USER MOD reduce.3.24.130724 H: found=0, std=0, add=936, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 934 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 71 THR OG1 : rot 78:sc= 1.07 USER MOD Set 1.2: A 74 GLN : amide:sc= -0.83! C(o=0.24!,f=-12!) USER MOD Single : A 1 GLY N :NH3+ -135:sc= 0.075 (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 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= -0.254 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 163:sc= 0 (180deg=-0.283) USER MOD Single : A 45 HIS : no HD1:sc= -0.161 X(o=-0.16,f=-0.017) USER MOD Single : A 47 SER OG : rot -48:sc= 0.204 USER MOD Single : A 48 HIS : no HD1:sc= -7.17! C(o=-7.2!,f=-7.6!) USER MOD Single : A 54 HIS : no HD1:sc= -1.23 K(o=-1.2,f=-2.6!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= -0.303 K(o=-0.3,f=-3.6!) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 SER OG : rot -51:sc= 1.22 USER MOD Single : A 64 LYS NZ :NH3+ -124:sc= -0.445 (180deg=-1.74) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 ASN : amide:sc= 0.79 K(o=0.79,f=-3.9!) USER MOD Single : A 69 ASN : amide:sc= -0.907 K(o=-0.91,f=-4!) USER MOD Single : A 75 HIS : no HD1:sc= -1.06 K(o=-1.1,f=-2.2) USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 80 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 84 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 89 SER OG : rot -149:sc=-0.000969 USER MOD Single : A 90 THR OG1 : rot 180:sc= -0.016 USER MOD Single : A 91 ASN : amide:sc= -0.706 K(o=-0.71,f=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 36:sc= 1.14 USER MOD Single : A 108 GLN : amide:sc= -3.47 K(o=-3.5,f=-10!) USER MOD Single : A 111 THR OG1 : rot -27:sc= 0.344 USER MOD Single : A 113 SER OG : rot 180:sc= 0.0208 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 6.998 18.609 3.405 1.00 0.00 N ATOM 2 CA GLY A 1 7.842 19.067 2.317 1.00 0.00 C ATOM 3 C GLY A 1 8.312 17.932 1.429 1.00 0.00 C ATOM 4 O GLY A 1 7.744 16.840 1.453 1.00 0.00 O ATOM 0 H1 GLY A 1 6.171 19.233 3.489 1.00 0.00 H new ATOM 0 H2 GLY A 1 6.681 17.637 3.213 1.00 0.00 H new ATOM 0 H3 GLY A 1 7.537 18.627 4.294 1.00 0.00 H new ATOM 0 HA2 GLY A 1 7.293 19.791 1.715 1.00 0.00 H new ATOM 0 HA3 GLY A 1 8.708 19.586 2.727 1.00 0.00 H new ATOM 8 N SER A 2 9.352 18.189 0.643 1.00 0.00 N ATOM 9 CA SER A 2 9.895 17.181 -0.260 1.00 0.00 C ATOM 10 C SER A 2 11.307 17.553 -0.703 1.00 0.00 C ATOM 11 O SER A 2 11.738 18.696 -0.548 1.00 0.00 O ATOM 12 CB SER A 2 8.990 17.022 -1.484 1.00 0.00 C ATOM 13 OG SER A 2 9.224 18.052 -2.429 1.00 0.00 O ATOM 0 H SER A 2 9.836 19.087 0.613 1.00 0.00 H new ATOM 0 HA SER A 2 9.939 16.233 0.277 1.00 0.00 H new ATOM 0 HB2 SER A 2 9.167 16.052 -1.948 1.00 0.00 H new ATOM 0 HB3 SER A 2 7.946 17.040 -1.173 1.00 0.00 H new ATOM 0 HG SER A 2 8.635 17.927 -3.202 1.00 0.00 H new ATOM 19 N SER A 3 12.023 16.578 -1.256 1.00 0.00 N ATOM 20 CA SER A 3 13.388 16.801 -1.718 1.00 0.00 C ATOM 21 C SER A 3 13.413 17.097 -3.214 1.00 0.00 C ATOM 22 O SER A 3 14.109 18.006 -3.667 1.00 0.00 O ATOM 23 CB SER A 3 14.257 15.579 -1.414 1.00 0.00 C ATOM 24 OG SER A 3 14.683 15.579 -0.063 1.00 0.00 O ATOM 0 H SER A 3 11.680 15.627 -1.395 1.00 0.00 H new ATOM 0 HA SER A 3 13.789 17.665 -1.187 1.00 0.00 H new ATOM 0 HB2 SER A 3 13.695 14.669 -1.621 1.00 0.00 H new ATOM 0 HB3 SER A 3 15.126 15.574 -2.072 1.00 0.00 H new ATOM 0 HG SER A 3 15.235 14.787 0.106 1.00 0.00 H new ATOM 30 N GLY A 4 12.648 16.323 -3.978 1.00 0.00 N ATOM 31 CA GLY A 4 12.597 16.518 -5.415 1.00 0.00 C ATOM 32 C GLY A 4 13.055 15.294 -6.183 1.00 0.00 C ATOM 33 O GLY A 4 14.176 15.254 -6.689 1.00 0.00 O ATOM 0 H GLY A 4 12.063 15.565 -3.627 1.00 0.00 H new ATOM 0 HA2 GLY A 4 11.577 16.767 -5.709 1.00 0.00 H new ATOM 0 HA3 GLY A 4 13.223 17.368 -5.686 1.00 0.00 H new ATOM 37 N SER A 5 12.186 14.292 -6.268 1.00 0.00 N ATOM 38 CA SER A 5 12.510 13.058 -6.975 1.00 0.00 C ATOM 39 C SER A 5 13.218 13.356 -8.293 1.00 0.00 C ATOM 40 O SER A 5 12.726 14.131 -9.113 1.00 0.00 O ATOM 41 CB SER A 5 11.239 12.248 -7.238 1.00 0.00 C ATOM 42 OG SER A 5 11.484 11.200 -8.161 1.00 0.00 O ATOM 0 H SER A 5 11.253 14.310 -5.857 1.00 0.00 H new ATOM 0 HA SER A 5 13.182 12.474 -6.346 1.00 0.00 H new ATOM 0 HB2 SER A 5 10.868 11.832 -6.301 1.00 0.00 H new ATOM 0 HB3 SER A 5 10.460 12.904 -7.626 1.00 0.00 H new ATOM 0 HG SER A 5 10.657 10.696 -8.311 1.00 0.00 H new ATOM 48 N SER A 6 14.377 12.736 -8.488 1.00 0.00 N ATOM 49 CA SER A 6 15.157 12.938 -9.704 1.00 0.00 C ATOM 50 C SER A 6 15.233 11.651 -10.520 1.00 0.00 C ATOM 51 O SER A 6 15.602 10.597 -10.005 1.00 0.00 O ATOM 52 CB SER A 6 16.567 13.419 -9.357 1.00 0.00 C ATOM 53 OG SER A 6 17.353 13.579 -10.525 1.00 0.00 O ATOM 0 H SER A 6 14.797 12.090 -7.820 1.00 0.00 H new ATOM 0 HA SER A 6 14.659 13.700 -10.304 1.00 0.00 H new ATOM 0 HB2 SER A 6 16.510 14.366 -8.821 1.00 0.00 H new ATOM 0 HB3 SER A 6 17.045 12.703 -8.689 1.00 0.00 H new ATOM 0 HG SER A 6 18.249 13.889 -10.276 1.00 0.00 H new ATOM 59 N GLY A 7 14.879 11.746 -11.798 1.00 0.00 N ATOM 60 CA GLY A 7 14.914 10.584 -12.666 1.00 0.00 C ATOM 61 C GLY A 7 14.308 10.859 -14.028 1.00 0.00 C ATOM 62 O GLY A 7 13.125 11.181 -14.134 1.00 0.00 O ATOM 0 H GLY A 7 14.569 12.607 -12.248 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.947 10.258 -12.790 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.376 9.763 -12.191 1.00 0.00 H new ATOM 66 N GLN A 8 15.121 10.733 -15.072 1.00 0.00 N ATOM 67 CA GLN A 8 14.658 10.974 -16.434 1.00 0.00 C ATOM 68 C GLN A 8 14.340 9.660 -17.140 1.00 0.00 C ATOM 69 O GLN A 8 13.341 9.553 -17.851 1.00 0.00 O ATOM 70 CB GLN A 8 15.713 11.749 -17.224 1.00 0.00 C ATOM 71 CG GLN A 8 17.058 11.043 -17.300 1.00 0.00 C ATOM 72 CD GLN A 8 18.024 11.727 -18.247 1.00 0.00 C ATOM 73 OE1 GLN A 8 18.079 11.407 -19.435 1.00 0.00 O ATOM 74 NE2 GLN A 8 18.792 12.677 -17.726 1.00 0.00 N ATOM 0 H GLN A 8 16.103 10.466 -15.001 1.00 0.00 H new ATOM 0 HA GLN A 8 13.745 11.568 -16.382 1.00 0.00 H new ATOM 0 HB2 GLN A 8 15.344 11.920 -18.235 1.00 0.00 H new ATOM 0 HB3 GLN A 8 15.852 12.728 -16.765 1.00 0.00 H new ATOM 0 HG2 GLN A 8 17.499 11.002 -16.304 1.00 0.00 H new ATOM 0 HG3 GLN A 8 16.906 10.013 -17.624 1.00 0.00 H new ATOM 0 HE21 GLN A 8 18.714 12.910 -16.736 1.00 0.00 H new ATOM 0 HE22 GLN A 8 19.460 13.173 -18.316 1.00 0.00 H new ATOM 83 N GLU A 9 15.197 8.663 -16.940 1.00 0.00 N ATOM 84 CA GLU A 9 15.007 7.357 -17.560 1.00 0.00 C ATOM 85 C GLU A 9 14.715 6.293 -16.507 1.00 0.00 C ATOM 86 O GLU A 9 15.596 5.906 -15.739 1.00 0.00 O ATOM 87 CB GLU A 9 16.246 6.966 -18.367 1.00 0.00 C ATOM 88 CG GLU A 9 16.350 7.675 -19.707 1.00 0.00 C ATOM 89 CD GLU A 9 17.731 7.561 -20.323 1.00 0.00 C ATOM 90 OE1 GLU A 9 18.636 8.306 -19.894 1.00 0.00 O ATOM 91 OE2 GLU A 9 17.905 6.725 -21.234 1.00 0.00 O ATOM 0 H GLU A 9 16.029 8.735 -16.354 1.00 0.00 H new ATOM 0 HA GLU A 9 14.151 7.423 -18.232 1.00 0.00 H new ATOM 0 HB2 GLU A 9 17.137 7.187 -17.779 1.00 0.00 H new ATOM 0 HB3 GLU A 9 16.234 5.889 -18.535 1.00 0.00 H new ATOM 0 HG2 GLU A 9 15.615 7.256 -20.394 1.00 0.00 H new ATOM 0 HG3 GLU A 9 16.100 8.728 -19.577 1.00 0.00 H new ATOM 98 N SER A 10 13.472 5.823 -16.477 1.00 0.00 N ATOM 99 CA SER A 10 13.062 4.806 -15.515 1.00 0.00 C ATOM 100 C SER A 10 13.064 3.421 -16.155 1.00 0.00 C ATOM 101 O SER A 10 12.570 3.238 -17.267 1.00 0.00 O ATOM 102 CB SER A 10 11.670 5.125 -14.967 1.00 0.00 C ATOM 103 OG SER A 10 11.733 6.124 -13.964 1.00 0.00 O ATOM 0 H SER A 10 12.731 6.130 -17.108 1.00 0.00 H new ATOM 0 HA SER A 10 13.778 4.808 -14.693 1.00 0.00 H new ATOM 0 HB2 SER A 10 11.024 5.460 -15.779 1.00 0.00 H new ATOM 0 HB3 SER A 10 11.222 4.221 -14.556 1.00 0.00 H new ATOM 0 HG SER A 10 10.830 6.311 -13.631 1.00 0.00 H new ATOM 109 N VAL A 11 13.625 2.449 -15.443 1.00 0.00 N ATOM 110 CA VAL A 11 13.692 1.079 -15.939 1.00 0.00 C ATOM 111 C VAL A 11 12.608 0.213 -15.309 1.00 0.00 C ATOM 112 O VAL A 11 12.158 0.478 -14.195 1.00 0.00 O ATOM 113 CB VAL A 11 15.068 0.447 -15.657 1.00 0.00 C ATOM 114 CG1 VAL A 11 16.175 1.267 -16.301 1.00 0.00 C ATOM 115 CG2 VAL A 11 15.295 0.312 -14.159 1.00 0.00 C ATOM 0 H VAL A 11 14.040 2.585 -14.521 1.00 0.00 H new ATOM 0 HA VAL A 11 13.535 1.124 -17.017 1.00 0.00 H new ATOM 0 HB VAL A 11 15.087 -0.551 -16.095 1.00 0.00 H new ATOM 0 HG11 VAL A 11 17.140 0.805 -16.091 1.00 0.00 H new ATOM 0 HG12 VAL A 11 16.019 1.306 -17.379 1.00 0.00 H new ATOM 0 HG13 VAL A 11 16.161 2.279 -15.895 1.00 0.00 H new ATOM 0 HG21 VAL A 11 16.272 -0.136 -13.978 1.00 0.00 H new ATOM 0 HG22 VAL A 11 15.256 1.297 -13.695 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.520 -0.322 -13.729 1.00 0.00 H new ATOM 125 N GLU A 12 12.193 -0.824 -16.030 1.00 0.00 N ATOM 126 CA GLU A 12 11.160 -1.730 -15.541 1.00 0.00 C ATOM 127 C GLU A 12 11.692 -3.156 -15.439 1.00 0.00 C ATOM 128 O GLU A 12 11.257 -4.046 -16.170 1.00 0.00 O ATOM 129 CB GLU A 12 9.940 -1.693 -16.463 1.00 0.00 C ATOM 130 CG GLU A 12 9.310 -0.315 -16.585 1.00 0.00 C ATOM 131 CD GLU A 12 10.025 0.565 -17.591 1.00 0.00 C ATOM 132 OE1 GLU A 12 10.558 0.023 -18.582 1.00 0.00 O ATOM 133 OE2 GLU A 12 10.050 1.797 -17.389 1.00 0.00 O ATOM 0 H GLU A 12 12.556 -1.057 -16.954 1.00 0.00 H new ATOM 0 HA GLU A 12 10.864 -1.399 -14.546 1.00 0.00 H new ATOM 0 HB2 GLU A 12 10.234 -2.038 -17.454 1.00 0.00 H new ATOM 0 HB3 GLU A 12 9.192 -2.393 -16.091 1.00 0.00 H new ATOM 0 HG2 GLU A 12 8.266 -0.422 -16.878 1.00 0.00 H new ATOM 0 HG3 GLU A 12 9.319 0.172 -15.610 1.00 0.00 H new ATOM 140 N ASP A 13 12.634 -3.366 -14.527 1.00 0.00 N ATOM 141 CA ASP A 13 13.226 -4.685 -14.327 1.00 0.00 C ATOM 142 C ASP A 13 12.966 -5.188 -12.911 1.00 0.00 C ATOM 143 O ASP A 13 12.562 -6.334 -12.713 1.00 0.00 O ATOM 144 CB ASP A 13 14.730 -4.638 -14.598 1.00 0.00 C ATOM 145 CG ASP A 13 15.295 -5.997 -14.962 1.00 0.00 C ATOM 146 OD1 ASP A 13 15.307 -6.332 -16.165 1.00 0.00 O ATOM 147 OD2 ASP A 13 15.724 -6.727 -14.044 1.00 0.00 O ATOM 0 H ASP A 13 13.005 -2.640 -13.914 1.00 0.00 H new ATOM 0 HA ASP A 13 12.760 -5.376 -15.029 1.00 0.00 H new ATOM 0 HB2 ASP A 13 14.929 -3.936 -15.408 1.00 0.00 H new ATOM 0 HB3 ASP A 13 15.244 -4.259 -13.715 1.00 0.00 H new ATOM 152 N SER A 14 13.204 -4.324 -11.929 1.00 0.00 N ATOM 153 CA SER A 14 13.001 -4.683 -10.530 1.00 0.00 C ATOM 154 C SER A 14 11.670 -4.140 -10.017 1.00 0.00 C ATOM 155 O SER A 14 11.385 -4.192 -8.820 1.00 0.00 O ATOM 156 CB SER A 14 14.148 -4.147 -9.672 1.00 0.00 C ATOM 157 OG SER A 14 15.326 -4.912 -9.860 1.00 0.00 O ATOM 0 H SER A 14 13.537 -3.371 -12.076 1.00 0.00 H new ATOM 0 HA SER A 14 12.981 -5.771 -10.459 1.00 0.00 H new ATOM 0 HB2 SER A 14 14.342 -3.106 -9.928 1.00 0.00 H new ATOM 0 HB3 SER A 14 13.861 -4.168 -8.621 1.00 0.00 H new ATOM 0 HG SER A 14 16.045 -4.548 -9.302 1.00 0.00 H new ATOM 163 N LEU A 15 10.860 -3.618 -10.932 1.00 0.00 N ATOM 164 CA LEU A 15 9.559 -3.064 -10.574 1.00 0.00 C ATOM 165 C LEU A 15 8.480 -4.142 -10.609 1.00 0.00 C ATOM 166 O LEU A 15 8.290 -4.811 -11.624 1.00 0.00 O ATOM 167 CB LEU A 15 9.189 -1.925 -11.525 1.00 0.00 C ATOM 168 CG LEU A 15 9.955 -0.615 -11.334 1.00 0.00 C ATOM 169 CD1 LEU A 15 9.579 0.386 -12.416 1.00 0.00 C ATOM 170 CD2 LEU A 15 9.686 -0.037 -9.953 1.00 0.00 C ATOM 0 H LEU A 15 11.081 -3.567 -11.926 1.00 0.00 H new ATOM 0 HA LEU A 15 9.624 -2.674 -9.558 1.00 0.00 H new ATOM 0 HB2 LEU A 15 9.345 -2.268 -12.548 1.00 0.00 H new ATOM 0 HB3 LEU A 15 8.124 -1.719 -11.416 1.00 0.00 H new ATOM 0 HG LEU A 15 11.022 -0.824 -11.417 1.00 0.00 H new ATOM 0 HD11 LEU A 15 10.134 1.312 -12.264 1.00 0.00 H new ATOM 0 HD12 LEU A 15 9.824 -0.027 -13.395 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.510 0.591 -12.366 1.00 0.00 H new ATOM 0 HD21 LEU A 15 10.239 0.895 -9.835 1.00 0.00 H new ATOM 0 HD22 LEU A 15 8.619 0.157 -9.841 1.00 0.00 H new ATOM 0 HD23 LEU A 15 10.007 -0.748 -9.192 1.00 0.00 H new ATOM 182 N ALA A 16 7.775 -4.302 -9.494 1.00 0.00 N ATOM 183 CA ALA A 16 6.712 -5.295 -9.398 1.00 0.00 C ATOM 184 C ALA A 16 5.344 -4.628 -9.303 1.00 0.00 C ATOM 185 O ALA A 16 5.148 -3.697 -8.521 1.00 0.00 O ATOM 186 CB ALA A 16 6.943 -6.202 -8.199 1.00 0.00 C ATOM 0 H ALA A 16 7.921 -3.757 -8.644 1.00 0.00 H new ATOM 0 HA ALA A 16 6.731 -5.899 -10.305 1.00 0.00 H new ATOM 0 HB1 ALA A 16 6.141 -6.938 -8.140 1.00 0.00 H new ATOM 0 HB2 ALA A 16 7.899 -6.714 -8.309 1.00 0.00 H new ATOM 0 HB3 ALA A 16 6.954 -5.604 -7.288 1.00 0.00 H new ATOM 192 N THR A 17 4.399 -5.109 -10.105 1.00 0.00 N ATOM 193 CA THR A 17 3.050 -4.558 -10.113 1.00 0.00 C ATOM 194 C THR A 17 2.350 -4.800 -8.781 1.00 0.00 C ATOM 195 O THR A 17 1.802 -5.876 -8.542 1.00 0.00 O ATOM 196 CB THR A 17 2.200 -5.167 -11.244 1.00 0.00 C ATOM 197 OG1 THR A 17 2.865 -4.996 -12.501 1.00 0.00 O ATOM 198 CG2 THR A 17 0.826 -4.517 -11.299 1.00 0.00 C ATOM 0 H THR A 17 4.544 -5.879 -10.758 1.00 0.00 H new ATOM 0 HA THR A 17 3.148 -3.485 -10.280 1.00 0.00 H new ATOM 0 HB THR A 17 2.073 -6.230 -11.041 1.00 0.00 H new ATOM 0 HG1 THR A 17 2.320 -5.387 -13.215 1.00 0.00 H new ATOM 0 HG21 THR A 17 0.244 -4.964 -12.105 1.00 0.00 H new ATOM 0 HG22 THR A 17 0.311 -4.673 -10.351 1.00 0.00 H new ATOM 0 HG23 THR A 17 0.936 -3.448 -11.480 1.00 0.00 H new ATOM 206 N VAL A 18 2.370 -3.791 -7.915 1.00 0.00 N ATOM 207 CA VAL A 18 1.735 -3.894 -6.606 1.00 0.00 C ATOM 208 C VAL A 18 0.375 -3.205 -6.600 1.00 0.00 C ATOM 209 O VAL A 18 0.288 -1.979 -6.659 1.00 0.00 O ATOM 210 CB VAL A 18 2.617 -3.277 -5.504 1.00 0.00 C ATOM 211 CG1 VAL A 18 1.883 -3.273 -4.172 1.00 0.00 C ATOM 212 CG2 VAL A 18 3.935 -4.028 -5.394 1.00 0.00 C ATOM 0 H VAL A 18 2.819 -2.893 -8.096 1.00 0.00 H new ATOM 0 HA VAL A 18 1.602 -4.956 -6.401 1.00 0.00 H new ATOM 0 HB VAL A 18 2.836 -2.244 -5.774 1.00 0.00 H new ATOM 0 HG11 VAL A 18 2.522 -2.834 -3.406 1.00 0.00 H new ATOM 0 HG12 VAL A 18 0.969 -2.687 -4.262 1.00 0.00 H new ATOM 0 HG13 VAL A 18 1.632 -4.296 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL A 18 4.546 -3.579 -4.611 1.00 0.00 H new ATOM 0 HG22 VAL A 18 3.740 -5.072 -5.148 1.00 0.00 H new ATOM 0 HG23 VAL A 18 4.466 -3.973 -6.344 1.00 0.00 H new ATOM 222 N LYS A 19 -0.685 -4.003 -6.526 1.00 0.00 N ATOM 223 CA LYS A 19 -2.043 -3.471 -6.510 1.00 0.00 C ATOM 224 C LYS A 19 -2.406 -2.948 -5.123 1.00 0.00 C ATOM 225 O LYS A 19 -2.013 -3.525 -4.109 1.00 0.00 O ATOM 226 CB LYS A 19 -3.040 -4.550 -6.937 1.00 0.00 C ATOM 227 CG LYS A 19 -2.937 -4.927 -8.405 1.00 0.00 C ATOM 228 CD LYS A 19 -4.190 -5.639 -8.887 1.00 0.00 C ATOM 229 CE LYS A 19 -4.470 -6.891 -8.070 1.00 0.00 C ATOM 230 NZ LYS A 19 -3.603 -8.028 -8.484 1.00 0.00 N ATOM 0 H LYS A 19 -0.630 -5.020 -6.476 1.00 0.00 H new ATOM 0 HA LYS A 19 -2.090 -2.642 -7.216 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -2.880 -5.441 -6.330 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -4.052 -4.200 -6.730 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -2.775 -4.029 -9.002 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -2.071 -5.571 -8.556 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -5.042 -4.962 -8.821 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -4.076 -5.907 -9.937 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -4.310 -6.678 -7.013 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -5.517 -7.172 -8.