USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 795 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 73 SER OG : rot -88:sc= 0.0972 USER MOD Set 1.2: A 74 ASN : amide:sc= 0.585 K(o=0.68,f=-4.4!) USER MOD Single : A 1 GLY N :NH3+ -144:sc= 0.0596 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= -0.0655 USER MOD Single : A 6 SER OG : rot 180:sc= 0.515 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN : amide:sc= -0.0252 X(o=-0.025,f=-0.28) USER MOD Single : A 17 ASN : amide:sc= -0.981 K(o=-0.98,f=-2.7) USER MOD Single : A 18 THR OG1 : rot 72:sc= -0.361 USER MOD Single : A 20 TYR OH : rot 180:sc= -0.561 USER MOD Single : A 22 LYS NZ :NH3+ 168:sc=-0.00594 (180deg=-0.128) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.118 USER MOD Single : A 35 SER OG : rot 180:sc=9.78e-05 USER MOD Single : A 36 LYS NZ :NH3+ 159:sc= 0.886 (180deg=0.165) USER MOD Single : A 39 MET CE :methyl -167:sc= 0 (180deg=-0.193) USER MOD Single : A 40 HIS : no HD1:sc= -6.39! C(o=-6.4!,f=-6.1!) USER MOD Single : A 54 SER OG : rot 180:sc= 0.00304 USER MOD Single : A 59 ASN : amide:sc= -5.61! C(o=-5.6!,f=-12!) USER MOD Single : A 60 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= -0.0145 X(o=-0.015,f=-0.41) USER MOD Single : A 81 LYS NZ :NH3+ 153:sc= -0.712 (180deg=-1.98!) USER MOD Single : A 87 THR OG1 : rot 46:sc= -0.0941 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 57:sc= 0.984 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.027 18.831 -20.633 1.00 0.00 N ATOM 2 CA GLY A 1 2.343 19.393 -20.377 1.00 0.00 C ATOM 3 C GLY A 1 3.433 18.576 -21.074 1.00 0.00 C ATOM 4 O GLY A 1 3.171 17.909 -22.073 1.00 0.00 O ATOM 0 H1 GLY A 1 0.332 19.600 -20.722 1.00 0.00 H new ATOM 0 H2 GLY A 1 1.050 18.281 -21.516 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.756 18.209 -19.845 1.00 0.00 H new ATOM 0 HA2 GLY A 1 2.376 20.425 -20.728 1.00 0.00 H new ATOM 0 HA3 GLY A 1 2.530 19.415 -19.303 1.00 0.00 H new ATOM 8 N SER A 2 4.633 18.655 -20.518 1.00 0.00 N ATOM 9 CA SER A 2 5.764 17.931 -21.073 1.00 0.00 C ATOM 10 C SER A 2 5.530 16.424 -20.956 1.00 0.00 C ATOM 11 O SER A 2 5.267 15.916 -19.867 1.00 0.00 O ATOM 12 CB SER A 2 7.066 18.322 -20.372 1.00 0.00 C ATOM 13 OG SER A 2 8.213 17.838 -21.066 1.00 0.00 O ATOM 0 H SER A 2 4.847 19.209 -19.689 1.00 0.00 H new ATOM 0 HA SER A 2 5.856 18.197 -22.126 1.00 0.00 H new ATOM 0 HB2 SER A 2 7.122 19.408 -20.292 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.064 17.927 -19.356 1.00 0.00 H new ATOM 0 HG SER A 2 9.024 18.110 -20.588 1.00 0.00 H new ATOM 19 N SER A 3 5.634 15.751 -22.093 1.00 0.00 N ATOM 20 CA SER A 3 5.436 14.312 -22.131 1.00 0.00 C ATOM 21 C SER A 3 6.298 13.637 -21.062 1.00 0.00 C ATOM 22 O SER A 3 7.493 13.427 -21.264 1.00 0.00 O ATOM 23 CB SER A 3 5.768 13.747 -23.514 1.00 0.00 C ATOM 24 OG SER A 3 4.598 13.544 -24.302 1.00 0.00 O ATOM 0 H SER A 3 5.853 16.176 -22.994 1.00 0.00 H new ATOM 0 HA SER A 3 4.386 14.106 -21.926 1.00 0.00 H new ATOM 0 HB2 SER A 3 6.441 14.430 -24.033 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.298 12.801 -23.402 1.00 0.00 H new ATOM 0 HG SER A 3 4.852 13.184 -25.178 1.00 0.00 H new ATOM 30 N GLY A 4 5.657 13.316 -19.947 1.00 0.00 N ATOM 31 CA GLY A 4 6.350 12.669 -18.846 1.00 0.00 C ATOM 32 C GLY A 4 6.208 13.481 -17.557 1.00 0.00 C ATOM 33 O GLY A 4 7.118 14.218 -17.180 1.00 0.00 O ATOM 0 H GLY A 4 4.666 13.492 -19.783 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.947 11.668 -18.696 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.405 12.554 -19.093 1.00 0.00 H new ATOM 37 N SER A 5 5.060 13.318 -16.916 1.00 0.00 N ATOM 38 CA SER A 5 4.788 14.026 -15.677 1.00 0.00 C ATOM 39 C SER A 5 4.791 13.046 -14.502 1.00 0.00 C ATOM 40 O SER A 5 5.613 13.162 -13.594 1.00 0.00 O ATOM 41 CB SER A 5 3.450 14.766 -15.748 1.00 0.00 C ATOM 42 OG SER A 5 2.371 13.888 -16.057 1.00 0.00 O ATOM 0 H SER A 5 4.308 12.706 -17.232 1.00 0.00 H new ATOM 0 HA SER A 5 5.574 14.766 -15.526 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.256 15.257 -14.794 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.508 15.549 -16.504 1.00 0.00 H new ATOM 0 HG SER A 5 1.534 14.397 -16.092 1.00 0.00 H new ATOM 48 N SER A 6 3.862 12.103 -14.557 1.00 0.00 N ATOM 49 CA SER A 6 3.747 11.103 -13.509 1.00 0.00 C ATOM 50 C SER A 6 5.119 10.493 -13.216 1.00 0.00 C ATOM 51 O SER A 6 5.910 11.065 -12.467 1.00 0.00 O ATOM 52 CB SER A 6 2.752 10.009 -13.899 1.00 0.00 C ATOM 53 OG SER A 6 3.029 9.469 -15.188 1.00 0.00 O ATOM 0 H SER A 6 3.182 12.010 -15.311 1.00 0.00 H new ATOM 0 HA SER A 6 3.374 11.592 -12.609 1.00 0.00 H new ATOM 0 HB2 SER A 6 2.782 9.211 -13.158 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.741 10.417 -13.887 1.00 0.00 H new ATOM 0 HG SER A 6 2.372 8.773 -15.399 1.00 0.00 H new ATOM 59 N GLY A 7 5.360 9.339 -13.821 1.00 0.00 N ATOM 60 CA GLY A 7 6.622 8.645 -13.634 1.00 0.00 C ATOM 61 C GLY A 7 6.650 7.909 -12.293 1.00 0.00 C ATOM 62 O GLY A 7 7.599 7.184 -11.998 1.00 0.00 O ATOM 0 H GLY A 7 4.702 8.867 -14.441 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.774 7.934 -14.446 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.444 9.360 -13.678 1.00 0.00 H new ATOM 66 N LEU A 8 5.597 8.120 -11.516 1.00 0.00 N ATOM 67 CA LEU A 8 5.489 7.486 -10.214 1.00 0.00 C ATOM 68 C LEU A 8 5.220 5.991 -10.400 1.00 0.00 C ATOM 69 O LEU A 8 5.788 5.162 -9.691 1.00 0.00 O ATOM 70 CB LEU A 8 4.439 8.197 -9.357 1.00 0.00 C ATOM 71 CG LEU A 8 4.623 9.707 -9.187 1.00 0.00 C ATOM 72 CD1 LEU A 8 3.384 10.342 -8.552 1.00 0.00 C ATOM 73 CD2 LEU A 8 5.896 10.019 -8.398 1.00 0.00 C ATOM 0 H LEU A 8 4.811 8.721 -11.764 1.00 0.00 H new ATOM 0 HA LEU A 8 6.428 7.576 -9.668 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.458 8.018 -9.797 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.434 7.738 -8.368 1.00 0.00 H new ATOM 0 HG LEU A 8 4.741 10.150 -10.176 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.541 11.415 -8.442 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.517 10.165 -9.189 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.210 9.899 -7.572 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.003 11.099 -8.292 1.00 0.00 H new ATOM 0 HD22 LEU A 8 5.833 9.562 -7.411 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.760 9.620 -8.929 1.00 0.00 H new ATOM 85 N ARG A 9 4.355 5.693 -11.358 1.00 0.00 N ATOM 86 CA ARG A 9 4.004 4.313 -11.646 1.00 0.00 C ATOM 87 C ARG A 9 5.239 3.416 -11.534 1.00 0.00 C ATOM 88 O ARG A 9 5.264 2.485 -10.731 1.00 0.00 O ATOM 89 CB ARG A 9 3.410 4.177 -13.050 1.00 0.00 C ATOM 90 CG ARG A 9 2.298 5.203 -13.275 1.00 0.00 C ATOM 91 CD ARG A 9 1.253 4.671 -14.259 1.00 0.00 C ATOM 92 NE ARG A 9 1.390 5.358 -15.563 1.00 0.00 N ATOM 93 CZ ARG A 9 0.967 4.849 -16.728 1.00 0.00 C ATOM 94 NH1 ARG A 9 0.378 3.646 -16.759 1.00 0.00 N ATOM 95 NH2 ARG A 9 1.134 5.543 -17.862 1.00 0.00 N ATOM 0 H ARG A 9 3.887 6.384 -11.945 1.00 0.00 H new ATOM 0 HA ARG A 9 3.257 4.002 -10.916 1.00 0.00 H new ATOM 0 HB2 ARG A 9 4.193 4.315 -13.795 1.00 0.00 H new ATOM 0 HB3 ARG A 9 3.014 3.170 -13.186 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.820 5.441 -12.325 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.725 6.130 -13.658 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.379 3.596 -14.390 1.00 0.00 H new ATOM 0 HD3 ARG A 9 0.251 4.829 -13.859 1.00 0.00 H new ATOM 0 HE ARG A 9 1.834 6.276 -15.575 1.00 0.00 H new ATOM 0 HH11 ARG A 9 0.252 3.118 -15.896 1.00 0.00 H new ATOM 0 HH12 ARG A 9 0.056 3.259 -17.646 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.583 6.459 -17.838 1.00 0.00 H new ATOM 0 HH22 ARG A 9 0.812 5.156 -18.749 1.00 0.00 H new ATOM 109 N LYS A 10 6.234 3.730 -12.351 1.00 0.00 N ATOM 110 CA LYS A 10 7.470 2.965 -12.353 1.00 0.00 C ATOM 111 C LYS A 10 8.020 2.887 -10.928 1.00 0.00 C ATOM 112 O LYS A 10 8.400 1.814 -10.462 1.00 0.00 O ATOM 113 CB LYS A 10 8.459 3.548 -13.364 1.00 0.00 C ATOM 114 CG LYS A 10 7.896 3.480 -14.785 1.00 0.00 C ATOM 115 CD LYS A 10 7.843 2.035 -15.285 1.00 0.00 C ATOM 116 CE LYS A 10 8.622 1.878 -16.592 1.00 0.00 C ATOM 117 NZ LYS A 10 8.367 0.549 -17.191 1.00 0.00 N ATOM 0 H LYS A 10 6.210 4.503 -13.016 1.00 0.00 H new ATOM 0 HA LYS A 10 7.284 1.941 -12.678 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.680 4.584 -13.106 1.00 0.00 H new ATOM 0 HB3 LYS A 10 9.400 3.000 -13.315 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.896 3.912 -14.805 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.515 4.078 -15.454 1.00 0.00 H new ATOM 0 HD2 LYS A 10 8.258 1.369 -14.528 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.806 1.737 -15.438 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.331 2.661 -17.292 1.00 0.00 H new ATOM 0 HE3 LYS A 10 9.689 2.000 -16.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 8.903 0.459 -18.077 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 8.667 -0.194 -16.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 7.351 0.447 -17.389 1.00 0.00 H new ATOM 131 N GLN A 11 8.045 4.040 -10.274 1.00 0.00 N ATOM 132 CA GLN A 11 8.542 4.116 -8.911 1.00 0.00 C ATOM 133 C GLN A 11 7.734 3.192 -7.998 1.00 0.00 C ATOM 134 O GLN A 11 8.298 2.337 -7.318 1.00 0.00 O ATOM 135 CB GLN A 11 8.513 5.557 -8.397 1.00 0.00 C ATOM 136 CG GLN A 11 9.128 6.516 -9.417 1.00 0.00 C ATOM 137 CD GLN A 11 10.063 7.517 -8.735 1.00 0.00 C ATOM 138 OE1 GLN A 11 10.916 7.165 -7.937 1.00 0.00 O ATOM 139 NE2 GLN A 11 9.855 8.781 -9.092 1.00 0.00 N ATOM 0 H GLN A 11 7.729 4.928 -10.663 1.00 0.00 H new ATOM 0 HA GLN A 11 9.580 3.783 -8.905 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.484 5.852 -8.189 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.059 5.622 -7.456 1.00 0.00 H new ATOM 0 HG2 GLN A 11 9.680 5.950 -10.167 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.336 7.051 -9.941 1.00 0.00 H new ATOM 0 HE21 GLN A 11 9.123 9.007 -9.766 1.00 0.00 H new ATOM 0 HE22 GLN A 11 10.427 9.525 -8.692 1.00 0.00 H new ATOM 148 N VAL A 12 6.424 3.394 -8.014 1.00 0.00 N ATOM 149 CA VAL A 12 5.533 2.589 -7.197 1.00 0.00 C ATOM 150 C VAL A 12 5.831 1.107 -7.432 1.00 0.00 C ATOM 151 O VAL A 12 6.206 0.391 -6.504 1.00 0.00 O ATOM 152 CB VAL A 12 4.077 2.960 -7.489 1.00 0.00 C ATOM 153 CG1 VAL A 12 3.116 2.084 -6.683 1.00 0.00 C ATOM 154 CG2 VAL A 12 3.825 4.444 -7.219 1.00 0.00 C ATOM 0 H VAL A 12 5.959 4.104 -8.580 1.00 0.00 H new ATOM 0 HA VAL A 12 5.700 2.790 -6.139 1.00 0.00 H new ATOM 0 HB VAL A 12 3.890 2.776 -8.547 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.088 2.368 -6.909 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.269 1.038 -6.947 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.305 2.221 -5.618 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.783 4.681 -7.434 1.00 0.00 H new ATOM 0 HG22 VAL A 12 4.039 4.665 -6.173 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.473 5.045 -7.857 1.00 0.00 H new ATOM 164 N GLU A 13 5.654 0.691 -8.677 1.00 0.00 N ATOM 165 CA GLU A 13 5.899 -0.693 -9.045 1.00 0.00 C ATOM 166 C GLU A 13 7.128 -1.229 -8.308 1.00 0.00 C ATOM 167 O GLU A 13 7.076 -2.299 -7.704 1.00 0.00 O ATOM 168 CB GLU A 13 6.063 -0.837 -10.560 1.00 0.00 C ATOM 169 CG GLU A 13 4.793 -0.402 -11.293 1.00 0.00 C ATOM 170 CD GLU A 13 4.394 -1.428 -12.355 1.00 0.00 C ATOM 171 OE1 GLU A 13 4.945 -1.330 -13.473 1.00 0.00 O ATOM 172 OE2 GLU A 13 3.548 -2.286 -12.026 1.00 0.00 O ATOM 0 H GLU A 13 5.344 1.288 -9.444 1.00 0.00 H new ATOM 0 HA GLU A 13 5.034 -1.286 -8.748 1.00 0.00 H new ATOM 0 HB2 GLU A 13 6.906 -0.234 -10.897 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.293 -1.873 -10.808 1.00 0.00 H new ATOM 0 HG2 GLU A 13 3.980 -0.279 -10.577 1.00 0.00 H new ATOM 0 HG3 GLU A 13 4.954 0.569 -11.762 1.00 0.00 H new ATOM 179 N LEU A 14 8.204 -0.460 -8.381 1.00 0.00 N ATOM 180 CA LEU A 14 9.444 -0.844 -7.727 1.00 0.00 