATOM 0 HA THR A 515 11.156 0.575 2.408 1.00 0.00 H new ATOM 0 HB THR A 515 11.420 3.125 2.990 1.00 0.00 H new ATOM 0 HG1 THR A 515 10.451 3.476 0.693 1.00 0.00 H new ATOM 0 HG21 THR A 515 13.719 3.139 2.094 1.00 0.00 H new ATOM 0 HG22 THR A 515 13.335 1.544 2.783 1.00 0.00 H new ATOM 0 HG23 THR A 515 13.322 1.778 1.019 1.00 0.00 H new ATOM 1367 N ILE A 516 9.186 1.033 3.722 1.00 0.00 N ATOM 1368 CA ILE A 516 7.937 1.135 4.457 1.00 0.00 C ATOM 1369 C ILE A 516 8.212 1.717 5.844 1.00 0.00 C ATOM 1370 O ILE A 516 9.199 1.361 6.486 1.00 0.00 O ATOM 1371 CB ILE A 516 7.221 -0.217 4.488 1.00 0.00 C ATOM 1372 CG1 ILE A 516 7.298 -0.910 3.126 1.00 0.00 C ATOM 1373 CG2 ILE A 516 5.778 -0.063 4.972 1.00 0.00 C ATOM 1374 CD1 ILE A 516 7.097 -2.420 3.266 1.00 0.00 C ATOM 0 H ILE A 516 9.912 0.490 4.189 1.00 0.00 H new ATOM 0 HA ILE A 516 7.254 1.820 3.954 1.00 0.00 H new ATOM 0 HB ILE A 516 7.734 -0.858 5.205 1.00 0.00 H new ATOM 0 HG12 ILE A 516 6.538 -0.499 2.461 1.00 0.00 H new ATOM 0 HG13 ILE A 516 8.266 -0.710 2.666 1.00 0.00 H new ATOM 0 HG21 ILE A 516 5.292 -1.039 4.984 1.00 0.00 H new ATOM 0 HG22 ILE A 516 5.774 0.357 5.978 1.00 0.00 H new ATOM 0 HG23 ILE A 516 5.238 0.603 4.299 1.00 0.00 H new ATOM 0 HD11 ILE A 516 7.156 -2.888 2.283 1.00 0.00 H new ATOM 0 HD12 ILE A 516 7.873 -2.832 3.911 1.00 0.00 H new ATOM 0 HD13 ILE A 516 6.118 -2.618 3.703 1.00 0.00 H new ATOM 1386 N THR A 517 7.322 2.603 6.267 1.00 0.00 N ATOM 1387 CA THR A 517 7.457 3.238 7.567 1.00 0.00 C ATOM 1388 C THR A 517 6.163 3.090 8.370 1.00 0.00 C ATOM 1389 O THR A 517 5.110 2.793 7.808 1.00 0.00 O ATOM 1390 CB THR A 517 7.868 4.695 7.341 1.00 0.00 C ATOM 1391 OG1 THR A 517 7.370 4.999 6.041 1.00 0.00 O ATOM 1392 CG2 THR A 517 9.383 4.861 7.207 1.00 0.00 C ATOM 0 H THR A 517 6.504 2.896 5.732 1.00 0.00 H new ATOM 0 HA THR A 517 8.230 2.755 8.164 1.00 0.00 H new ATOM 0 HB THR A 517 7.507 5.306 8.168 1.00 0.00 H new ATOM 0 HG1 THR A 517 7.646 5.905 5.788 1.00 0.00 H new ATOM 0 HG21 THR A 517 9.621 5.913 7.048 1.00 0.00 H new ATOM 0 HG22 THR A 517 9.869 4.512 8.118 1.00 0.00 H new ATOM 0 HG23 THR A 517 9.740 4.276 6.359 1.00 0.00 H new ATOM 1400 N SER A 518 6.285 3.303 9.672 1.00 0.00 N ATOM 1401 CA SER A 518 5.138 3.196 10.558 1.00 0.00 C ATOM 1402 C SER A 518 4.680 4.590 10.991 1.00 0.00 C ATOM 1403 O SER A 518 5.185 5.137 11.971 1.00 0.00 O ATOM 1404 CB SER A 518 5.467 2.341 11.783 1.00 0.00 C ATOM 1405 OG SER A 518 5.274 0.951 11.531 1.00 0.00 O ATOM 0 H SER A 518 7.160 3.549 10.135 1.00 0.00 H new ATOM 0 HA SER A 518 4.329 2.708 10.014 1.00 0.00 H new ATOM 0 HB2 SER A 518 6.501 2.516 12.080 1.00 0.00 H new ATOM 0 HB3 SER A 518 4.839 2.649 12.619 1.00 0.00 H new