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -3.824 -8.862 -7.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -3.774 -8.248 -9.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -2.604 -7.769 -8.352 1.00 0.00 H new ATOM 244 N VAL A 20 -3.159 -1.854 -5.087 1.00 0.00 N ATOM 245 CA VAL A 20 -3.577 -1.255 -3.825 1.00 0.00 C ATOM 246 C VAL A 20 -5.090 -1.077 -3.776 1.00 0.00 C ATOM 247 O VAL A 20 -5.680 -0.442 -4.650 1.00 0.00 O ATOM 248 CB VAL A 20 -2.903 0.112 -3.602 1.00 0.00 C ATOM 249 CG1 VAL A 20 -3.453 0.780 -2.351 1.00 0.00 C ATOM 250 CG2 VAL A 20 -1.393 -0.048 -3.510 1.00 0.00 C ATOM 0 H VAL A 20 -3.492 -1.364 -5.917 1.00 0.00 H new ATOM 0 HA VAL A 20 -3.268 -1.937 -3.033 1.00 0.00 H new ATOM 0 HB VAL A 20 -3.127 0.752 -4.456 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -2.965 1.745 -2.209 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -4.527 0.929 -2.460 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -3.261 0.146 -1.486 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -0.933 0.927 -3.352 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -1.147 -0.704 -2.675 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -1.016 -0.482 -4.436 1.00 0.00 H new ATOM 260 N VAL A 21 -5.714 -1.642 -2.747 1.00 0.00 N ATOM 261 CA VAL A 21 -7.160 -1.544 -2.582 1.00 0.00 C ATOM 262 C VAL A 21 -7.518 -0.852 -1.272 1.00 0.00 C ATOM 263 O VAL A 21 -7.057 -1.249 -0.201 1.00 0.00 O ATOM 264 CB VAL A 21 -7.823 -2.934 -2.614 1.00 0.00 C ATOM 265 CG1 VAL A 21 -9.329 -2.811 -2.436 1.00 0.00 C ATOM 266 CG2 VAL A 21 -7.488 -3.654 -3.911 1.00 0.00 C ATOM 0 H VAL A 21 -5.241 -2.172 -2.015 1.00 0.00 H new ATOM 0 HA VAL A 21 -7.535 -0.951 -3.416 1.00 0.00 H new ATOM 0 HB VAL A 21 -7.430 -3.524 -1.786 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -9.781 -3.803 -2.461 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -9.545 -2.338 -1.478 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -9.742 -2.204 -3.241 1.00 0.00 H new ATOM 0 HG21 VAL A 21 -7.965 -4.634 -3.917 1.00 0.00 H new ATOM 0 HG22 VAL A 21 -7.851 -3.069 -4.756 1.00 0.00 H new ATOM 0 HG23 VAL A 21 -6.408 -3.775 -3.991 1.00 0.00 H new ATOM 276 N LEU A 22 -8.343 0.185 -1.364 1.00 0.00 N ATOM 277 CA LEU A 22 -8.765 0.933 -0.185 1.00 0.00 C ATOM 278 C LEU A 22 -9.842 0.175 0.585 1.00 0.00 C ATOM 279 O LEU A 22 -10.851 -0.239 0.014 1.00 0.00 O ATOM 280 CB LEU A 22 -9.288 2.312 -0.592 1.00 0.00 C ATOM 281 CG LEU A 22 -8.233 3.329 -1.028 1.00 0.00 C ATOM 282 CD1 LEU A 22 -8.862 4.419 -1.881 1.00 0.00 C ATOM 283 CD2 LEU A 22 -7.540 3.931 0.185 1.00 0.00 C ATOM 0 H LEU A 22 -8.733 0.527 -2.242 1.00 0.00 H new ATOM 0 HA LEU A 22 -7.899 1.057 0.465 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -9.998 2.182 -1.409 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -9.842 2.731 0.248 1.00 0.00 H new ATOM 0 HG LEU A 22 -7.485 2.813 -1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 22 -8.096 5.133 -2.182 1.00 0.00 H new ATOM 0 HD12 LEU A 22 -9.311 3.973 -2.769 1.00 0.00 H new ATOM 0 HD13 LEU A 22 -9.631 4.933 -1.305 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -6.792 4.653 -0.144 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -8.276 4.432 0.813 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -7.054 3.140 0.756 1.00 0.00 H new ATOM 295 N ILE A 23 -9.621 0.000 1.883 1.00 0.00 N ATOM 296 CA ILE A 23 -10.574 -0.705 2.732 1.00 0.00 C ATOM 297 C ILE A 23 -11.834 0.125 2.950 1.00 0.00 C ATOM 298 O ILE A 23 -12.946 -0.291 2.624 1.00 0.00 O ATOM 299 CB ILE A 23 -9.959 -1.054 4.100 1.00 0.00 C ATOM 300 CG1 ILE A 23 -9.306 -2.437 4.053 1.00 0.00 C ATOM 301 CG2 ILE A 23 -11.021 -1.001 5.187 1.00 0.00 C ATOM 302 CD1 ILE A 23 -10.242 -3.531 3.591 1.00 0.00 C ATOM 0 H ILE A 23 -8.790 0.337 2.370 1.00 0.00 H new ATOM 0 HA ILE A 23 -10.835 -1.628 2.215 1.00 0.00 H new ATOM 0 HB ILE A 23 -9.190 -0.318 4.334 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -8.445 -2.401 3.386 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -8.930 -2.686 5.045 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -10.571 -1.250 6.148 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -11.444 0.002 5.234 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -11.810 -1.717 4.960 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -9.712 -4.483 3.582 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -11.091 -3.595 4.271 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -10.598 -3.305 2.586 1.00 0.00 H new ATOM 314 N PRO A 24 -11.659 1.330 3.514 1.00 0.00 N ATOM 315 CA PRO A 24 -12.771 2.245 3.787 1.00 0.00 C ATOM 316 C PRO A 24 -13.373 2.822 2.510 1.00 0.00 C ATOM 317 O PRO A 24 -14.582 3.041 2.426 1.00 0.00 O ATOM 318 CB PRO A 24 -12.121 3.354 4.620 1.00 0.00 C ATOM 319 CG PRO A 24 -10.684 3.328 4.229 1.00 0.00 C ATOM 320 CD PRO A 24 -10.362 1.891 3.929 1.00 0.00 C ATOM 0 HA PRO A 24 -13.598 1.744 4.290 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -12.571 4.324 4.408 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -12.244 3.171 5.687 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -10.505 3.958 3.358 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.054 3.709 5.033 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.615 1.803 3.140 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -9.964 1.377 4.804 1.00 0.00 H new ATOM 328 N VAL A 25 -12.523 3.066 1.518 1.00 0.00 N ATOM 329 CA VAL A 25 -12.972 3.616 0.244 1.00 0.00 C ATOM 330 C VAL A 25 -13.456 2.513 -0.690 1.00 0.00 C ATOM 331 O VAL A 25 -14.571 2.568 -1.207 1.00 0.00 O ATOM 332 CB VAL A 25 -11.849 4.408 -0.452 1.00 0.00 C ATOM 333 CG1 VAL A 25 -12.430 5.362 -1.485 1.00 0.00 C ATOM 334 CG2 VAL A 25 -11.015 5.162 0.573 1.00 0.00 C ATOM 0 H VAL A 25 -11.519 2.892 1.572 1.00 0.00 H new ATOM 0 HA VAL A 25 -13.799 4.291 0.464 1.00 0.00 H new ATOM 0 HB VAL A 25 -11.197 3.704 -0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -11.622 5.913 -1.966 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -12.980 4.794 -2.236 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -13.105 6.063 -0.994 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -10.226 5.716 0.064 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -11.652 5.857 1.120 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -10.568 4.454 1.271 1.00 0.00 H new ATOM 344 N GLY A 26 -12.609 1.511 -0.903 1.00 0.00 N ATOM 345 CA GLY A 26 -12.968 0.408 -1.776 1.00 0.00 C ATOM 346 C GLY A 26 -12.504 0.623 -3.203 1.00 0.00 C ATOM 347 O GLY A 26 -12.804 -0.179 -4.086 1.00 0.00 O ATOM 0 H GLY A 26 -11.680 1.443 -0.487 1.00 0.00 H new ATOM 0 HA2 GLY A 26 -12.532 -0.513 -1.390 1.00 0.00 H new ATOM 0 HA3 GLY A 26 -14.050 0.277 -1.765 1.00 0.00 H new ATOM 351 N GLN A 27 -11.772 1.709 -3.428 1.00 0.00 N ATOM 352 CA GLN A 27 -11.268 2.028 -4.759 1.00 0.00 C ATOM 353 C GLN A 27 -9.966 1.286 -5.040 1.00 0.00 C ATOM 354 O GLN A 27 -9.140 1.102 -4.146 1.00 0.00 O ATOM 355 CB GLN A 27 -11.050 3.535 -4.897 1.00 0.00 C ATOM 356 CG GLN A 27 -10.915 4.001 -6.338 1.00 0.00 C ATOM 357 CD GLN A 27 -10.810 5.508 -6.457 1.00 0.00 C ATOM 358 OE1 GLN A 27 -11.811 6.220 -6.373 1.00 0.00 O ATOM 359 NE2 GLN A 27 -9.594 6.004 -6.653 1.00 0.00 N ATOM 0 H GLN A 27 -11.515 2.383 -2.707 1.00 0.00 H new ATOM 0 HA GLN A 27 -12.012 1.708 -5.488 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -11.885 4.059 -4.431 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -10.151 3.816 -4.347 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -10.031 3.543 -6.783 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -11.776 3.654 -6.910 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -8.792 5.377 -6.716 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -9.462 7.012 -6.740 1.00 0.00 H new ATOM 368 N GLU A 28 -9.789 0.861 -6.287 1.00 0.00 N ATOM 369 CA GLU A 28 -8.587 0.137 -6.684 1.00 0.00 C ATOM 370 C GLU A 28 -7.548 1.089 -7.270 1.00 0.00 C ATOM 371 O GLU A 28 -7.887 2.022 -7.998 1.00 0.00 O ATOM 372 CB GLU A 28 -8.933 -0.949 -7.705 1.00 0.00 C ATOM 373 CG GLU A 28 -9.332 -2.272 -7.074 1.00 0.00 C ATOM 374 CD GLU A 28 -9.278 -3.426 -8.056 1.00 0.00 C ATOM 375 OE1 GLU A 28 -8.198 -4.038 -8.193 1.00 0.00 O ATOM 376 OE2 GLU A 28 -10.315 -3.718 -8.688 1.00 0.00 O ATOM 0 H GLU A 28 -10.462 1.005 -7.039 1.00 0.00 H new ATOM 0 HA GLU A 28 -8.165 -0.332 -5.795 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -9.749 -0.596 -8.336 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -8.074 -1.111 -8.356 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -8.671 -2.484 -6.234 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -10.342 -2.189 -6.672 1.00 0.00 H new ATOM 383 N ILE A 29 -6.283 0.846 -6.946 1.00 0.00 N ATOM 384 CA ILE A 29 -5.194 1.680 -7.440 1.00 0.00 C ATOM 385 C ILE A 29 -3.988 0.834 -7.832 1.00 0.00 C ATOM 386 O ILE A 29 -3.667 -0.153 -7.171 1.00 0.00 O ATOM 387 CB ILE A 29 -4.759 2.718 -6.388 1.00 0.00 C ATOM 388 CG1 ILE A 29 -5.976 3.473 -5.850 1.00 0.00 C ATOM 389 CG2 ILE A 29 -3.750 3.687 -6.987 1.00 0.00 C ATOM 390 CD1 ILE A 29 -5.634 4.487 -4.782 1.00 0.00 C ATOM 0 H ILE A 29 -5.986 0.078 -6.343 1.00 0.00 H new ATOM 0 HA ILE A 29 -5.570 2.202 -8.320 1.00 0.00 H new ATOM 0 HB ILE A 29 -4.284 2.195 -5.558 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -6.473 3.981 -6.676 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -6.688 2.755 -5.443 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -3.452 4.415 -6.232 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -2.873 3.136 -7.326 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -4.202 4.206 -7.833 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -6.545 4.984 -4.447 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -5.165 3.982 -3.938 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -4.946 5.227 -5.190 1.00 0.00 H new ATOM 402 N VAL A 30 -3.321 1.229 -8.913 1.00 0.00 N ATOM 403 CA VAL A 30 -2.148 0.510 -9.393 1.00 0.00 C ATOM 404 C VAL A 30 -0.937 1.432 -9.485 1.00 0.00 C ATOM 405 O VAL A 30 -1.016 2.521 -10.054 1.00 0.00 O ATOM 406 CB VAL A 30 -2.404 -0.123 -10.773 1.00 0.00 C ATOM 407 CG1 VAL A 30 -1.120 -0.715 -11.335 1.00 0.00 C ATOM 408 CG2 VAL A 30 -3.492 -1.182 -10.680 1.00 0.00 C ATOM 0 H VAL A 30 -3.574 2.044 -9.472 1.00 0.00 H new ATOM 0 HA VAL A 30 -1.944 -0.281 -8.671 1.00 0.00 H new ATOM 0 HB VAL A 30 -2.745 0.657 -11.453 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -1.320 -1.158 -12.311 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -0.372 0.071 -11.440 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.746 -1.483 -10.658 1.00 0.00 H new ATOM 0 HG21 VAL A 30 -3.660 -1.619 -11.664 1.00 0.00 H new ATOM 0 HG22 VAL A 30 -3.182 -1.962 -9.985 1.00 0.00 H new ATOM 0 HG23 VAL A 30 -4.415 -0.725 -10.324 1.00 0.00 H new ATOM 418 N ILE A 31 0.182 0.988 -8.922 1.00 0.00 N ATOM 419 CA ILE A 31 1.410 1.773 -8.943 1.00 0.00 C ATOM 420 C ILE A 31 2.639 0.873 -8.879 1.00 0.00 C ATOM 421 O ILE A 31 2.730 -0.038 -8.055 1.00 0.00 O ATOM 422 CB ILE A 31 1.458 2.773 -7.772 1.00 0.00 C ATOM 423 CG1 ILE A 31 2.851 3.396 -7.663 1.00 0.00 C ATOM 424 CG2 ILE A 31 1.078 2.083 -6.470 1.00 0.00 C ATOM 425 CD1 ILE A 31 3.022 4.287 -6.452 1.00 0.00 C ATOM 0 H ILE A 31 0.263 0.089 -8.446 1.00 0.00 H new ATOM 0 HA ILE A 31 1.416 2.325 -9.883 1.00 0.00 H new ATOM 0 HB ILE A 31 0.738 3.568 -7.963 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.594 2.600 -7.626 1.00 0.00 H new ATOM 0 HG13 ILE A 31 3.051 3.977 -8.563 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.117 2.803 -5.652 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.068 1.681 -6.552 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.777 1.270 -6.272 1.00 0.00 H new ATOM 0 HD11 ILE