C ATOM 181 C LEU A 14 9.206 -0.961 -6.221 1.00 0.00 C ATOM 182 O LEU A 14 9.614 -1.941 -5.598 1.00 0.00 O ATOM 183 CB LEU A 14 10.568 0.125 -8.099 1.00 0.00 C ATOM 184 CG LEU A 14 11.968 -0.251 -7.607 1.00 0.00 C ATOM 185 CD1 LEU A 14 12.359 -1.650 -8.085 1.00 0.00 C ATOM 186 CD2 LEU A 14 12.995 0.805 -8.020 1.00 0.00 C ATOM 0 H LEU A 14 8.243 0.427 -8.883 1.00 0.00 H new ATOM 0 HA LEU A 14 9.771 -1.824 -8.075 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.598 0.216 -9.185 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.318 1.110 -7.704 1.00 0.00 H new ATOM 0 HG LEU A 14 11.953 -0.276 -6.517 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.358 -1.893 -7.722 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.646 -2.379 -7.700 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.353 -1.677 -9.175 1.00 0.00 H new ATOM 0 HD21 LEU A 14 13.981 0.514 -7.658 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.016 0.886 -9.107 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.720 1.768 -7.590 1.00 0.00 H new ATOM 198 N LEU A 15 8.547 0.052 -5.677 1.00 0.00 N ATOM 199 CA LEU A 15 8.250 0.075 -4.255 1.00 0.00 C ATOM 200 C LEU A 15 7.510 -1.208 -3.872 1.00 0.00 C ATOM 201 O LEU A 15 7.978 -1.971 -3.029 1.00 0.00 O ATOM 202 CB LEU A 15 7.497 1.354 -3.886 1.00 0.00 C ATOM 203 CG LEU A 15 6.888 1.393 -2.483 1.00 0.00 C ATOM 204 CD1 LEU A 15 7.978 1.341 -1.411 1.00 0.00 C ATOM 205 CD2 LEU A 15 5.976 2.609 -2.314 1.00 0.00 C ATOM 0 H LEU A 15 8.210 0.863 -6.196 1.00 0.00 H new ATOM 0 HA LEU A 15 9.172 0.097 -3.673 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.181 2.197 -3.987 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.698 1.504 -4.612 1.00 0.00 H new ATOM 0 HG LEU A 15 6.268 0.506 -2.355 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.518 1.370 -0.423 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.550 0.419 -1.518 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.643 2.196 -1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.556 2.612 -1.308 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.553 3.521 -2.470 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.168 2.562 -3.044 1.00 0.00 H new ATOM 217 N PHE A 16 6.365 -1.405 -4.510 1.00 0.00 N ATOM 218 CA PHE A 16 5.555 -2.582 -4.247 1.00 0.00 C ATOM 219 C PHE A 16 6.341 -3.864 -4.532 1.00 0.00 C ATOM 220 O PHE A 16 6.482 -4.717 -3.657 1.00 0.00 O ATOM 221 CB PHE A 16 4.352 -2.517 -5.190 1.00 0.00 C ATOM 222 CG PHE A 16 3.319 -1.454 -4.808 1.00 0.00 C ATOM 223 CD1 PHE A 16 3.589 -0.573 -3.808 1.00 0.00 C ATOM 224 CD2 PHE A 16 2.132 -1.391 -5.468 1.00 0.00 C ATOM 225 CE1 PHE A 16 2.631 0.413 -3.454 1.00 0.00 C ATOM 226 CE2 PHE A 16 1.174 -0.405 -5.114 1.00 0.00 C ATOM 227 CZ PHE A 16 1.443 0.476 -4.114 1.00 0.00 C ATOM 0 H PHE A 16 5.979 -0.769 -5.208 1.00 0.00 H new ATOM 0 HA PHE A 16 5.252 -2.598 -3.200 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.706 -2.318 -6.201 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.865 -3.492 -5.209 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.532 -0.623 -3.283 1.00 0.00 H new ATOM 0 HD2 PHE A 16 1.918 -2.091 -6.262 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.845 1.113 -2.660 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.232 -0.355 -5.639 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.714 1.226 -3.844 1.00 0.00 H new ATOM 237 N ASN A 17 6.833 -3.958 -5.758 1.00 0.00 N ATOM 238 CA ASN A 17 7.602 -5.121 -6.169 1.00 0.00 C ATOM 239 C ASN A 17 8.731 -5.361 -5.165 1.00 0.00 C ATOM 240 O ASN A 17 8.971 -6.496 -4.754 1.00 0.00 O ATOM 241 CB ASN A 17 8.231 -4.907 -7.546 1.00 0.00 C ATOM 242 CG ASN A 17 7.182 -5.027 -8.653 1.00 0.00 C ATOM 243 OD1 ASN A 17 6.084 -4.502 -8.563 1.00 0.00 O ATOM 244 ND2 ASN A 17 7.579 -5.745 -9.700 1.00 0.00 N ATOM 0 H ASN A 17 6.714 -3.248 -6.481 1.00 0.00 H new ATOM 0 HA ASN A 17 6.926 -5.975 -6.211 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.698 -3.923 -7.588 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.020 -5.641 -7.707 1.00 0.00 H new ATOM 0 HD21 ASN A 17 6.951 -5.883 -10.491 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.512 -6.157 -9.711 1.00 0.00 H new ATOM 251 N THR A 18 9.395 -4.275 -4.799 1.00 0.00 N ATOM 252 CA THR A 18 10.494 -4.352 -3.851 1.00 0.00 C ATOM 253 C THR A 18 9.993 -4.851 -2.494 1.00 0.00 C ATOM 254 O THR A 18 10.454 -5.877 -1.996 1.00 0.00 O ATOM 255 CB THR A 18 11.159 -2.977 -3.784 1.00 0.00 C ATOM 256 OG1 THR A 18 11.777 -2.828 -5.060 1.00 0.00 O ATOM 257 CG2 THR A 18 12.328 -2.938 -2.797 1.00 0.00 C ATOM 0 H THR A 18 9.193 -3.336 -5.142 1.00 0.00 H new ATOM 0 HA THR A 18 11.243 -5.075 -4.173 1.00 0.00 H new ATOM 0 HB THR A 18 10.419 -2.230 -3.498 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.088 -2.682 -5.742 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.764 -1.939 -2.789 1.00 0.00 H new ATOM 0 HG22 THR A 18 11.969 -3.186 -1.798 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.085 -3.662 -3.100 1.00 0.00 H new ATOM 265 N ARG A 19 9.055 -4.102 -1.933 1.00 0.00 N ATOM 266 CA ARG A 19 8.486 -4.455 -0.644 1.00 0.00 C ATOM 267 C ARG A 19 8.115 -5.939 -0.615 1.00 0.00 C ATOM 268 O ARG A 19 8.406 -6.637 0.355 1.00 0.00 O ATOM 269 CB ARG A 19 7.240 -3.619 -0.344 1.00 0.00 C ATOM 270 CG ARG A 19 7.609 -2.156 -0.089 1.00 0.00 C ATOM 271 CD ARG A 19 8.265 -1.988 1.284 1.00 0.00 C ATOM 272 NE ARG A 19 9.237 -0.872 1.246 1.00 0.00 N ATOM 273 CZ ARG A 19 10.016 -0.520 2.278 1.00 0.00 C ATOM 274 NH1 ARG A 19 9.943 -1.194 3.434 1.00 0.00 N ATOM 275 NH2 ARG A 19 10.869 0.506 2.154 1.00 0.00 N ATOM 0 H ARG A 19 8.675 -3.251 -2.348 1.00 0.00 H new ATOM 0 HA ARG A 19 9.239 -4.251 0.117 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.545 -3.682 -1.182 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.726 -4.025 0.527 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.289 -1.808 -0.866 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.714 -1.536 -0.147 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.503 -1.793 2.039 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.769 -2.911 1.571 1.00 0.00 H new ATOM 0 HE ARG A 19 9.319 -0.338 0.381 1.00 0.00 H new ATOM 0 HH11 ARG A 19 9.294 -1.975 3.529 1.00 0.00 H new ATOM 0 HH12 ARG A 19 10.536 -0.926 4.219 1.00 0.00 H new ATOM 0 HH21 ARG A 19 10.925 1.019 1.274 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.462 0.774 2.939 1.00 0.00 H new ATOM 289 N TYR A 20 7.479 -6.378 -1.692 1.00 0.00 N ATOM 290 CA TYR A 20 7.065 -7.766 -1.802 1.00 0.00 C ATOM 291 C TYR A 20 8.237 -8.711 -1.528 1.00 0.00 C ATOM 292 O TYR A 20 8.099 -9.676 -0.778 1.00 0.00 O ATOM 293 CB TYR A 20 6.602 -7.954 -3.248 1.00 0.00 C ATOM 294 CG TYR A 20 5.937 -9.305 -3.518 1.00 0.00 C ATOM 295 CD1 TYR A 20 4.882 -9.724 -2.733 1.00 0.00 C ATOM 296 CD2 TYR A 20 6.392 -10.106 -4.546 1.00 0.00 C ATOM 297 CE1 TYR A 20 4.256 -10.996 -2.987 1.00 0.00 C ATOM 298 CE2 TYR A 20 5.767 -11.378 -4.800 1.00 0.00 C ATOM 299 CZ TYR A 20 4.730 -11.760 -4.008 1.00 0.00 C ATOM 300 OH TYR A 20 4.139 -12.962 -4.247 1.00 0.00 O ATOM 0 H TYR A 20 7.241 -5.797 -2.496 1.00 0.00 H new ATOM 0 HA TYR A 20 6.281 -7.991 -1.079 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.901 -7.159 -3.500 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.460 -7.844 -3.911 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.526 -9.098 -1.928 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.218 -9.778 -5.160 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.429 -11.336 -2.381 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.114 -12.014 -5.601 1.00 0.00 H new ATOM 0 HH TYR A 20 4.580 -13.398 -5.006 1.00 0.00 H new ATOM 310 N ALA A 21 9.365 -8.400 -2.151 1.00 0.00 N ATOM 311 CA ALA A 21 10.560 -9.209 -1.984 1.00 0.00 C ATOM 312 C ALA A 21 10.774 -9.493 -0.496 1.00 0.00 C ATOM 313 O ALA A 21 10.982 -10.640 -0.103 1.00 0.00 O ATOM 314 CB ALA A 21 11.754 -8.493 -2.619 1.00 0.00 C ATOM 0 H ALA A 21 9.476 -7.599 -2.772 1.00 0.00 H new ATOM 0 HA ALA A 21 10.448 -10.168 -2.490 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.651 -9.100 -2.494 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.564 -8.341 -3.682 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.899 -7.527 -2.135 1.00 0.00 H new ATOM 320 N LYS A 22 10.717 -8.429 0.291 1.00 0.00 N ATOM 321 CA LYS A 22 10.902 -8.549 1.727 1.00 0.00 C ATOM 322 C LYS A 22 9.842 -9.495 2.296 1.00 0.00 C ATOM 323 O LYS A 22 10.082 -10.172 3.295 1.00 0.00 O ATOM 324 CB LYS A 22 10.910 -7.167 2.384 1.00 0.00 C ATOM 325 CG LYS A 22 11.420 -7.248 3.825 1.00 0.00 C ATOM 326 CD LYS A 22 11.563 -5.852 4.435 1.00 0.00 C ATOM 327 CE LYS A 22 12.036 -5.934 5.887 1.00 0.00 C ATOM 328 NZ LYS A 22 13.427 -6.436 5.951 1.00 0.00 N ATOM 0 H LYS A 22 10.545 -7.479 -0.039 1.00 0.00 H new ATOM 0 HA LYS A 22 11.874 -8.988 1.951 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.542 -6.490 1.808 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.903 -6.750 2.374 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.731 -7.842 4.425 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.383 -7.758 3.846 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.273 -5.267 3.850 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.606 -5.332 4.389 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.977 -4.950 6.351 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.379 -6.594 6.453 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.803 -6.296 6.911 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.441 -7.449 5.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 14.016 -5.916 5.269 1.00 0.00 H new ATOM 342 N ALA A 23 8.693 -9.510 1.637 1.00 0.00 N ATOM 343 CA ALA A 23 7.596 -10.361 2.064 1.00 0.00 C ATOM 344 C ALA A 23 7.925 -11.817 1.728 1.00 0.00 C ATOM 345 O ALA A 23 7.291 -12.736 2.245 1.00 0.00 O ATOM 346 CB ALA A 23 6.298 -9.889 1.407 1.00 0.00 C ATOM 0 H ALA A 23 8.498 -8.946 0.810 1.00 0.00 H new ATOM 0 HA ALA A 23 7.457 -10.296 3.143 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.475 -10.528 1.727 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.094 -8.860 1.702 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.398 -9.943 0.323 1.00 0.00 H new ATOM 352 N ILE A 24 8.915 -11.982 0.863 1.00 0.00 N ATOM 353 CA ILE A 24 9.335 -13.310 0.451 1.00 0.00 C ATOM 354 C ILE A 24 10.792 -13.531 0.865 1.00 0.00 C ATOM 355 O ILE A 24 11.356 -14.596 0.618 1.00 0.00 O ATOM 356 CB ILE A 24 9.083 -13.513 -1.044 1.00 0.00 C ATOM 357 CG1 ILE A 24 9.645 -12.345 -1.858 1.00 0.00 C ATOM 358 CG2 ILE A 24 7.597 -13.743 -1.324 1.00 0.00 C ATOM 359 CD1 ILE A 24 9.501 -12.603 -3.359 1.00 0.00 C ATOM 0 H ILE A 24 9.438 -11.218 0.436 1.00 0.00 H new ATOM 0 HA ILE A 24 8.740 -14.071 0.956 1.00 0.00 H new ATOM 0 HB ILE A 24 9.613 -14.411 -1.360 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.122 -11.427 -1.592 1.00 0.00 H new ATOM 0 HG13 ILE A 24 10.696 -12.197 -1.610 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.446 -13.884 -2.394 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.259 -14.631 -0.789 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.025 -12.878 -0.988 1.00 0.00 H new ATOM 0 HD11 ILE A 24 9.908 -11.758 -3.914 1.00 0.00 H new ATOM 0 HD12 ILE A 24 10.045 -13.509 -3.626 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.447 -12.726 -3.607 1.00 0.00 H new ATOM 371 N GLY A 25 11.358 -12.507 1.486 1.00 0.00 N ATOM 372 CA GLY A 25 12.738 -12.576 1.936 1.00 0.00 C ATOM 373 C GLY A 25 13.707 -12.403 0.764 1.00 0.00 C ATOM 374 O GLY A 25 14.818 -12.930 0.790 1.00 0.00 O ATOM 0 H GLY A 25 10.887 -11.625 1.688 1.00 0.00 H new ATOM 0 HA2 GLY A 25 12.920 -11.801 2.681 1.00 0.00 H new ATOM 0 HA3 GLY A 25 12.918 -13.535 2.423 1.00 0.00 H new ATOM 378 N ILE A 26 13.249 -11.665 -0.236 1.00 0.00 N ATOM 379 CA ILE A 26 14.061 -11.416 -1.415 