USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 874 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 47 HIS : no HD1:sc= -0.761 K(o=-1.1,f=-4.5!) USER MOD Set 1.2: A 51 GLN : amide:sc= -0.369 K(o=-1.1,f=-2.5) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -0.205 X(o=-0.21,f=-0.061) USER MOD Single : A 5 SER OG : rot -57:sc= -0.219 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 166:sc= -0.301 (180deg=-0.568) USER MOD Single : A -1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 12 THR OG1 : rot 71:sc= 0.265 USER MOD Single : A 13 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN :FLIP amide:sc= -1.72 F(o=-2.4!,f=-1.7) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 19 ASN : amide:sc= -0.274 X(o=-0.27,f=-0.56) USER MOD Single : A 22 SER OG : rot 68:sc= -0.556 USER MOD Single : A 31 THR OG1 : rot 73:sc= 1.3 USER MOD Single : A 38 ASN : amide:sc= -3.49! C(o=-3.5!,f=-7.9!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.058 USER MOD Single : A 48 SER OG : rot 180:sc= -0.129 USER MOD Single : A 49 LYS NZ :NH3+ -109:sc= 0.0396 (180deg=0) USER MOD Single : A 54 THR OG1 : rot -67:sc= 0.0109 USER MOD Single : A 55 ASN : amide:sc= -0.125 X(o=-0.12,f=-0.13) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -7.27! C(o=-7.3!,f=-7.6!) USER MOD Single : A 74 GLN : amide:sc= -1.57 K(o=-1.6,f=-9.2!) USER MOD Single : A 79 HIS : no HD1:sc= -0.107 K(o=-0.11,f=-0.61) USER MOD Single : A 85 LYS NZ :NH3+ -162:sc= -0.128 (180deg=-0.55) USER MOD Single : A 86 GLN : amide:sc= 0 X(o=0,f=-0.017) USER MOD Single : A 87 ASN :FLIP amide:sc= -0.19 F(o=-1.1,f=-0.19) USER MOD Single : A 90 GLN :FLIP amide:sc= -0.161 F(o=-1.4,f=-0.16) USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 GLN : amide:sc= -0.0971 K(o=-0.097,f=-2!) USER MOD Single : A 95 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.36) USER MOD Single : A 97 GLN : amide:sc= 0 X(o=0,f=-0.3) USER MOD Single : A 103 SER OG : rot 180:sc= 0.0948 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -1 2.916 0.895 -0.644 1.00 0.00 N ATOM 2 CA GLY A -1 3.551 -0.358 -1.007 1.00 0.00 C ATOM 3 C GLY A -1 2.689 -1.200 -1.926 1.00 0.00 C ATOM 4 O GLY A -1 1.593 -1.616 -1.551 1.00 0.00 O ATOM 0 H1 GLY A -1 3.545 1.434 -0.015 1.00 0.00 H new ATOM 0 H2 GLY A -1 2.727 1.450 -1.503 1.00 0.00 H new ATOM 0 H3 GLY A -1 2.020 0.701 -0.153 1.00 0.00 H new ATOM 0 HA2 GLY A -1 4.503 -0.151 -1.496 1.00 0.00 H new ATOM 0 HA3 GLY A -1 3.773 -0.924 -0.103 1.00 0.00 H new ATOM 8 N SER A 0 3.183 -1.451 -3.134 1.00 0.00 N ATOM 9 CA SER A 0 2.447 -2.245 -4.111 1.00 0.00 C ATOM 10 C SER A 0 3.236 -3.490 -4.504 1.00 0.00 C ATOM 11 O SER A 0 3.605 -3.664 -5.665 1.00 0.00 O ATOM 12 CB SER A 0 2.143 -1.407 -5.355 1.00 0.00 C ATOM 13 OG SER A 0 1.222 -0.371 -5.059 1.00 0.00 O ATOM 0 H SER A 0 4.090 -1.116 -3.460 1.00 0.00 H new ATOM 0 HA SER A 0 1.509 -2.559 -3.654 1.00 0.00 H new ATOM 0 HB2 SER A 0 3.067 -0.977 -5.742 1.00 0.00 H new ATOM 0 HB3 SER A 0 1.736 -2.047 -6.138 1.00 0.00 H new ATOM 0 HG SER A 0 1.045 0.151 -5.869 1.00 0.00 H new ATOM 19 N ALA A 1 3.491 -4.354 -3.527 1.00 0.00 N ATOM 20 CA ALA A 1 4.234 -5.584 -3.770 1.00 0.00 C ATOM 21 C ALA A 1 3.291 -6.746 -4.064 1.00 0.00 C ATOM 22 O ALA A 1 3.337 -7.338 -5.142 1.00 0.00 O ATOM 23 CB ALA A 1 5.120 -5.910 -2.577 1.00 0.00 C ATOM 0 H ALA A 1 3.194 -4.225 -2.560 1.00 0.00 H new ATOM 0 HA ALA A 1 4.865 -5.431 -4.646 1.00 0.00 H new ATOM 0 HB1 ALA A 1 5.669 -6.831 -2.772 1.00 0.00 H new ATOM 0 HB2 ALA A 1 5.825 -5.095 -2.414 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.502 -6.038 -1.689 1.00 0.00 H new ATOM 29 N ARG A 2 2.437 -7.068 -3.098 1.00 0.00 N ATOM 30 CA ARG A 2 1.485 -8.161 -3.253 1.00 0.00 C ATOM 31 C ARG A 2 0.484 -7.856 -4.363 1.00 0.00 C ATOM 32 O ARG A 2 -0.234 -8.743 -4.825 1.00 0.00 O ATOM 33 CB ARG A 2 0.744 -8.411 -1.938 1.00 0.00 C ATOM 