A 31 4.033 4.694 -6.440 1.00 0.00 H new ATOM 0 HD12 ILE A 31 2.302 5.104 -6.497 1.00 0.00 H new ATOM 0 HD13 ILE A 31 2.854 3.705 -5.546 1.00 0.00 H new ATOM 437 N PRO A 32 3.609 1.132 -9.768 1.00 0.00 N ATOM 438 CA PRO A 32 4.852 0.358 -9.833 1.00 0.00 C ATOM 439 C PRO A 32 5.753 0.609 -8.629 1.00 0.00 C ATOM 440 O PRO A 32 6.083 1.752 -8.315 1.00 0.00 O ATOM 441 CB PRO A 32 5.519 0.863 -11.114 1.00 0.00 C ATOM 442 CG PRO A 32 4.974 2.236 -11.309 1.00 0.00 C ATOM 443 CD PRO A 32 3.567 2.202 -10.780 1.00 0.00 C ATOM 0 HA PRO A 32 4.664 -0.716 -9.830 1.00 0.00 H new ATOM 0 HB2 PRO A 32 6.604 0.878 -11.016 1.00 0.00 H new ATOM 0 HB3 PRO A 32 5.285 0.220 -11.962 1.00 0.00 H new ATOM 0 HG2 PRO A 32 5.574 2.973 -10.775 1.00 0.00 H new ATOM 0 HG3 PRO A 32 4.988 2.516 -12.362 1.00 0.00 H new ATOM 0 HD2 PRO A 32 3.279 3.158 -10.342 1.00 0.00 H new ATOM 0 HD3 PRO A 32 2.847 1.982 -11.568 1.00 0.00 H new ATOM 451 N PHE A 33 6.150 -0.468 -7.958 1.00 0.00 N ATOM 452 CA PHE A 33 7.013 -0.364 -6.787 1.00 0.00 C ATOM 453 C PHE A 33 8.240 -1.260 -6.936 1.00 0.00 C ATOM 454 O PHE A 33 8.275 -2.149 -7.786 1.00 0.00 O ATOM 455 CB PHE A 33 6.241 -0.744 -5.522 1.00 0.00 C ATOM 456 CG PHE A 33 6.792 -0.118 -4.273 1.00 0.00 C ATOM 457 CD1 PHE A 33 7.035 1.245 -4.215 1.00 0.00 C ATOM 458 CD2 PHE A 33 7.068 -0.892 -3.158 1.00 0.00 C ATOM 459 CE1 PHE A 33 7.541 1.825 -3.067 1.00 0.00 C ATOM 460 CE2 PHE A 33 7.574 -0.318 -2.007 1.00 0.00 C ATOM 461 CZ PHE A 33 7.812 1.042 -1.962 1.00 0.00 C ATOM 0 H PHE A 33 5.888 -1.422 -8.205 1.00 0.00 H new ATOM 0 HA PHE A 33 7.347 0.670 -6.703 1.00 0.00 H new ATOM 0 HB2 PHE A 33 5.199 -0.446 -5.639 1.00 0.00 H new ATOM 0 HB3 PHE A 33 6.252 -1.828 -5.411 1.00 0.00 H new ATOM 0 HD1 PHE A 33 6.827 1.861 -5.077 1.00 0.00 H new ATOM 0 HD2 PHE A 33 6.886 -1.956 -3.188 1.00 0.00 H new ATOM 0 HE1 PHE A 33 7.724 2.889 -3.034 1.00 0.00 H new ATOM 0 HE2 PHE A 33 7.783 -0.932 -1.144 1.00 0.00 H new ATOM 0 HZ PHE A 33 8.209 1.492 -1.064 1.00 0.00 H new ATOM 471 N LYS A 34 9.247 -1.017 -6.103 1.00 0.00 N ATOM 472 CA LYS A 34 10.476 -1.800 -6.139 1.00 0.00 C ATOM 473 C LYS A 34 10.482 -2.855 -5.038 1.00 0.00 C ATOM 474 O LYS A 34 10.205 -2.556 -3.876 1.00 0.00 O ATOM 475 CB LYS A 34 11.693 -0.884 -5.988 1.00 0.00 C ATOM 476 CG LYS A 34 11.777 0.196 -7.054 1.00 0.00 C ATOM 477 CD LYS A 34 12.560 -0.278 -8.267 1.00 0.00 C ATOM 478 CE LYS A 34 14.060 -0.182 -8.034 1.00 0.00 C ATOM 479 NZ LYS A 34 14.568 1.201 -8.249 1.00 0.00 N ATOM 0 H LYS A 34 9.235 -0.283 -5.394 1.00 0.00 H new ATOM 0 HA LYS A 34 10.526 -2.306 -7.103 1.00 0.00 H new ATOM 0 HB2 LYS A 34 11.663 -0.412 -5.006 1.00 0.00 H new ATOM 0 HB3 LYS A 34 12.599 -1.489 -6.023 1.00 0.00 H new ATOM 0 HG2 LYS A 34 10.772 0.486 -7.359 1.00 0.00 H new ATOM 0 HG3 LYS A 34 12.252 1.084 -6.637 1.00 0.00 H new ATOM 0 HD2 LYS A 34 12.291 -1.310 -8.495 1.00 0.00 H new ATOM 0 HD3 LYS A 34 12.286 0.322 -9.135 1.00 0.00 H new ATOM 0 HE2 LYS A 34 14.290 -0.499 -7.017 1.00 0.00 H new ATOM 0 HE3 LYS A 34 14.576 -0.867 -8.706 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 15.594 1.224 -8.080 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 14.371 1.495 -9.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 14.094 1.851 -7.590 1.00 0.00 H new ATOM 493 N VAL A 35 10.800 -4.091 -5.410 1.00 0.00 N ATOM 494 CA VAL A 35 10.844 -5.190 -4.454 1.00 0.00 C ATOM 495 C VAL A 35 12.074 -5.090 -3.558 1.00 0.00 C ATOM 496 O VAL A 35 12.112 -5.669 -2.472 1.00 0.00 O ATOM 497 CB VAL A 35 10.853 -6.555 -5.167 1.00 0.00 C ATOM 498 CG1 VAL A 35 9.660 -6.676 -6.104 1.00 0.00 C ATOM 499 CG2 VAL A 35 12.158 -6.752 -5.924 1.00 0.00 C ATOM 0 H VAL A 35 11.031 -4.356 -6.368 1.00 0.00 H new ATOM 0 HA VAL A 35 9.945 -5.113 -3.843 1.00 0.00 H new ATOM 0 HB VAL A 35 10.774 -7.339 -4.414 1.00 0.00 H new ATOM 0 HG11 VAL A 35 9.683 -7.647 -6.599 1.00 0.00 H new ATOM 0 HG12 VAL A 35 8.737 -6.582 -5.532 1.00 0.00 H new ATOM 0 HG13 VAL A 35 9.704 -5.886 -6.853 1.00 0.00 H new ATOM 0 HG21 VAL A 35 12.147 -7.722 -6.422 1.00 0.00 H new ATOM 0 HG22 VAL A 35 12.270 -5.963 -6.668 1.00 0.00 H new ATOM 0 HG23 VAL A 35 12.994 -6.712 -5.225 1.00 0.00 H new ATOM 509 N ASP A 36 13.076 -4.350 -4.019 1.00 0.00 N ATOM 510 CA ASP A 36 14.308 -4.172 -3.259 1.00 0.00 C ATOM 511 C ASP A 36 14.294 -2.846 -2.505 1.00 0.00 C ATOM 512 O ASP A 36 15.343 -2.316 -2.139 1.00 0.00 O ATOM 513 CB ASP A 36 15.520 -4.232 -4.189 1.00 0.00 C ATOM 514 CG ASP A 36 15.386 -3.297 -5.375 1.00 0.00 C ATOM 515 OD1 ASP A 36 14.780 -2.218 -5.214 1.00 0.00 O ATOM 516 OD2 ASP A 36 15.887 -3.646 -6.465 1.00 0.00 O ATOM 0 H ASP A 36 13.060 -3.864 -4.915 1.00 0.00 H new ATOM 0 HA ASP A 36 14.378 -4.982 -2.533 1.00 0.00 H new ATOM 0 HB2 ASP A 36 16.418 -3.976 -3.627 1.00 0.00 H new ATOM 0 HB3 ASP A 36 15.649 -5.253 -4.548 1.00 0.00 H new ATOM 521 N THR A 37 13.097 -2.313 -2.278 1.00 0.00 N ATOM 522 CA THR A 37 12.947 -1.047 -1.570 1.00 0.00 C ATOM 523 C THR A 37 11.905 -1.157 -0.463 1.00 0.00 C ATOM 524 O THR A 37 10.785 -1.613 -0.695 1.00 0.00 O ATOM 525 CB THR A 37 12.541 0.088 -2.530 1.00 0.00 C ATOM 526 OG1 THR A 37 13.501 0.202 -3.586 1.00 0.00 O ATOM 527 CG2 THR A 37 12.436 1.412 -1.788 1.00 0.00 C ATOM 0 H THR A 37 12.218 -2.738 -2.574 1.00 0.00 H new ATOM 0 HA THR A 37 13.917 -0.813 -1.131 1.00 0.00 H new ATOM 0 HB THR A 37 11.565 -0.153 -2.951 1.00 0.00 H new ATOM 0 HG1 THR A 37 13.235 0.924 -4.193 1.00 0.00 H new ATOM 0 HG21 THR A 37 12.148 2.198 -2.486 1.00 0.00 H new ATOM 0 HG22 THR A 37 11.684 1.331 -1.003 1.00 0.00 H new ATOM 0 HG23 THR A 37 13.400 1.657 -1.343 1.00 0.00 H new ATOM 535 N ILE A 38 12.281 -0.737 0.740 1.00 0.00 N ATOM 536 CA ILE A 38 11.377 -0.787 1.883 1.00 0.00 C ATOM 537 C ILE A 38 9.981 -0.308 1.502 1.00 0.00 C ATOM 538 O ILE A 38 9.812 0.445 0.541 1.00 0.00 O ATOM 539 CB ILE A 38 11.900 0.068 3.052 1.00 0.00 C ATOM 540 CG1 ILE A 38 12.231 1.482 2.570 1.00 0.00 C ATOM 541 CG2 ILE A 38 13.124 -0.583 3.680 1.00 0.00 C ATOM 542 CD1 ILE A 38 12.573 2.439 3.691 1.00 0.00 C ATOM 0 H ILE A 38 13.205 -0.358 0.949 1.00 0.00 H new ATOM 0 HA ILE A 38 11.327 -1.829 2.200 1.00 0.00 H new ATOM 0 HB ILE A 38 11.120 0.135 3.810 1.00 0.00 H new ATOM 0 HG12 ILE A 38 13.070 1.433 1.876 1.00 0.00 H new ATOM 0 HG13 ILE A 38 11.380 1.876 2.014 1.00 0.00 H new ATOM 0 HG21 ILE A 38 13.481 0.034 4.505 1.00 0.00 H new ATOM 0 HG22 ILE A 38 12.858 -1.571 4.055 1.00 0.00 H new ATOM 0 HG23 ILE A 38 13.910 -0.678 2.931 1.00 0.00 H new ATOM 0 HD11 ILE A 38 12.796 3.421 3.275 1.00 0.00 H new ATOM 0 HD12 ILE A 38 11.727 2.518 4.373 1.00 0.00 H new ATOM 0 HD13 ILE A 38 13.443 2.068 4.233 1.00 0.00 H new ATOM 554 N LEU A 39 8.983 -0.746 2.261 1.00 0.00 N ATOM 555 CA LEU A 39 7.600 -0.360 2.004 1.00 0.00 C ATOM 556 C LEU A 39 7.368 1.104 2.364 1.00 0.00 C ATOM 557 O LEU A 39 6.494 1.763 1.798 1.00 0.00 O ATOM 558 CB LEU A 39 6.645 -1.250 2.801 1.00 0.00 C ATOM 559 CG LEU A 39 6.567 -2.713 2.362 1.00 0.00 C ATOM 560 CD1 LEU A 39 6.027 -3.580 3.489 1.00 0.00 C ATOM 561 CD2 LEU A 39 5.701 -2.851 1.119 1.00 0.00 C ATOM 0 H LEU A 39 9.105 -1.369 3.060 1.00 0.00 H new ATOM 0 HA LEU A 39 7.404 -0.489 0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 39 6.943 -1.221 3.849 1.00 0.00 H new ATOM 0 HB3 LEU A 39 5.645 -0.820 2.742 1.00 0.00 H new ATOM 0 HG LEU A 39 7.573 -3.054 2.119 1.00 0.00 H new ATOM 0 HD11 LEU A 39 5.978 -4.618 3.159 1.00 0.00 H new ATOM 0 HD12 LEU A 39 6.686 -3.505 4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 39 5.029 -3.240 3.764 1.00 0.00 H new ATOM 0 HD21 LEU A 39 5.657 -3.898 0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 39 4.695 -2.492 1.335 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.130 -2.261 0.309 1.00 0.00 H new ATOM 573 N LYS A 40 8.156 1.609 3.306 1.00 0.00 N ATOM 574 CA LYS A 40 8.040 2.997 3.739 1.00 0.00 C ATOM 575 C LYS A 40 7.820 3.922 2.547 1.00 0.00 C ATOM 576 O LYS A 40 6.818 4.633 2.478 1.00 0.00 O ATOM 577 CB LYS A 40 9.297 3.421 4.503 1.00 0.00 C ATOM 578 CG LYS A 40 9.119 4.699 5.304 1.00 0.00 C ATOM 579 CD LYS A 40 7.897 4.628 6.204 1.00 0.00 C ATOM 580 CE LYS A 40 8.027 5.564 7.396 1.00 0.00 C ATOM 581 NZ LYS A 40 7.283 5.058 8.583 1.00 0.00 N ATOM 0 H LYS A 40 8.883 1.078 3.785 1.00 0.00 H new ATOM 0 HA LYS A 40 7.177 3.075 4.400 1.00 0.00 H new ATOM 0 HB2 LYS A 40 9.590 2.617 5.178 1.00 0.00 H new ATOM 0 HB3 LYS A 40 10.114 3.557 3.795 1.00 0.00 H new ATOM 0 HG2 LYS A 40 10.008 4.877 5.909 1.00 0.00 H new ATOM 0 HG3 LYS A 40 9.022 5.545 4.624 1.00 0.00 H new ATOM 0 HD2 LYS A 40 7.007 4.888 5.631 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.762 3.605 6.556 1.00 0.00 H new ATOM 0 HE2 LYS A 40 9.080 5.683 7.651 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.651 6.551 7.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 7.397 5.724 9.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 6.274 4.969 8.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 7.658 4.128 8.857 1.00 0.00 H new ATOM 595 N TYR A 41 8.763 3.908 1.611 1.00 0.00 N ATOM 596 CA TYR A 41 8.672 4.747 0.422 1.00 0.00 C ATOM 597 C TYR A 41 7.223 4.893 -0.032 1.00 0.00 C ATOM 598 O TYR A 41 6.681 5.999 -0.073 1.00 0.00 O ATOM 599 CB TYR A 41 9.516 4.157 -0.709 1.00 0.00 C ATOM 600 CG TYR A 41 10.950 4.635 -0.708 1.00 0.00 C ATOM 601 CD1 TYR A 41 11.812 4.305 0.330 1.00 0.00 C ATOM 602 CD2 TYR A 41 11.443 5.417 -1.745 1.00 0.00 C ATOM 603 CE1 TYR A 41 13.123 4.741 0.336 1.00 0.00 C ATOM 604 CE2 TYR A 41 12.753 5.856 -1.748 1.00 0.00 C ATOM 605 CZ TYR A 41 13.589 5.516 -0.705 1.00 0.00 C ATOM 606 OH TYR A 41 14.895 5.950 -0.704 1.00 0.00 O ATOM 0 H TYR A 41 9.599 3.325 1.653 1.00 0.00 H new ATOM 0 HA TYR A 41 9.055 5.735 0.675 1.00 0.00 H new ATOM 0 HB2 TYR A 41 9.504 3.070 -0.630 1.00 0.00 H new ATOM 0 HB3 TYR A 41 9.057 4.412 -1.664 1.00 0.00 H new ATOM 0 HD1 TYR A 41 11.451 3.697 1.146 1.00 0.00 H new ATOM 0 HD2 TYR A 41 10.791 5.686 -2.563 1.00 0.00 H new ATOM 0 HE1 TYR A 41 13.779 4.476 1.152 1.00 0.00 H new ATOM 0 HE2 TYR A 41 13.120 6.462 -2.563 1.00 0.00 H new ATOM 0 HH TYR A 41 15.063 6.484 -1.509 1.00 0.00 H new ATOM 616 N LEU A 42 6.600 3.770 -0.373 1.00 0.00 N ATOM 617 CA LEU A 42 5.213 3.771 -0.824 1.00 0.00 C ATOM 618 C LEU A 42 4.294 4.357 0.243 1.00 0.00 C ATOM 619 O LEU A 42 3.363 5.102 -0.065 1.00 0.00 O ATOM 620 CB LEU A 42 4.769 2.349 -1.172 1.00 0.00 C ATOM 621 CG LEU A 42 3.495 2.230 -2.009 1.00 0.00 C ATOM 622 CD1 LEU A 42 3.762 2.642 -3.448 1.00 0.00 C ATOM 623 CD2 LEU A 42 2.949 0.811 -1.951 1.00 0.00 C ATOM 0 H LEU A 42 7.034 2.847 -0.346 1.00 0.00 H new ATOM 0 HA LEU A 42 5.147 4.394 -1.716 1.00 0.00 H new ATOM 0 HB2 LEU A 42 5.580 1.858 -1.709 1.00 0.00 H new ATOM 0 HB3 LEU A 42 4.622 1.798 -0.243 1.00 0.00 H new ATOM 0 HG LEU A 42 2.746 2.903 -1.593 1.00 0.00 H new ATOM 0 HD11 LEU A 42 2.844 2.551 -4.029 1.00 0.00 H new ATOM 0 HD12 LEU A 42 4.106 3.676 -3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 42 4.528 1.995 -3.876 1.00 0.00 H new ATOM 0 HD21 LEU A 42 2.042 0.745 -2.552 1.00 0.00 H new ATOM 0 HD22 LEU A 42 3.694 0.118 -2.341 1.00 0.00 H new ATOM 0 HD23 LEU A 42 2.719 0.552 -0.918 1.00 0.00 H new ATOM 635 N LYS A 43 4.562 4.017 1.499 1.00 0.00 N ATOM 636 CA LYS A 43 3.762 4.511 2.613 1.00 0.00 C ATOM 637 C LYS A 43 3.720 6.036 2.618 1.00 0.00 C ATOM 638 O LYS A 43 2.656 6.637 2.471 1.00 0.00 O ATOM 639 CB LYS A 43 4.329 4.002 3.941 1.00 0.00 C ATOM 640 CG LYS A 43 3.461 4.337 5.141 1.00 0.00 C ATOM 641 CD LYS A 43 3.862 3.526 6.362 1.00 0.00 C ATOM 642 CE LYS A 43 3.371 2.090 6.263 1.00 0.00 C ATOM 643 NZ LYS A 43 4.195 1.164 7.089 1.00 0.00 N ATOM 0 H LYS A 43 5.328 3.401 1.771 1.00 0.00 H new ATOM 0 HA LYS A 43 2.745 4.137 2.492 1.00 0.00 H new ATOM 0 HB2 LYS A 43 4.452 2.921 3.883 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.321 4.429 4.090 1.00 0.00 H new ATOM 0 HG2 LYS A 43 3.544 5.400 5.366 1.00 0.00 H new ATOM 0 HG3 LYS A 43 2.416 4.143 4.901 1.00 0.00 H new ATOM 0 HD2 LYS A 43 4.947 3.534 6.465 1.00 0.00 H new ATOM 0 HD3 LYS A 43 3.453 3.991 7.259 1.00 0.00 H new ATOM 0 HE2 LYS A 43 2.332 2.038 6.587 1.00 0.00 H new ATOM 0 HE3 LYS A 43 3.397 1.768 5.222 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 3.679 0.272 7.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 5.093 0.970 6.