1.00 0.00 C ATOM 380 C ILE A 26 14.676 -10.018 -1.320 1.00 0.00 C ATOM 381 O ILE A 26 14.081 -9.113 -0.737 1.00 0.00 O ATOM 382 CB ILE A 26 13.241 -11.643 -2.687 1.00 0.00 C ATOM 383 CG1 ILE A 26 12.968 -13.132 -2.905 1.00 0.00 C ATOM 384 CG2 ILE A 26 13.920 -11.001 -3.898 1.00 0.00 C ATOM 385 CD1 ILE A 26 12.830 -13.452 -4.395 1.00 0.00 C ATOM 0 H ILE A 26 12.326 -11.231 -0.254 1.00 0.00 H new ATOM 0 HA ILE A 26 14.888 -12.125 -1.465 1.00 0.00 H new ATOM 0 HB ILE A 26 12.275 -11.154 -2.563 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.779 -13.721 -2.477 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.056 -13.418 -2.382 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.317 -11.177 -4.789 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.019 -9.928 -3.733 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.908 -11.440 -4.036 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.636 -14.517 -4.522 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.002 -12.880 -4.815 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.753 -13.187 -4.911 1.00 0.00 H new ATOM 397 N SER A 27 15.858 -9.886 -1.903 1.00 0.00 N ATOM 398 CA SER A 27 16.560 -8.614 -1.891 1.00 0.00 C ATOM 399 C SER A 27 16.119 -7.763 -3.083 1.00 0.00 C ATOM 400 O SER A 27 15.956 -6.550 -2.958 1.00 0.00 O ATOM 401 CB SER A 27 18.076 -8.821 -1.919 1.00 0.00 C ATOM 402 OG SER A 27 18.665 -8.627 -0.636 1.00 0.00 O ATOM 0 H SER A 27 16.347 -10.639 -2.387 1.00 0.00 H new ATOM 0 HA SER A 27 16.309 -8.093 -0.967 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.298 -9.828 -2.271 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.523 -8.128 -2.632 1.00 0.00 H new ATOM 0 HG SER A 27 19.633 -8.770 -0.695 1.00 0.00 H new ATOM 408 N GLU A 28 15.939 -8.431 -4.213 1.00 0.00 N ATOM 409 CA GLU A 28 15.520 -7.751 -5.427 1.00 0.00 C ATOM 410 C GLU A 28 13.995 -7.635 -5.471 1.00 0.00 C ATOM 411 O GLU A 28 13.295 -8.319 -4.726 1.00 0.00 O ATOM 412 CB GLU A 28 16.052 -8.468 -6.669 1.00 0.00 C ATOM 413 CG GLU A 28 15.098 -9.580 -7.110 1.00 0.00 C ATOM 414 CD GLU A 28 15.838 -10.647 -7.920 1.00 0.00 C ATOM 415 OE1 GLU A 28 16.939 -10.322 -8.415 1.00 0.00 O ATOM 416 OE2 GLU A 28 15.286 -11.763 -8.026 1.00 0.00 O ATOM 0 H GLU A 28 16.076 -9.437 -4.313 1.00 0.00 H new ATOM 0 HA GLU A 28 15.941 -6.746 -5.421 1.00 0.00 H new ATOM 0 HB2 GLU A 28 16.181 -7.751 -7.480 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.035 -8.890 -6.457 1.00 0.00 H new ATOM 0 HG2 GLU A 28 14.637 -10.037 -6.234 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.292 -9.157 -7.710 1.00 0.00 H new ATOM 423 N PRO A 29 13.512 -6.742 -6.376 1.00 0.00 N ATOM 424 CA PRO A 29 12.083 -6.528 -6.527 1.00 0.00 C ATOM 425 C PRO A 29 11.431 -7.692 -7.276 1.00 0.00 C ATOM 426 O PRO A 29 11.989 -8.201 -8.247 1.00 0.00 O ATOM 427 CB PRO A 29 11.959 -5.204 -7.263 1.00 0.00 C ATOM 428 CG PRO A 29 13.314 -4.955 -7.904 1.00 0.00 C ATOM 429 CD PRO A 29 14.311 -5.915 -7.275 1.00 0.00 C ATOM 0 HA PRO A 29 11.560 -6.487 -5.571 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.173 -5.248 -8.017 1.00 0.00 H new ATOM 0 HB3 PRO A 29 11.698 -4.399 -6.577 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.261 -5.111 -8.981 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.627 -3.923 -7.747 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.809 -6.520 -8.032 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.089 -5.378 -6.733 1.00 0.00 H new ATOM 437 N VAL A 30 10.258 -8.080 -6.797 1.00 0.00 N ATOM 438 CA VAL A 30 9.524 -9.174 -7.410 1.00 0.00 C ATOM 439 C VAL A 30 8.117 -8.697 -7.776 1.00 0.00 C ATOM 440 O VAL A 30 7.678 -7.641 -7.322 1.00 0.00 O ATOM 441 CB VAL A 30 9.520 -10.388 -6.478 1.00 0.00 C ATOM 442 CG1 VAL A 30 8.550 -11.460 -6.979 1.00 0.00 C ATOM 443 CG2 VAL A 30 10.930 -10.957 -6.314 1.00 0.00 C ATOM 0 H VAL A 30 9.798 -7.656 -5.991 1.00 0.00 H new ATOM 0 HA VAL A 30 10.010 -9.490 -8.333 1.00 0.00 H new ATOM 0 HB VAL A 30 9.176 -10.058 -5.498 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.566 -12.312 -6.299 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.542 -11.048 -7.020 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.850 -11.785 -7.975 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.899 -11.819 -5.647 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.314 -11.265 -7.287 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.583 -10.194 -5.891 1.00 0.00 H new ATOM 453 N LYS A 31 7.449 -9.497 -8.593 1.00 0.00 N ATOM 454 CA LYS A 31 6.101 -9.170 -9.025 1.00 0.00 C ATOM 455 C LYS A 31 5.151 -9.260 -7.829 1.00 0.00 C ATOM 456 O LYS A 31 5.313 -10.121 -6.966 1.00 0.00 O ATOM 457 CB LYS A 31 5.688 -10.051 -10.206 1.00 0.00 C ATOM 458 CG LYS A 31 6.516 -9.724 -11.450 1.00 0.00 C ATOM 459 CD LYS A 31 5.935 -10.405 -12.691 1.00 0.00 C ATOM 460 CE LYS A 31 6.855 -11.525 -13.183 1.00 0.00 C ATOM 461 NZ LYS A 31 6.235 -12.241 -14.320 1.00 0.00 N ATOM 0 H LYS A 31 7.816 -10.372 -8.968 1.00 0.00 H new ATOM 0 HA LYS A 31 6.057 -8.144 -9.392 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.818 -11.101 -9.944 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.629 -9.905 -10.421 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.541 -8.645 -11.601 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.546 -10.049 -11.301 1.00 0.00 H new ATOM 0 HD2 LYS A 31 4.951 -10.813 -12.459 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.796 -9.669 -13.483 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.815 -11.108 -13.488 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.054 -12.224 -12.370 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.871 -12.998 -14.642 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.330 -12.655 -14.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 6.067 -11.574 -15.100 1.00 0.00 H new ATOM 475 N VAL A 32 4.180 -8.359 -7.817 1.00 0.00 N ATOM 476 CA VAL A 32 3.203 -8.325 -6.741 1.00 0.00 C ATOM 477 C VAL A 32 1.881 -8.912 -7.240 1.00 0.00 C ATOM 478 O VAL A 32 1.240 -8.345 -8.124 1.00 0.00 O ATOM 479 CB VAL A 32 3.061 -6.898 -6.208 1.00 0.00 C ATOM 480 CG1 VAL A 32 1.706 -6.702 -5.524 1.00 0.00 C ATOM 481 CG2 VAL A 32 4.210 -6.550 -5.260 1.00 0.00 C ATOM 0 H VAL A 32 4.048 -7.647 -8.535 1.00 0.00 H new ATOM 0 HA VAL A 32 3.535 -8.938 -5.903 1.00 0.00 H new ATOM 0 HB VAL A 32 3.110 -6.216 -7.057 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.630 -5.680 -5.154 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.906 -6.889 -6.241 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.616 -7.398 -4.690 1.00 0.00 H new ATOM 0 HG21 VAL A 32 4.085 -5.530 -4.896 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.207 -7.240 -4.416 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.158 -6.631 -5.792 1.00 0.00 H new ATOM 491 N PRO A 33 1.503 -10.071 -6.636 1.00 0.00 N ATOM 492 CA PRO A 33 0.268 -10.740 -7.010 1.00 0.00 C ATOM 493 C PRO A 33 -0.948 -10.006 -6.441 1.00 0.00 C ATOM 494 O PRO A 33 -1.648 -10.534 -5.579 1.00 0.00 O ATOM 495 CB PRO A 33 0.412 -12.156 -6.475 1.00 0.00 C ATOM 496 CG PRO A 33 1.509 -12.095 -5.425 1.00 0.00 C ATOM 497 CD PRO A 33 2.237 -10.771 -5.586 1.00 0.00 C ATOM 0 HA PRO A 33 0.104 -10.750 -8.087 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.525 -12.507 -6.041 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.674 -12.850 -7.273 1.00 0.00 H new ATOM 0 HG2 PRO A 33 1.084 -12.178 -4.425 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.201 -12.928 -5.547 1.00 0.00 H new ATOM 0 HD2 PRO A 33 2.236 -10.203 -4.656 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.279 -10.923 -5.866 1.00 0.00 H new ATOM 505 N TYR A 34 -1.161 -8.801 -6.948 1.00 0.00 N ATOM 506 CA TYR A 34 -2.280 -7.989 -6.501 1.00 0.00 C ATOM 507 C TYR A 34 -3.509 -8.856 -6.221 1.00 0.00 C ATOM 508 O TYR A 34 -4.027 -8.862 -5.105 1.00 0.00 O ATOM 509 CB TYR A 34 -2.596 -7.035 -7.655 1.00 0.00 C ATOM 510 CG TYR A 34 -1.496 -6.008 -7.932 1.00 0.00 C ATOM 511 CD1 TYR A 34 -0.773 -5.472 -6.886 1.00 0.00 C ATOM 512 CD2 TYR A 34 -1.227 -5.618 -9.229 1.00 0.00 C ATOM 513 CE1 TYR A 34 0.262 -4.505 -7.147 1.00 0.00 C ATOM 514 CE2 TYR A 34 -0.192 -4.652 -9.490 1.00 0.00 C ATOM 515 CZ TYR A 34 0.501 -4.143 -8.436 1.00 0.00 C ATOM 516 OH TYR A 34 1.479 -3.230 -8.683 1.00 0.00 O ATOM 0 H TYR A 34 -0.578 -8.367 -7.664 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.029 -7.463 -5.580 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -2.769 -7.619 -8.559 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.524 -6.508 -7.433 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -0.983 -5.778 -5.872 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.793 -6.038 -10.048 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.835 -4.077 -6.338 1.00 0.00 H new ATOM 0 HE2 TYR A 34 0.029 -4.339 -10.500 1.00 0.00 H new ATOM 0 HH TYR A 34 1.539 -3.068 -9.648 1.00 0.00 H new ATOM 526 N SER A 35 -3.940 -9.567 -7.252 1.00 0.00 N ATOM 527 CA SER A 35 -5.098 -10.435 -7.131 1.00 0.00 C ATOM 528 C SER A 35 -5.058 -11.178 -5.794 1.00 0.00 C ATOM 529 O SER A 35 -6.001 -11.101 -5.008 1.00 0.00 O ATOM 530 CB SER A 35 -5.163 -11.432 -8.290 1.00 0.00 C ATOM 531 OG SER A 35 -4.971 -10.798 -9.551 1.00 0.00 O ATOM 0 H SER A 35 -3.507 -9.560 -8.176 1.00 0.00 H new ATOM 0 HA SER A 35 -5.994 -9.816 -7.169 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.402 -12.200 -8.151 1.00 0.00 H new ATOM 0 HB3 SER A 35 -6.130 -11.936 -8.281 1.00 0.00 H new ATOM 0 HG SER A 35 -5.018 -11.468 -10.265 1.00 0.00 H new ATOM 537 N LYS A 36 -3.955 -11.880 -5.577 1.00 0.00 N ATOM 538 CA LYS A 36 -3.780 -12.636 -4.348 1.00 0.00 C ATOM 539 C LYS A 36 -4.136 -11.749 -3.153 1.00 0.00 C ATOM 540 O LYS A 36 -4.799 -12.196 -2.219 1.00 0.00 O ATOM 541 CB LYS A 36 -2.369 -13.225 -4.278 1.00 0.00 C ATOM 542 CG LYS A 36 -2.109 -14.166 -5.456 1.00 0.00 C ATOM 543 CD LYS A 36 -2.970 -15.427 -5.351 1.00 0.00 C ATOM 544 CE LYS A 36 -2.744 -16.347 -6.552 1.00 0.00 C ATOM 545 NZ LYS A 36 -3.280 -17.699 -6.277 1.00 0.00 N ATOM 0 H LYS A 36 -3.174 -11.941 -6.231 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.458 -13.489 -4.325 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.634 -12.420 -4.282 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.243 -13.767 -3.341 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.325 -13.651 -6.392 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.055 -14.442 -5.480 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.731 -15.959 -4.430 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -4.022 -15.149 -5.294 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.229 -15.929 -7.434 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.679 -16.410 -6.774 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -3.448 -18.195 -7.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -2.594 -18.235 -5.