34 CG ARG A 2 -0.304 -9.508 -2.028 1.00 0.00 C ATOM 35 CD ARG A 2 0.293 -10.807 -2.548 1.00 0.00 C ATOM 36 NE ARG A 2 -0.216 -11.970 -1.826 1.00 0.00 N ATOM 37 CZ ARG A 2 -0.113 -13.216 -2.276 1.00 0.00 C ATOM 38 NH1 ARG A 2 0.478 -13.459 -3.438 1.00 0.00 N ATOM 39 NH2 ARG A 2 -0.601 -14.223 -1.562 1.00 0.00 N ATOM 0 H ARG A 2 2.385 -6.587 -2.200 1.00 0.00 H new ATOM 0 HA ARG A 2 2.041 -9.058 -3.525 1.00 0.00 H new ATOM 0 HB2 ARG A 2 1.468 -8.675 -1.167 1.00 0.00 H new ATOM 0 HB3 ARG A 2 0.263 -7.486 -1.620 1.00 0.00 H new ATOM 0 HG2 ARG A 2 -0.742 -9.676 -1.044 1.00 0.00 H new ATOM 0 HG3 ARG A 2 -1.112 -9.188 -2.686 1.00 0.00 H new ATOM 0 HD2 ARG A 2 0.066 -10.911 -3.609 1.00 0.00 H new ATOM 0 HD3 ARG A 2 1.378 -10.770 -2.456 1.00 0.00 H new ATOM 0 HE ARG A 2 -0.675 -11.818 -0.928 1.00 0.00 H new ATOM 0 HH11 ARG A 2 0.855 -12.688 -3.989 1.00 0.00 H new ATOM 0 HH12 ARG A 2 0.555 -14.417 -3.780 1.00 0.00 H new ATOM 0 HH21 ARG A 2 -1.055 -14.041 -0.667 1.00 0.00 H new ATOM 0 HH22 ARG A 2 -0.522 -15.179 -1.908 1.00 0.00 H new ATOM 53 N GLN A 3 0.442 -6.597 -4.786 1.00 0.00 N ATOM 54 CA GLN A 3 -0.472 -6.176 -5.841 1.00 0.00 C ATOM 55 C GLN A 3 0.009 -6.662 -7.204 1.00 0.00 C ATOM 56 O GLN A 3 -0.768 -7.203 -7.992 1.00 0.00 O ATOM 57 CB GLN A 3 -0.608 -4.652 -5.849 1.00 0.00 C ATOM 58 CG GLN A 3 -0.585 -4.033 -4.461 1.00 0.00 C ATOM 59 CD GLN A 3 -1.593 -4.666 -3.522 1.00 0.00 C ATOM 60 OE1 GLN A 3 -2.802 -4.512 -3.695 1.00 0.00 O ATOM 61 NE2 GLN A 3 -1.099 -5.384 -2.520 1.00 0.00 N ATOM 0 H GLN A 3 1.030 -5.851 -4.415 1.00 0.00 H new ATOM 0 HA GLN A 3 -1.447 -6.620 -5.641 1.00 0.00 H new ATOM 0 HB2 GLN A 3 0.202 -4.226 -6.441 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -1.541 -4.381 -6.343 1.00 0.00 H new ATOM 0 HG2 GLN A 3 0.414 -4.136 -4.038 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -0.789 -2.965 -4.540 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -0.090 -5.485 -2.414 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -1.729 -5.834 -1.856 1.00 0.00 H new ATOM 70 N LEU A 4 1.295 -6.465 -7.477 1.00 0.00 N ATOM 71 CA LEU A 4 1.880 -6.883 -8.746 1.00 0.00 C ATOM 72 C LEU A 4 2.469 -8.286 -8.638 1.00 0.00 C ATOM 73 O LEU A 4 2.882 -8.876 -9.637 1.00 0.00 O ATOM 74 CB LEU A 4 2.964 -5.895 -9.180 1.00 0.00 C ATOM 75 CG LEU A 4 2.485 -4.677 -9.969 1.00 0.00 C ATOM 76 CD1 LEU A 4 2.089 -5.078 -11.382 1.00 0.00 C ATOM 77 CD2 LEU A 4 1.319 -4.005 -9.257 1.00 0.00 C ATOM 0 H LEU A 4 1.952 -6.019 -6.837 1.00 0.00 H new ATOM 0 HA LEU A 4 1.089 -6.898 -9.496 1.00 0.00 H new ATOM 0 HB2 LEU A 4 3.485 -5.544 -8.289 1.00 0.00 H new ATOM 0 HB3 LEU A 4 3.694 -6.431 -9.786 1.00 0.00 H new ATOM 0 HG LEU A 4 3.306 -3.963 -10.032 1.00 0.00 H new ATOM 0 HD11 LEU A 4 1.751 -4.198 -11.929 1.00 0.00 H new ATOM 0 HD12 LEU A 4 2.949 -5.513 -11.891 1.00 0.00 H new ATOM 0 HD13 LEU A 4 1.283 -5.811 -11.340 1.00 0.00 H new ATOM 0 HD21 LEU A 4 0.991 -3.140 -9.833 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.495 -4.712 -9.162 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.636 -3.682 -8.265 1.00 0.00 H new ATOM 89 N SER A 5 2.502 -8.817 -7.420 1.00 0.00 N ATOM 90 CA SER A 5 3.041 -10.150 -7.181 1.00 0.00 C ATOM 91 C SER A 5 2.420 -11.166 -8.134 1.00 0.00 C ATOM 92 O SER A 5 3.012 -12.206 -8.425 1.00 0.00 O ATOM 93 CB SER A 5 2.790 -10.573 -5.732 1.00 0.00 C ATOM 94 OG SER A 5 1.402 -10.635 -5.453 1.00 0.00 O ATOM 0 H SER A 5 2.161 -8.344 -6.583 1.00 0.00 H new ATOM 0 HA SER A 5 4.115 -10.118 -7.362 1.00 0.00 H new ATOM 0 HB2 SER A 5 3.245 -11.547 -5.550 1.00 0.00 H new ATOM 0 HB3 SER A 5 3.269 -9.866 -5.055 1.00 0.00 H new ATOM 0 HG SER A 5 0.992 -9.764 -5.637 1.00 0.00 H new ATOM 100 N LYS A 6 1.222 -10.858 -8.618 1.00 0.00 N ATOM 101 CA LYS A 6 0.518 -11.741 -9.540 1.00 0.00 C ATOM 102 C LYS A 6 1.445 -12.214 -10.655 1.00 0.00 C ATOM 103 O LYS A 6 1.338 -13.347 -11.127 1.00 0.00 O ATOM 104 CB LYS A 6 -0.694 -11.026 -10.140 1.00 0.00 C ATOM 105 CG LYS A 6 -1.505 -11.892 -11.089 1.00 0.00 C ATOM 106 CD LYS A 6 -2.289 -11.050 -12.081 1.00 0.00 C ATOM 107 CE LYS A 6 -3.359 -11.870 -12.784 1.00 0.00 C ATOM 108 NZ LYS A 6 -4.594 -11.994 -11.960 1.00 0.00 N ATOM 0 H LYS A 6 0.718 -10.002 -8.387 1.00 0.00 H new ATOM 0 HA LYS A 6 0.177 -12.612 -8.980 1.00 0.00 H new ATOM 0 HB2 LYS A 6 -1.340 -10.684 -9.332 1.00 0.00 H new ATOM 0 HB3 LYS A 6 -0.354 -10.138 -10.673 1.00 0.00 H new ATOM 0 HG2 LYS A 6 -0.838 -12.565 -11.629 1.00 0.00 H new ATOM 0 HG3 LYS A 6 -2.192 -12.515 -10.517 1.00 0.00 H new ATOM 0 HD2 LYS A 6 -2.754 -10.212 -11.561 1.00 0.00 H new ATOM 0 HD3 LYS A 6 -1.608 -10.628 -12.820 1.00 0.00 H new ATOM 0 HE2 LYS A 6 -3.605 -11.405 -13.739 1.00 0.00 H new ATOM 0 HE3 LYS A 6 -2.969 -12.863 -13.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 -5.299 -12.560 -12.474 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 -4.365 -12.461 -11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 -4.981 -11.048 -11.770 1.00 0.00 H new ATOM 122 N LEU A 7 2.356 -11.341 -11.071 1.00 0.00 N ATOM 123 CA LEU A 7 3.304 -11.670 -12.130 1.00 0.00 C ATOM 124 C LEU A 7 4.607 -12.206 -11.547 1.00 0.00 C ATOM 125 O LEU A 7 5.325 -12.967 -12.197 1.00 0.00 O ATOM 126 CB LEU A 7 3.585 -10.438 -12.991 1.00 0.00 C ATOM 127 CG LEU A 7 4.597 -10.625 -14.122 1.00 0.00 C ATOM 128 CD1 LEU A 7 4.295 -9.678 -15.272 1.00 0.00 C ATOM 129 CD2 LEU A 7 6.014 -10.410 -13.610 1.00 0.00 C ATOM 0 H LEU A 7 2.458 -10.400 -10.691 1.00 0.00 H new ATOM 0 HA LEU A 7 2.860 -12.447 -12.753 1.00 0.00 H new ATOM 0 HB2 LEU A 7 2.644 -10.101 -13.425 1.00 0.00 H new ATOM 0 HB3 LEU A 7 3.941 -9.639 -12.341 1.00 0.00 H new ATOM 0 HG LEU A 7 4.516 -11.648 -14.491 1.00 0.00 H new ATOM 0 HD11 LEU A 7 5.026 -9.826 -16.067 1.00 0.00 H new ATOM 0 HD12 LEU A 7 3.295 -9.880 -15.656 1.00 0.00 H new ATOM 0 HD13 LEU A 7 4.347 -8.648 -14.919 1.00 0.00 H new ATOM 0 HD21 LEU A 7 6.721 -10.547 -14.428 1.00 0.00 H new ATOM 0 HD22 LEU A 7 6.108 -9.399 -13.214 1.00 0.00 H new ATOM 0 HD23 LEU A 7 6.229 -11.130 -12.820 1.00 0.00 H new ATOM 141 N LYS A 8 4.908 -11.804 -10.317 1.00 0.00 N ATOM 142 CA LYS A 8 6.123 -12.246 -9.643 1.00 0.00 C ATOM 143 C LYS A 8 6.324 -13.748 -9.812 1.00 0.00 C ATOM 144 O LYS A 8 7.327 -14.190 -10.372 1.00 0.00 O ATOM 145 CB LYS A 8 6.063 -11.893 -8.155 1.00 0.00 C ATOM 146 CG LYS A 8 7.361 -12.160 -7.413 1.00 0.00 C ATOM 147 CD LYS A 8 7.113 -12.453 -5.943 1.00 0.00 C ATOM 148 CE LYS A 8 7.234 -13.939 -5.643 1.00 0.00 C ATOM 149 NZ LYS A 8 5.901 -14.584 -5.489 1.00 0.00 N ATOM 0 H LYS A 8 4.327 -11.172 -9.766 1.00 0.00 H new ATOM 0 HA LYS A 8 6.969 -11.731 -10.099 1.00 0.00 H new ATOM 0 HB2 LYS A 8 5.805 -10.839 -8.050 1.00 0.00 H new ATOM 0 HB3 LYS A 8 5.262 -12.465 -7.687 1.00 0.00 H new ATOM 0 HG2 LYS A 8 7.876 -13.004 -7.871 1.00 0.00 H new ATOM 0 HG3 LYS A 8 8.019 -11.296 -7.507 1.00 0.00 H new ATOM 0 HD2 LYS A 8 7.828 -11.899 -5.335 1.00 0.00 H new ATOM 0 HD3 LYS A 8 6.119 -12.104 -5.664 1.00 0.00 H new ATOM 0 HE2 LYS A 8 7.783 -14.428 -6.447 1.00 0.00 H new ATOM 0 HE3 LYS A 8 7.813 -14.079 -4.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 6.010 -15.618 -5.523 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 5.486 -14.309 -4.