ATOM 0 HG SER A 518 5.496 0.439 12.336 1.00 0.00 H new ATOM 1411 N GLY A 519 3.729 5.126 10.241 1.00 0.00 N ATOM 1412 CA GLY A 519 3.198 6.446 10.535 1.00 0.00 C ATOM 1413 C GLY A 519 2.999 7.255 9.252 1.00 0.00 C ATOM 1414 O GLY A 519 3.907 7.353 8.428 1.00 0.00 O ATOM 0 H GLY A 519 3.312 4.670 9.430 1.00 0.00 H new ATOM 0 HA2 GLY A 519 2.248 6.351 11.060 1.00 0.00 H new ATOM 0 HA3 GLY A 519 3.879 6.976 11.201 1.00 0.00 H new ATOM 1418 N ALA A 520 1.805 7.816 9.123 1.00 0.00 N ATOM 1419 CA ALA A 520 1.475 8.613 7.954 1.00 0.00 C ATOM 1420 C ALA A 520 2.436 9.800 7.864 1.00 0.00 C ATOM 1421 O ALA A 520 3.014 10.213 8.868 1.00 0.00 O ATOM 1422 CB ALA A 520 0.012 9.053 8.033 1.00 0.00 C ATOM 0 H ALA A 520 1.055 7.734 9.809 1.00 0.00 H new ATOM 0 HA ALA A 520 1.590 8.025 7.043 1.00 0.00 H new ATOM 0 HB1 ALA A 520 -0.236 9.651 7.156 1.00 0.00 H new ATOM 0 HB2 ALA A 520 -0.631 8.174 8.066 1.00 0.00 H new ATOM 0 HB3 ALA A 520 -0.141 9.648 8.933 1.00 0.00 H new ATOM 1428 N PRO A 521 2.581 10.329 6.619 1.00 0.00 N ATOM 1429 CA PRO A 521 3.463 11.460 6.385 1.00 0.00 C ATOM 1430 C PRO A 521 2.838 12.758 6.901 1.00 0.00 C ATOM 1431 O PRO A 521 1.619 12.920 6.870 1.00 0.00 O ATOM 1432 CB PRO A 521 3.698 11.470 4.883 1.00 0.00 C ATOM 1433 CG PRO A 521 2.578 10.638 4.280 1.00 0.00 C ATOM 1434 CD PRO A 521 1.912 9.866 5.407 1.00 0.00 C ATOM 0 HA PRO A 521 4.408 11.376 6.922 1.00 0.00 H new ATOM 0 HB2 PRO A 521 3.683 12.487 4.492 1.00 0.00 H new ATOM 0 HB3 PRO A 521 4.673 11.049 4.637 1.00 0.00 H new ATOM 0 HG2 PRO A 521 1.854 11.279 3.777 1.00 0.00 H new ATOM 0 HG3 PRO A 521 2.973 9.953 3.529 1.00 0.00 H new ATOM 0 HD2 PRO A 521 0.841 10.066 5.445 1.00 0.00 H new ATOM 0 HD3 PRO A 521 2.031 8.791 5.275 1.00 0.00 H new ATOM 1442 N ALA A 522 3.702 13.650 7.363 1.00 0.00 N ATOM 1443 CA ALA A 522 3.251 14.928 7.885 1.00 0.00 C ATOM 1444 C ALA A 522 3.908 16.059 7.092 1.00 0.00 C ATOM 1445 O ALA A 522 4.501 16.967 7.673 1.00 0.00 O ATOM 1446 CB ALA A 522 3.563 15.007 9.381 1.00 0.00 C ATOM 0 H ALA A 522 4.712 13.512 7.386 1.00 0.00 H new ATOM 0 HA ALA A 522 2.172 15.030 7.771 1.00 0.00 H new ATOM 0 HB1 ALA A 522 3.225 15.966 9.773 1.00 0.00 H new ATOM 0 HB2 ALA A 522 3.049 14.200 9.903 1.00 0.00 H new ATOM 0 HB3 ALA A 522 4.638 14.911 9.534 1.00 0.00 H new ATOM 1452 N GLY A 523 3.781 15.968 5.776 1.00 0.00 N ATOM 1453 CA GLY A 523 4.356 16.972 4.898 1.00 0.00 C ATOM 1454 C GLY A 523 5.813 17.256 5.268 1.00 0.00 C ATOM 1455 O GLY A 523 6.507 16.382 5.787 1.00 0.00 O ATOM 0 H GLY A 523 3.288 15.214 5.297 1.00 0.00 H new ATOM 0 HA2 GLY A 523 4.300 16.631 3.864 1.00 0.00 H new ATOM 0 HA3 GLY A 523 3.775 17.892 4.962 1.00 0.00 H new TER 1459 GLY A 523