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -4.175 -17.618 -5.753 1.00 0.00 H new ATOM 559 N PHE A 37 -3.679 -10.507 -3.222 1.00 0.00 N ATOM 560 CA PHE A 37 -3.940 -9.553 -2.158 1.00 0.00 C ATOM 561 C PHE A 37 -5.361 -8.995 -2.259 1.00 0.00 C ATOM 562 O PHE A 37 -5.916 -8.518 -1.270 1.00 0.00 O ATOM 563 CB PHE A 37 -2.942 -8.407 -2.329 1.00 0.00 C ATOM 564 CG PHE A 37 -1.540 -8.718 -1.800 1.00 0.00 C ATOM 565 CD1 PHE A 37 -0.709 -9.527 -2.510 1.00 0.00 C ATOM 566 CD2 PHE A 37 -1.126 -8.185 -0.619 1.00 0.00 C ATOM 567 CE1 PHE A 37 0.591 -9.816 -2.018 1.00 0.00 C ATOM 568 CE2 PHE A 37 0.175 -8.474 -0.128 1.00 0.00 C ATOM 569 CZ PHE A 37 1.006 -9.283 -0.838 1.00 0.00 C ATOM 0 H PHE A 37 -3.129 -10.140 -3.999 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.837 -10.040 -1.188 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.872 -8.155 -3.387 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.326 -7.525 -1.816 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.038 -9.950 -3.448 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.786 -7.543 -0.055 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.251 -10.459 -2.581 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.504 -8.051 0.810 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.995 -9.502 -0.465 1.00 0.00 H new ATOM 579 N LEU A 38 -5.910 -9.074 -3.462 1.00 0.00 N ATOM 580 CA LEU A 38 -7.255 -8.583 -3.705 1.00 0.00 C ATOM 581 C LEU A 38 -8.268 -9.602 -3.180 1.00 0.00 C ATOM 582 O LEU A 38 -9.113 -9.272 -2.350 1.00 0.00 O ATOM 583 CB LEU A 38 -7.441 -8.237 -5.184 1.00 0.00 C ATOM 584 CG LEU A 38 -6.577 -7.093 -5.719 1.00 0.00 C ATOM 585 CD1 LEU A 38 -6.802 -6.892 -7.219 1.00 0.00 C ATOM 586 CD2 LEU A 38 -6.819 -5.807 -4.926 1.00 0.00 C ATOM 0 H LEU A 38 -5.447 -9.471 -4.280 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.425 -7.654 -3.161 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.233 -9.129 -5.774 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.488 -7.983 -5.348 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.530 -7.363 -5.584 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.176 -6.073 -7.574 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.540 -7.806 -7.752 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.850 -6.653 -7.401 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.193 -5.010 -5.326 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -7.868 -5.521 -5.008 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.569 -5.973 -3.878 1.00 0.00 H new ATOM 598 N MET A 39 -8.150 -10.821 -3.687 1.00 0.00 N ATOM 599 CA MET A 39 -9.045 -11.891 -3.280 1.00 0.00 C ATOM 600 C MET A 39 -8.783 -12.302 -1.829 1.00 0.00 C ATOM 601 O MET A 39 -9.659 -12.861 -1.171 1.00 0.00 O ATOM 602 CB MET A 39 -8.847 -13.099 -4.197 1.00 0.00 C ATOM 603 CG MET A 39 -9.072 -12.718 -5.661 1.00 0.00 C ATOM 604 SD MET A 39 -9.123 -14.188 -6.673 1.00 0.00 S ATOM 605 CE MET A 39 -7.393 -14.630 -6.666 1.00 0.00 C ATOM 0 H MET A 39 -7.448 -11.091 -4.376 1.00 0.00 H new ATOM 0 HA MET A 39 -10.071 -11.531 -3.356 1.00 0.00 H new ATOM 0 HB2 MET A 39 -7.839 -13.494 -4.071 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.538 -13.893 -3.914 1.00 0.00 H new ATOM 0 HG2 MET A 39 -10.005 -12.164 -5.762 1.00 0.00 H new ATOM 0 HG3 MET A 39 -8.273 -12.060 -6.001 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.207 -15.384 -7.430 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.791 -13.746 -6.875 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.124 -15.030 -5.688 1.00 0.00 H new ATOM 615 N HIS A 40 -7.574 -12.010 -1.374 1.00 0.00 N ATOM 616 CA HIS A 40 -7.185 -12.342 -0.014 1.00 0.00 C ATOM 617 C HIS A 40 -6.573 -11.113 0.660 1.00 0.00 C ATOM 618 O HIS A 40 -5.376 -11.086 0.941 1.00 0.00 O ATOM 619 CB HIS A 40 -6.253 -13.555 0.004 1.00 0.00 C ATOM 620 CG HIS A 40 -6.658 -14.656 -0.947 1.00 0.00 C ATOM 621 ND1 HIS A 40 -7.532 -15.669 -0.592 1.00 0.00 N ATOM 622 CD2 HIS A 40 -6.302 -14.891 -2.242 1.00 0.00 C ATOM 623 CE1 HIS A 40 -7.686 -16.472 -1.634 1.00 0.00 C ATOM 624 NE2 HIS A 40 -6.922 -15.989 -2.655 1.00 0.00 N ATOM 0 H HIS A 40 -6.850 -11.547 -1.923 1.00 0.00 H new ATOM 0 HA HIS A 40 -8.066 -12.626 0.561 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -5.243 -13.228 -0.244 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -6.218 -13.958 1.016 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -5.629 -14.286 -2.832 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -8.308 -17.354 -1.669 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -6.841 -16.404 -3.583 1.00 0.00 H new ATOM 632 N PRO A 41 -7.444 -10.098 0.907 1.00 0.00 N ATOM 633 CA PRO A 41 -7.002 -8.869 1.542 1.00 0.00 C ATOM 634 C PRO A 41 -6.769 -9.079 3.040 1.00 0.00 C ATOM 635 O PRO A 41 -6.031 -8.323 3.669 1.00 0.00 O ATOM 636 CB PRO A 41 -8.097 -7.857 1.247 1.00 0.00 C ATOM 637 CG PRO A 41 -9.322 -8.670 0.861 1.00 0.00 C ATOM 638 CD PRO A 41 -8.869 -10.095 0.588 1.00 0.00 C ATOM 0 HA PRO A 41 -6.043 -8.520 1.160 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.300 -7.235 2.119 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.802 -7.187 0.439 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.061 -8.651 1.662 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.799 -8.245 -0.022 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.414 -10.809 1.205 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.043 -10.374 -0.451 1.00 0.00 H new ATOM 646 N GLU A 42 -7.413 -10.110 3.567 1.00 0.00 N ATOM 647 CA GLU A 42 -7.285 -10.429 4.979 1.00 0.00 C ATOM 648 C GLU A 42 -5.999 -11.219 5.230 1.00 0.00 C ATOM 649 O GLU A 42 -5.343 -11.034 6.254 1.00 0.00 O ATOM 650 CB GLU A 42 -8.509 -11.200 5.480 1.00 0.00 C ATOM 651 CG GLU A 42 -9.502 -10.262 6.169 1.00 0.00 C ATOM 652 CD GLU A 42 -9.588 -10.560 7.667 1.00 0.00 C ATOM 653 OE1 GLU A 42 -8.742 -10.009 8.405 1.00 0.00 O ATOM 654 OE2 GLU A 42 -10.497 -11.332 8.041 1.00 0.00 O ATOM 0 H GLU A 42 -8.025 -10.735 3.042 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.230 -9.496 5.539 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.996 -11.700 4.643 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.194 -11.977 6.176 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.195 -9.227 6.017 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.487 -10.372 5.715 1.00 0.00 H new ATOM 661 N GLU A 43 -5.678 -12.084 4.279 1.00 0.00 N ATOM 662 CA GLU A 43 -4.483 -12.903 4.385 1.00 0.00 C ATOM 663 C GLU A 43 -3.262 -12.126 3.888 1.00 0.00 C ATOM 664 O GLU A 43 -2.255 -12.031 4.588 1.00 0.00 O ATOM 665 CB GLU A 43 -4.647 -14.216 3.616 1.00 0.00 C ATOM 666 CG GLU A 43 -5.639 -15.143 4.321 1.00 0.00 C ATOM 667 CD GLU A 43 -7.015 -14.484 4.444 1.00 0.00 C ATOM 668 OE1 GLU A 43 -7.632 -14.258 3.381 1.00 0.00 O ATOM 669 OE2 GLU A 43 -7.417 -14.221 5.597 1.00 0.00 O ATOM 0 H GLU A 43 -6.225 -12.235 3.431 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.329 -13.152 5.435 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.994 -14.008 2.604 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.681 -14.712 3.526 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.728 -16.077 3.765 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.264 -15.397 5.312 1.00 0.00 H new ATOM 676 N LEU A 44 -3.391 -11.590 2.683 1.00 0.00 N ATOM 677 CA LEU A 44 -2.311 -10.825 2.085 1.00 0.00 C ATOM 678 C LEU A 44 -2.730 -9.358 1.977 1.00 0.00 C ATOM 679 O LEU A 44 -3.731 -9.040 1.336 1.00 0.00 O ATOM 680 CB LEU A 44 -1.890 -11.444 0.750 1.00 0.00 C ATOM 681 CG LEU A 44 -2.002 -12.967 0.653 1.00 0.00 C ATOM 682 CD1 LEU A 44 -1.896 -13.433 -0.801 1.00 0.00 C ATOM 683 CD2 LEU A 44 -0.970 -13.651 1.551 1.00 0.00 C ATOM 0 H LEU A 44 -4.227 -11.671 2.105 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.425 -10.858 2.719 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.498 -11.004 -0.040 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.856 -11.162 0.551 1.00 0.00 H new ATOM 0 HG LEU A 44 -2.988 -13.261 1.014 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -1.979 -14.519 -0.842 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.700 -12.986 -1.386 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -0.934 -13.127 -1.212 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.071 -14.733 1.463 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.033 -13.354 1.244 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.135 -13.354 2.587 1.00 0.00 H new ATOM 695 N PHE A 45 -1.944 -8.502 2.613 1.00 0.00 N ATOM 696 CA PHE A 45 -2.221 -7.076 2.596 1.00 0.00 C ATOM 697 C PHE A 45 -0.934 -6.265 2.762 1.00 0.00 C ATOM 698 O PHE A 45 0.155 -6.832 2.845 1.00 0.00 O ATOM 699 CB PHE A 45 -3.148 -6.787 3.779 1.00 0.00 C ATOM 700 CG PHE A 45 -2.564 -7.179 5.137 1.00 0.00 C ATOM 701 CD1 PHE A 45 -1.681 -6.355 5.762 1.00 0.00 C ATOM 702 CD2 PHE A 45 -2.929 -8.353 5.721 1.00 0.00 C ATOM 703 CE1 PHE A 45 -1.139 -6.720 7.023 1.00 0.00 C ATOM 704 CE2 PHE A 45 -2.388 -8.717 6.982 1.00 0.00 C ATOM 705 CZ PHE A 45 -1.504 -7.893 7.606 1.00 0.00 C ATOM 0 H PHE A 45 -1.115 -8.769 3.144 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.675 -6.796 1.645 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.385 -5.723 3.790 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.087 -7.321 3.631 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.392 -5.423 5.299 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.630 -9.008 5.225 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.437 -6.066 7.519 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.678 -9.648 7.446 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.092 -8.170 8.565 1.00 0.00 H new ATOM 715 N VAL A 46 -1.101 -4.952 2.806 1.00 0.00 N ATOM 716 CA VAL A 46 0.033 -4.057 2.960 1.00 0.00 C ATOM 717 C VAL A 46 -0.234 -3.097 4.121 1.00 0.00 C ATOM 718 O VAL A 46 -1.368 -2.667 4.326 1.00 0.00 O ATOM 719 CB VAL A 46 0.315 -3.336 1.640 1.00 0.00 C ATOM 720 CG1 VAL A 46 1.408 -2.280 1.815 1.00 0.00 C ATOM 721 CG2 VAL A 46 0.686 -4.333 0.540 1.00 0.00 C ATOM 0 H VAL A 46 -2.006 -4.486 2.738 1.00 0.00 H new ATOM 0 HA VAL A 46 0.933 -4.621 3.205 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.598 -2.825 1.335 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.589 -1.782 0.862 1.00 0.00 H new ATOM 0 HG12 VAL A 46 1.089 -1.545 2.553 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.326 -2.759 2.154 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.882 -3.795 -0.388 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.579 -4.884 0.835 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.138 -5.031 0.388 1.00 0.00 H new ATOM 731 N VAL A 47 0.829 -2.788 4.849 1.00 0.00 N ATOM 732 CA VAL A 47 0.723 -1.886 5.983 1.00 0.00 C ATOM 733 C VAL A 47 1.691 -0.717 5.791 1.00 0.00 C ATOM 734 O VAL A 47 2.729 -0.864 5.148 1.00 0.00 O ATOM 735 CB VAL A 47 0.963 -2.653 7.285 1.00 0.00 C ATOM 736 CG1 VAL A 47 -0.204 -3.595 7.589 1.00 0.00 C ATOM 737 CG2 VAL A 47 2.287 -3.418 7.236 1.00 0.00 C ATOM 0 H VAL A 47 1.768 -3.146 4.675 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.282 -1.469 6.047 1.00 0.00 H new ATOM 0 HB VAL A 47 1.027 -1.926 8.095 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.008 -4.128 8.519 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.122 -3.016 7.689 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.314 -4.313 6.776 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.432 -3.954 8.174 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.266 -4.130 6.411 1.00 0.00 H new ATOM 0 HG23 VAL A 47 3.108 -2.716 7.088 1.00 0.00 H new ATOM 747 N GLY A 48 1.316 0.419 6.361 1.00 0.00 N ATOM 748 CA GLY A 48 2.138 1.613 6.261 1.00 0.00 C ATOM 749 C GLY A 48 1.558 2.593 5.239 1.00 0.00 C ATOM 750 O GLY A 48 1.797 3.797 5.324 1.00 0.00 O ATOM 0 H GLY A 48 0.454 0.538 6.893 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.205 2.096 7.236 1.00 0.00 H new ATOM 0 HA3 GLY A 48 3.152 1.338 5.971 1.00 0.00 H new ATOM 754 N LEU A 49 0.808 2.042 4.297 1.00 0.00 N ATOM 755 CA LEU A 49 0.192 2.852 3.260 1.00 0.00 C ATOM 756 C LEU A 49 -0.371 4.130 3.885 1.00 0.00 C ATOM 757 O LEU A 49 -0.671 4.162 5.077 1.00 0.00 O ATOM 758 CB LEU A 49 -0.846 2.036 2.488 1.00 0.00 C ATOM 759 CG LEU A 49 -0.297 1.100 1.409 1.00 0.00 C ATOM 760 CD1 LEU A 49 -1.333 0.045 1.019 1.00 0.00 C ATOM 761 CD2 LEU A 49 0.200 1.892 0.198 1.00 0.00 C ATOM 0 H LEU A 49 0.613 1.043 4.230 1.00 0.00 H new ATOM 0 HA LEU A 49 0.935 3.157 2.523 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.415 1.441 3.202 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.547 2.727 2.019 1.00 0.00 H new ATOM 0 HG LEU A 49 0.562 0.570 1.821 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.917 -0.607 0.251 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.596 -0.548 1.895 