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 4.389 1.602 8.012 1.00 0.00 H new ATOM 657 N ASP A 44 4.883 6.655 2.787 1.00 0.00 N ATOM 658 CA ASP A 44 4.979 8.110 2.808 1.00 0.00 C ATOM 659 C ASP A 44 4.306 8.717 1.581 1.00 0.00 C ATOM 660 O ASP A 44 3.784 9.831 1.633 1.00 0.00 O ATOM 661 CB ASP A 44 6.444 8.546 2.869 1.00 0.00 C ATOM 662 CG ASP A 44 6.608 9.952 3.410 1.00 0.00 C ATOM 663 OD1 ASP A 44 5.965 10.274 4.431 1.00 0.00 O ATOM 664 OD2 ASP A 44 7.378 10.732 2.812 1.00 0.00 O ATOM 0 H ASP A 44 5.773 6.172 2.911 1.00 0.00 H new ATOM 0 HA ASP A 44 4.464 8.470 3.699 1.00 0.00 H new ATOM 0 HB2 ASP A 44 7.001 7.851 3.497 1.00 0.00 H new ATOM 0 HB3 ASP A 44 6.878 8.491 1.871 1.00 0.00 H new ATOM 669 N HIS A 45 4.322 7.977 0.476 1.00 0.00 N ATOM 670 CA HIS A 45 3.714 8.443 -0.765 1.00 0.00 C ATOM 671 C HIS A 45 2.224 8.709 -0.573 1.00 0.00 C ATOM 672 O HIS A 45 1.684 9.683 -1.099 1.00 0.00 O ATOM 673 CB HIS A 45 3.921 7.413 -1.876 1.00 0.00 C ATOM 674 CG HIS A 45 3.678 7.958 -3.250 1.00 0.00 C ATOM 675 ND1 HIS A 45 4.656 8.017 -4.220 1.00 0.00 N ATOM 676 CD2 HIS A 45 2.558 8.468 -3.815 1.00 0.00 C ATOM 677 CE1 HIS A 45 4.149 8.542 -5.321 1.00 0.00 C ATOM 678 NE2 HIS A 45 2.878 8.824 -5.102 1.00 0.00 N ATOM 0 H HIS A 45 4.749 7.053 0.415 1.00 0.00 H new ATOM 0 HA HIS A 45 4.198 9.377 -1.050 1.00 0.00 H new ATOM 0 HB2 HIS A 45 4.940 7.031 -1.821 1.00 0.00 H new ATOM 0 HB3 HIS A 45 3.254 6.568 -1.706 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.593 8.575 -3.342 1.00 0.00 H new ATOM 0 HE1 HIS A 45 4.684 8.712 -6.244 1.00 0.00 H new ATOM 0 HE2 HIS A 45 2.238 9.239 -5.779 1.00 0.00 H new ATOM 687 N PHE A 46 1.564 7.838 0.183 1.00 0.00 N ATOM 688 CA PHE A 46 0.136 7.978 0.443 1.00 0.00 C ATOM 689 C PHE A 46 -0.112 8.901 1.633 1.00 0.00 C ATOM 690 O PHE A 46 -1.100 9.634 1.668 1.00 0.00 O ATOM 691 CB PHE A 46 -0.493 6.609 0.705 1.00 0.00 C ATOM 692 CG PHE A 46 -0.870 5.873 -0.549 1.00 0.00 C ATOM 693 CD1 PHE A 46 0.039 5.038 -1.179 1.00 0.00 C ATOM 694 CD2 PHE A 46 -2.134 6.016 -1.098 1.00 0.00 C ATOM 695 CE1 PHE A 46 -0.305 4.360 -2.333 1.00 0.00 C ATOM 696 CE2 PHE A 46 -2.484 5.339 -2.252 1.00 0.00 C ATOM 697 CZ PHE A 46 -1.568 4.511 -2.870 1.00 0.00 C ATOM 0 H PHE A 46 1.996 7.027 0.627 1.00 0.00 H new ATOM 0 HA PHE A 46 -0.327 8.419 -0.439 1.00 0.00 H new ATOM 0 HB2 PHE A 46 0.207 6.000 1.278 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.382 6.739 1.322 1.00 0.00 H new ATOM 0 HD1 PHE A 46 1.028 4.916 -0.763 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -2.854 6.663 -0.619 1.00 0.00 H new ATOM 0 HE1 PHE A 46 0.413 3.713 -2.814 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.473 5.458 -2.669 1.00 0.00 H new ATOM 0 HZ PHE A 46 -1.839 3.982 -3.772 1.00 0.00 H new ATOM 707 N SER A 47 0.792 8.857 2.607 1.00 0.00 N ATOM 708 CA SER A 47 0.670 9.685 3.801 1.00 0.00 C ATOM 709 C SER A 47 0.621 11.165 3.434 1.00 0.00 C ATOM 710 O SER A 47 -0.101 11.946 4.053 1.00 0.00 O ATOM 711 CB SER A 47 1.840 9.422 4.751 1.00 0.00 C ATOM 712 OG SER A 47 2.990 10.149 4.357 1.00 0.00 O ATOM 0 H SER A 47 1.617 8.257 2.592 1.00 0.00 H new ATOM 0 HA SER A 47 -0.262 9.422 4.302 1.00 0.00 H new ATOM 0 HB2 SER A 47 1.559 9.703 5.766 1.00 0.00 H new ATOM 0 HB3 SER A 47 2.067 8.356 4.767 1.00 0.00 H new ATOM 0 HG SER A 47 3.143 10.024 3.397 1.00 0.00 H new ATOM 718 N HIS A 48 1.395 11.542 2.421 1.00 0.00 N ATOM 719 CA HIS A 48 1.441 12.928 1.969 1.00 0.00 C ATOM 720 C HIS A 48 0.225 13.260 1.110 1.00 0.00 C ATOM 721 O HIS A 48 -0.506 14.212 1.390 1.00 0.00 O ATOM 722 CB HIS A 48 2.724 13.187 1.179 1.00 0.00 C ATOM 723 CG HIS A 48 2.584 12.934 -0.290 1.00 0.00 C ATOM 724 ND1 HIS A 48 3.053 11.792 -0.905 1.00 0.00 N ATOM 725 CD2 HIS A 48 2.023 13.683 -1.268 1.00 0.00 C ATOM 726 CE1 HIS A 48 2.787 11.850 -2.198 1.00 0.00 C ATOM 727 NE2 HIS A 48 2.161 12.987 -2.444 1.00 0.00 N ATOM 0 H HIS A 48 1.998 10.907 1.898 1.00 0.00 H new ATOM 0 HA HIS A 48 1.429 13.571 2.849 1.00 0.00 H new ATOM 0 HB2 HIS A 48 3.034 14.221 1.333 1.00 0.00 H new ATOM 0 HB3 HIS A 48 3.518 12.554 1.574 1.00 0.00 H new ATOM 0 HD2 HIS A 48 1.554 14.648 -1.146 1.00 0.00 H new ATOM 0 HE1 HIS A 48 3.039 11.096 -2.929 1.00 0.00 H new ATOM 0 HE2 HIS A 48 1.833 13.298 -3.359 1.00 0.00 H new ATOM 736 N LEU A 49 0.013 12.471 0.063 1.00 0.00 N ATOM 737 CA LEU A 49 -1.114 12.681 -0.839 1.00 0.00 C ATOM 738 C LEU A 49 -2.429 12.724 -0.066 1.00 0.00 C ATOM 739 O LEU A 49 -3.126 13.739 -0.061 1.00 0.00 O ATOM 740 CB LEU A 49 -1.164 11.573 -1.892 1.00 0.00 C ATOM 741 CG LEU A 49 -2.102 11.813 -3.076 1.00 0.00 C ATOM 742 CD1 LEU A 49 -3.455 12.310 -2.592 1.00 0.00 C ATOM 743 CD2 LEU A 49 -1.485 12.805 -4.051 1.00 0.00 C ATOM 0 H LEU A 49 0.607 11.679 -0.183 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.975 13.640 -1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -0.156 11.421 -2.278 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.461 10.646 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 49 -2.250 10.867 -3.596 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -4.109 12.475 -3.448 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -3.901 11.566 -1.932 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -3.326 13.246 -2.048 1.00 0.00 H new ATOM 0 HD21 LEU A 49 -2.166 12.964 -4.887 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -1.307 13.752 -3.542 1.00 0.00 H new ATOM 0 HD23 LEU A 49 -0.540 12.410 -4.423 1.00 0.00 H new ATOM 755 N LEU A 50 -2.760 11.616 0.588 1.00 0.00 N ATOM 756 CA LEU A 50 -3.990 11.527 1.367 1.00 0.00 C ATOM 757 C LEU A 50 -4.075 12.662 2.382 1.00 0.00 C ATOM 758 O LEU A 50 -5.149 13.210 2.628 1.00 0.00 O ATOM 759 CB LEU A 50 -4.066 10.178 2.085 1.00 0.00 C ATOM 760 CG LEU A 50 -4.403 8.970 1.211 1.00 0.00 C ATOM 761 CD1 LEU A 50 -4.152 7.676 1.969 1.00 0.00 C ATOM 762 CD2 LEU A 50 -5.848 9.041 0.738 1.00 0.00 C ATOM 0 H LEU A 50 -2.194 10.767 0.594 1.00 0.00 H new ATOM 0 HA LEU A 50 -4.833 11.614 0.681 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -3.108 9.993 2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -4.815 10.251 2.874 1.00 0.00 H new ATOM 0 HG LEU A 50 -3.753 8.986 0.336 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -4.397 6.827 1.331 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -3.102 7.621 2.258 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -4.776 7.651 2.862 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -6.071 8.173 0.117 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -6.513 9.050 1.601 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -5.996 9.951 0.156 1.00 0.00 H new ATOM 774 N GLY A 51 -2.934 13.012 2.969 1.00 0.00 N ATOM 775 CA GLY A 51 -2.901 14.081 3.949 1.00 0.00 C ATOM 776 C GLY A 51 -2.780 13.563 5.368 1.00 0.00 C ATOM 777 O GLY A 51 -2.656 14.344 6.312 1.00 0.00 O ATOM 0 H GLY A 51 -2.032 12.574 2.783 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -2.061 14.741 3.734 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -3.808 14.679 3.860 1.00 0.00 H new ATOM 781 N ILE A 52 -2.817 12.244 5.520 1.00 0.00 N ATOM 782 CA ILE A 52 -2.710 11.624 6.835 1.00 0.00 C ATOM 783 C ILE A 52 -1.303 11.091 7.079 1.00 0.00 C ATOM 784 O ILE A 52 -0.610 10.652 6.161 1.00 0.00 O ATOM 785 CB ILE A 52 -3.719 10.471 6.997 1.00 0.00 C ATOM 786 CG1 ILE A 52 -3.355 9.312 6.066 1.00 0.00 C ATOM 787 CG2 ILE A 52 -5.132 10.960 6.715 1.00 0.00 C ATOM 788 CD1 ILE A 52 -4.367 8.188 6.077 1.00 0.00 C ATOM 0 H ILE A 52 -2.920 11.584 4.749 1.00 0.00 H new ATOM 0 HA ILE A 52 -2.934 12.399 7.568 1.00 0.00 H new ATOM 0 HB ILE A 52 -3.678 10.113 8.026 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -3.256 9.691 5.049 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -2.381 8.916 6.355 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -5.833 10.134 6.834 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -5.388 11.756 7.414 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -5.189 11.340 5.695 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -4.045 7.401 5.395 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -4.449 7.782 7.085 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -5.337 8.569 5.759 1.00 0.00 H new ATOM 800 N PRO A 53 -0.868 11.127 8.348 1.00 0.00 N ATOM 801 CA PRO A 53 0.460 10.649 8.743 1.00 0.00 C ATOM 802 C PRO A 53 0.585 9.133 8.641 1.00 0.00 C ATOM 803 O PRO A 53 -0.417 8.418 8.618 1.00 0.00 O ATOM 804 CB PRO A 53 0.578 11.098 10.202 1.00 0.00 C ATOM 805 CG PRO A 53 -0.828 11.202 10.682 1.00 0.00 C ATOM 806 CD PRO A 53 -1.640 11.637 9.493 1.00 0.00 C ATOM 0 HA PRO A 53 1.244 11.043 8.096 1.00 0.00 H new ATOM 0 HB2 PRO A 53 1.146 10.379 10.793 1.00 0.00 H new ATOM 0 HB3 PRO A 53 1.095 12.054 10.281 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -1.181 10.245 11.067 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -0.910 11.923 11.496 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -2.646 11.218 9.518 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -1.747 12.721 9.454 1.00 0.00 H new ATOM 814 N HIS A 54 1.821 8.649 8.580 1.00 0.00 N ATOM 815 CA HIS A 54 2.077 7.216 8.481 1.00 0.00 C ATOM 816 C HIS A 54 2.035 6.560 9.858 1.00 0.00 C ATOM 817 O HIS A 54 2.395 5.393 10.012 1.00 0.00 O ATOM 818 CB HIS A 54 3.434 6.963 7.824 1.00 0.00 C ATOM 819 CG HIS A 54 4.576 7.621 8.536 1.00 0.00 C ATOM 820 ND1 HIS A 54 4.779 7.511 9.896 1.00 0.00 N ATOM 821 CD2 HIS A 54 5.581 8.398 8.069 1.00 0.00 C ATOM 822 CE1 HIS A 54 5.858 8.193 10.234 1.00 0.00 C ATOM 823 NE2 HIS A 54 6.364 8.741 9.144 1.00 0.00 N ATOM 0 H HIS A 54 2.661 9.227 8.597 1.00 0.00 H new ATOM 0 HA HIS A 54 1.295 6.774 7.864 1.00 0.00 H new ATOM 0 HB2 HIS A 54 3.613 5.889 7.782 1.00 0.00 H new ATOM 0 HB3 HIS A 54 3.403 7.322 6.795 1.00 0.00 H new ATOM 0 HD2 HIS A 54 5.738 8.693 7.042 1.00 0.00 H new ATOM 0 HE1 HIS A 54 6.259 8.287 11.232 1.00 0.00 H new ATOM 0 HE2 HIS A 54 7.200 9.324 9.107 1.00 0.00 H new ATOM 832 N SER A 55 1.593 7.319 10.856 1.00 0.00 N ATOM 833 CA SER A 55 1.508 6.812 12.221 1.00 0.00 C ATOM 834 C SER A 55 0.169 6.121 12.462 1.00 0.00 C ATOM 835 O SER A 55 -0.042 5.497 13.502 1.00 0.00 O ATOM 836 CB SER A 55 1.693 7.954 13.223 1.00 0.00 C ATOM 837 OG SER A 55 2.252 7.481 14.436 1.00 0.00 O ATOM 0 H SER A 55 1.289 8.286 10.745 1.00 0.00 H new ATOM 0 HA SER A 55 2.304 6.081 12.361 1.00 0.00 H new ATOM 0 HB2 SER A 55 2.341 8.718 12.793 1.00 0.00 H new ATOM 0 HB3 SER A 55 0.731 8.427 13.422 1.00 0.00 H new ATOM 0 HG SER A 55 2.362 8.229 15.059 1.00 0.00 H new ATOM 843 N VAL A 56 -0.732 6.237 11.492 1.00 0.00 N ATOM 844 CA VAL A 56 -2.050 5.623 11.596 1.00 0.00 C ATOM 845 C VAL A 56 -2.323 4.701 10.412 1.00 0.00 C ATOM 846 O VAL A 56 -3.122 3.769 10.508 1.00 0.00 O ATOM 847 CB VAL A 56 -3.161 6.687 11.670 1.00 0.00 C ATOM 848 CG1 VAL A 56 -3.207 7.317 13.054 1.00 0.00 C ATOM 849 CG2 VAL A 56 -2.954 7.748 10.599 1.00 0.00 C ATOM 0 H VAL A 56 -0.573 6.751 10.625 1.00 0.00 H new ATOM 0 HA VAL A 56 -2.054 5.039 12.516 1.00 0.00 H new ATOM 0 HB VAL A 56 -4.119 6.200 11.487 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -3.998 8.066 13.087 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -3.406 6.546 13.798 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -2.249 7.791 13.270 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -3.748 8.492 10.666 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -1.989 8.233 10.749 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -2.976 7.281 9.615 1.00 0.00 H new ATOM 859 N LEU A 57 -1.653 4.967 9.297 1.00 0.00 N ATOM 860 CA LEU A 57 -1.821 4.161 8.092 1.00 0.00 C ATOM 861 C LEU A 57 -0.923 2.929 8.132 1.00 0.00 C ATOM 862 O LEU A 57 0.271 3.029 8.415 1.00 0.00 O ATOM 863 CB LEU A 57 -1.508 4.995 6.849 1.00 0.00 C ATOM 864 CG LEU A 57 -0.946 4.228 5.651 1.00 0.00 C ATOM 865 CD1 LEU A 57 -2.005 3.312 5.058 1.00 0.00 C ATOM 866 CD2 LEU A 57 -0.424 5.194 4.598 1.00 0.00 C ATOM 0 H LEU A 57 -0.988 5.735 9.201 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.859 3.830 8.047 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.421 5.500 6.535 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.794 5.770 7.126 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.115 3.612 5.996 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -1.586 2.775 4.207 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -2.332 2.597 5.813 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.857 3.906 4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.028 4.631 3.753 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -1.237 5.836 4.258 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.367 5.808 5.028 1.00 0.00 H new ATOM 878 N GLN A 58 -1.505 1.769 7.844 1.00 0.00 N ATOM 879 CA GLN A 58 -0.755 0.518 7.845 1.00 0.00 C ATOM 880 C GLN A 58 -1.098 -0.323 6.619 1.00 0.00 C ATOM 881 O GLN A 58 -2.182 -0.195 6.051 1.00 0.00 O ATOM 882 CB GLN A 58 -1.048 -0.275 9.120 1.00 0.00 C ATOM 883 CG GLN A 58 -0.575 0.416 10.389 1.00 0.00 C ATOM 884 CD GLN A 58 0.914 0.254 10.621 1.00 0.00 C ATOM 885 OE1 GLN A 58 1.720 0.432 9.707 1.00 0.00 O ATOM 886 NE2 GLN A 58 1.288 -0.086 11.849 1.00 0.00 N ATOM 0 H GLN A 58 -2.492 1.669 7.607 1.00 0.00 H new ATOM 0 HA GLN A 58 0.307 0.760 7.812 1.00 0.00 H new ATOM 0 HB2 GLN A 58 -2.122 -0.450 9.190 1.00 0.00 H new ATOM 0 HB3 GLN A 58 -0.570 -1.252 9.048 1.00 0.00 H new ATOM 0 HG2 GLN A 58 -0.817 1.477 10.332 1.00 0.00 H new ATOM 0 HG3 GLN A 58 -1.118 0.011 11.243 1.00 0.00 H new ATOM 0 HE21 GLN A 58 0.586 -0.223 12.576 1.00 0.00 H new ATOM 0 HE22 GLN A 58 2.277 -0.210 12.065 1.00 0.00 H new ATOM 895 N ILE A 59 -0.166 -1.181 6.218 1.00 0.00 N ATOM 896 CA ILE A 59 -0.370 -2.042 5.060 1.00 0.00 C ATOM 897 C ILE A 59 -0.623 -3.485 5.486 1.00 0.00 C ATOM 898 O ILE A 59 -0.104 -3.942 6.504 1.00 0.00 O ATOM 899 CB ILE A 59 0.841 -2.005 4.110 1.00 0.00 C ATOM 900 CG1 ILE A 59 1.121 -0.569 3.661 1.00 0.00 C ATOM 901 CG2 ILE A 59 0.599 -2.904 2.907 1.00 0.00 C ATOM 902 CD1 ILE A 59 2.344 -0.438 2.782 1.00 0.00 C ATOM 0 H ILE A 59 0.737 -1.298 6.678 1.00 0.00 H new ATOM 0 HA ILE A 59 -1.246 -1.661 4.534 1.00 0.00 H new ATOM 0 HB ILE A 59 1.715 -2.376 4.645 1.00 0.00 H new ATOM 0 HG12 ILE A 59 0.253 -0.190 3.121 1.00 0.00 H new ATOM 0 HG13 ILE A 59 1.248 0.060 4.542 1.00 0.00 H new ATOM 0 HG21 ILE A 59 1.464 -2.867 2.245 1.00 0.00 H new ATOM 0 HG22 ILE A 59 0.444 -3.929 3.244 1.00 0.00 H new ATOM 0 HG23 ILE A 59 -0.285 -2.561 2.369 1.00 0.00 H new ATOM 0 HD11 ILE A 59 2.481 0.607 2.502 1.00 0.00 H new ATOM 0 HD12 ILE A 59 3.222 -0.786 3.326 1.00 0.00 H new ATOM 0 HD13 ILE A 59 2.212 -1.040 1.883 1.00 0.00 H new ATOM 914 N ARG A 60 -1.423 -4.196 4.699 1.00 0.00 N ATOM 915 CA ARG A 60 -1.745 -5.588 4.994 1.00 0.00 C ATOM 916 C ARG A 60 -1.479 -6.476 3.782 1.00 0.00 C ATOM 917 O ARG A 60 -1.976 -6.214 2.687 1.00 0.00 O ATOM 918 CB ARG A 60 -3.208 -5.715 5.422 1.00 0.00 C ATOM 919 CG ARG A 60 -3.480 -6.918 6.311 1.00 0.00 C ATOM 920 CD ARG A 60 -4.928 -7.370 6.209 1.00 0.00 C ATOM 921 NE ARG A 60 -5.368 -8.073 7.411 1.00 0.00 N ATOM 922 CZ ARG A 60 -6.422 -8.880 7.446 1.00 0.00 C ATOM 923 NH1 ARG A 60 -7.141 -9.085 6.351 1.00 0.00 N ATOM 924 NH2 ARG A 60 -6.760 -9.483 8.579 1.00 0.00 N ATOM 0 H ARG A 60 -1.860 -3.832 3.852 1.00 0.00 H new ATOM 0 HA ARG A 60 -1.104 -5.918 5.812 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -3.503 -4.809 5.951 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -3.834 -5.783 4.532 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -2.821 -7.738 6.027 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.248 -6.667 7.346 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -5.567 -6.503 6.042 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.044 -8.023 5.344 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.837 -7.937 8.271 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -6.885 -8.622 5.479 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -7.950 -9.705 6.381 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -6.210 -9.327 9.424 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -7.570 -10.103 8.605 1.00 0.00 H new ATOM 938 N TYR A 61 -0.692 -7.526 3.986 1.00 0.00 N ATOM 939 CA TYR A 61 -0.357 -8.451 2.911 1.00 0.00 C ATOM 940 C TYR A 61 -0.443 -9.897 3.389 1.00 0.00 C ATOM 941 O TYR A 61 0.028 -10.233 4.476 1.00 0.00 O ATOM 942 CB TYR A 61 1.048 -8.161 2.379 1.00 0.00 C ATOM 943 CG TYR A 61 1.540 -9.185 1.381 1.00 0.00 C ATOM 944 CD1 TYR A 61 1.065 -9.197 0.075 1.00 0.00 C ATOM 945 CD2 TYR A 61 2.483 -10.139 1.743 1.00 0.00 C ATOM 946 CE1 TYR A 61 1.512 -10.131 -0.839 1.00 0.00 C ATOM 947 CE2 TYR A 61 2.937 -11.076 0.835 1.00 0.00 C ATOM 948 CZ TYR A 61 2.448 -11.068 -0.455 1.00 0.00 C ATOM 949 OH TYR A 61 2.897 -11.999 -1.363 1.00 0.00 O ATOM 0 H TYR A 61 -0.274 -7.758 4.887 1.00 0.00 H new ATOM 0 HA TYR A 61 -1.079 -8.310 2.107 1.00 0.00 H new ATOM 0 HB2 TYR A 61 1.054 -7.177 1.910 1.00 0.00 H new ATOM 0 HB3 TYR A 61 1.744 -8.119 3.217 1.00 0.00 H new ATOM 0 HD1 TYR A 61 0.334 -8.463 -0.230 1.00 0.00 H new ATOM 0 HD2 TYR A 61 2.868 -10.148 2.752 1.00 0.00 H new ATOM 0 HE1 TYR A 61 1.130 -10.128 -1.849 1.00 0.00 H new ATOM 0 HE2 TYR A 61 3.670 -11.810 1.133 1.00 0.00 H new ATOM 0 HH TYR A 61 3.555 -12.585 -0.933 1.00 0.00 H new ATOM 959 N SER A 62 -1.048 -10.750 2.568 1.00 0.00 N ATOM 960 CA SER A 62 -1.199 -12.161 2.907 1.00 0.00 C ATOM 961 C SER A 62 -1.940 -12.324 4.231 1.00 0.00 C ATOM 962 O SER A 62 -1.781 -13.328 4.924 1.00 0.00 O ATOM 963 CB SER A 62 0.170 -12.837 2.990 1.00 0.00 C ATOM 964 OG SER A 62 0.045 -14.199 3.360 1.00 0.00 O ATOM 0 H SER A 62 -1.441 -10.489 1.664 1.00 0.00 H new ATOM 0 HA SER A 62 -1.784 -12.638 2.121 1.00 0.00 H new ATOM 0 HB2 SER A 62 0.674 -12.764 2.026 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.793 -12.315 3.716 1.00 0.00 H new ATOM 0 HG SER A 62 -0.509 -14.270 4.165 1.00 0.00 H new ATOM 970 N GLY A 63 -2.752 -11.329 4.574 1.00 0.00 N ATOM 971 CA GLY A 63 -3.506 -11.381 5.813 1.00 0.00 C ATOM 972 C GLY A 63 -2.649 -11.084 7.027 1.00 0.00 C ATOM 973 O GLY A 63 -3.086 -11.258 8.164 1.00 0.00 O ATOM 0 H GLY A 63 -2.901 -10.488 4.016 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -4.325 -10.664 5.766 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -3.953 -12.369 5.921 1.00 0.00 H new ATOM 977 N LYS A 64 -1.421 -10.635 6.786 1.00 0.00 N ATOM 978 CA LYS A 64 -0.498 -10.313 7.868 1.00 0.00 C ATOM 979 C LYS A 64 0.020 -8.885 7.734 1.00 0.00 C ATOM 980 O LYS A 64 0.194 -8.379 6.624 1.00 0.00 O ATOM 981 CB LYS A 64 0.675 -11.294 7.874 1.00 0.00 C ATOM 982 CG LYS A 64 1.843 -10.852 7.008 1.00 0.00 C ATOM 983 CD LYS A 64 3.045 -11.764 7.186 1.00 0.00 C ATOM 984 CE LYS A 64 2.659 -13.229 7.053 1.00 0.00 C ATOM 985 NZ LYS A 64 2.244 -13.813 8.359 1.00 0.00 N ATOM 0 H LYS A 64 -1.042 -10.486 5.851 1.00 0.00 H new ATOM 0 HA LYS A 64 -1.039 -10.398 8.811 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.023 -11.425 8.899 1.00 0.00 H new ATOM 0 HB3 LYS A 64 0.326 -12.267 7.529 1.00 0.00 H new ATOM 0 HG2 LYS A 64 1.540 -10.848 5.961 1.00 0.00 H new ATOM 0 HG3 LYS A 64 2.120 -9.829 7.263 1.00 0.00 H new ATOM 0 HD2 LYS A 64 3.803 -11.518 6.442 1.00 0.00 H new ATOM 0 HD3 LYS A 64 3.491 -11.592 8.165 1.00 0.00 H new ATOM 0 HE2 LYS A 64 1.844 -13.326 6.336 1.00 0.00 H new ATOM 0 HE3 LYS A 64 3.503 -13.792 6.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 2.828 -14.648 8.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 2.370 -13.106 9.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 1.244 -14.093 8.312 1.00 0.00 H new ATOM 999 N ILE A 65 0.267 -8.240 8.869 1.00 0.00 N ATOM 1000 CA ILE A 65 0.769 -6.872 8.877 1.00 0.00 C ATOM 1001 C ILE A 65 2.265 -6.833 8.585 1.00 0.00 C ATOM 1002 O ILE A 65 3.018 -7.702 9.027 1.00 0.00 O ATOM 1003 CB ILE A 65 0.503 -6.182 10.228 1.00 0.00 C ATOM 1004 CG1 ILE A 65 -0.939 -6.432 10.678 1.00 0.00 C ATOM 1005 CG2 ILE A 65 0.780 -4.690 10.125 1.00 0.00 C ATOM 1006 CD1 ILE A 65 -1.972 -6.014 9.655 1.00 0.00 C ATOM 0 H ILE A 65 0.127 -8.643 9.795 1.00 0.00 H new ATOM 0 HA ILE A 65 0.234 -6.336 8.093 1.00 0.00 H new ATOM 0 HB ILE A 65 1.176 -6.606 10.974 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -1.064 -7.493 10.897 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -1.120 -5.892 11.607 1.00 0.00 H new ATOM 0 HG21 ILE A 65 0.587 -4.217 11.088 1.00 0.00 H new ATOM 0 HG22 ILE A 65 1.821 -4.532 9.845 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.130 -4.251 9.368 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -2.970 -6.220 10.041 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -1.874 -4.947 9.454 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -1.817 -6.573 8.732 1.00 0.00 H new ATOM 1018 N LEU A 66 2.690 -5.818 7.840 1.00 0.00 N ATOM 1019 CA LEU A 66 4.098 -5.664 7.490 1.00 0.00 C ATOM 1020 C LEU A 66 4.662 -4.366 8.060 1.00 0.00 C ATOM 1021 O LEU A 66 3.924 -3.413 8.310 1.00 0.00 O ATOM 1022 CB LEU A 66 4.271 -5.684 5.971 1.00 0.00 C ATOM 1023 CG LEU A 66 3.279 -6.550 5.193 1.00 0.00 C ATOM 1024 CD1 LEU A 66 3.492 -6.392 3.696 1.00 0.00 C ATOM 1025 CD2 LEU A 66 3.410 -8.010 5.602 1.00 0.00 C ATOM 0 H LEU A 66 2.080 -5.090 7.467 1.00 0.00 H new ATOM 0 HA LEU A 66 4.648 -6.499 7.924 1.00 0.00 H new ATOM 0 HB2 LEU A 66 4.195 -4.661 5.603 1.00 0.00 H new ATOM 0 HB3 LEU A 66 5.280 -6.030 5.745 1.00 0.00 H new ATOM 0 HG LEU A 66 2.269 -6.216 5.432 1.00 0.00 H new ATOM 0 HD11 LEU A 66 2.777 -7.016 3.159 1.00 0.00 H new ATOM 0 HD12 LEU A 66 3.346 -5.349 3.416 1.00 0.00 H new ATOM 0 HD13 LEU A 66 4.506 -6.698 3.438 1.00 0.00 H new ATOM 0 HD21 LEU A 66 2.697 -8.611 5.038 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.422 -8.357 5.393 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.205 -8.109 6.668 1.00 0.00 H new ATOM 1037 N LYS A 67 5.975 -4.336 8.263 1.00 0.00 N ATOM 1038 CA LYS A 67 6.639 -3.155 8.800 1.00 0.00 C ATOM 1039 C LYS A 67 7.274 -2.333 7.684 1.00 0.00 C ATOM 1040 O LYS A 67 7.515 -2.838 6.588 1.00 0.00 O ATOM 1041 CB LYS A 67 7.707 -3.564 9.817 1.00 0.00 C ATOM 1042 CG LYS A 67 7.929 -2.536 10.914 1.00 0.00 C ATOM 1043 CD LYS A 67 8.865 -3.061 11.989 1.00 0.00 C ATOM 1044 CE LYS A 67 10.321 -2.797 11.638 1.00 0.00 C ATOM 1045 NZ LYS A 67 11.221 -3.010 12.806 1.00 0.00 N ATOM 0 H LYS A 67 6.600 -5.117 8.063 1.00 0.00 H new ATOM 0 HA LYS A 67 5.888 -2.541 9.297 1.00 0.00 H new ATOM 0 HB2 LYS A 67 7.419 -4.512 10.272 1.00 0.00 H new ATOM 0 HB3 LYS A 67 8.648 -3.734 9.294 1.00 0.00 H new ATOM 0 HG2 LYS A 67 8.344 -1.625 10.482 1.00 0.00 H new ATOM 0 HG3 LYS A 67 6.972 -2.269 11.362 1.00 0.00 H new ATOM 0 HD2 LYS A 67 8.628 -2.588 12.942 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.709 -4.132 12.117 1.00 0.00 H new ATOM 0 HE2 LYS A 67 10.623 -3.454 10.822 1.00 0.00 H new ATOM 0 HE3 LYS A 67 10.428 -1.773 11.279 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 12.204 -2.820 12.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 10.950 -2.365 13.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 11.138 -3.994 13.133 1.00 0.00 H new ATOM 1059 N ASN A 68 7.544 -1.063 7.970 1.00 0.00 N ATOM 1060 CA ASN A 68 8.152 -0.171 6.989 1.00 0.00 C ATOM 1061 C ASN A 68 9.613 -0.539 6.751 1.00 0.00 C ATOM 1062 O ASN A 68 10.071 -0.599 5.611 1.00 0.00 O ATOM 1063 CB ASN A 68 8.050 1.282 7.458 1.00 0.00 C ATOM 1064 CG ASN A 68 8.358 1.436 8.935 1.00 0.00 C ATOM 1065 OD1 ASN A 68 7.646 0.905 9.787 1.00 0.00 O ATOM 1066 ND2 ASN A 68 9.424 2.165 9.244 1.00 0.00 N ATOM 0 H ASN A 68 7.351 -0.629 8.873 1.00 0.00 H new ATOM 0 HA ASN A 68 7.610 -0.281 6.049 1.00 0.00 H new ATOM 0 HB2 ASN A 68 8.740 1.897 6.880 1.00 0.00 H new ATOM 0 HB3 ASN A 68 7.046 1.656 7.258 1.00 0.00 H new ATOM 0 HD21 ASN A 68 9.681 2.303 10.221 1.00 0.00 H new ATOM 0 HD22 ASN A 68 9.985 2.587 8.504 1.00 0.00 H new ATOM 1073 N ASN A 69 10.340 -0.785 7.837 1.00 0.00 N ATOM 1074 CA ASN A 69 11.750 -1.147 7.747 1.00 0.00 C ATOM 1075 C ASN A 69 11.933 -2.418 6.922 1.00 0.00 C ATOM 1076 O ASN A 69 12.993 -2.642 6.338 1.00 0.00 O ATOM 1077 CB ASN A 69 12.337 -1.345 9.145 1.00 0.00 C ATOM 1078 CG ASN A 69 12.316 -0.070 9.966 1.00 0.00 C ATOM 1079 OD1 ASN A 69 11.366 0.190 10.706 1.00 0.00 O ATOM 1080 ND2 ASN A 69 13.366 0.733 9.840 1.00 0.00 N ATOM 0 H ASN A 69 9.976 -0.740 8.789 1.00 0.00 H new ATOM 0 HA ASN A 69 12.278 -0.333 7.250 1.00 0.00 H new ATOM 0 HB2 ASN A 69 11.774 -2.119 9.666 1.00 0.00 H new ATOM 0 HB3 ASN A 69 13.363 -1.701 9.058 1.00 0.00 H new ATOM 0 HD21 ASN A 69 13.408 1.605 10.368 1.00 0.00 H new ATOM 0 HD22 ASN A 69 14.131 0.478 9.215 1.00 0.00 H new ATOM 1087 N GLU A 70 10.893 -3.245 6.880 1.00 0.00 N ATOM 1088 CA GLU A 70 10.940 -4.493 6.127 1.00 0.00 C ATOM 1089 C GLU A 70 10.913 -4.223 4.625 1.00 0.00 C ATOM 1090 O GLU A 70 10.890 -3.072 4.189 1.00 0.00 O ATOM 1091 CB GLU A 70 9.767 -5.394 6.516 1.00 0.00 C ATOM 1092 CG GLU A 70 9.981 -6.142 7.821 1.00 0.00 C ATOM 1093 CD GLU A 70 8.810 -7.037 8.179 1.00 0.00 C ATOM 1094 OE1 GLU A 70 8.719 -8.149 7.617 1.00 0.00 O ATOM 1095 OE2 GLU A 70 7.985 -6.625 9.021 1.00 0.00 O ATOM 0 H GLU A 70 10.008 -3.074 7.358 1.00 0.00 H new ATOM 0 HA GLU A 70 11.874 -5.000 6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 70 8.865 -4.787 6.598 1.00 0.00 H new ATOM 0 HB3 GLU A 70 9.594 -6.116 5.718 1.00 0.00 H new ATOM 0 HG2 GLU A 70 10.885 -6.746 7.745 1.00 0.00 H new ATOM 0 HG3 GLU A 70 10.144 -5.424 8.625 1.00 0.00 H new ATOM 1102 N THR A 71 10.915 -5.294 3.837 1.00 0.00 N ATOM 1103 CA THR A 71 10.892 -5.175 2.385 1.00 0.00 C ATOM 1104 C THR A 71 10.084 -6.303 1.753 1.00 0.00 C ATOM 1105 O THR A 71 9.800 -7.313 2.398 1.00 0.00 O ATOM 1106 CB THR A 71 12.316 -5.188 1.798 1.00 0.00 C ATOM 1107 OG1 THR A 71 13.222 -4.533 2.694 1.00 0.00 O ATOM 1108 CG2 THR A 71 12.349 -4.498 0.442 1.00 0.00 C ATOM 0 H THR A 71 10.932 -6.254 4.181 1.00 0.00 H new ATOM 0 HA THR A 71 10.420 -4.220 2.154 1.00 0.00 H new ATOM 0 HB THR A 71 12.622 -6.226 1.668 1.00 0.00 H new ATOM 0 HG1 THR A 71 13.450 -5.139 3.430 1.00 0.00 H new ATOM 0 HG21 THR A 71 13.365 -4.520 0.047 1.00 0.00 H new ATOM 0 HG22 THR A 71 11.681 -5.016 -0.246 1.00 0.00 H new ATOM 0 HG23 THR A 71 12.025 -3.463 0.552 1.00 0.00 H new ATOM 1116 N LEU A 72 9.718 -6.125 0.489 1.00 0.00 N ATOM 1117 CA LEU A 72 8.942 -7.129 -0.231 1.00 0.00 C ATOM 1118 C LEU A 72 9.774 -8.384 -0.480 1.00 0.00 C ATOM 1119 O LEU A 72 9.258 -9.501 -0.443 1.00 0.00 O ATOM 1120 CB LEU A 72 8.445 -6.561 -1.561 1.00 0.00 C ATOM 1121 CG LEU A 72 7.405 -5.444 -1.467 1.00 0.00 C ATOM 1122 CD1 LEU A 72 6.223 -5.886 -0.617 1.00 0.00 C ATOM 1123 CD2 LEU A 72 8.030 -4.179 -0.898 1.00 0.00 C ATOM 0 H LEU A 72 9.946 -5.295 -0.059 1.00 0.00 H new ATOM 0 HA LEU A 72 8.084 -7.400 0.384 1.00 0.00 H new ATOM 0 HB2 LEU A 72 9.304 -6.184 -2.116 1.00 0.00 H new ATOM 0 HB3 LEU A 72 8.021 -7.377 -2.146 1.00 0.00 H new ATOM 0 HG LEU A 72 7.043 -5.225 -2.472 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.493 -5.079 -0.561 1.00 0.00 H new ATOM 0 HD12 LEU A 72 5.759 -6.764 -1.067 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.569 -6.133 0.387 1.00 0.00 H new ATOM 0 HD21 LEU A 72 7.275 -3.395 -0.839 1.00 0.00 H new ATOM 0 HD22 LEU A 72 8.421 -4.383 0.099 1.00 0.00 H new ATOM 0 HD23 LEU A 72 8.843 -3.851 -1.546 1.00 0.00 H new ATOM 1135 N VAL A 73 11.065 -8.192 -0.732 1.00 0.00 N ATOM 1136 CA VAL A 73 11.969 -9.307 -0.984 1.00 0.00 C ATOM 1137 C VAL A 73 12.197 -10.126 0.281 1.00 0.00 C ATOM 1138 O VAL A 73 12.675 -11.259 0.221 1.00 0.00 O ATOM 1139 CB VAL A 73 13.328 -8.819 -1.518 1.00 0.00 C ATOM 1140 CG1 VAL A 73 13.172 -8.217 -2.907 1.00 0.00 C ATOM 1141 CG2 VAL A 73 13.947 -7.813 -0.559 1.00 0.00 C ATOM 0 H VAL A 73 11.508 -7.274 -0.767 1.00 0.00 H new ATOM 0 HA VAL A 73 11.495 -9.934 -1.739 1.00 0.00 H new ATOM 0 HB VAL A 73 13.998 -9.676 -1.593 1.00 0.00 H new ATOM 0 HG11 VAL A 73 14.143 -7.878 -3.268 1.00 0.00 H new ATOM 0 HG12 VAL A 73 12.775 -8.970 -3.588 1.00 0.00 H new ATOM 0 HG13 VAL A 73 12.486 -7.371 -2.862 1.00 0.00 H new ATOM 0 HG21 VAL A 73 14.907 -7.479 -0.952 1.00 0.00 H new ATOM 0 HG22 VAL A 73 13.281 -6.957 -0.450 1.00 0.00 H new ATOM 0 HG23 VAL A 73 14.097 -8.282 0.414 1.00 0.00 H new ATOM 1151 N