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 5.275 -14.276 -6.261 1.00 0.00 H new ATOM 163 N ARG A 9 5.364 -14.527 -9.325 1.00 0.00 N ATOM 164 CA ARG A 9 5.436 -15.980 -9.423 1.00 0.00 C ATOM 165 C ARG A 9 5.741 -16.414 -10.853 1.00 0.00 C ATOM 166 O ARG A 9 6.682 -17.171 -11.097 1.00 0.00 O ATOM 167 CB ARG A 9 4.123 -16.610 -8.956 1.00 0.00 C ATOM 168 CG ARG A 9 3.643 -16.092 -7.610 1.00 0.00 C ATOM 169 CD ARG A 9 2.463 -16.898 -7.091 1.00 0.00 C ATOM 170 NE ARG A 9 2.685 -17.383 -5.732 1.00 0.00 N ATOM 171 CZ ARG A 9 3.402 -18.463 -5.445 1.00 0.00 C ATOM 172 NH1 ARG A 9 3.963 -19.168 -6.418 1.00 0.00 N ATOM 173 NH2 ARG A 9 3.560 -18.841 -4.183 1.00 0.00 N ATOM 0 H ARG A 9 4.527 -14.177 -8.859 1.00 0.00 H new ATOM 0 HA ARG A 9 6.245 -16.323 -8.778 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.353 -16.421 -9.704 1.00 0.00 H new ATOM 0 HB3 ARG A 9 4.250 -17.691 -8.895 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.460 -16.136 -6.890 1.00 0.00 H new ATOM 0 HG3 ARG A 9 3.356 -15.044 -7.703 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.565 -16.281 -7.113 1.00 0.00 H new ATOM 0 HD3 ARG A 9 2.284 -17.745 -7.753 1.00 0.00 H new ATOM 0 HE ARG A 9 2.266 -16.864 -4.961 1.00 0.00 H new ATOM 0 HH11 ARG A 9 3.844 -18.881 -7.390 1.00 0.00 H new ATOM 0 HH12 ARG A 9 4.513 -19.997 -6.195 1.00 0.00 H new ATOM 0 HH21 ARG A 9 3.130 -18.302 -3.431 1.00 0.00 H new ATOM 0 HH22 ARG A 9 4.111 -19.671 -3.964 1.00 0.00 H new ATOM 187 N PHE A 10 4.939 -15.931 -11.796 1.00 0.00 N ATOM 188 CA PHE A 10 5.122 -16.271 -13.203 1.00 0.00 C ATOM 189 C PHE A 10 6.562 -16.021 -13.640 1.00 0.00 C ATOM 190 O PHE A 10 7.200 -16.886 -14.241 1.00 0.00 O ATOM 191 CB PHE A 10 4.164 -15.456 -14.074 1.00 0.00 C ATOM 192 CG PHE A 10 4.373 -15.660 -15.548 1.00 0.00 C ATOM 193 CD1 PHE A 10 5.337 -14.936 -16.231 1.00 0.00 C ATOM 194 CD2 PHE A 10 3.607 -16.577 -16.249 1.00 0.00 C ATOM 195 CE1 PHE A 10 5.530 -15.122 -17.587 1.00 0.00 C ATOM 196 CE2 PHE A 10 3.796 -16.767 -17.605 1.00 0.00 C ATOM 197 CZ PHE A 10 4.760 -16.039 -18.274 1.00 0.00 C ATOM 0 H PHE A 10 4.156 -15.303 -11.612 1.00 0.00 H new ATOM 0 HA PHE A 10 4.903 -17.331 -13.327 1.00 0.00 H new ATOM 0 HB2 PHE A 10 3.138 -15.723 -13.820 1.00 0.00 H new ATOM 0 HB3 PHE A 10 4.285 -14.398 -13.841 1.00 0.00 H new ATOM 0 HD1 PHE A 10 5.944 -14.219 -15.698 1.00 0.00 H new ATOM 0 HD2 PHE A 10 2.853 -17.150 -15.730 1.00 0.00 H new ATOM 0 HE1 PHE A 10 6.283 -14.550 -18.109 1.00 0.00 H new ATOM 0 HE2 PHE A 10 3.191 -17.484 -18.140 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.911 -16.187 -19.333 1.00 0.00 H new ATOM 207 N LEU A 11 7.069 -14.831 -13.334 1.00 0.00 N ATOM 208 CA LEU A 11 8.434 -14.465 -13.695 1.00 0.00 C ATOM 209 C LEU A 11 9.439 -15.428 -13.071 1.00 0.00 C ATOM 210 O LEU A 11 10.323 -15.950 -13.752 1.00 0.00 O ATOM 211 CB LEU A 11 8.735 -13.034 -13.246 1.00 0.00 C ATOM 212 CG LEU A 11 9.496 -12.163 -14.246 1.00 0.00 C ATOM 213 CD1 LEU A 11 10.858 -12.767 -14.553 1.00 0.00 C ATOM 214 CD2 LEU A 11 8.688 -11.989 -15.524 1.00 0.00 C ATOM 0 H LEU A 11 6.555 -14.104 -12.837 1.00 0.00 H new ATOM 0 HA LEU A 11 8.526 -14.526 -14.779 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.791 -12.542 -13.011 1.00 0.00 H new ATOM 0 HB3 LEU A 11 9.310 -13.078 -12.321 1.00 0.00 H new ATOM 0 HG LEU A 11 9.650 -11.181 -13.799 1.00 0.00 H new ATOM 0 HD11 LEU A 11 11.385 -12.133 -15.266 1.00 0.00 H new ATOM 0 HD12 LEU A 11 11.439 -12.840 -13.634 1.00 0.00 H new ATOM 0 HD13 LEU A 11 10.727 -13.762 -14.979 1.00 0.00 H new ATOM 0 HD21 LEU A 11 9.245 -11.366 -16.224 1.00 0.00 H new ATOM 0 HD22 LEU A 11 8.503 -12.965 -15.973 1.00 0.00 H new ATOM 0 HD23 LEU A 11 7.737 -11.511 -15.291 1.00 0.00 H new ATOM 226 N THR A 12 9.297 -15.662 -11.770 1.00 0.00 N ATOM 227 CA THR A 12 10.191 -16.563 -11.053 1.00 0.00 C ATOM 228 C THR A 12 10.298 -17.909 -11.761 1.00 0.00 C ATOM 229 O THR A 12 11.381 -18.318 -12.181 1.00 0.00 O ATOM 230 CB THR A 12 9.716 -16.793 -9.606 1.00 0.00 C ATOM 231 OG1 THR A 12 9.665 -15.547 -8.903 1.00 0.00 O ATOM 232 CG2 THR A 12 10.643 -17.754 -8.878 1.00 0.00 C ATOM 0 H THR A 12 8.571 -15.240 -11.191 1.00 0.00 H new ATOM 0 HA THR A 12 11.171 -16.086 -11.034 1.00 0.00 H new ATOM 0 HB THR A 12 8.719 -17.231 -9.640 1.00 0.00 H new ATOM 0 HG1 THR A 12 8.917 -15.011 -9.241 1.00 0.00 H new ATOM 0 HG21 THR A 12 10.287 -17.901 -7.858 1.00 0.00 H new ATOM 0 