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.226 0.537 0.633 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.585 1.203 -0.554 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.624 2.467 -0.224 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.994 2.571 0.508 1.00 0.00 H new ATOM 773 N PRO A 50 -0.501 5.179 3.029 1.00 0.00 N ATOM 774 CA PRO A 50 -1.022 6.457 3.485 1.00 0.00 C ATOM 775 C PRO A 50 -2.537 6.389 3.687 1.00 0.00 C ATOM 776 O PRO A 50 -3.126 5.310 3.641 1.00 0.00 O ATOM 777 CB PRO A 50 -0.609 7.455 2.416 1.00 0.00 C ATOM 778 CG PRO A 50 -0.280 6.630 1.181 1.00 0.00 C ATOM 779 CD PRO A 50 -0.155 5.178 1.611 1.00 0.00 C ATOM 0 HA PRO A 50 -0.626 6.750 4.457 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.412 8.162 2.211 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.254 8.038 2.738 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.062 6.740 0.429 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.649 6.975 0.728 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.827 4.537 1.040 1.00 0.00 H new ATOM 0 HD3 PRO A 50 0.856 4.803 1.451 1.00 0.00 H new ATOM 787 N GLU A 51 -3.126 7.556 3.906 1.00 0.00 N ATOM 788 CA GLU A 51 -4.561 7.643 4.115 1.00 0.00 C ATOM 789 C GLU A 51 -5.290 7.706 2.771 1.00 0.00 C ATOM 790 O GLU A 51 -4.820 8.351 1.835 1.00 0.00 O ATOM 791 CB GLU A 51 -4.916 8.849 4.987 1.00 0.00 C ATOM 792 CG GLU A 51 -4.351 10.141 4.394 1.00 0.00 C ATOM 793 CD GLU A 51 -5.402 11.252 4.398 1.00 0.00 C ATOM 794 OE1 GLU A 51 -6.063 11.404 5.449 1.00 0.00 O ATOM 795 OE2 GLU A 51 -5.522 11.925 3.352 1.00 0.00 O ATOM 0 H GLU A 51 -2.635 8.449 3.943 1.00 0.00 H new ATOM 0 HA GLU A 51 -4.887 6.746 4.642 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -5.999 8.930 5.078 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.522 8.704 5.993 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.480 10.458 4.967 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -4.013 9.959 3.374 1.00 0.00 H new ATOM 802 N GLY A 52 -6.427 7.027 2.719 1.00 0.00 N ATOM 803 CA GLY A 52 -7.225 6.997 1.505 1.00 0.00 C ATOM 804 C GLY A 52 -6.473 6.298 0.371 1.00 0.00 C ATOM 805 O GLY A 52 -6.674 6.616 -0.800 1.00 0.00 O ATOM 0 H GLY A 52 -6.814 6.494 3.498 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.165 6.479 1.696 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.477 8.014 1.206 1.00 0.00 H new ATOM 809 N ILE A 53 -5.621 5.360 0.758 1.00 0.00 N ATOM 810 CA ILE A 53 -4.838 4.614 -0.212 1.00 0.00 C ATOM 811 C ILE A 53 -4.676 3.171 0.270 1.00 0.00 C ATOM 812 O ILE A 53 -4.495 2.928 1.462 1.00 0.00 O ATOM 813 CB ILE A 53 -3.510 5.323 -0.487 1.00 0.00 C ATOM 814 CG1 ILE A 53 -3.739 6.784 -0.877 1.00 0.00 C ATOM 815 CG2 ILE A 53 -2.694 4.569 -1.539 1.00 0.00 C ATOM 816 CD1 ILE A 53 -2.448 7.423 -1.393 1.00 0.00 C ATOM 0 H ILE A 53 -5.456 5.100 1.730 1.00 0.00 H new ATOM 0 HA ILE A 53 -5.357 4.574 -1.170 1.00 0.00 H new ATOM 0 HB ILE A 53 -2.926 5.324 0.433 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.510 6.842 -1.645 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.105 7.341 -0.015 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.755 5.094 -1.716 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.484 3.560 -1.183 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.260 4.515 -2.469 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.639 8.462 -1.663 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -1.687 7.385 -0.614 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -2.098 6.878 -2.270 1.00 0.00 H new ATOM 828 N SER A 54 -4.749 2.252 -0.681 1.00 0.00 N ATOM 829 CA SER A 54 -4.613 0.839 -0.368 1.00 0.00 C ATOM 830 C SER A 54 -3.674 0.168 -1.372 1.00 0.00 C ATOM 831 O SER A 54 -2.762 0.806 -1.896 1.00 0.00 O ATOM 832 CB SER A 54 -5.975 0.142 -0.366 1.00 0.00 C ATOM 833 OG SER A 54 -6.030 -0.920 0.582 1.00 0.00 O ATOM 0 H SER A 54 -4.901 2.458 -1.669 1.00 0.00 H new ATOM 0 HA SER A 54 -4.188 0.750 0.632 1.00 0.00 H new ATOM 0 HB2 SER A 54 -6.754 0.870 -0.140 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.183 -0.250 -1.362 1.00 0.00 H new ATOM 0 HG SER A 54 -6.916 -1.338 0.554 1.00 0.00 H new ATOM 839 N LEU A 55 -3.930 -1.109 -1.611 1.00 0.00 N ATOM 840 CA LEU A 55 -3.119 -1.874 -2.544 1.00 0.00 C ATOM 841 C LEU A 55 -3.893 -2.062 -3.850 1.00 0.00 C ATOM 842 O LEU A 55 -4.877 -2.798 -3.892 1.00 0.00 O ATOM 843 CB LEU A 55 -2.661 -3.186 -1.905 1.00 0.00 C ATOM 844 CG LEU A 55 -1.653 -4.008 -2.710 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.418 -3.174 -3.056 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.285 -5.299 -1.975 1.00 0.00 C ATOM 0 H LEU A 55 -4.688 -1.634 -1.175 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.206 -1.331 -2.790 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.222 -2.960 -0.933 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.540 -3.804 -1.722 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.122 -4.296 -3.651 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.283 -3.782 -3.628 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.717 -2.310 -3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.061 -2.835 -2.138 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.567 -5.864 -2.569 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -0.843 -5.054 -1.009 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.182 -5.899 -1.822 1.00 0.00 H new ATOM 858 N ARG A 56 -3.418 -1.384 -4.885 1.00 0.00 N ATOM 859 CA ARG A 56 -4.053 -1.468 -6.189 1.00 0.00 C ATOM 860 C ARG A 56 -3.070 -1.053 -7.286 1.00 0.00 C ATOM 861 O ARG A 56 -2.022 -0.477 -6.999 1.00 0.00 O ATOM 862 CB ARG A 56 -5.291 -0.570 -6.258 1.00 0.00 C ATOM 863 CG ARG A 56 -6.488 -1.234 -5.575 1.00 0.00 C ATOM 864 CD ARG A 56 -7.775 -0.990 -6.365 1.00 0.00 C ATOM 865 NE ARG A 56 -8.765 -2.046 -6.059 1.00 0.00 N ATOM 866 CZ ARG A 56 -9.999 -2.093 -6.579 1.00 0.00 C ATOM 867 NH1 ARG A 56 -10.402 -1.142 -7.434 1.00 0.00 N ATOM 868 NH2 ARG A 56 -10.830 -3.089 -6.245 1.00 0.00 N ATOM 0 H ARG A 56 -2.601 -0.774 -4.847 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.359 -2.503 -6.342 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.079 0.386 -5.779 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.533 -0.358 -7.299 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.311 -2.306 -5.484 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.598 -0.842 -4.564 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.185 -0.012 -6.114 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.559 -0.981 -7.433 1.00 0.00 H new ATOM 0 HE ARG A 56 -8.491 -2.785 -5.411 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -9.769 -0.383 -7.688 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -11.341 -1.177 -7.830 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.524 -3.812 -5.594 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -11.769 -3.124 -6.641 1.00 0.00 H new ATOM 882 N ARG A 57 -3.443 -1.364 -8.519 1.00 0.00 N ATOM 883 CA ARG A 57 -2.607 -1.031 -9.660 1.00 0.00 C ATOM 884 C ARG A 57 -2.095 0.406 -9.541 1.00 0.00 C ATOM 885 O ARG A 57 -2.865 1.321 -9.255 1.00 0.00 O ATOM 886 CB ARG A 57 -3.379 -1.184 -10.971 1.00 0.00 C ATOM 887 CG ARG A 57 -2.969 -2.463 -11.703 1.00 0.00 C ATOM 888 CD ARG A 57 -4.197 -3.288 -12.096 1.00 0.00 C ATOM 889 NE ARG A 57 -4.182 -4.587 -11.386 1.00 0.00 N ATOM 890 CZ ARG A 57 -5.264 -5.357 -11.207 1.00 0.00 C ATOM 891 NH1 ARG A 57 -6.452 -4.965 -11.685 1.00 0.00 N ATOM 892 NH2 ARG A 57 -5.157 -6.520 -10.551 1.00 0.00 N ATOM 0 H ARG A 57 -4.313 -1.843 -8.753 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.763 -1.721 -9.666 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -4.449 -1.205 -10.766 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -3.193 -0.320 -11.609 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.397 -2.208 -12.595 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.316 -3.058 -11.065 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.107 -2.740 -11.851 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.205 -3.453 -13.173 1.00 0.00 H new ATOM 0 HE ARG A 57 -3.293 -4.916 -11.010 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -6.533 -4.080 -12.186 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -7.275 -5.551 -11.549 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.252 -6.819 -10.188 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.980 -7.106 -10.415 1.00 0.00 H new ATOM 906 N PRO A 58 -0.765 0.563 -9.775 1.00 0.00 N ATOM 907 CA PRO A 58 -0.141 1.873 -9.697 1.00 0.00 C ATOM 908 C PRO A 58 -0.491 2.720 -10.923 1.00 0.00 C ATOM 909 O PRO A 58 0.397 3.247 -11.592 1.00 0.00 O ATOM 910 CB PRO A 58 1.348 1.594 -9.575 1.00 0.00 C ATOM 911 CG PRO A 58 1.544 0.164 -10.053 1.00 0.00 C ATOM 912 CD PRO A 58 0.178 -0.498 -10.117 1.00 0.00 C ATOM 0 HA PRO A 58 -0.494 2.457 -8.847 1.00 0.00 H new ATOM 0 HB2 PRO A 58 1.927 2.291 -10.181 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.684 1.711 -8.545 1.00 0.00 H new ATOM 0 HG2 PRO A 58 2.021 0.151 -11.033 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.200 -0.379 -9.373 1.00 0.00 H new ATOM 0 HD2 PRO A 58 -0.021 -0.900 -11.111 1.00 0.00 H new ATOM 0 HD3 PRO A 58 0.108 -1.330 -9.417 1.00 0.00 H new ATOM 920 N ASN A 59 -1.787 2.825 -11.179 1.00 0.00 N ATOM 921 CA ASN A 59 -2.265 3.599 -12.312 1.00 0.00 C ATOM 922 C ASN A 59 -3.662 4.141 -12.001 1.00 0.00 C ATOM 923 O ASN A 59 -3.944 5.314 -12.240 1.00 0.00 O ATOM 924 CB ASN A 59 -2.363 2.733 -13.569 1.00 0.00 C ATOM 925 CG ASN A 59 -2.374 1.245 -13.210 1.00 0.00 C ATOM 926 OD1 ASN A 59 -1.502 0.739 -12.524 1.00 0.00 O ATOM 927 ND2 ASN A 59 -3.409 0.576 -13.711 1.00 0.00 N ATOM 0 H ASN A 59 -2.520 2.387 -10.621 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.559 4.411 -12.488 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -3.270 2.985 -14.119 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -1.521 2.946 -14.228 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -3.508 -0.423 -13.528 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -4.104 1.062 -14.278 1.00 0.00 H new ATOM 934 N CYS A 60 -4.499 3.260 -11.473 1.00 0.00 N ATOM 935 CA CYS A 60 -5.859 3.635 -11.126 1.00 0.00 C ATOM 936 C CYS A 60 -5.800 4.816 -10.156 1.00 0.00 C ATOM 937 O CYS A 60 -6.780 5.542 -9.995 1.00 0.00 O ATOM 938 CB CYS A 60 -6.640 2.456 -10.543 1.00 0.00 C ATOM 939 SG CYS A 60 -8.434 2.814 -10.578 1.00 0.00 S ATOM 0 H CYS A 60 -4.261 2.288 -11.277 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.397 3.933 -12.026 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -6.430 1.552 -11.115 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -6.319 2.267 -9.519 1.00 0.00 H new ATOM 0 HG CYS A 60 -9.088 1.805 -10.083 1.00 0.00 H new ATOM 945 N PHE A 61 -4.640 4.973 -9.535 1.00 0.00 N ATOM 946 CA PHE A 61 -4.440 6.054 -8.585 1.00 0.00 C ATOM 947 C PHE A 61 -4.055 7.350 -9.302 1.00 0.00 C ATOM 948 O PHE A 61 -3.944 7.377 -10.527 1.00 0.00 O ATOM 949 CB PHE A 61 -3.291 5.635 -7.666 1.00 0.00 C ATOM 950 CG PHE A 61 -3.650 4.505 -6.698 1.00 0.00 C ATOM 951 CD1 PHE A 61 -4.360 4.776 -5.570 1.00 0.00 C ATOM 952 CD2 PHE A 61 -3.260 3.230 -6.966 1.00 0.00 C ATOM 953 CE1 PHE A 61 -4.693 3.727 -4.672 1.00 0.00 C ATOM 954 CE2 PHE A 61 -3.593 2.182 -6.068 1.00 0.00 C ATOM 955 CZ PHE A 61 -4.302 2.453 -4.940 1.00 0.00 C ATOM 0 H PHE A 61 -3.829 4.370 -9.671 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.360 6.236 -8.030 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.446 5.321 -8.278 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.964 6.502 -7.092 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.670 5.788 -5.357 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -2.697 3.015 -7.862 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -5.257 3.942 -3.776 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.283 