GLN A 74 11.851 -9.546 1.426 1.00 0.00 N ATOM 1152 CA GLN A 74 12.018 -10.222 2.706 1.00 0.00 C ATOM 1153 C GLN A 74 10.835 -11.140 2.996 1.00 0.00 C ATOM 1154 O GLN A 74 10.915 -12.022 3.852 1.00 0.00 O ATOM 1155 CB GLN A 74 12.172 -9.198 3.832 1.00 0.00 C ATOM 1156 CG GLN A 74 13.580 -8.639 3.958 1.00 0.00 C ATOM 1157 CD GLN A 74 13.636 -7.384 4.806 1.00 0.00 C ATOM 1158 OE1 GLN A 74 13.140 -6.329 4.408 1.00 0.00 O ATOM 1159 NE2 GLN A 74 14.241 -7.491 5.983 1.00 0.00 N ATOM 0 H GLN A 74 11.453 -8.609 1.493 1.00 0.00 H new ATOM 0 HA GLN A 74 12.921 -10.830 2.651 1.00 0.00 H new ATOM 0 HB2 GLN A 74 11.477 -8.375 3.661 1.00 0.00 H new ATOM 0 HB3 GLN A 74 11.889 -9.663 4.776 1.00 0.00 H new ATOM 0 HG2 GLN A 74 14.230 -9.397 4.395 1.00 0.00 H new ATOM 0 HG3 GLN A 74 13.970 -8.419 2.964 1.00 0.00 H new ATOM 0 HE21 GLN A 74 14.638 -8.385 6.273 1.00 0.00 H new ATOM 0 HE22 GLN A 74 14.309 -6.680 6.597 1.00 0.00 H new ATOM 1168 N HIS A 75 9.737 -10.927 2.277 1.00 0.00 N ATOM 1169 CA HIS A 75 8.537 -11.736 2.457 1.00 0.00 C ATOM 1170 C HIS A 75 8.405 -12.768 1.342 1.00 0.00 C ATOM 1171 O HIS A 75 7.594 -13.689 1.427 1.00 0.00 O ATOM 1172 CB HIS A 75 7.296 -10.844 2.491 1.00 0.00 C ATOM 1173 CG HIS A 75 7.042 -10.221 3.829 1.00 0.00 C ATOM 1174 ND1 HIS A 75 6.296 -10.832 4.815 1.00 0.00 N ATOM 1175 CD2 HIS A 75 7.442 -9.035 4.344 1.00 0.00 C ATOM 1176 CE1 HIS A 75 6.246 -10.048 5.877 1.00 0.00 C ATOM 1177 NE2 HIS A 75 6.934 -8.951 5.617 1.00 0.00 N ATOM 0 H HIS A 75 9.654 -10.201 1.565 1.00 0.00 H new ATOM 0 HA HIS A 75 8.623 -12.263 3.407 1.00 0.00 H new ATOM 0 HB2 HIS A 75 7.405 -10.055 1.747 1.00 0.00 H new ATOM 0 HB3 HIS A 75 6.426 -11.435 2.204 1.00 0.00 H new ATOM 0 HD2 HIS A 75 8.048 -8.293 3.846 1.00 0.00 H new ATOM 0 HE1 HIS A 75 5.730 -10.267 6.800 1.00 0.00 H new ATOM 0 HE2 HIS A 75 7.066 -8.168 6.258 1.00 0.00 H new ATOM 1186 N GLY A 76 9.209 -12.608 0.295 1.00 0.00 N ATOM 1187 CA GLY A 76 9.166 -13.533 -0.823 1.00 0.00 C ATOM 1188 C GLY A 76 8.489 -12.938 -2.041 1.00 0.00 C ATOM 1189 O GLY A 76 7.485 -13.465 -2.523 1.00 0.00 O ATOM 0 H GLY A 76 9.890 -11.854 0.201 1.00 0.00 H new ATOM 0 HA2 GLY A 76 10.182 -13.830 -1.084 1.00 0.00 H new ATOM 0 HA3 GLY A 76 8.637 -14.437 -0.522 1.00 0.00 H new ATOM 1193 N VAL A 77 9.037 -11.835 -2.542 1.00 0.00 N ATOM 1194 CA VAL A 77 8.479 -11.168 -3.712 1.00 0.00 C ATOM 1195 C VAL A 77 9.549 -10.931 -4.772 1.00 0.00 C ATOM 1196 O VAL A 77 10.548 -10.257 -4.523 1.00 0.00 O ATOM 1197 CB VAL A 77 7.838 -9.819 -3.336 1.00 0.00 C ATOM 1198 CG1 VAL A 77 7.397 -9.070 -4.585 1.00 0.00 C ATOM 1199 CG2 VAL A 77 6.665 -10.032 -2.391 1.00 0.00 C ATOM 0 H VAL A 77 9.867 -11.385 -2.156 1.00 0.00 H new ATOM 0 HA VAL A 77 7.711 -11.827 -4.116 1.00 0.00 H new ATOM 0 HB VAL A 77 8.584 -9.213 -2.822 1.00 0.00 H new ATOM 0 HG11 VAL A 77 6.947 -8.119 -4.299 1.00 0.00 H new ATOM 0 HG12 VAL A 77 8.262 -8.885 -5.222 1.00 0.00 H new ATOM 0 HG13 VAL A 77 6.667 -9.669 -5.129 1.00 0.00 H new ATOM 0 HG21 VAL A 77 6.224 -9.069 -2.136 1.00 0.00 H new ATOM 0 HG22 VAL A 77 5.915 -10.657 -2.877 1.00 0.00 H new ATOM 0 HG23 VAL A 77 7.014 -10.523 -1.483 1.00 0.00 H new ATOM 1209 N LYS A 78 9.332 -11.490 -5.958 1.00 0.00 N ATOM 1210 CA LYS A 78 10.276 -11.340 -7.059 1.00 0.00 C ATOM 1211 C LYS A 78 9.931 -10.122 -7.910 1.00 0.00 C ATOM 1212 O LYS A 78 8.795 -9.646 -7.923 1.00 0.00 O ATOM 1213 CB LYS A 78 10.280 -12.598 -7.930 1.00 0.00 C ATOM 1214 CG LYS A 78 9.319 -12.529 -9.104 1.00 0.00 C ATOM 1215 CD LYS A 78 8.830 -13.910 -9.507 1.00 0.00 C ATOM 1216 CE LYS A 78 7.667 -13.826 -10.484 1.00 0.00 C ATOM 1217 NZ LYS A 78 7.110 -15.170 -10.800 1.00 0.00 N ATOM 0 H LYS A 78 8.510 -12.051 -6.181 1.00 0.00 H new ATOM 0 HA LYS A 78 11.270 -11.196 -6.635 1.00 0.00 H new ATOM 0 HB2 LYS A 78 11.289 -12.765 -8.307 1.00 0.00 H new ATOM 0 HB3 LYS A 78 10.024 -13.458 -7.312 1.00 0.00 H new ATOM 0 HG2 LYS A 78 8.467 -11.903 -8.841 1.00 0.00 H new ATOM 0 HG3 LYS A 78 9.813 -12.055 -9.952 1.00 0.00 H new ATOM 0 HD2 LYS A 78 9.648 -14.469 -9.961 1.00 0.00 H new ATOM 0 HD3 LYS A 78 8.521 -14.461 -8.619 1.00 0.00 H new ATOM 0 HE2 LYS A 78 6.883 -13.198 -10.062 1.00 0.00 H new ATOM 0 HE3 LYS A 78 8.000 -13.345 -11.404 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 6.320 -15.070 -11.469 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 7.851 -15.762 -11.226 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 6.769 -15.619 -9.926 1.00 0.00 H new ATOM 1231 N PRO A 79 10.931 -9.604 -8.637 1.00 0.00 N ATOM 1232 CA PRO A 79 10.756 -8.436 -9.506 1.00 0.00 C ATOM 1233 C PRO A 79 9.897 -8.744 -10.727 1.00 0.00 C ATOM 1234 O PRO A 79 9.914 -9.862 -11.242 1.00 0.00 O ATOM 1235 CB PRO A 79 12.186 -8.093 -9.931 1.00 0.00 C ATOM 1236 CG PRO A 79 12.933 -9.377 -9.819 1.00 0.00 C ATOM 1237 CD PRO A 79 12.310 -10.120 -8.670 1.00 0.00 C ATOM 0 HA PRO A 79 10.241 -7.622 -8.995 1.00 0.00 H new ATOM 0 HB2 PRO A 79 12.214 -7.706 -10.950 1.00 0.00 H new ATOM 0 HB3 PRO A 79 12.617 -7.327 -9.287 1.00 0.00 H new ATOM 0 HG2 PRO A 79 12.860 -9.953 -10.742 1.00 0.00 H new ATOM 0 HG3 PRO A 79 13.993 -9.197 -9.639 1.00 0.00 H new ATOM 0 HD2 PRO A 79 12.332 -11.198 -8.830 1.00 0.00 H new ATOM 0 HD3 PRO A 79 12.834 -9.926 -7.734 1.00 0.00 H new ATOM 1245 N GLN A 80 9.147 -7.747 -11.184 1.00 0.00 N ATOM 1246 CA GLN A 80 8.281 -7.913 -12.345 1.00 0.00 C ATOM 1247 C GLN A 80 7.183 -8.934 -12.063 1.00 0.00 C ATOM 1248 O GLN A 80 6.935 -9.830 -12.869 1.00 0.00 O ATOM 1249 CB GLN A 80 9.100 -8.351 -13.561 1.00 0.00 C ATOM 1250 CG GLN A 80 9.630 -7.190 -14.387 1.00 0.00 C ATOM 1251 CD GLN A 80 10.187 -7.633 -15.725 1.00 0.00 C ATOM 1252 OE1 GLN A 80 11.219 -8.302 -15.791 1.00 0.00 O ATOM 1253 NE2 GLN A 80 9.505 -7.262 -16.803 1.00 0.00 N ATOM 0 H GLN A 80 9.121 -6.816 -10.768 1.00 0.00 H new ATOM 0 HA GLN A 80 7.813 -6.952 -12.558 1.00 0.00 H new ATOM 0 HB2 GLN A 80 9.939 -8.959 -13.224 1.00 0.00 H new ATOM 0 HB3 GLN A 80 8.482 -8.985 -14.196 1.00 0.00 H new ATOM 0 HG2 GLN A 80 8.828 -6.470 -14.552 1.00 0.00 H new ATOM 0 HG3 GLN A 80 10.410 -6.675 -13.825 1.00 0.00 H new ATOM 0 HE21 GLN A 80 8.655 -6.708 -16.703 1.00 0.00 H new ATOM 0 HE22 GLN A 80 9.832 -7.531 -17.731 1.00 0.00 H new ATOM 1262 N GLU A 81 6.529 -8.790 -10.915 1.00 0.00 N ATOM 1263 CA GLU A 81 5.459 -9.701 -10.527 1.00 0.00 C ATOM 1264 C GLU A 81 4.221 -8.927 -10.081 1.00 0.00 C ATOM 1265 O GLU A 81 4.296 -7.735 -9.781 1.00 0.00 O ATOM 1266 CB GLU A 81 5.928 -10.626 -9.402 1.00 0.00 C ATOM 1267 CG GLU A 81 5.677 -10.069 -8.011 1.00 0.00 C ATOM 1268 CD GLU A 81 5.964 -11.079 -6.917 1.00 0.00 C ATOM 1269 OE1 GLU A 81 6.914 -11.874 -7.077 1.00 0.00 O ATOM 1270 OE2 GLU A 81 5.238 -11.075 -5.901 1.00 0.00 O ATOM 0 H GLU A 81 6.721 -8.052 -10.238 1.00 0.00 H new ATOM 0 HA GLU A 81 5.197 -10.303 -11.397 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.420 -11.586 -9.497 1.00 0.00 H new ATOM 0 HB3 GLU A 81 6.995 -10.817 -9.521 1.00 0.00 H new ATOM 0 HG2 GLU A 81 6.300 -9.188 -7.859 1.00 0.00 H new ATOM 0 HG3 GLU A 81 4.640 -9.743 -7.936 1.00 0.00 H new ATOM 1277 N ILE A 82 3.084 -9.614 -10.040 1.00 0.00 N ATOM 1278 CA ILE A 82 1.831 -8.992 -9.631 1.00 0.00 C ATOM 1279 C ILE A 82 1.426 -9.442 -8.231 1.00 0.00 C ATOM 1280 O ILE A 82 1.439 -10.634 -7.922 1.00 0.00 O ATOM 1281 CB ILE A 82 0.692 -9.321 -10.613 1.00 0.00 C ATOM 1282 CG1 ILE A 82 1.078 -8.903 -12.034 1.00 0.00 C ATOM 1283 CG2 ILE A 82 -0.594 -8.631 -10.184 1.00 0.00 C ATOM 1284 CD1 ILE A 82 0.189 -9.501 -13.102 1.00 0.00 C ATOM 0 H ILE A 82 3.005 -10.601 -10.285 1.00 0.00 H new ATOM 0 HA ILE A 82 1.999 -7.915 -9.630 1.00 0.00 H new ATOM 0 HB ILE A 82 0.524 -10.398 -10.603 1.00 0.00 H new ATOM 0 HG12 ILE A 82 1.040 -7.816 -12.107 1.00 0.00 H new ATOM 0 HG13 ILE A 82 2.110 -9.199 -12.224 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -1.390 -8.874 -10.889 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -0.875 -8.972 -9.188 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -0.440 -7.552 -10.168 1.00 0.00 H new ATOM 0 HD11 ILE A 82 0.521 -9.162 -14.083 1.00 0.00 H new ATOM 0 HD12 ILE A 82 0.246 -10.589 -13.056 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -0.841 -9.184 -12.938 1.00 0.00 H new ATOM 1296 N VAL A 83 1.064 -8.480 -7.388 1.00 0.00 N ATOM 1297 CA VAL A 83 0.652 -8.777 -6.021 1.00 0.00 C ATOM 1298 C VAL A 83 -0.597 -7.989 -5.641 1.00 0.00 C ATOM 1299 O VAL A 83 -0.985 -7.051 -6.335 1.00 0.00 O ATOM 1300 CB VAL A 83 1.773 -8.458 -5.015 1.00 0.00 C ATOM 1301 CG1 VAL A 83 3.067 -9.148 -5.420 1.00 0.00 C ATOM 1302 CG2 VAL A 83 1.974 -6.955 -4.900 1.00 0.00 C ATOM 0 H VAL A 83 1.048 -7.489 -7.628 1.00 0.00 H new ATOM 0 HA VAL A 83 0.432 -9.844 -5.981 1.00 0.00 H new ATOM 0 HB VAL A 83 1.478 -8.838 -4.037 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.848 -8.911 -4.697 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.912 -10.227 -5.445 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.370 -8.802 -6.408 1.00 0.00 H new ATOM 0 HG21 VAL A 83 2.770 -6.748 -4.185 1.00 0.00 H new ATOM 0 HG22 VAL A 83 2.247 -6.549 -5.874 1.00 0.00 H new ATOM 0 HG23 VAL A 83 1.049 -6.489 -4.559 1.00 0.00 H new ATOM 1312 N GLN A 84 -1.220 -8.377 -4.533 1.00 0.00 N ATOM 1313 CA GLN A 84 -2.425 -7.707 -4.060 1.00 0.00 C ATOM 1314 C GLN A 84 -2.310 -7.360 -2.579 1.00 0.00 C ATOM 1315 O GLN A 84 -2.239 -8.246 -1.727 1.00 0.00 O ATOM 1316 CB GLN A 84 -3.651 -8.590 -4.295 1.00 0.00 C ATOM 1317 CG GLN A 84 -4.971 -7.885 -4.023 1.00 0.00 C ATOM 1318 CD GLN A 84 -6.171 -8.715 -4.434 1.00 0.00 C ATOM 1319 OE1 GLN A 84 -6.066 -9.602 -5.281 1.00 0.00 O ATOM 1320 NE2 GLN A 84 -7.321 -8.429 -3.836 1.00 0.00 N ATOM 0 H GLN A 84 -0.910 -9.152 -3.946 1.00 0.00 H new ATOM 0 HA GLN A 84 -2.540 -6.781 -4.623 1.00 0.00 H new ATOM 0 HB2 GLN A 84 -3.643 -8.942 -5.327 1.00 0.00 H new ATOM 0 HB3 GLN A 84 -3.581 -9.471 -3.657 1.00 0.00 H new ATOM 0 HG2 GLN A 84 -5.042 -7.652 -2.961 1.00 0.00 H new ATOM 0 HG3 GLN A 84 -4.989 -6.936 -4.559 1.00 0.00 H new ATOM 0 HE21 GLN A 84 -7.362 -7.685 -3.139 1.00 0.00 H new ATOM 0 HE22 GLN A 84 -8.163 -8.953 -4.073 1.00 0.00 H new ATOM 1329 N VAL A 85 -2.291 -6.065 -2.279 1.00 0.00 N ATOM 1330 CA VAL A 85 -2.185 -5.601 -0.901 1.00 0.00 C ATOM 1331 C VAL A 85 -3.367 -4.714 -0.528 1.00 0.00 C ATOM 1332 O VAL A 85 -4.089 -4.227 -1.397 1.00 0.00 O ATOM 1333 CB VAL A 85 -0.878 -4.820 -0.671 1.00 0.00 C ATOM 1334 CG1 VAL A 85 0.327 -5.735 -0.835 1.00 0.00 C ATOM 1335 CG2 VAL A 85 -0.791 -3.635 -1.621 1.00 0.00 C ATOM 0 H VAL A 85 -2.348 -5.319 -2.972 1.00 0.00 H new ATOM 0 HA VAL A 85 -2.186 -6.488 -0.267 1.00 0.00 H new ATOM 0 HB VAL A 85 -0.878 -4.438 0.350 1.00 0.00 H new ATOM 0 HG11 VAL A 85 1.241 -5.166 -0.669 1.00 0.00 H new ATOM 0 HG12 VAL A 85 0.268 -6.547 -0.110 1.00 0.00 H new ATOM 0 HG13 VAL A 85 0.335 -6.149 -1.843 1.00 0.00 H new ATOM 0 HG21 VAL A 85 0.139 -3.095 -1.444 1.00 0.00 H new ATOM 0 HG22 VAL A 85 -0.813 -3.992 -2.651 1.00 0.00 H new ATOM 0 HG23 VAL A 85 -1.636 -2.968 -1.450 1.00 0.00 H new ATOM 1345 N GLU A 86 -3.558 -4.507 0.772 1.00 0.00 N ATOM 1346 CA GLU A 86 -4.653 -3.678 1.260 1.00 0.00 C ATOM 1347 C GLU A 86 -4.124 -2.512 2.090 1.00 0.00 C ATOM 1348 O GLU A 86 -3.059 -2.604 2.701 1.00 0.00 O ATOM 1349 CB GLU A 86 -5.623 -4.515 2.096 1.00 0.00 C ATOM 1350 CG GLU A 86 -6.342 -5.590 1.299 1.00 0.00 C ATOM 1351 CD GLU A 86 -5.574 -6.897 1.256 1.00 0.00 C ATOM 1352 OE1 GLU A 86 -5.280 -7.447 2.339 1.00 0.00 O ATOM 1353 OE2 GLU A 86 -5.268 -7.370 0.142 1.00 0.00 O ATOM 0 H GLU A 86 -2.969 -4.902 1.505 1.00 0.00 H new ATOM 0 HA GLU A 86 -5.183 -3.276 0.397 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -5.074 -4.985 2.912 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -6.362 -3.855 2.549 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -7.325 -5.765 1.736 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -6.505 -5.235 0.281 1.00 0.00 H new ATOM 1360 N ILE A 87 -4.876 -1.416 2.107 1.00 0.00 N ATOM 1361 CA ILE A 87 -4.484 -0.233 2.862 1.00 0.00 C ATOM 1362 C ILE A 87 -5.636 0.278 3.720 1.00 0.00 C ATOM 1363 O ILE A 87 -6.789 0.291 3.288 1.00 0.00 O ATOM 1364 CB ILE A 87 -4.011 0.898 1.931 1.00 0.00 C ATOM 1365 CG1 ILE A 87 -2.607 0.599 1.401 1.00 0.00 C ATOM 1366 CG2 ILE A 87 -4.034 2.232 2.663 1.00 0.00 C ATOM 1367 CD1 ILE A 87 -2.018 1.725 0.580 1.00 0.00 C ATOM 0 H ILE A 87 -5.760 -1.323 1.606 1.00 0.00 H new ATOM 0 HA ILE A 87 -3.657 -0.530 3.507 1.00 0.00 H new ATOM 0 HB ILE A 87 -4.693 0.959 1.083 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -1.947 0.390 2.243 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -2.642 -0.304 0.792 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.697 3.021 1.991 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -5.050 2.447 2.995 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.372 2.184 3.528 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -1.022 1.443 0.237 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -2.657 1.920 -0.282 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.950 2.625 1.192 1.00 0.00 H new ATOM 1379 N PHE A 88 -5.317 0.701 4.939 1.00 0.00 N ATOM 1380 CA PHE A 88 -6.325 1.215 5.859 1.00 0.00 C ATOM 1381 C PHE A 88 -5.676 2.005 6.992 1.00 0.00 C ATOM 1382 O PHE A 88 -4.456 1.983 7.158 1.00 0.00 O ATOM 1383 CB PHE A 88 -7.155 0.066 6.433 1.00 0.00 C ATOM 1384 CG PHE A 88 -6.352 -0.899 7.258 1.00 0.00 C ATOM 1385 CD1 PHE A 88 -5.909 -0.549 8.523 1.00 0.00 C ATOM 1386 CD2 PHE A 88 -6.041 -2.158 6.769 1.00 0.00 C ATOM 