HG22 THR A 12 10.656 -18.711 -9.399 1.00 0.00 H new ATOM 0 HG23 THR A 12 11.651 -17.340 -8.854 1.00 0.00 H new ATOM 240 N THR A 13 9.167 -18.596 -11.890 1.00 0.00 N ATOM 241 CA THR A 13 9.134 -19.897 -12.547 1.00 0.00 C ATOM 242 C THR A 13 9.534 -19.783 -14.013 1.00 0.00 C ATOM 243 O THR A 13 10.104 -20.713 -14.586 1.00 0.00 O ATOM 244 CB THR A 13 7.736 -20.537 -12.456 1.00 0.00 C ATOM 245 OG1 THR A 13 7.730 -21.800 -13.130 1.00 0.00 O ATOM 246 CG2 THR A 13 6.683 -19.625 -13.068 1.00 0.00 C ATOM 0 H THR A 13 8.262 -18.273 -11.548 1.00 0.00 H new ATOM 0 HA THR A 13 9.851 -20.532 -12.026 1.00 0.00 H new ATOM 0 HB THR A 13 7.497 -20.687 -11.403 1.00 0.00 H new ATOM 0 HG1 THR A 13 6.838 -22.201 -13.066 1.00 0.00 H new ATOM 0 HG21 THR A 13 5.704 -20.098 -12.992 1.00 0.00 H new ATOM 0 HG22 THR A 13 6.670 -18.675 -12.534 1.00 0.00 H new ATOM 0 HG23 THR A 13 6.920 -19.448 -14.117 1.00 0.00 H new ATOM 254 N LEU A 14 9.232 -18.638 -14.616 1.00 0.00 N ATOM 255 CA LEU A 14 9.562 -18.402 -16.018 1.00 0.00 C ATOM 256 C LEU A 14 11.072 -18.416 -16.233 1.00 0.00 C ATOM 257 O LEU A 14 11.562 -18.964 -17.219 1.00 0.00 O ATOM 258 CB LEU A 14 8.982 -17.064 -16.480 1.00 0.00 C ATOM 259 CG LEU A 14 9.601 -16.464 -17.743 1.00 0.00 C ATOM 260 CD1 LEU A 14 8.544 -15.743 -18.565 1.00 0.00 C ATOM 261 CD2 LEU A 14 10.737 -15.518 -17.382 1.00 0.00 C ATOM 0 H LEU A 14 8.760 -17.859 -14.157 1.00 0.00 H new ATOM 0 HA LEU A 14 9.123 -19.206 -16.609 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.913 -17.193 -16.650 1.00 0.00 H new ATOM 0 HB3 LEU A 14 9.091 -16.344 -15.669 1.00 0.00 H new ATOM 0 HG LEU A 14 10.009 -17.275 -18.346 1.00 0.00 H new ATOM 0 HD11 LEU A 14 9.003 -15.323 -19.460 1.00 0.00 H new ATOM 0 HD12 LEU A 14 7.765 -16.448 -18.854 1.00 0.00 H new ATOM 0 HD13 LEU A 14 8.106 -14.941 -17.971 1.00 0.00 H new ATOM 0 HD21 LEU A 14 11.166 -15.100 -18.293 1.00 0.00 H new ATOM 0 HD22 LEU A 14 10.354 -14.711 -16.758 1.00 0.00 H new ATOM 0 HD23 LEU A 14 11.506 -16.065 -16.836 1.00 0.00 H new ATOM 273 N GLN A 15 11.802 -17.812 -15.301 1.00 0.00 N ATOM 274 CA GLN A 15 13.257 -17.758 -15.388 1.00 0.00 C ATOM 275 C GLN A 15 13.883 -19.043 -14.857 1.00 0.00 C ATOM 276 O GLN A 15 14.956 -19.450 -15.300 1.00 0.00 O ATOM 277 CB GLN A 15 13.791 -16.555 -14.607 1.00 0.00 C ATOM 278 CG GLN A 15 13.485 -16.612 -13.119 1.00 0.00 C ATOM 279 CD GLN A 15 14.257 -15.577 -12.325 1.00 0.00 C ATOM 280 OE1 GLN A 15 13.698 -14.377 -12.216 1.00 0.00 O flip ATOM 281 NE2 GLN A 15 15.343 -15.852 -11.815 1.00 0.00 N flip ATOM 0 H GLN A 15 11.411 -17.354 -14.478 1.00 0.00 H new ATOM 0 HA GLN A 15 13.529 -17.651 -16.438 1.00 0.00 H new ATOM 0 HB2 GLN A 15 14.870 -16.492 -14.745 1.00 0.00 H new ATOM 0 HB3 GLN A 15 13.363 -15.643 -15.023 1.00 0.00 H new ATOM 0 HG2 GLN A 15 12.417 -16.460 -12.965 1.00 0.00 H new ATOM 0 HG3 GLN A 15 13.723 -17.606 -12.741 1.00 0.00 H new ATOM 0 HE21 GLN A 15 15.735 -16.787 -11.924 1.00 0.00 H new ATOM 0 HE22 GLN A 15 15.850 -15.145 -11.283 1.00 0.00 H new ATOM 290 N GLN A 16 13.205 -19.676 -13.905 1.00 0.00 N ATOM 291 CA GLN A 16 13.696 -20.915 -13.313 1.00 0.00 C ATOM 292 C GLN A 16 13.561 -22.077 -14.292 1.00 0.00 C ATOM 293 O GLN A 16 14.516 -22.817 -14.528 1.00 0.00 O ATOM 294 CB GLN A 16 12.933 -21.226 -12.024 1.00 0.00 C ATOM 295 CG GLN A 16 13.127 -20.183 -10.936 1.00 0.00 C ATOM 296 CD GLN A 16 14.051 -20.657 -9.831 1.00 0.00 C ATOM 297 OE1 GLN A 16 13.624 -21.339 -8.899 1.00 0.00 O ATOM 298 NE2 GLN A 16 15.326 -20.298 -9.930 1.00 0.00 N ATOM 0 H GLN A 16 12.315 -19.352 -13.527 1.00 0.00 H new ATOM 0 HA GLN A 16 14.752 -20.783 -13.078 1.00 0.00 H new ATOM 0 HB2 GLN A 16 11.870 -21.308 -12.252 1.00 0.00 H new ATOM 0 HB3 GLN A 16 13.254 -22.197 -11.647 1.00 0.00 H new ATOM 0 HG2 GLN A 16 13.533 -19.273 -11.378 1.00 0.00 H new ATOM 0 HG3 GLN A 16 12.158 -19.925 -10.509 1.00 0.00 H new