1.170 -6.281 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.555 1.656 -4.257 1.00 0.00 H new ATOM 965 N GLY A 62 -3.864 8.394 -8.509 1.00 0.00 N ATOM 966 CA GLY A 62 -3.494 9.690 -9.052 1.00 0.00 C ATOM 967 C GLY A 62 -2.093 10.097 -8.594 1.00 0.00 C ATOM 968 O GLY A 62 -1.622 9.648 -7.550 1.00 0.00 O ATOM 0 H GLY A 62 -3.959 8.369 -7.494 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.529 9.655 -10.141 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -4.217 10.441 -8.734 1.00 0.00 H new ATOM 972 N ILE A 63 -1.465 10.943 -9.397 1.00 0.00 N ATOM 973 CA ILE A 63 -0.127 11.417 -9.087 1.00 0.00 C ATOM 974 C ILE A 63 -0.020 11.681 -7.584 1.00 0.00 C ATOM 975 O ILE A 63 0.863 11.143 -6.916 1.00 0.00 O ATOM 976 CB ILE A 63 0.227 12.628 -9.951 1.00 0.00 C ATOM 977 CG1 ILE A 63 0.719 12.192 -11.333 1.00 0.00 C ATOM 978 CG2 ILE A 63 1.238 13.532 -9.242 1.00 0.00 C ATOM 979 CD1 ILE A 63 -0.309 12.531 -12.414 1.00 0.00 C ATOM 0 H ILE A 63 -1.858 11.313 -10.262 1.00 0.00 H new ATOM 0 HA ILE A 63 0.613 10.655 -9.331 1.00 0.00 H new ATOM 0 HB ILE A 63 -0.679 13.215 -10.102 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.665 12.685 -11.558 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.911 11.119 -11.333 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.472 14.385 -9.879 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.814 13.886 -8.302 1.00 0.00 H new ATOM 0 HG23 ILE A 63 2.149 12.970 -9.039 1.00 0.00 H new ATOM 0 HD11 ILE A 63 0.066 12.210 -13.386 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.246 12.017 -12.199 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -0.481 13.607 -12.428 1.00 0.00 H new ATOM 991 N ALA A 64 -0.930 12.510 -7.095 1.00 0.00 N ATOM 992 CA ALA A 64 -0.949 12.853 -5.683 1.00 0.00 C ATOM 993 C ALA A 64 -0.827 11.575 -4.851 1.00 0.00 C ATOM 994 O ALA A 64 0.031 11.481 -3.975 1.00 0.00 O ATOM 995 CB ALA A 64 -2.225 13.636 -5.365 1.00 0.00 C ATOM 0 H ALA A 64 -1.660 12.955 -7.652 1.00 0.00 H new ATOM 0 HA ALA A 64 -0.103 13.492 -5.432 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -2.240 13.893 -4.306 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -2.250 14.549 -5.961 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -3.096 13.024 -5.602 1.00 0.00 H new ATOM 1001 N LYS A 65 -1.697 10.623 -5.154 1.00 0.00 N ATOM 1002 CA LYS A 65 -1.697 9.355 -4.445 1.00 0.00 C ATOM 1003 C LYS A 65 -0.347 8.664 -4.646 1.00 0.00 C ATOM 1004 O LYS A 65 0.362 8.387 -3.679 1.00 0.00 O ATOM 1005 CB LYS A 65 -2.894 8.503 -4.872 1.00 0.00 C ATOM 1006 CG LYS A 65 -4.212 9.227 -4.589 1.00 0.00 C ATOM 1007 CD LYS A 65 -5.336 8.229 -4.308 1.00 0.00 C ATOM 1008 CE LYS A 65 -6.297 8.769 -3.247 1.00 0.00 C ATOM 1009 NZ LYS A 65 -7.646 8.970 -3.823 1.00 0.00 N ATOM 0 H LYS A 65 -2.407 10.705 -5.882 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.816 9.517 -3.374 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.821 8.275 -5.935 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.876 7.552 -4.340 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -4.089 9.892 -3.734 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.479 9.850 -5.442 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.883 8.023 -5.228 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.911 7.283 -3.971 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -6.353 8.073 -2.410 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -5.919 9.712 -2.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.286 9.337 -3.089 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.591 9.652 -4.607 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -8.011 8.063 -4.178 1.00 0.00 H new ATOM 1023 N LEU A 66 -0.032 8.405 -5.906 1.00 0.00 N ATOM 1024 CA LEU A 66 1.220 7.751 -6.246 1.00 0.00 C ATOM 1025 C LEU A 66 2.336 8.300 -5.354 1.00 0.00 C ATOM 1026 O LEU A 66 3.085 7.535 -4.749 1.00 0.00 O ATOM 1027 CB LEU A 66 1.507 7.887 -7.742 1.00 0.00 C ATOM 1028 CG LEU A 66 0.565 7.125 -8.677 1.00 0.00 C ATOM 1029 CD1 LEU A 66 0.769 7.556 -10.131 1.00 0.00 C ATOM 1030 CD2 LEU A 66 0.721 5.614 -8.500 1.00 0.00 C ATOM 0 H LEU A 66 -0.623 8.636 -6.705 1.00 0.00 H new ATOM 0 HA LEU A 66 1.154 6.680 -6.054 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.470 8.944 -8.004 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.526 7.547 -7.929 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.461 7.376 -8.407 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.088 6.999 -10.774 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.568 8.623 -10.226 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.797 7.353 -10.430 1.00 0.00 H new ATOM 0 HD21 LEU A 66 0.040 5.096 -9.176 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.747 5.325 -8.727 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.487 5.342 -7.471 1.00 0.00 H new ATOM 1042 N ARG A 67 2.410 9.622 -5.301 1.00 0.00 N ATOM 1043 CA ARG A 67 3.421 10.283 -4.493 1.00 0.00 C ATOM 1044 C ARG A 67 3.331 9.812 -3.040 1.00 0.00 C ATOM 1045 O ARG A 67 4.293 9.270 -2.498 1.00 0.00 O ATOM 1046 CB ARG A 67 3.257 11.803 -4.540 1.00 0.00 C ATOM 1047 CG ARG A 67 3.638 12.354 -5.915 1.00 0.00 C ATOM 1048 CD ARG A 67 4.000 13.838 -5.831 1.00 0.00 C ATOM 1049 NE ARG A 67 5.246 14.099 -6.586 1.00 0.00 N ATOM 1050 CZ ARG A 67 5.944 15.240 -6.512 1.00 0.00 C ATOM 1051 NH1 ARG A 67 5.522 16.233 -5.717 1.00 0.00 N ATOM 1052 NH2 ARG A 67 7.064 15.389 -7.232 1.00 0.00 N ATOM 0 H ARG A 67 1.786 10.253 -5.804 1.00 0.00 H new ATOM 0 HA ARG A 67 4.396 10.021 -4.904 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.225 12.068 -4.312 1.00 0.00 H new ATOM 0 HB3 ARG A 67 3.881 12.263 -3.774 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.482 11.792 -6.314 1.00 0.00 H new ATOM 0 HG3 ARG A 67 2.808 12.217 -6.608 1.00 0.00 H new ATOM 0 HD2 ARG A 67 3.187 14.442 -6.234 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.128 14.131 -4.789 1.00 0.00 H new ATOM 0 HE ARG A 67 5.595 13.364 -7.201 1.00 0.00 H new ATOM 0 HH11 ARG A 67 4.670 16.120 -5.168 1.00 0.00 H new ATOM 0 HH12 ARG A 67 6.053 17.102 -5.660 1.00 0.00 H new ATOM 0 HH21 ARG A 67 7.386 14.633 -7.837 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.595 16.258 -7.175 1.00 0.00 H new ATOM 1066 N LYS A 68 2.166 10.035 -2.450 1.00 0.00 N ATOM 1067 CA LYS A 68 1.937 9.640 -1.071 1.00 0.00 C ATOM 1068 C LYS A 68 2.576 8.272 -0.824 1.00 0.00 C ATOM 1069 O LYS A 68 3.491 8.147 -0.012 1.00 0.00 O ATOM 1070 CB LYS A 68 0.445 9.691 -0.739 1.00 0.00 C ATOM 1071 CG LYS A 68 0.076 11.018 -0.071 1.00 0.00 C ATOM 1072 CD LYS A 68 -0.933 11.796 -0.918 1.00 0.00 C ATOM 1073 CE LYS A 68 -1.308 13.119 -0.246 1.00 0.00 C ATOM 1074 NZ LYS A 68 -0.482 14.224 -0.781 1.00 0.00 N ATOM 0 H LYS A 68 1.370 10.485 -2.902 1.00 0.00 H new ATOM 0 HA LYS A 68 2.415 10.343 -0.389 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -0.139 9.564 -1.651 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.187 8.863 -0.078 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.343 10.828 0.917 1.00 0.00 H new ATOM 0 HG3 LYS A 68 0.974 11.618 0.074 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.512 11.991 -1.904 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -1.829 11.193 -1.068 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.364 13.332 -0.413 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -1.166 13.039 0.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -0.749 15.114 -0.315 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 0.523 14.026 -0.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -0.638 14.310 -1.806 1.00 0.00 H new ATOM 1088 N ILE A 69 2.067 7.280 -1.540 1.00 0.00 N ATOM 1089 CA ILE A 69 2.576 5.925 -1.409 1.00 0.00 C ATOM 1090 C ILE A 69 4.102 5.966 -1.302 1.00 0.00 C ATOM 1091 O ILE A 69 4.670 5.523 -0.305 1.00 0.00 O ATOM 1092 CB ILE A 69 2.063 5.047 -2.552 1.00 0.00 C ATOM 1093 CG1 ILE A 69 0.540 4.910 -2.497 1.00 0.00 C ATOM 1094 CG2 ILE A 69 2.762 3.686 -2.553 1.00 0.00 C ATOM 1095 CD1 ILE A 69 -0.006 4.339 -3.807 1.00 0.00 C ATOM 0 H ILE A 69 1.308 7.387 -2.213 1.00 0.00 H new ATOM 0 HA ILE A 69 2.204 5.465 -0.493 1.00 0.00 H new ATOM 0 HB ILE A 69 2.308 5.535 -3.495 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.259 4.260 -1.668 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.090 5.884 -2.305 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.379 3.081 -3.375 1.00 0.00 H new ATOM 0 HG22 ILE A 69 3.836 3.828 -2.676 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.570 3.178 -1.608 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -1.091 4.252 -3.742 1.00 0.00 H new ATOM 0 HD12 ILE A 69 0.256 5.003 -4.631 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.427 3.355 -3.983 1.00 0.00 H new ATOM 1107 N LEU A 70 4.722 6.503 -2.343 1.00 0.00 N ATOM 1108 CA LEU A 70 6.171 6.608 -2.379 1.00 0.00 C ATOM 1109 C LEU A 70 6.661 7.282 -1.096 1.00 0.00 C ATOM 1110 O LEU A 70 7.613 6.817 -0.471 1.00 0.00 O ATOM 1111 CB LEU A 70 6.625 7.315 -3.657 1.00 0.00 C ATOM 1112 CG LEU A 70 6.365 6.566 -4.966 1.00 0.00 C ATOM 1113 CD1 LEU A 70 6.615 7.471 -6.174 1.00 0.00 C ATOM 1114 CD2 LEU A 70 7.189 5.278 -5.034 1.00 0.00 C ATOM 0 H LEU A 70 4.247 6.870 -3.168 1.00 0.00 H new ATOM 0 HA LEU A 70 6.624 5.617 -2.412 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.126 8.283 -3.710 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.694 7.511 -3.580 1.00 0.00 H new ATOM 0 HG LEU A 70 5.314 6.277 -4.992 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.423 6.915 -7.091 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.950 8.333 -6.127 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.651 7.811 -6.166 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.986 4.765 -5.974 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.250 5.521 -4.976 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.919 4.629 -4.201 1.00 0.00 H new ATOM 1126 N GLU A 71 5.988 8.368 -0.742 1.00 0.00 N ATOM 1127 CA GLU A 71 6.343 9.111 0.455 1.00 0.00 C ATOM 1128 C GLU A 71 6.167 8.233 1.696 1.00 0.00 C ATOM 1129 O GLU A 71 6.773 8.492 2.735 1.00 0.00 O ATOM 1130 CB GLU A 71 5.518 10.394 0.569 1.00 0.00 C ATOM 1131 CG GLU A 71 5.641 11.239 -0.701 1.00 0.00 C ATOM 1132 CD GLU A 71 5.755 12.726 -0.361 1.00 0.00 C ATOM 1133 OE1 GLU A 71 6.904 13.174 -0.157 1.00 0.00 O ATOM 1134 OE2 GLU A 71 4.692 13.381 -0.313 1.00 0.00 O ATOM 0 H GLU A 71 5.199 8.751 -1.263 1.00 0.00 H new ATOM 0 HA GLU A 71 7.392 9.399 0.383 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.472 10.144 0.744 1.00 0.00 H new ATOM 0 HB3 GLU A 71 5.855 10.972 1.429 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.517 10.924 -1.268 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.772 11.073 -1.338 1.00 0.00 H new ATOM 1141 N ALA A 72 5.333 7.214 1.548 1.00 0.00 N ATOM 1142 CA ALA A 72 5.069 6.297 2.644 1.00 0.00 C ATOM 1143 C ALA A 72 5.705 4.941 2.333 1.00 0.00 C ATOM 1144 O ALA A 72 5.260 3.912 2.839 1.00 0.00 O ATOM 1145 CB ALA A 72 3.560 6.195 2.871 1.00 0.00 C ATOM 0 H ALA A 72 4.831 7.003 0.685 1.00 0.00 H new ATOM 0 HA ALA A 72 5.514 6.665 3.569 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.361 5.507 3.693 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.162 7.179 3.117 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.080 5.826 1.965 1.00 0.00 H new ATOM 1151 N SER A 73 6.737 4.984 1.503 1.00 0.00 N ATOM 1152 CA SER A 73 7.439 3.771 1.119 1.00 0.00 C ATOM 1153 C SER A 73 8.022 3.089 2.358 1.00 0.00 C ATOM 1154 O SER A 73 7.588 2.001 2.734 1.00 0.00 O ATOM 1155 CB SER A 73 8.548 4.072 0.108 1.00 0.00 C ATOM 1156 OG SER A 73 9.530 4.956 0.642 1.00 0.00 O ATOM 0 H SER A 73 7.104 5.839 1.086 1.00 0.00 H new ATOM 0 HA SER A 73 6.724 3.099 0.644 1.00 0.00 H new ATOM 0 HB2 SER A 73 9.025 3.140 -0.195 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.112 