1387 CE1 PHE A 88 -5.170 -1.434 9.284 1.00 0.00 C ATOM 1388 CE2 PHE A 88 -5.302 -3.048 7.525 1.00 0.00 C ATOM 1389 CZ PHE A 88 -4.867 -2.686 8.785 1.00 0.00 C ATOM 0 H PHE A 88 -4.368 0.698 5.313 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.981 1.885 5.303 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.956 0.478 7.047 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.628 -0.475 5.613 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -6.144 0.428 8.919 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -6.380 -2.447 5.785 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -4.830 -1.147 10.268 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.065 -4.025 7.131 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.291 -3.380 9.379 1.00 0.00 H new ATOM 1399 N SER A 89 -6.500 2.701 7.768 1.00 0.00 N ATOM 1400 CA SER A 89 -6.007 3.502 8.883 1.00 0.00 C ATOM 1401 C SER A 89 -6.490 2.934 10.214 1.00 0.00 C ATOM 1402 O SER A 89 -7.692 2.800 10.446 1.00 0.00 O ATOM 1403 CB SER A 89 -6.466 4.954 8.738 1.00 0.00 C ATOM 1404 OG SER A 89 -5.867 5.779 9.722 1.00 0.00 O ATOM 0 H SER A 89 -7.512 2.727 7.646 1.00 0.00 H new ATOM 0 HA SER A 89 -4.918 3.470 8.868 1.00 0.00 H new ATOM 0 HB2 SER A 89 -6.209 5.322 7.745 1.00 0.00 H new ATOM 0 HB3 SER A 89 -7.551 5.006 8.827 1.00 0.00 H new ATOM 0 HG SER A 89 -6.476 6.512 9.949 1.00 0.00 H new ATOM 1410 N THR A 90 -5.544 2.602 11.087 1.00 0.00 N ATOM 1411 CA THR A 90 -5.871 2.049 12.395 1.00 0.00 C ATOM 1412 C THR A 90 -6.976 2.852 13.071 1.00 0.00 C ATOM 1413 O THR A 90 -7.854 2.289 13.724 1.00 0.00 O ATOM 1414 CB THR A 90 -4.637 2.017 13.316 1.00 0.00 C ATOM 1415 OG1 THR A 90 -4.271 3.350 13.690 1.00 0.00 O ATOM 1416 CG2 THR A 90 -3.464 1.338 12.626 1.00 0.00 C ATOM 0 H THR A 90 -4.545 2.707 10.911 1.00 0.00 H new ATOM 0 HA THR A 90 -6.217 1.029 12.229 1.00 0.00 H new ATOM 0 HB THR A 90 -4.892 1.446 14.209 1.00 0.00 H new ATOM 0 HG1 THR A 90 -3.487 3.321 14.277 1.00 0.00 H new ATOM 0 HG21 THR A 90 -2.604 1.327 13.296 1.00 0.00 H new ATOM 0 HG22 THR A 90 -3.736 0.314 12.369 1.00 0.00 H new ATOM 0 HG23 THR A 90 -3.210 1.885 11.718 1.00 0.00 H new ATOM 1424 N ASN A 91 -6.926 4.170 12.911 1.00 0.00 N ATOM 1425 CA ASN A 91 -7.924 5.051 13.506 1.00 0.00 C ATOM 1426 C ASN A 91 -8.519 5.987 12.458 1.00 0.00 C ATOM 1427 O ASN A 91 -8.065 7.116 12.270 1.00 0.00 O ATOM 1428 CB ASN A 91 -7.302 5.867 14.641 1.00 0.00 C ATOM 1429 CG ASN A 91 -8.303 6.199 15.731 1.00 0.00 C ATOM 1430 OD1 ASN A 91 -8.729 5.324 16.485 1.00 0.00 O ATOM 1431 ND2 ASN A 91 -8.683 7.468 15.818 1.00 0.00 N ATOM 0 H ASN A 91 -6.205 4.652 12.374 1.00 0.00 H new ATOM 0 HA ASN A 91 -8.725 4.431 13.909 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -6.471 5.309 15.073 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.890 6.791 14.236 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -9.355 7.752 16.532 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -8.303 8.160 15.171 1.00 0.00 H new ATOM 1438 N PRO A 92 -9.559 5.509 11.760 1.00 0.00 N ATOM 1439 CA PRO A 92 -10.239 6.287 10.721 1.00 0.00 C ATOM 1440 C PRO A 92 -11.035 7.453 11.296 1.00 0.00 C ATOM 1441 O PRO A 92 -11.487 8.332 10.562 1.00 0.00 O ATOM 1442 CB PRO A 92 -11.178 5.267 10.072 1.00 0.00 C ATOM 1443 CG PRO A 92 -11.423 4.249 11.132 1.00 0.00 C ATOM 1444 CD PRO A 92 -10.153 4.172 11.933 1.00 0.00 C ATOM 0 HA PRO A 92 -9.534 6.741 10.025 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -12.108 5.735 9.750 1.00 0.00 H new ATOM 0 HB3 PRO A 92 -10.724 4.817 9.189 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -12.265 4.536 11.762 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -11.668 3.281 10.695 1.00 0.00 H new ATOM 0 HD2 PRO A 92 -10.352 3.953 12.982 1.00 0.00 H new ATOM 0 HD3 PRO A 92 -9.492 3.388 11.564 1.00 0.00 H new ATOM 1452 N ASP A 93 -11.204 7.455 12.614 1.00 0.00 N ATOM 1453 CA ASP A 93 -11.944 8.515 13.289 1.00 0.00 C ATOM 1454 C ASP A 93 -11.130 9.804 13.332 1.00 0.00 C ATOM 1455 O ASP A 93 -11.686 10.903 13.313 1.00 0.00 O ATOM 1456 CB ASP A 93 -12.315 8.083 14.709 1.00 0.00 C ATOM 1457 CG ASP A 93 -12.859 6.669 14.760 1.00 0.00 C ATOM 1458 OD1 ASP A 93 -13.983 6.447 14.262 1.00 0.00 O ATOM 1459 OD2 ASP A 93 -12.161 5.784 15.297 1.00 0.00 O ATOM 0 H ASP A 93 -10.838 6.734 13.236 1.00 0.00 H new ATOM 0 HA ASP A 93 -12.857 8.703 12.725 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -11.435 8.154 15.349 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -13.059 8.770 15.112 1.00 0.00 H new ATOM 1464 N LEU A 94 -9.811 9.663 13.391 1.00 0.00 N ATOM 1465 CA LEU A 94 -8.919 10.816 13.439 1.00 0.00 C ATOM 1466 C LEU A 94 -8.392 11.154 12.048 1.00 0.00 C ATOM 1467 O LEU A 94 -8.460 12.302 11.609 1.00 0.00 O ATOM 1468 CB LEU A 94 -7.750 10.544 14.387 1.00 0.00 C ATOM 1469 CG LEU A 94 -8.033 10.746 15.876 1.00 0.00 C ATOM 1470 CD1 LEU A 94 -6.858 10.263 16.713 1.00 0.00 C ATOM 1471 CD2 LEU A 94 -8.333 12.209 16.168 1.00 0.00 C ATOM 0 H LEU A 94 -9.335 8.761 13.407 1.00 0.00 H new ATOM 0 HA LEU A 94 -9.488 11.669 13.810 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -7.418 9.517 14.237 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.920 11.192 14.104 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.910 10.156 16.143 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -7.077 10.415 17.770 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -6.690 9.202 16.526 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -5.964 10.825 16.444 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -8.532 12.334 17.232 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -7.476 12.820 15.885 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.206 12.522 15.596 1.00 0.00 H new ATOM 1483 N TYR A 95 -7.868 10.147 11.359 1.00 0.00 N ATOM 1484 CA TYR A 95 -7.328 10.337 10.017 1.00 0.00 C ATOM 1485 C TYR A 95 -7.921 9.323 9.043 1.00 0.00 C ATOM 1486 O TYR A 95 -7.313 8.301 8.725 1.00 0.00 O ATOM 1487 CB TYR A 95 -5.804 10.213 10.035 1.00 0.00 C ATOM 1488 CG TYR A 95 -5.133 11.144 11.020 1.00 0.00 C ATOM 1489 CD1 TYR A 95 -5.021 10.804 12.362 1.00 0.00 C ATOM 1490 CD2 TYR A 95 -4.608 12.363 10.607 1.00 0.00 C ATOM 1491 CE1 TYR A 95 -4.409 11.652 13.265 1.00 0.00 C ATOM 1492 CE2 TYR A 95 -3.993 13.216 11.502 1.00 0.00 C ATOM 1493 CZ TYR A 95 -3.897 12.856 12.830 1.00 0.00 C ATOM 1494 OH TYR A 95 -3.285 13.703 13.726 1.00 0.00 O ATOM 0 H TYR A 95 -7.805 9.190 11.707 1.00 0.00 H new ATOM 0 HA TYR A 95 -7.600 11.338 9.682 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -5.534 9.185 10.277 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -5.419 10.416 9.036 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -5.419 9.861 12.706 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -4.682 12.648 9.568 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -4.332 11.373 14.306 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -3.590 14.159 11.164 1.00 0.00 H new ATOM 0 HH TYR A 95 -2.978 14.508 13.258 1.00 0.00 H new ATOM 1504 N PRO A 96 -9.137 9.612 8.557 1.00 0.00 N ATOM 1505 CA PRO A 96 -9.839 8.740 7.611 1.00 0.00 C ATOM 1506 C PRO A 96 -9.183 8.730 6.235 1.00 0.00 C ATOM 1507 O PRO A 96 -8.763 9.771 5.729 1.00 0.00 O ATOM 1508 CB PRO A 96 -11.238 9.355 7.532 1.00 0.00 C ATOM 1509 CG PRO A 96 -11.043 10.787 7.893 1.00 0.00 C ATOM 1510 CD PRO A 96 -9.920 10.813 8.892 1.00 0.00 C ATOM 0 HA PRO A 96 -9.834 7.699 7.935 1.00 0.00 H new ATOM 0 HB2 PRO A 96 -11.660 9.253 6.532 1.00 0.00 H new ATOM 0 HB3 PRO A 96 -11.926 8.863 8.220 1.00 0.00 H new ATOM 0 HG2 PRO A 96 -10.796 11.381 7.013 1.00 0.00 H new ATOM 0 HG3 PRO A 96 -11.953 11.210 8.318 1.00 0.00 H new ATOM 0 HD2 PRO A 96 -9.323 11.720 8.801 1.00 0.00 H new ATOM 0 HD3 PRO A 96 -10.292 10.777 9.916 1.00 0.00 H new ATOM 1518 N VAL A 97 -9.099 7.548 5.632 1.00 0.00 N ATOM 1519 CA VAL A 97 -8.495 7.403 4.313 1.00 0.00 C ATOM 1520 C VAL A 97 -9.437 7.899 3.221 1.00 0.00 C ATOM 1521 O VAL A 97 -10.555 7.404 3.079 1.00 0.00 O ATOM 1522 CB VAL A 97 -8.119 5.938 4.025 1.00 0.00 C ATOM 1523 CG1 VAL A 97 -7.774 5.753 2.555 1.00 0.00 C ATOM 1524 CG2 VAL A 97 -6.963 5.501 4.912 1.00 0.00 C ATOM 0 H VAL A 97 -9.442 6.677 6.037 1.00 0.00 H new ATOM 0 HA VAL A 97 -7.589 8.009 4.311 1.00 0.00 H new ATOM 0 HB VAL A 97 -8.980 5.309 4.252 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -7.511 4.711 2.371 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -8.634 6.024 1.943 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -6.929 6.391 2.296 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -6.710 4.463 4.695 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.097 6.133 4.718 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.253 5.593 5.959 1.00 0.00 H new ATOM 1534 N ARG A 98 -8.976 8.879 2.450 1.00 0.00 N ATOM 1535 CA ARG A 98 -9.777 9.443 1.370 1.00 0.00 C ATOM 1536 C ARG A 98 -9.366 8.854 0.024 1.00 0.00 C ATOM 1537 O ARG A 98 -8.308 8.236 -0.097 1.00 0.00 O ATOM 1538 CB ARG A 98 -9.631 10.965 1.340 1.00 0.00 C ATOM 1539 CG ARG A 98 -10.091 11.647 2.618 1.00 0.00 C ATOM 1540 CD ARG A 98 -11.591 11.895 2.608 1.00 0.00 C ATOM 1541 NE ARG A 98 -12.095 12.253 3.932 1.00 0.00 N ATOM 1542 CZ ARG A 98 -13.385 12.414 4.208 1.00 0.00 C ATOM 1543 NH1 ARG A 98 -14.295 12.249 3.259 1.00 0.00 N ATOM 1544 NH2 ARG A 98 -13.765 12.740 5.437 1.00 0.00 N ATOM 0 H ARG A 98 -8.052 9.299 2.553 1.00 0.00 H new ATOM 0 HA ARG A 98 -10.821 9.189 1.554 1.00 0.00 H new ATOM 0 HB2 ARG A 98 -8.586 11.218 1.159 1.00 0.00 H new ATOM 0 HB3 ARG A 98 -10.204 11.360 0.501 1.00 0.00 H new ATOM 0 HG2 ARG A 98 -9.829 11.028 3.476 1.00 0.00 H new ATOM 0 HG3 ARG A 98 -9.565 12.595 2.736 1.00 0.00 H new ATOM 0 HD2 ARG A 98 -11.822 12.694 1.904 1.00 0.00 H new ATOM 0 HD3 ARG A 98 -12.104 11.001 2.254 1.00 0.00 H new ATOM 0 HE ARG A 98 -11.420 12.387 4.685 1.00 0.00 H new ATOM 0 HH11 ARG A 98 -14.006 11.998 2.314 1.00 0.00 H new ATOM 0 HH12 ARG A 98 -15.284 12.373 3.474 1.00 0.00 H new ATOM 0 HH21 ARG A 98 -13.067 12.867 6.170 1.00 0.00 H new ATOM 0 HH22 ARG A 98 -14.755 12.864 5.649 1.00 0.00 H new ATOM 1558 N ARG A 99 -10.208 9.051 -0.984 1.00 0.00 N ATOM 1559 CA ARG A 99 -9.933 8.539 -2.321 1.00 0.00 C ATOM 1560 C ARG A 99 -8.992 9.472 -3.078 1.00 0.00 C ATOM 1561 O ARG A 99 -8.906 10.662 -2.775 1.00 0.00 O ATOM 1562 CB ARG A 99 -11.237 8.368 -3.104 1.00 0.00 C ATOM 1563 CG ARG A 99 -11.952 9.679 -3.389 1.00 0.00 C ATOM 1564 CD ARG A 99 -13.446 9.468 -3.578 1.00 0.00 C ATOM 1565 NE ARG A 99 -14.114 10.678 -4.051 1.00 0.00 N ATOM 1566 CZ ARG A 99 -15.425 10.766 -4.243 1.00 0.00 C ATOM 1567 NH1 ARG A 99 -16.206 9.721 -4.003 1.00 0.00 N ATOM 1568 NH2 ARG A 99 -15.959 11.902 -4.675 1.00 0.00 N ATOM 0 H ARG A 99 -11.087 9.562 -0.901 1.00 0.00 H new ATOM 0 HA ARG A 99 -9.449 7.568 -2.218 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -11.021 7.869 -4.049 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.905 7.714 -2.543 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -11.783 10.374 -2.566 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -11.532 10.137 -4.284 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -13.611 8.661 -4.291 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -13.890 9.154 -2.633 1.00 0.00 H new ATOM 0 HE ARG A 99 -13.542 11.500 -4.244 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -15.800 8.847 -3.670 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -17.213 9.792 -4.151 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -15.362 12.708 -4.860 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -16.966 11.969 -4.822 1.00 0.00 H new ATOM 1582 N ILE A 100 -8.288 8.922 -4.062 1.00 0.00 N ATOM 1583 CA ILE A 100 -7.354 9.705 -4.861 1.00 0.00 C ATOM 1584 C ILE A 100 -7.716 9.649 -6.342 1.00 0.00 C ATOM 1585 O ILE A 100 -7.484 8.641 -7.010 1.00 0.00 O ATOM 1586 CB ILE A 100 -5.906 9.212 -4.679 1.00 0.00 C ATOM 1587 CG1 ILE A 100 -5.571 9.084 -3.192 1.00 0.00 C ATOM 1588 CG2 ILE A 100 -4.934 10.158 -5.367 1.00 0.00 C ATOM 1589 CD1 ILE A 100 -4.145 8.655 -2.928 1.00 0.00 C ATOM 0 H ILE A 100 -8.347 7.938 -4.325 1.00 0.00 H new ATOM 0 HA ILE A 100 -7.425 10.735 -4.510 1.00 0.00 H new ATOM 0 HB ILE A 100 -5.812 8.228 -5.139 1.00 0.00 H new ATOM 0 HG12 ILE A 100 -5.750 10.042 -2.704 1.00 0.00 H new ATOM 0 HG13 ILE A 100 -6.249 8.363 -2.736 1.00 0.00 H new ATOM 0 HG21 ILE A 100 -3.915 9.796 -5.229 1.00 0.00 H new ATOM 0 HG22 ILE A 100 -5.162 10.203 -6.432 1.00 0.00 H new ATOM 0 HG23 ILE A 100 -5.027 11.154 -4.933 1.00 0.00 H new ATOM 0 HD11 ILE A 100 -3.979 8.585 -1.853 1.00 0.00 H new ATOM 0 HD12 ILE A 100 -3.967 7.682 -3.387 1.00 0.00 H new ATOM 0 HD13 ILE A 100 -3.460 9.388 -3.354 1.00 0.00 H new ATOM 1601 N ASP A 101 -8.283 10.738 -6.848 1.00 0.00 N ATOM 1602 CA ASP A 101 -8.674 10.814 -8.251 1.00 0.00 C ATOM 1603 C ASP A 101 -7.502 10.464 -9.162 1.00 0.00 C ATOM 1604 O ASP A 101 -6.426 11.050 -9.058 1.00 0.00 O ATOM 1605 CB ASP A 101 -9.194 12.214 -8.582 1.00 0.00 C ATOM 1606 CG ASP A 101 -10.415 12.587 -7.764 1.00 0.00 C ATOM 1607 OD1 ASP A 101 -11.435 11.874 -7.864 1.00 0.00 O ATOM 1608 OD2 ASP A 101 -10.350 13.592 -7.026 1.00 0.00 O ATOM 0 H ASP A 101 -8.482 11.580 -6.308 1.00 0.00 H new ATOM 0 HA ASP A 101 -9.471 10.090 -8.421 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -8.404 12.943 -8.403 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -9.441 12.265 -9.642 1.00 0.00 H new ATOM 1613 N GLY A 102 -7.719 9.503 -10.055 1.00 0.00 N ATOM 1614 CA GLY