ATOM 0 HE21 GLN A 16 15.637 -19.732 -10.720 1.00 0.00 H new ATOM 0 HE22 GLN A 16 15.994 -20.588 -9.216 1.00 0.00 H new ATOM 307 N PHE A 17 12.368 -22.232 -14.857 1.00 0.00 N ATOM 308 CA PHE A 17 12.107 -23.305 -15.809 1.00 0.00 C ATOM 309 C PHE A 17 12.451 -22.867 -17.230 1.00 0.00 C ATOM 310 O PHE A 17 12.450 -23.675 -18.158 1.00 0.00 O ATOM 311 CB PHE A 17 10.640 -23.734 -15.737 1.00 0.00 C ATOM 312 CG PHE A 17 10.455 -25.222 -15.655 1.00 0.00 C ATOM 313 CD1 PHE A 17 10.778 -25.912 -14.498 1.00 0.00 C ATOM 314 CD2 PHE A 17 9.957 -25.932 -16.736 1.00 0.00 C ATOM 315 CE1 PHE A 17 10.608 -27.281 -14.419 1.00 0.00 C ATOM 316 CE2 PHE A 17 9.785 -27.301 -16.663 1.00 0.00 C ATOM 317 CZ PHE A 17 10.112 -27.977 -15.504 1.00 0.00 C ATOM 0 H PHE A 17 11.567 -21.628 -14.672 1.00 0.00 H new ATOM 0 HA PHE A 17 12.740 -24.153 -15.545 1.00 0.00 H new ATOM 0 HB2 PHE A 17 10.176 -23.270 -14.867 1.00 0.00 H new ATOM 0 HB3 PHE A 17 10.116 -23.358 -16.616 1.00 0.00 H new ATOM 0 HD1 PHE A 17 11.168 -25.373 -13.647 1.00 0.00 H new ATOM 0 HD2 PHE A 17 9.700 -25.409 -17.646 1.00 0.00 H new ATOM 0 HE1 PHE A 17 10.863 -27.806 -13.510 1.00 0.00 H new ATOM 0 HE2 PHE A 17 9.395 -27.842 -17.512 1.00 0.00 H new ATOM 0 HZ PHE A 17 9.980 -29.047 -15.446 1.00 0.00 H new ATOM 327 N GLY A 18 12.746 -21.581 -17.392 1.00 0.00 N ATOM 328 CA GLY A 18 13.087 -21.057 -18.701 1.00 0.00 C ATOM 329 C GLY A 18 14.251 -21.792 -19.335 1.00 0.00 C ATOM 330 O GLY A 18 14.408 -21.786 -20.555 1.00 0.00 O ATOM 0 H GLY A 18 12.755 -20.893 -16.639 1.00 0.00 H new ATOM 0 HA2 GLY A 18 12.218 -21.127 -19.355 1.00 0.00 H new ATOM 0 HA3 GLY A 18 13.334 -19.999 -18.612 1.00 0.00 H new ATOM 334 N ASN A 19 15.071 -22.427 -18.503 1.00 0.00 N ATOM 335 CA ASN A 19 16.228 -23.169 -18.989 1.00 0.00 C ATOM 336 C ASN A 19 15.825 -24.567 -19.449 1.00 0.00 C ATOM 337 O ASN A 19 16.576 -25.241 -20.154 1.00 0.00 O ATOM 338 CB ASN A 19 17.293 -23.268 -17.895 1.00 0.00 C ATOM 339 CG ASN A 19 18.291 -24.379 -18.158 1.00 0.00 C ATOM 340 OD1 ASN A 19 18.079 -25.526 -17.764 1.00 0.00 O ATOM 341 ND2 ASN A 19 19.388 -24.043 -18.827 1.00 0.00 N ATOM 0 H ASN A 19 14.955 -22.442 -17.490 1.00 0.00 H new ATOM 0 HA ASN A 19 16.641 -22.630 -19.842 1.00 0.00 H new ATOM 0 HB2 ASN A 19 17.822 -22.318 -17.820 1.00 0.00 H new ATOM 0 HB3 ASN A 19 16.808 -23.439 -16.934 1.00 0.00 H new ATOM 0 HD21 ASN A 19 20.096 -24.748 -19.033 1.00 0.00 H new ATOM 0 HD22 ASN A 19 19.523 -23.080 -19.135 1.00 0.00 H new ATOM 348 N ASP A 20 14.633 -24.995 -19.046 1.00 0.00 N ATOM 349 CA ASP A 20 14.128 -26.312 -19.418 1.00 0.00 C ATOM 350 C ASP A 20 13.457 -26.269 -20.787 1.00 0.00 C ATOM 351 O ASP A 20 13.707 -27.123 -21.639 1.00 0.00 O ATOM 352 CB ASP A 20 13.139 -26.818 -18.367 1.00 0.00 C ATOM 353 CG ASP A 20 13.099 -28.331 -18.291 1.00 0.00 C ATOM 354 OD1 ASP A 20 12.734 -28.967 -19.302 1.00 0.00 O ATOM 355 OD2 ASP A 20 13.433 -28.880 -17.220 1.00 0.00 O ATOM 0 H ASP A 20 13.999 -24.449 -18.462 1.00 0.00 H new ATOM 0 HA ASP A 20 14.974 -26.998 -19.469 1.00 0.00 H new ATOM 0 HB2 ASP A 20 13.412 -26.415 -17.392 1.00 0.00 H new ATOM 0 HB3 ASP A 20 12.143 -26.442 -18.599 1.00 0.00 H new ATOM 360 N ILE A 21 12.603 -25.272 -20.991 1.00 0.00 N ATOM 361 CA ILE A 21 11.896 -25.119 -22.256 1.00 0.00 C ATOM 362 C ILE A 21 12.860 -25.182 -23.436 1.00 0.00 C ATOM 363 O ILE A 21 12.546 -25.758 -24.478 1.00 0.00 O ATOM 364 CB ILE A 21 11.121 -23.789 -22.311 1.00 0.00 C ATOM 365 CG1 ILE A 21 10.600 -23.535 -23.727 1.00 0.00 C ATOM 366 CG2 ILE A 21 12.008 -22.641 -21.853 1.00 0.00 C ATOM 367 CD1 ILE A 21 9.784 -22.268 -23.853 1.00 0.00 C ATOM 0 H ILE A 21 12.384 -24.558 -20.296 1.00 0.00 H new ATOM 0 HA ILE A 21 11.188 -25.945 -22.324 1.00 0.00 H new ATOM 0 HB ILE A 21 10.267 -23.854 -21.637 1.00 0.00 H new ATOM 0 HG12 ILE A 21 11.446 -23.482 -24.412 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.990 -24.383 -24.038 1.00 0.00 H new ATOM 0 HG21 ILE A 21 11.447 -21.708 -21.897 1.00 0.00 H new ATOM 0 HG22 ILE A 21 12.335 -22.820 -20.829 1.00 0.00 H new ATOM 0 HG23 ILE A 21 12.879 -22.572 -22.505 1.00 0.00 H new ATOM 0 HD11 ILE A 21 9.448 -22.153 -24.883 1.00 0.00 H new ATOM 0 HD12 ILE A 21 8.918 -22.326 -23.193 1.00 0.00 H new ATOM 0 HD13 ILE A 21 10.397 -21.411 -23.573 1.00 0.00 H new ATOM 379 N SER A 22 14.036 -24.587 -23.265 1.00 0.00 N ATOM 380 CA SER A 22 15.046 -24.574 -24.316 1.00 0.00 C ATOM 381 C SER A 22 16.277 -23.787 -23.876 1.00 0.00 C ATOM 382 O SER A 22 16.230 -22.979 -22.949 1.00 0.00 O ATOM 383 CB SER A 22 14.471 -23.968 -25.598 1.00 0.00 C ATOM 384 OG SER A 22 14.474 -24.912 -26.654 1.00 0.00 O ATOM 0 H SER A 22 14.313 -24.108 -22.408 1.00 0.00 H new ATOM 0 HA SER A 22 15.345 -25.604 -24.512 1.00 0.00 H new ATOM 0 HB2 SER A 22 13.453 -23.624 -25.416 1.00 0.00 H new ATOM 0 HB3 SER A 22 15.056 -23.094 -25.885 1.00 0.00 H new ATOM 0 HG SER A 22 13.837 -25.629 -26.454 1.00 0.00 H new ATOM 390 N PRO A 23 17.407 -24.029 -24.557 1.00 0.00 N ATOM 391 CA PRO A 23 18.673 -23.354 -24.256 1.00 0.00 C ATOM 392 C PRO A 23 18.646 -21.877 -24.633 1.00 0.00 C ATOM 393 O PRO A 23 18.970 -21.013 -23.819 1.00 0.00 O ATOM 394 CB PRO A 23 19.690 -24.107 -25.117 1.00 0.00 C ATOM 395 CG PRO A 23 18.893 -24.668 -26.243 1.00 0.00 C ATOM 396 CD PRO A 23 17.536 -24.980 -25.674 1.00 0.00 C ATOM 0 HA PRO A 23 18.901 -23.371 -23.190 1.00 0.00 H new ATOM 0 HB2 PRO A 23 20.472 -23.440 -25.480 1.00 0.00 H new ATOM 0 HB3 PRO A 23 20.182 -24.896 -24.549 1.00 0.00 H new ATOM 0 HG2 PRO A 23 18.818 -23.953 -27.062 1.00 0.00 H new ATOM 0 HG3 PRO A 23 19.363 -25.565 -26.645 1.00 0.00 H new ATOM 0 HD2 PRO A 23 16.748 -24.840 -26.414 1.00 0.00 H new ATOM 0 HD3 PRO A 23 17.472 -26.013 -25.332 1.00 0.00 H new ATOM 404 N GLU A 24 18.257 -21.594 -25.873 1.00 0.00 N ATOM 405 CA GLU A 24 18.189 -20.220 -26.357 1.00 0.00 C ATOM 406 C GLU A 24 17.317 -19.364 -25.442 1.00 0.00 C ATOM 407 O GLU A 24 17.813 -18.478 -24.746 1.00 0.00 O ATOM 408 CB GLU A 24 17.638 -20.185 -27.784 1.00 0.00 C ATOM 409 CG GLU A 24 16.645 -21.297 -28.080 1.00 0.00 C ATOM 410 CD GLU A 24 15.448 -20.813 -28.875 1.00 0.00 C ATOM 411 OE1 GLU A 24 14.652 -20.021 -28.328 1.00 0.00 O ATOM 412 OE2 GLU A 24 15.308 -21.226 -30.046 1.00 0.00 O ATOM 0 H GLU A 24 17.985 -22.297 -26.560 1.00 0.00 H new ATOM 0 HA GLU A 24 19.199 -19.811 -26.355 1.00 0.00 H new ATOM 0 HB2 GLU A 24 17.155 -19.223 -27.955 1.00 0.00 H new ATOM 0 HB3 GLU A 24 18.468 -20.254 -28.487 1.00 0.00 H new ATOM 0 HG2 GLU A 24 17.148 -22.090 -28.634 1.00 0.00 H new ATOM 0 HG3 GLU A 24 16.301 -21.732 -27.141 1.00 0.00 H new ATOM 419 N ILE A 25 16.017 -19.635 -25.451 1.00 0.00 N ATOM 420 CA ILE A 25 15.076 -18.891 -24.623 1.00 0.00 C ATOM 421 C ILE A 25 15.518 -18.879 -23.164 1.00 0.00 C ATOM 422 O ILE A 25 15.308 -17.900 -22.448 1.00 0.00 O ATOM 423 CB ILE A 25 13.657 -19.482 -24.713 1.00 0.00 C ATOM 424 CG1 ILE A 25 12.672 -18.625 -23.914 1.00 0.00 C ATOM 425 CG2 ILE A 25 13.648 -20.917 -24.208 1.00 0.00 C ATOM 426 CD1 ILE A 25 12.830 -17.140 -24.157 1.00 0.00 C ATOM 0 H ILE A 25 15.591 -20.364 -26.023 1.00 0.00 H new ATOM 0 HA ILE A 25 15.060 -17.870 -25.004 1.00 0.00 H new ATOM 0 HB ILE A 25 13.345 -19.482 -25.758 1.00 0.00 H new ATOM 0 HG12 ILE A 25 11.655 -18.921 -24.170 1.00 0.00 H new ATOM 0 HG13 ILE A 25 12.805 -18.828 -22.851 1.00 0.00 H new ATOM 0 HG21 ILE A 25 12.638 -21.321 -24.278 1.00 0.00 H new ATOM 0 HG22 ILE A 25 14.323 -21.520 -24.815 1.00 0.00 H new ATOM 0 HG23 ILE A 25 13.976 -20.939 -23.169 1.00 0.00 H new ATOM 0 HD11 ILE A 25 12.100 -16.594 -23.559 1.00 0.00 H new ATOM 0 HD12 ILE A 25 13.836 -16.830 -23.874 1.00 0.00 H new ATOM 0 HD13 ILE A 25 12.667 -16.925 -25.213 1.00 0.00 H new ATOM 438 N GLY A 26 16.134 -19.974 -22.729 1.00 0.00 N