4.513 -0.788 1.00 0.00 H new ATOM 0 HG SER A 73 9.262 5.883 0.472 1.00 0.00 H new ATOM 1162 N ASN A 74 8.996 3.756 2.959 1.00 0.00 N ATOM 1163 CA ASN A 74 9.643 3.227 4.148 1.00 0.00 C ATOM 1164 C ASN A 74 8.583 2.631 5.076 1.00 0.00 C ATOM 1165 O ASN A 74 8.787 1.562 5.651 1.00 0.00 O ATOM 1166 CB ASN A 74 10.375 4.331 4.913 1.00 0.00 C ATOM 1167 CG ASN A 74 11.359 5.069 4.004 1.00 0.00 C ATOM 1168 OD1 ASN A 74 11.018 5.545 2.934 1.00 0.00 O ATOM 1169 ND2 ASN A 74 12.596 5.137 4.488 1.00 0.00 N ATOM 0 H ASN A 74 9.353 4.658 2.645 1.00 0.00 H new ATOM 0 HA ASN A 74 10.361 2.469 3.834 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.651 5.037 5.320 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.910 3.899 5.759 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.327 5.609 3.956 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.814 4.717 5.392 1.00 0.00 H new ATOM 1176 N SER A 75 7.475 3.346 5.194 1.00 0.00 N ATOM 1177 CA SER A 75 6.383 2.901 6.044 1.00 0.00 C ATOM 1178 C SER A 75 5.725 1.658 5.441 1.00 0.00 C ATOM 1179 O SER A 75 5.592 0.635 6.110 1.00 0.00 O ATOM 1180 CB SER A 75 5.347 4.010 6.236 1.00 0.00 C ATOM 1181 OG SER A 75 5.508 4.682 7.482 1.00 0.00 O ATOM 0 H SER A 75 7.309 4.231 4.715 1.00 0.00 H new ATOM 0 HA SER A 75 6.791 2.650 7.023 1.00 0.00 H new ATOM 0 HB2 SER A 75 5.432 4.730 5.422 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.345 3.584 6.181 1.00 0.00 H new ATOM 0 HG SER A 75 4.829 5.384 7.565 1.00 0.00 H new ATOM 1187 N ILE A 76 5.330 1.788 4.182 1.00 0.00 N ATOM 1188 CA ILE A 76 4.689 0.688 3.482 1.00 0.00 C ATOM 1189 C ILE A 76 5.396 -0.620 3.840 1.00 0.00 C ATOM 1190 O ILE A 76 6.584 -0.621 4.161 1.00 0.00 O ATOM 1191 CB ILE A 76 4.638 0.968 1.978 1.00 0.00 C ATOM 1192 CG1 ILE A 76 3.430 1.836 1.623 1.00 0.00 C ATOM 1193 CG2 ILE A 76 4.664 -0.335 1.177 1.00 0.00 C ATOM 1194 CD1 ILE A 76 3.347 2.068 0.113 1.00 0.00 C ATOM 0 H ILE A 76 5.442 2.638 3.629 1.00 0.00 H new ATOM 0 HA ILE A 76 3.651 0.587 3.800 1.00 0.00 H new ATOM 0 HB ILE A 76 5.530 1.531 1.704 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.516 1.354 1.971 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.502 2.794 2.138 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.627 -0.108 0.112 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.581 -0.881 1.400 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.803 -0.946 1.448 1.00 0.00 H new ATOM 0 HD11 ILE A 76 2.479 2.688 -0.113 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.252 2.572 -0.228 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.251 1.110 -0.398 1.00 0.00 H new ATOM 1206 N GLN A 77 4.637 -1.704 3.774 1.00 0.00 N ATOM 1207 CA GLN A 77 5.175 -3.016 4.088 1.00 0.00 C ATOM 1208 C GLN A 77 4.174 -4.107 3.704 1.00 0.00 C ATOM 1209 O GLN A 77 3.019 -4.071 4.126 1.00 0.00 O ATOM 1210 CB GLN A 77 5.553 -3.115 5.567 1.00 0.00 C ATOM 1211 CG GLN A 77 6.577 -4.227 5.799 1.00 0.00 C ATOM 1212 CD GLN A 77 7.265 -4.066 7.156 1.00 0.00 C ATOM 1213 OE1 GLN A 77 7.688 -2.989 7.542 1.00 0.00 O ATOM 1214 NE2 GLN A 77 7.352 -5.194 7.856 1.00 0.00 N ATOM 0 H GLN A 77 3.652 -1.700 3.507 1.00 0.00 H new ATOM 0 HA GLN A 77 6.084 -3.163 3.504 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.962 -2.163 5.906 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.660 -3.308 6.162 1.00 0.00 H new ATOM 0 HG2 GLN A 77 6.082 -5.197 5.751 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.323 -4.210 5.005 1.00 0.00 H new ATOM 0 HE21 GLN A 77 6.977 -6.062 7.473 1.00 0.00 H new ATOM 0 HE22 GLN A 77 7.794 -5.191 8.775 1.00 0.00 H new ATOM 1223 N PHE A 78 4.652 -5.051 2.907 1.00 0.00 N ATOM 1224 CA PHE A 78 3.813 -6.151 2.461 1.00 0.00 C ATOM 1225 C PHE A 78 3.818 -7.292 3.480 1.00 0.00 C ATOM 1226 O PHE A 78 4.756 -8.086 3.523 1.00 0.00 O ATOM 1227 CB PHE A 78 4.402 -6.657 1.143 1.00 0.00 C ATOM 1228 CG PHE A 78 4.025 -5.808 -0.073 1.00 0.00 C ATOM 1229 CD1 PHE A 78 4.274 -4.471 -0.073 1.00 0.00 C ATOM 1230 CD2 PHE A 78 3.442 -6.391 -1.155 1.00 0.00 C ATOM 1231 CE1 PHE A 78 3.925 -3.683 -1.201 1.00 0.00 C ATOM 1232 CE2 PHE A 78 3.093 -5.603 -2.283 1.00 0.00 C ATOM 1233 CZ PHE A 78 3.341 -4.266 -2.283 1.00 0.00 C ATOM 0 H PHE A 78 5.610 -5.077 2.558 1.00 0.00 H new ATOM 0 HA PHE A 78 2.784 -5.810 2.342 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.488 -6.687 1.230 1.00 0.00 H new ATOM 0 HB3 PHE A 78 4.067 -7.681 0.976 1.00 0.00 H new ATOM 0 HD1 PHE A 78 4.738 -4.008 0.786 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.245 -7.453 -1.156 1.00 0.00 H new ATOM 0 HE1 PHE A 78 4.123 -2.621 -1.200 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.630 -6.066 -3.142 1.00 0.00 H new ATOM 0 HZ PHE A 78 3.075 -3.667 -3.141 1.00 0.00 H new ATOM 1243 N VAL A 79 2.758 -7.338 4.274 1.00 0.00 N ATOM 1244 CA VAL A 79 2.629 -8.369 5.290 1.00 0.00 C ATOM 1245 C VAL A 79 1.978 -9.608 4.672 1.00 0.00 C ATOM 1246 O VAL A 79 0.950 -9.506 4.004 1.00 0.00 O ATOM 1247 CB VAL A 79 1.856 -7.825 6.493 1.00 0.00 C ATOM 1248 CG1 VAL A 79 1.528 -8.942 7.485 1.00 0.00 C ATOM 1249 CG2 VAL A 79 2.629 -6.694 7.175 1.00 0.00 C ATOM 0 H VAL A 79 1.981 -6.678 4.234 1.00 0.00 H new ATOM 0 HA VAL A 79 3.610 -8.666 5.659 1.00 0.00 H new ATOM 0 HB VAL A 79 0.914 -7.415 6.129 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.979 -8.528 8.330 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.919 -9.699 6.992 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.453 -9.396 7.841 1.00 0.00 H new ATOM 0 HG21 VAL A 79 2.058 -6.325 8.027 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.593 -7.068 7.519 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.787 -5.882 6.465 1.00 0.00 H new ATOM 1259 N ILE A 80 2.602 -10.750 4.918 1.00 0.00 N ATOM 1260 CA ILE A 80 2.096 -12.008 4.394 1.00 0.00 C ATOM 1261 C ILE A 80 1.548 -12.852 5.547 1.00 0.00 C ATOM 1262 O ILE A 80 2.217 -13.028 6.564 1.00 0.00 O ATOM 1263 CB ILE A 80 3.173 -12.717 3.571 1.00 0.00 C ATOM 1264 CG1 ILE A 80 3.945 -11.721 2.703 1.00 0.00 C ATOM 1265 CG2 ILE A 80 2.570 -13.852 2.741 1.00 0.00 C ATOM 1266 CD1 ILE A 80 3.055 -11.153 1.596 1.00 0.00 C ATOM 0 H ILE A 80 3.454 -10.831 5.473 1.00 0.00 H new ATOM 0 HA ILE A 80 1.268 -11.830 3.707 1.00 0.00 H new ATOM 0 HB ILE A 80 3.888 -13.166 4.260 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.322 -10.908 3.324 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.811 -12.213 2.261 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.357 -14.340 2.165 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.102 -14.579 3.405 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.821 -13.447 2.061 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.628 -10.448 0.994 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.699 -11.965 0.963 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.203 -10.640 2.042 1.00 0.00 H new ATOM 1278 N LYS A 81 0.337 -13.351 5.349 1.00 0.00 N ATOM 1279 CA LYS A 81 -0.308 -14.172 6.359 1.00 0.00 C ATOM 1280 C LYS A 81 -0.450 -15.602 5.834 1.00 0.00 C ATOM 1281 O LYS A 81 -0.229 -16.562 6.570 1.00 0.00 O ATOM 1282 CB LYS A 81 -1.633 -13.543 6.794 1.00 0.00 C ATOM 1283 CG LYS A 81 -1.466 -12.048 7.072 1.00 0.00 C ATOM 1284 CD LYS A 81 -0.990 -11.806 8.506 1.00 0.00 C ATOM 1285 CE LYS A 81 -2.123 -11.255 9.374 1.00 0.00 C ATOM 1286 NZ LYS A 81 -3.423 -11.824 8.952 1.00 0.00 N ATOM 0 H LYS A 81 -0.215 -13.203 4.504 1.00 0.00 H new ATOM 0 HA LYS A 81 0.306 -14.222 7.258 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.382 -13.690 6.016 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -2.001 -14.044 7.689 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.749 -11.622 6.370 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.414 -11.536 6.909 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -0.621 -12.739 8.933 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.156 -11.105 8.503 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -1.937 -11.495 10.421 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -2.153 -10.168 9.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.077 -11.833 9.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.825 -11.243 8.188 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -3.282 -12.796 8.610 1.00 0.00 H new ATOM 1300 N ARG A 82 -0.816 -15.698 4.564 1.00 0.00 N ATOM 1301 CA ARG A 82 -0.990 -16.995 3.932 1.00 0.00 C ATOM 1302 C ARG A 82 -0.436 -16.968 2.506 1.00 0.00 C ATOM 1303 O ARG A 82 -1.130 -16.567 1.573 1.00 0.00 O ATOM 1304 CB ARG A 82 -2.466 -17.395 3.890 1.00 0.00 C ATOM 1305 CG ARG A 82 -3.004 -17.653 5.299 1.00 0.00 C ATOM 1306 CD ARG A 82 -4.248 -18.542 5.257 1.00 0.00 C ATOM 1307 NE ARG A 82 -4.410 -19.248 6.547 1.00 0.00 N ATOM 1308 CZ ARG A 82 -4.793 -18.654 7.686 1.00 0.00 C ATOM 1309 NH1 ARG A 82 -5.056 -17.340 7.700 1.00 0.00 N ATOM 1310 NH2 ARG A 82 -4.914 -19.374 8.809 1.00 0.00 N ATOM 0 H ARG A 82 -0.997 -14.899 3.956 1.00 0.00 H new ATOM 0 HA ARG A 82 -0.444 -17.728 4.525 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.047 -16.605 3.414 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.587 -18.291 3.281 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.233 -18.129 5.905 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.246 -16.705 5.779 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.131 -17.937 5.051 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.161 -19.265 4.446 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.218 -20.250 6.571 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.965 -16.792 6.844 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -5.347 -16.887 8.566 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -4.715 -20.374 8.797 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -5.205 -18.922 9.676 1.00 0.00 H new ATOM 1324 N PRO A 83 0.843 -17.413 2.378 1.00 0.00 N ATOM 1325 CA PRO A 83 1.499 -17.444 1.081 1.00 0.00 C ATOM 1326 C PRO A 83 0.974 -18.602 0.229 1.00 0.00 C ATOM 1327 O PRO A 83 1.180 -18.627 -0.983 1.00 0.00 O ATOM 1328 CB PRO A 83 2.982 -17.560 1.393 1.00 0.00 C ATOM 1329 CG PRO A 83 3.069 -18.056 2.827 1.00 0.00 C ATOM 1330 CD PRO A 83 1.696 -17.896 3.460 1.00 0.00 C ATOM 0 HA PRO A 83 1.300 -16.552 0.487 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.472 -18.254 0.710 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.481 -16.597 1.282 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.381 -19.100 2.851 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.814 -17.487 3.383 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.331 -18.842 3.859 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.722 -17.189 4.289 1.00 0.00 H new ATOM 1338 N GLU A 84 0.307 -19.531 0.897 1.00 0.00 N ATOM 1339 CA GLU A 84 -0.248 -20.689 0.217 1.00 0.00 C ATOM 1340 C GLU A 84 -1.242 -20.245 -0.859 1.00 0.00 C ATOM 1341 O GLU A 84 -1.526 -20.994 -1.792 1.00 0.00 O ATOM 1342 CB GLU A 84 -0.908 -21.645 1.212 1.00 0.00 C ATOM 1343 CG GLU A 84 -2.179 -21.031 1.803 1.00 0.00 C ATOM 1344 CD GLU A 84 -3.092 -22.113 2.382 1.00 0.00 C ATOM 1345 OE1 GLU A 84 -3.286 -23.129 1.680 1.00 0.00 O ATOM 1346 OE2 GLU A 84 -3.577 -21.900 3.515 1.00 0.00 O ATOM 0 H GLU A 84 0.138 -19.506 1.903 1.00 0.00 H new ATOM 0 HA GLU A 84 0.567 -21.227 -0.267 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.151 -22.583 0.713 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.208 -21.882 2.013 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.914 -20.318 2.584 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.712 -20.475 1.031 1.00 0.00 H new ATOM 1353 N LEU A 85 -1.742 -19.030 -0.693 1.00 0.00 N ATOM 1354 CA LEU A 85 -2.697 -18.478 -1.638 1.00 0.00 C ATOM 1355 C LEU A 85 -1.970 -18.100 -2.930 1.00 0.00 C ATOM 1356 O LEU A 85 -2.450 -18.390 -4.025 1.00 0.00 O ATOM 1357 CB LEU A 85 -3.469 -17.318 -1.005 1.00 0.00 C ATOM 1358 CG