A 102 -6.671 9.090 -10.970 1.00 0.00 C ATOM 1615 C GLY A 102 -7.215 8.367 -12.186 1.00 0.00 C ATOM 1616 O GLY A 102 -8.232 7.677 -12.104 1.00 0.00 O ATOM 0 H GLY A 102 -8.602 9.003 -10.161 1.00 0.00 H new ATOM 0 HA2 GLY A 102 -6.109 9.966 -11.293 1.00 0.00 H new ATOM 0 HA3 GLY A 102 -5.972 8.438 -10.446 1.00 0.00 H new ATOM 1620 N LEU A 103 -6.539 8.526 -13.318 1.00 0.00 N ATOM 1621 CA LEU A 103 -6.961 7.884 -14.558 1.00 0.00 C ATOM 1622 C LEU A 103 -5.856 6.991 -15.113 1.00 0.00 C ATOM 1623 O LEU A 103 -4.951 7.460 -15.805 1.00 0.00 O ATOM 1624 CB LEU A 103 -7.349 8.939 -15.596 1.00 0.00 C ATOM 1625 CG LEU A 103 -8.083 8.424 -16.834 1.00 0.00 C ATOM 1626 CD1 LEU A 103 -9.582 8.373 -16.583 1.00 0.00 C ATOM 1627 CD2 LEU A 103 -7.773 9.299 -18.040 1.00 0.00 C ATOM 0 H LEU A 103 -5.696 9.094 -13.403 1.00 0.00 H new ATOM 0 HA LEU A 103 -7.829 7.263 -14.338 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -7.978 9.685 -15.109 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -6.443 9.450 -15.922 1.00 0.00 H new ATOM 0 HG LEU A 103 -7.735 7.413 -17.044 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -10.088 8.004 -17.475 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -9.788 7.705 -15.747 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -9.946 9.373 -16.347 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -8.304 8.918 -18.912 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -8.092 10.322 -17.839 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -6.700 9.285 -18.233 1.00 0.00 H new ATOM 1639 N THR A 104 -5.936 5.699 -14.807 1.00 0.00 N ATOM 1640 CA THR A 104 -4.943 4.740 -15.275 1.00 0.00 C ATOM 1641 C THR A 104 -5.358 3.312 -14.939 1.00 0.00 C ATOM 1642 O THR A 104 -6.003 3.066 -13.920 1.00 0.00 O ATOM 1643 CB THR A 104 -3.559 5.019 -14.660 1.00 0.00 C ATOM 1644 OG1 THR A 104 -2.615 4.042 -15.116 1.00 0.00 O ATOM 1645 CG2 THR A 104 -3.627 4.996 -13.141 1.00 0.00 C ATOM 0 H THR A 104 -6.678 5.293 -14.237 1.00 0.00 H new ATOM 0 HA THR A 104 -4.880 4.852 -16.357 1.00 0.00 H new ATOM 0 HB THR A 104 -3.237 6.011 -14.978 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.737 4.227 -14.722 1.00 0.00 H new ATOM 0 HG21 THR A 104 -2.638 5.196 -12.729 1.00 0.00 H new ATOM 0 HG22 THR A 104 -4.324 5.760 -12.796 1.00 0.00 H new ATOM 0 HG23 THR A 104 -3.968 4.016 -12.807 1.00 0.00 H new ATOM 1653 N ASP A 105 -4.983 2.374 -15.802 1.00 0.00 N ATOM 1654 CA ASP A 105 -5.315 0.969 -15.596 1.00 0.00 C ATOM 1655 C ASP A 105 -4.636 0.091 -16.643 1.00 0.00 C ATOM 1656 O ASP A 105 -4.934 0.185 -17.834 1.00 0.00 O ATOM 1657 CB ASP A 105 -6.830 0.768 -15.647 1.00 0.00 C ATOM 1658 CG ASP A 105 -7.410 1.087 -17.011 1.00 0.00 C ATOM 1659 OD1 ASP A 105 -7.632 2.282 -17.297 1.00 0.00 O ATOM 1660 OD2 ASP A 105 -7.642 0.141 -17.793 1.00 0.00 O ATOM 0 H ASP A 105 -4.449 2.561 -16.651 1.00 0.00 H new ATOM 0 HA ASP A 105 -4.951 0.676 -14.611 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.066 -0.264 -15.387 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -7.303 1.402 -14.897 1.00 0.00 H new ATOM 1665 N VAL A 106 -3.722 -0.761 -16.191 1.00 0.00 N ATOM 1666 CA VAL A 106 -3.001 -1.656 -17.088 1.00 0.00 C ATOM 1667 C VAL A 106 -2.659 -2.970 -16.395 1.00 0.00 C ATOM 1668 O VAL A 106 -2.007 -2.982 -15.351 1.00 0.00 O ATOM 1669 CB VAL A 106 -1.704 -1.007 -17.604 1.00 0.00 C ATOM 1670 CG1 VAL A 106 -0.913 -0.404 -16.453 1.00 0.00 C ATOM 1671 CG2 VAL A 106 -0.865 -2.025 -18.363 1.00 0.00 C ATOM 0 H VAL A 106 -3.463 -0.850 -15.208 1.00 0.00 H new ATOM 0 HA VAL A 106 -3.660 -1.856 -17.933 1.00 0.00 H new ATOM 0 HB VAL A 106 -1.969 -0.203 -18.291 1.00 0.00 H new ATOM 0 HG11 VAL A 106 0.000 0.050 -16.838 1.00 0.00 H new ATOM 0 HG12 VAL A 106 -1.515 0.357 -15.957 1.00 0.00 H new ATOM 0 HG13 VAL A 106 -0.656 -1.186 -15.739 1.00 0.00 H new ATOM 0 HG21 VAL A 106 0.048 -1.550 -18.721 1.00 0.00 H new ATOM 0 HG22 VAL A 106 -0.608 -2.851 -17.700 1.00 0.00 H new ATOM 0 HG23 VAL A 106 -1.433 -2.404 -19.212 1.00 0.00 H new ATOM 1681 N SER A 107 -3.102 -4.077 -16.984 1.00 0.00 N ATOM 1682 CA SER A 107 -2.846 -5.397 -16.421 1.00 0.00 C ATOM 1683 C SER A 107 -3.128 -6.489 -17.448 1.00 0.00 C ATOM 1684 O SER A 107 -3.494 -6.204 -18.588 1.00 0.00 O ATOM 1685 CB SER A 107 -3.704 -5.620 -15.175 1.00 0.00 C ATOM 1686 OG SER A 107 -3.064 -5.111 -14.017 1.00 0.00 O ATOM 0 H SER A 107 -3.640 -4.085 -17.851 1.00 0.00 H new ATOM 0 HA SER A 107 -1.794 -5.447 -16.142 1.00 0.00 H new ATOM 0 HB2 SER A 107 -4.671 -5.133 -15.304 1.00 0.00 H new ATOM 0 HB3 SER A 107 -3.898 -6.685 -15.049 1.00 0.00 H new ATOM 0 HG SER A 107 -2.579 -4.290 -14.245 1.00 0.00 H new ATOM 1692 N GLN A 108 -2.954 -7.741 -17.035 1.00 0.00 N ATOM 1693 CA GLN A 108 -3.189 -8.876 -17.919 1.00 0.00 C ATOM 1694 C GLN A 108 -3.833 -10.032 -17.161 1.00 0.00 C ATOM 1695 O GLN A 108 -3.817 -10.065 -15.930 1.00 0.00 O ATOM 1696 CB GLN A 108 -1.875 -9.335 -18.554 1.00 0.00 C ATOM 1697 CG GLN A 108 -2.054 -9.993 -19.913 1.00 0.00 C ATOM 1698 CD GLN A 108 -2.315 -11.483 -19.811 1.00 0.00 C ATOM 1699 OE1 GLN A 108 -1.904 -12.132 -18.849 1.00 0.00 O ATOM 1700 NE2 GLN A 108 -3.002 -12.034 -20.805 1.00 0.00 N ATOM 0 H GLN A 108 -2.651 -7.994 -16.094 1.00 0.00 H new ATOM 0 HA GLN A 108 -3.872 -8.557 -18.706 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -1.213 -8.476 -18.660 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -1.382 -10.037 -17.882 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -2.884 -9.518 -20.436 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -1.160 -9.825 -20.514 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -3.324 -11.458 -21.583 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -3.208 -13.033 -20.790 1.00 0.00 H new ATOM 1709 N ILE A 109 -4.398 -10.978 -17.904 1.00 0.00 N ATOM 1710 CA ILE A 109 -5.047 -12.136 -17.301 1.00 0.00 C ATOM 1711 C ILE A 109 -4.302 -13.422 -17.641 1.00 0.00 C ATOM 1712 O ILE A 109 -4.428 -13.951 -18.746 1.00 0.00 O ATOM 1713 CB ILE A 109 -6.510 -12.266 -17.763 1.00 0.00 C ATOM 1714 CG1 ILE A 109 -6.655 -11.787 -19.209 1.00 0.00 C ATOM 1715 CG2 ILE A 109 -7.428 -11.476 -16.842 1.00 0.00 C ATOM 1716 CD1 ILE A 109 -8.075 -11.852 -19.727 1.00 0.00 C ATOM 0 H ILE A 109 -4.419 -10.965 -18.924 1.00 0.00 H new ATOM 0 HA ILE A 109 -5.028 -11.982 -16.222 1.00 0.00 H new ATOM 0 HB ILE A 109 -6.799 -13.316 -17.718 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -6.297 -10.760 -19.281 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -6.015 -12.393 -19.850 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -8.459 -11.578 -17.181 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -7.341 -11.860 -15.825 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -7.143 -10.424 -16.859 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -8.103 -11.498 -20.757 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -8.430 -12.882 -19.688 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -8.717 -11.223 -19.110 1.00 0.00 H new ATOM 1728 N ILE A 110 -3.527 -13.922 -16.685 1.00 0.00 N ATOM 1729 CA ILE A 110 -2.764 -15.148 -16.882 1.00 0.00 C ATOM 1730 C ILE A 110 -2.553 -15.883 -15.563 1.00 0.00 C ATOM 1731 O ILE A 110 -2.422 -15.263 -14.507 1.00 0.00 O ATOM 1732 CB ILE A 110 -1.392 -14.861 -17.521 1.00 0.00 C ATOM 1733 CG1 ILE A 110 -0.675 -16.171 -17.853 1.00 0.00 C ATOM 1734 CG2 ILE A 110 -0.543 -14.006 -16.592 1.00 0.00 C ATOM 1735 CD1 ILE A 110 0.318 -16.046 -18.987 1.00 0.00 C ATOM 0 H ILE A 110 -3.411 -13.496 -15.765 1.00 0.00 H new ATOM 0 HA ILE A 110 -3.346 -15.776 -17.556 1.00 0.00 H new ATOM 0 HB ILE A 110 -1.548 -14.310 -18.448 1.00 0.00 H new ATOM 0 HG12 ILE A 110 -0.155 -16.527 -16.963 1.00 0.00 H new ATOM 0 HG13 ILE A 110 -1.417 -16.926 -18.112 1.00 0.00 H new ATOM 0 HG21 ILE A 110 0.423 -13.812 -17.058 1.00 0.00 H new ATOM 0 HG22 ILE A 110 -1.051 -13.060 -16.402 1.00 0.00 H new ATOM 0 HG23 ILE A 110 -0.392 -14.532 -15.649 1.00 0.00 H new ATOM 0 HD11 ILE A 110 0.788 -17.013 -19.167 1.00 0.00 H new ATOM 0 HD12 ILE A 110 -0.199 -15.720 -19.889 1.00 0.00 H new ATOM 0 HD13 ILE A 110 1.082 -15.315 -18.723 1.00 0.00 H new ATOM 1747 N THR A 111 -2.520 -17.210 -15.630 1.00 0.00 N ATOM 1748 CA THR A 111 -2.325 -18.031 -14.442 1.00 0.00 C ATOM 1749 C THR A 111 -1.890 -19.444 -14.814 1.00 0.00 C ATOM 1750 O THR A 111 -2.502 -20.088 -15.667 1.00 0.00 O ATOM 1751 CB THR A 111 -3.610 -18.108 -13.595 1.00 0.00 C ATOM 1752 OG1 THR A 111 -4.139 -16.794 -13.387 1.00 0.00 O ATOM 1753 CG2 THR A 111 -3.334 -18.768 -12.252 1.00 0.00 C ATOM 0 H THR A 111 -2.626 -17.739 -16.495 1.00 0.00 H new ATOM 0 HA THR A 111 -1.539 -17.555 -13.855 1.00 0.00 H new ATOM 0 HB THR A 111 -4.340 -18.711 -14.135 1.00 0.00 H new ATOM 0 HG1 THR A 111 -3.411 -16.139 -13.425 1.00 0.00 H new ATOM 0 HG21 THR A 111 -4.256 -18.811 -11.672 1.00 0.00 H new ATOM 0 HG22 THR A 111 -2.959 -19.779 -12.413 1.00 0.00 H new ATOM 0 HG23 THR A 111 -2.589 -18.188 -11.708 1.00 0.00 H new ATOM 1761 N VAL A 112 -0.830 -19.921 -14.170 1.00 0.00 N ATOM 1762 CA VAL A 112 -0.314 -21.259 -14.433 1.00 0.00 C ATOM 1763 C VAL A 112 -1.014 -22.298 -13.565 1.00 0.00 C ATOM 1764 O VAL A 112 -1.264 -22.068 -12.382 1.00 0.00 O ATOM 1765 CB VAL A 112 1.204 -21.335 -14.182 1.00 0.00 C ATOM 1766 CG1 VAL A 112 1.943 -20.351 -15.076 1.00 0.00 C ATOM 1767 CG2 VAL A 112 1.514 -21.072 -12.716 1.00 0.00 C ATOM 0 H VAL A 112 -0.312 -19.401 -13.462 1.00 0.00 H new ATOM 0 HA VAL A 112 -0.512 -21.474 -15.483 1.00 0.00 H new ATOM 0 HB VAL A 112 1.546 -22.340 -14.428 1.00 0.00 H new ATOM 0 HG11 VAL A 112 3.014 -20.419 -14.885 1.00 0.00 H new ATOM 0 HG12 VAL A 112 1.745 -20.590 -16.121 1.00 0.00 H new ATOM 0 HG13 VAL A 112 1.600 -19.338 -14.864 1.00 0.00 H new ATOM 0 HG21 VAL A 112 2.591 -21.129 -12.556 1.00 0.00 H new ATOM 0 HG22 VAL A 112 1.159 -20.079 -12.441 1.00 0.00 H new ATOM 0 HG23 VAL A 112 1.015 -21.819 -12.099 1.00 0.00 H new ATOM 1777 N SER A 113 -1.328 -23.444 -14.161 1.00 0.00 N ATOM 1778 CA SER A 113 -2.003 -24.519 -13.443 1.00 0.00 C ATOM 1779 C SER A 113 -0.991 -25.476 -12.821 1.00 0.00 C ATOM 1780 O SER A 113 0.212 -25.358 -13.048 1.00 0.00 O ATOM 1781 CB SER A 113 -2.934 -25.285 -14.386 1.00 0.00 C ATOM 1782 OG SER A 113 -2.293 -25.563 -15.619 1.00 0.00 O ATOM 0 H SER A 113 -1.126 -23.652 -15.139 1.00 0.00 H new ATOM 0 HA SER A 113 -2.594 -24.073 -12.643 1.00 0.00 H new ATOM 0 HB2 SER A 113 -3.246 -26.218 -13.916 1.00 0.00 H new ATOM 0 HB3 SER A 113 -3.837 -24.701 -14.565 1.00 0.00 H new ATOM 0 HG SER A 113 -2.907 -26.054 -16.204 1.00 0.00 H new ATOM 1788 N GLY A 114 -1.489 -26.425 -12.034 1.00 0.00 N ATOM 1789 CA GLY A 114 -0.616 -27.389 -11.390 1.00 0.00 C ATOM 1790 C GLY A 114 -1.302 -28.719 -11.145 1.00 0.00 C ATOM 1791 O GLY A 114 -2.508 -28.785 -10.907 1.00 0.00 O ATOM 0 H GLY A 114 -2.482 -26.543 -11.831 1.00 0.00 H new ATOM 0 HA2 GLY A 114 0.266 -27.547 -12.011 1.00 0.00 H new ATOM 0 HA3 GLY A 114 -0.269 -26.982 -10.440 1.00 0.00 H new ATOM 1795 N PRO A 115 -0.523 -29.810 -11.204 1.00 0.00 N ATOM 1796 CA PRO A 115 -1.042 -31.164 -10.990 1.00 0.00 C ATOM 1797 C PRO A 115 -1.443 -31.409 -9.539 1.00 0.00 C ATOM 1798 O PRO A 115 -1.241 -30.554 -8.677 1.00 0.00 O ATOM 1799 CB PRO A 115 0.138 -32.060 -11.377 1.00 0.00 C ATOM 1800 CG PRO A 115 1.344 -31.212 -11.163 1.00 0.00 C ATOM 1801 CD PRO A 115 0.922 -29.805 -11.483 1.00 0.00 C ATOM 0 HA PRO A 115 -1.946 -31.351 -11.570 1.00 0.00 H new ATOM 0 HB2 PRO A 115 0.171 -32.959 -10.761 1.00 0.00 H new ATOM 0 HB3 PRO A 115 0.063 -32.387 -12.414 1.00 0.00 H new ATOM 0 HG2 PRO A 115 1.698 -31.289 -10.135 1.00 0.00 H new ATOM 0 HG3 PRO A 115 2.164 -31.530 -11.807 1.00 0.00 H new ATOM 0 HD2 PRO A 115 1.448 -29.077 -10.865 1.00 0.00 H new ATOM 0 HD3 PRO A 115 1.130 -29.550 -12.522 1.00 0.00 H new ATOM 1809 N SER A 116 -2.013 -32.581 -9.278 1.00 0.00 N ATOM 1810 CA SER A 116 -2.446 -32.937 -7.931 1.00 0.00 C ATOM 1811 C SER A 116 -2.343 -34.442 -7.708 1.00 0.00 C ATOM 1812 O SER A 116 -2.108 -35.206 -8.645 1.00 0.00 O ATOM 1813 CB SER A 116 -3.884 -32.472 -7.696 1.00 0.00 C ATOM 1814 OG SER A 116 -4.791 -33.178 -8.527 1.00 0.00 O ATOM 0 H SER A 116 -2.186 -33.300 -9.981 1.00 0.00 H new ATOM 0 HA SER A 116 -1.789 -32.436 -7.220 1.00 0.00 H new ATOM 0 HB2 SER A 116 -4.152 -32.622 -6.650 1.00 0.00 H new ATOM 0 HB3 SER A 116 -3.961 -31.403 -7.894 1.00 0.00 H new ATOM 0 HG SER A 116 -5.703 -32.864 -8.357 1.00 0.00 H new ATOM 1820 N SER A 117 -2.521 -34.862 -6.459 1.00 0.00 N ATOM 1821 CA SER A 117 -2.445 -36.276 -6.110 1.00 0.00 C ATOM 1822 C SER A 117 -3.375 -36.599 -4.945 1.00 0.00 C ATOM 1823 O SER A 117 -3.993 -35.707 -4.363 1.00 0.00 O ATOM 1824 CB SER A 117 -1.007 -36.657 -5.751 1.00 0.00 C ATOM 1825 OG SER A 117 -0.141 -36.482 -6.858 1.00 0.00 O ATOM 0 H SER A 117 -2.719 -34.243 -5.672 1.00 0.00 H new ATOM 0 HA SER A 117 -2.762 -36.857 -6.976 1.00 0.00 H new ATOM 0 HB2 SER A 117 -0.663 -36.046 -4.916 1.00 0.00 H new ATOM 0 HB3 SER A 117 -0.974 -37.695 -5.421 1.00 0.00 H new ATOM 0 HG SER A 117 0.772 -36.731 -6.602 1.00 0.00 H new ATOM 1831 N GLY A 118 -3.470 -37.882 -4.609 1.00 0.00 N ATOM 1832 CA GLY A 118 -4.326 -38.301 -3.515 1.00 0.00 C ATOM 1833 C GLY A 118 -5.426 -39.240 -3.967 1.00 0.00 C ATOM 1834 O GLY A 118 -5.946 -40.025 -3.174 1.00 0.00 O ATOM 0 H GLY A 118 -2.969 -38.639 -5.075 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -3.722 -38.794 -2.753 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -4.771 -37.422 -3.049 1.00 0.00 H new TER 1838 GLY A 118