LEU A 85 -4.247 -17.648 0.270 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -4.858 -16.385 0.881 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -5.301 -18.725 0.007 1.00 0.00 C ATOM 0 H LEU A 85 -1.504 -18.412 0.082 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.447 -19.224 -1.900 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.764 -16.518 -0.780 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.169 -16.927 -1.744 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.548 -18.054 1.001 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.406 -16.647 1.786 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -4.064 -15.680 1.128 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.540 -15.927 0.164 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -5.839 -18.940 0.930 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -6.003 -18.371 -0.748 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -4.813 -19.632 -0.349 1.00 0.00 H new ATOM 1372 N LEU A 86 -0.823 -17.459 -2.760 1.00 0.00 N ATOM 1373 CA LEU A 86 -0.024 -17.039 -3.899 1.00 0.00 C ATOM 1374 C LEU A 86 0.032 -18.173 -4.924 1.00 0.00 C ATOM 1375 O LEU A 86 -0.731 -18.181 -5.889 1.00 0.00 O ATOM 1376 CB LEU A 86 1.353 -16.557 -3.439 1.00 0.00 C ATOM 1377 CG LEU A 86 1.359 -15.405 -2.432 1.00 0.00 C ATOM 1378 CD1 LEU A 86 2.774 -15.136 -1.915 1.00 0.00 C ATOM 1379 CD2 LEU A 86 0.719 -14.151 -3.030 1.00 0.00 C ATOM 0 H LEU A 86 -0.428 -17.220 -1.851 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.486 -16.185 -4.394 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.883 -17.401 -2.998 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.920 -16.248 -4.317 1.00 0.00 H new ATOM 0 HG LEU A 86 0.753 -15.698 -1.574 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.750 -14.313 -1.201 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.158 -16.030 -1.425 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.423 -14.873 -2.750 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.736 -13.347 -2.294 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.277 -13.844 -3.915 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.313 -14.366 -3.308 1.00 0.00 H new ATOM 1391 N THR A 87 0.942 -19.104 -4.680 1.00 0.00 N ATOM 1392 CA THR A 87 1.108 -20.241 -5.569 1.00 0.00 C ATOM 1393 C THR A 87 0.989 -19.797 -7.029 1.00 0.00 C ATOM 1394 O THR A 87 -0.009 -20.082 -7.689 1.00 0.00 O ATOM 1395 CB THR A 87 0.083 -21.305 -5.172 1.00 0.00 C ATOM 1396 OG1 THR A 87 -1.158 -20.604 -5.159 1.00 0.00 O ATOM 1397 CG2 THR A 87 0.259 -21.778 -3.728 1.00 0.00 C ATOM 0 H THR A 87 1.573 -19.094 -3.878 1.00 0.00 H new ATOM 0 HA THR A 87 2.103 -20.676 -5.474 1.00 0.00 H new ATOM 0 HB THR A 87 0.166 -22.158 -5.846 1.00 0.00 H new ATOM 0 HG1 THR A 87 -1.228 -20.049 -5.963 1.00 0.00 H new ATOM 0 HG21 THR A 87 -0.493 -22.532 -3.498 1.00 0.00 H new ATOM 0 HG22 THR A 87 1.253 -22.208 -3.604 1.00 0.00 H new ATOM 0 HG23 THR A 87 0.143 -20.932 -3.051 1.00 0.00 H new ATOM 1405 N GLU A 88 2.021 -19.107 -7.490 1.00 0.00 N ATOM 1406 CA GLU A 88 2.045 -18.622 -8.859 1.00 0.00 C ATOM 1407 C GLU A 88 3.480 -18.598 -9.389 1.00 0.00 C ATOM 1408 O GLU A 88 4.396 -18.162 -8.693 1.00 0.00 O ATOM 1409 CB GLU A 88 1.400 -17.238 -8.962 1.00 0.00 C ATOM 1410 CG GLU A 88 0.445 -17.166 -10.155 1.00 0.00 C ATOM 1411 CD GLU A 88 -0.985 -16.872 -9.697 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -1.684 -17.851 -9.357 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -1.346 -15.676 -9.696 1.00 0.00 O ATOM 0 H GLU A 88 2.847 -18.872 -6.940 1.00 0.00 H new ATOM 0 HA GLU A 88 1.462 -19.306 -9.476 1.00 0.00 H new ATOM 0 HB2 GLU A 88 0.857 -17.016 -8.043 1.00 0.00 H new ATOM 0 HB3 GLU A 88 2.175 -16.478 -9.065 1.00 0.00 H new ATOM 0 HG2 GLU A 88 0.777 -16.389 -10.844 1.00 0.00 H new ATOM 0 HG3 GLU A 88 0.469 -18.109 -10.702 1.00 0.00 H new ATOM 1420 N GLY A 89 3.632 -19.071 -10.617 1.00 0.00 N ATOM 1421 CA GLY A 89 4.940 -19.109 -11.249 1.00 0.00 C ATOM 1422 C GLY A 89 4.915 -19.976 -12.509 1.00 0.00 C ATOM 1423 O GLY A 89 4.534 -21.144 -12.457 1.00 0.00 O ATOM 0 H GLY A 89 2.870 -19.432 -11.192 1.00 0.00 H new ATOM 0 HA2 GLY A 89 5.253 -18.097 -11.506 1.00 0.00 H new ATOM 0 HA3 GLY A 89 5.676 -19.502 -10.547 1.00 0.00 H new ATOM 1427 N VAL A 90 5.327 -19.370 -13.613 1.00 0.00 N ATOM 1428 CA VAL A 90 5.357 -20.072 -14.885 1.00 0.00 C ATOM 1429 C VAL A 90 6.233 -19.296 -15.871 1.00 0.00 C ATOM 1430 O VAL A 90 6.492 -18.109 -15.675 1.00 0.00 O ATOM 1431 CB VAL A 90 3.931 -20.289 -15.397 1.00 0.00 C ATOM 1432 CG1 VAL A 90 3.303 -18.968 -15.846 1.00 0.00 C ATOM 1433 CG2 VAL A 90 3.905 -21.321 -16.526 1.00 0.00 C ATOM 0 H VAL A 90 5.643 -18.401 -13.653 1.00 0.00 H new ATOM 0 HA VAL A 90 5.800 -21.061 -14.764 1.00 0.00 H new ATOM 0 HB VAL A 90 3.335 -20.680 -14.573 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.290 -19.150 -16.205 1.00 0.00 H new ATOM 0 HG12 VAL A 90 3.271 -18.276 -15.004 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.900 -18.535 -16.649 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.880 -21.456 -16.872 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.524 -20.972 -17.353 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.293 -22.271 -16.159 1.00 0.00 H new ATOM 1443 N LYS A 91 6.667 -19.997 -16.907 1.00 0.00 N ATOM 1444 CA LYS A 91 7.509 -19.389 -17.923 1.00 0.00 C ATOM 1445 C LYS A 91 7.718 -20.382 -19.068 1.00 0.00 C ATOM 1446 O LYS A 91 7.913 -21.574 -18.834 1.00 0.00 O ATOM 1447 CB LYS A 91 8.813 -18.881 -17.305 1.00 0.00 C ATOM 1448 CG LYS A 91 9.456 -17.807 -18.184 1.00 0.00 C ATOM 1449 CD LYS A 91 10.982 -17.865 -18.094 1.00 0.00 C ATOM 1450 CE LYS A 91 11.540 -16.607 -17.426 1.00 0.00 C ATOM 1451 NZ LYS A 91 12.053 -16.922 -16.074 1.00 0.00 N ATOM 0 H LYS A 91 6.451 -20.981 -17.065 1.00 0.00 H new ATOM 0 HA LYS A 91 7.020 -18.511 -18.346 1.00 0.00 H new ATOM 0 HB2 LYS A 91 8.615 -18.474 -16.314 1.00 0.00 H new ATOM 0 HB3 LYS A 91 9.506 -19.712 -17.175 1.00 0.00 H new ATOM 0 HG2 LYS A 91 9.144 -17.945 -19.219 1.00 0.00 H new ATOM 0 HG3 LYS A 91 9.107 -16.822 -17.874 1.00 0.00 H new ATOM 0 HD2 LYS A 91 11.283 -18.746 -17.527 1.00 0.00 H new ATOM 0 HD3 LYS A 91 11.405 -17.969 -19.093 1.00 0.00 H new ATOM 0 HE2 LYS A 91 12.340 -16.188 -18.037 1.00 0.00 H new ATOM 0 HE3 LYS A 91 10.761 -15.848 -17.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 12.428 -16.057 -15.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 11.281 -17.300 -15.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 12.811 -17.630 -16.147 1.00 0.00 H new ATOM 1465 N GLU A 92 7.669 -19.855 -20.283 1.00 0.00 N ATOM 1466 CA GLU A 92 7.850 -20.680 -21.465 1.00 0.00 C ATOM 1467 C GLU A 92 8.017 -19.801 -22.706 1.00 0.00 C ATOM 1468 O GLU A 92 7.075 -19.132 -23.128 1.00 0.00 O ATOM 1469 CB GLU A 92 6.684 -21.655 -21.637 1.00 0.00 C ATOM 1470 CG GLU A 92 7.123 -22.907 -22.399 1.00 0.00 C ATOM 1471 CD GLU A 92 6.690 -24.177 -21.663 1.00 0.00 C ATOM 1472 OE1 GLU A 92 5.490 -24.254 -21.322 1.00 0.00 O ATOM 1473 OE2 GLU A 92 7.569 -25.042 -21.459 1.00 0.00 O ATOM 0 H GLU A 92 7.506 -18.866 -20.474 1.00 0.00 H new ATOM 0 HA GLU A 92 8.758 -21.269 -21.337 1.00 0.00 H new ATOM 0 HB2 GLU A 92 6.295 -21.938 -20.659 1.00 0.00 H new ATOM 0 HB3 GLU A 92 5.872 -21.165 -22.173 1.00 0.00 H new ATOM 0 HG2 GLU A 92 6.692 -22.898 -23.400 1.00 0.00 H new ATOM 0 HG3 GLU A 92 8.206 -22.903 -22.519 1.00 0.00 H new ATOM 1480 N PRO A 93 9.254 -19.830 -23.269 1.00 0.00 N ATOM 1481 CA PRO A 93 9.556 -19.044 -24.453 1.00 0.00 C ATOM 1482 C PRO A 93 8.934 -19.673 -25.702 1.00 0.00 C ATOM 1483 O PRO A 93 8.613 -20.860 -25.710 1.00 0.00 O ATOM 1484 CB PRO A 93 11.074 -18.987 -24.511 1.00 0.00 C ATOM 1485 CG PRO A 93 11.568 -20.123 -23.630 1.00 0.00 C ATOM 1486 CD PRO A 93 10.394 -20.611 -22.796 1.00 0.00 C ATOM 0 HA PRO A 93 9.134 -18.040 -24.410 1.00 0.00 H new ATOM 0 HB2 PRO A 93 11.430 -19.103 -25.535 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.443 -18.026 -24.152 1.00 0.00 H new ATOM 0 HG2 PRO A 93 11.966 -20.934 -24.240 1.00 0.00 H new ATOM 0 HG3 PRO A 93 12.378 -19.782 -22.986 1.00 0.00 H new ATOM 0 HD2 PRO A 93 10.227 -21.679 -22.934 1.00 0.00 H new ATOM 0 HD3 PRO A 93 10.570 -20.451 -21.732 1.00 0.00 H new ATOM 1494 N SER A 94 8.783 -18.847 -26.728 1.00 0.00 N ATOM 1495 CA SER A 94 8.205 -19.307 -27.979 1.00 0.00 C ATOM 1496 C SER A 94 8.107 -18.145 -28.969 1.00 0.00 C ATOM 1497 O SER A 94 7.884 -17.003 -28.570 1.00 0.00 O ATOM 1498 CB SER A 94 6.825 -19.930 -27.753 1.00 0.00 C ATOM 1499 OG SER A 94 6.886 -21.352 -27.685 1.00 0.00 O ATOM 0 H SER A 94 9.051 -17.863 -26.718 1.00 0.00 H new ATOM 0 HA SER A 94 8.857 -20.076 -28.394 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.399 -19.541 -26.828 1.00 0.00 H new ATOM 0 HB3 SER A 94 6.157 -19.634 -28.562 1.00 0.00 H new ATOM 0 HG SER A 94 7.508 -21.619 -26.977 1.00 0.00 H new ATOM 1505 N GLY A 95 8.278 -18.476 -30.240 1.00 0.00 N ATOM 1506 CA GLY A 95 8.212 -17.473 -31.290 1.00 0.00 C ATOM 1507 C GLY A 95 9.407 -17.592 -32.238 1.00 0.00 C ATOM 1508 O GLY A 95 10.372 -16.838 -32.123 1.00 0.00 O ATOM 0 H GLY A 95 8.462 -19.424 -30.567 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.285 -17.590 -31.851 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.193 -16.478 -30.846 1.00 0.00 H new ATOM 1512 N PRO A 96 9.301 -18.570 -33.177 1.00 0.00 N ATOM 1513 CA PRO A 96 10.362 -18.797 -34.144 1.00 0.00 C ATOM 1514 C PRO A 96 10.361 -17.713 -35.223 1.00 0.00 C ATOM 1515 O PRO A 96 10.105 -17.996 -36.393 1.00 0.00 O ATOM 1516 CB PRO A 96 10.097 -20.187 -34.699 1.00 0.00 C ATOM 1517 CG PRO A 96 8.646 -20.498 -34.369 1.00 0.00 C ATOM 1518 CD PRO A 96 8.173 -19.482 -33.342 1.00 0.00 C ATOM 0 HA PRO A 96 11.356 -18.743 -33.699 1.00 0.00 H new ATOM 0 HB2 PRO A 96 10.268 -20.217 -35.775 1.00 0.00 H new ATOM 0 HB3 PRO A 96 10.766 -20.921 -34.250 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.031 -20.447 -35.267 1.00 0.00 H new ATOM 0 HG3 PRO A 96 8.553 -21.510 -33.976 1.00 0.00 H new ATOM 0 HD2 PRO A 96 7.284 -18.954 -33.687 1.00 0.00 H new ATOM 0 HD3 PRO A 96 7.912 -19.964 -32.400 1.00 0.00 H new ATOM 1526 N SER A 97 10.650 -16.494 -34.792 1.00 0.00 N ATOM 1527 CA SER A 97 10.686 -15.365 -35.707 1.00 0.00 C ATOM 1528 C SER A 97 12.034 -15.321 -36.430 1.00 0.00 C ATOM 1529 O SER A 97 13.085 -15.317 -35.791 1.00 0.00 O ATOM 1530 CB SER A 97 10.436 -14.049 -34.968 1.00 0.00 C ATOM 1531 OG SER A 97 9.147 -13.514 -35.253 1.00 0.00 O ATOM 0 H SER A 97 10.861 -16.263 -33.821 1.00 0.00 H new ATOM 0 HA SER A 97 9.891 -15.494 -36.442 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.532 -14.212 -33.895 1.00 0.00 H new ATOM 0 HB3 SER A 97 11.200 -13.324 -35.250 1.00 0.00 H new ATOM 0 HG SER A 97 9.025 -12.675 -34.761 1.00 0.00 H new ATOM 1537 N SER A 98 11.959 -15.289 -37.752 1.00 0.00 N ATOM 1538 CA SER A 98 13.160 -15.244 -38.569 1.00 0.00 C ATOM 1539 C SER A 98 13.205 -13.937 -39.363 1.00 0.00 C ATOM 1540 O SER A 98 12.270 -13.619 -40.095 1.00 0.00 O ATOM 1541 CB SER A 98 13.227 -16.444 -39.516 1.00 0.00 C ATOM 1542 OG SER A 98 14.059 -17.482 -39.006 1.00 0.00 O ATOM 0 H SER A 98 11.085 -15.293 -38.278 1.00 0.00 H new ATOM 0 HA SER A 98 14.025 -15.289 -37.908 1.00 0.00 H new ATOM 0 HB2 SER A 98 12.222 -16.833 -39.680 1.00 0.00 H new ATOM 0 HB3 SER A 98 13.605 -16.120 -40.485 1.00 0.00 H new ATOM 0 HG SER A 98 14.074 -18.230 -39.639 1.00 0.00 H new ATOM 1548 N GLY A 99 14.303 -13.216 -39.192 1.00 0.00 N ATOM 1549 CA GLY A 99 14.482 -11.950 -39.883 1.00 0.00 C ATOM 1550 C GLY A 99 15.964 -11.582 -39.977 1.00 0.00 C ATOM 1551 O GLY A 99 16.684 -12.099 -40.830 1.00 0.00 O ATOM 0 H GLY A 99 15.078 -13.484 -38.585 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.055 -12.014 -40.884 1.00 0.00 H new ATOM 0 HA3 GLY A 99 13.941 -11.164 -39.356 1.00 0.00 H new TER 1555 GLY A 99