ATOM 439 CA GLY A 26 16.599 -20.068 -21.357 1.00 0.00 C ATOM 440 C GLY A 26 17.639 -19.017 -21.023 1.00 0.00 C ATOM 441 O GLY A 26 17.387 -18.121 -20.219 1.00 0.00 O ATOM 0 H GLY A 26 16.319 -20.797 -23.302 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.750 -19.962 -20.681 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.021 -21.059 -21.187 1.00 0.00 H new ATOM 445 N GLU A 27 18.810 -19.129 -21.641 1.00 0.00 N ATOM 446 CA GLU A 27 19.893 -18.181 -21.403 1.00 0.00 C ATOM 447 C GLU A 27 19.398 -16.744 -21.543 1.00 0.00 C ATOM 448 O GLU A 27 19.778 -15.867 -20.767 1.00 0.00 O ATOM 449 CB GLU A 27 21.045 -18.433 -22.377 1.00 0.00 C ATOM 450 CG GLU A 27 20.658 -18.262 -23.836 1.00 0.00 C ATOM 451 CD GLU A 27 21.816 -18.514 -24.781 1.00 0.00 C ATOM 452 OE1 GLU A 27 22.899 -18.909 -24.301 1.00 0.00 O ATOM 453 OE2 GLU A 27 21.640 -18.316 -26.001 1.00 0.00 O ATOM 0 H GLU A 27 19.034 -19.866 -22.310 1.00 0.00 H new ATOM 0 HA GLU A 27 20.251 -18.326 -20.384 1.00 0.00 H new ATOM 0 HB2 GLU A 27 21.862 -17.750 -22.144 1.00 0.00 H new ATOM 0 HB3 GLU A 27 21.422 -19.444 -22.226 1.00 0.00 H new ATOM 0 HG2 GLU A 27 19.844 -18.947 -24.074 1.00 0.00 H new ATOM 0 HG3 GLU A 27 20.281 -17.251 -23.992 1.00 0.00 H new ATOM 460 N ARG A 28 18.549 -16.512 -22.539 1.00 0.00 N ATOM 461 CA ARG A 28 18.004 -15.182 -22.783 1.00 0.00 C ATOM 462 C ARG A 28 17.099 -14.746 -21.635 1.00 0.00 C ATOM 463 O ARG A 28 17.345 -13.728 -20.988 1.00 0.00 O ATOM 464 CB ARG A 28 17.223 -15.161 -24.098 1.00 0.00 C ATOM 465 CG ARG A 28 17.456 -13.907 -24.926 1.00 0.00 C ATOM 466 CD ARG A 28 18.612 -14.088 -25.897 1.00 0.00 C ATOM 467 NE ARG A 28 19.507 -12.934 -25.903 1.00 0.00 N ATOM 468 CZ ARG A 28 20.343 -12.657 -26.897 1.00 0.00 C ATOM 469 NH1 ARG A 28 20.398 -13.447 -27.961 1.00 0.00 N ATOM 470 NH2 ARG A 28 21.127 -11.588 -26.829 1.00 0.00 N ATOM 0 H ARG A 28 18.224 -17.227 -23.189 1.00 0.00 H new ATOM 0 HA ARG A 28 18.837 -14.483 -22.852 1.00 0.00 H new ATOM 0 HB2 ARG A 28 17.501 -16.033 -24.690 1.00 0.00 H new ATOM 0 HB3 ARG A 28 16.159 -15.249 -23.880 1.00 0.00 H new ATOM 0 HG2 ARG A 28 16.550 -13.661 -25.479 1.00 0.00 H new ATOM 0 HG3 ARG A 28 17.663 -13.066 -24.264 1.00 0.00 H new ATOM 0 HD2 ARG A 28 19.175 -14.982 -25.628 1.00 0.00 H new ATOM 0 HD3 ARG A 28 18.220 -14.248 -26.901 1.00 0.00 H new ATOM 0 HE ARG A 28 19.489 -12.306 -25.099 1.00 0.00 H new ATOM 0 HH11 ARG A 28 19.797 -14.269 -28.017 1.00 0.00 H new ATOM 0 HH12 ARG A 28 21.041 -13.232 -28.723 1.00 0.00 H new ATOM 0 HH21 ARG A 28 21.088 -10.978 -26.012 1.00 0.00 H new ATOM 0 HH22 ARG A 28 21.769 -11.377 -27.593 1.00 0.00 H new ATOM 484 N VAL A 29 16.050 -15.524 -21.387 1.00 0.00 N ATOM 485 CA VAL A 29 15.108 -15.219 -20.317 1.00 0.00 C ATOM 486 C VAL A 29 15.838 -14.818 -19.040 1.00 0.00 C ATOM 487 O VAL A 29 15.636 -13.723 -18.515 1.00 0.00 O ATOM 488 CB VAL A 29 14.193 -16.421 -20.016 1.00 0.00 C ATOM 489 CG1 VAL A 29 13.604 -16.307 -18.617 1.00 0.00 C ATOM 490 CG2 VAL A 29 13.091 -16.526 -21.059 1.00 0.00 C ATOM 0 H VAL A 29 15.831 -16.370 -21.913 1.00 0.00 H new ATOM 0 HA VAL A 29 14.498 -14.384 -20.661 1.00 0.00 H new ATOM 0 HB VAL A 29 14.792 -17.331 -20.060 1.00 0.00 H new ATOM 0 HG11 VAL A 29 12.960 -17.165 -18.422 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.410 -16.284 -17.884 1.00 0.00 H new ATOM 0 HG13 VAL A 29 13.019 -15.390 -18.542 1.00 0.00 H new ATOM 0 HG21 VAL A 29 12.454 -17.381 -20.831 1.00 0.00 H new ATOM 0 HG22 VAL A 29 12.493 -15.615 -21.049 1.00 0.00 H new ATOM 0 HG23 VAL A 29 13.535 -16.658 -22.046 1.00 0.00 H new ATOM 500 N ARG A 30 16.688 -15.712 -18.545 1.00 0.00 N ATOM 501 CA ARG A 30 17.448 -15.451 -17.329 1.00 0.00 C ATOM 502 C ARG A 30 18.328 -14.215 -17.492 1.00 0.00 C ATOM 503 O ARG A 30 18.393 -13.364 -16.604 1.00 0.00 O ATOM 504 CB ARG A 30 18.313 -16.662 -16.973 1.00 0.00 C ATOM 505 CG ARG A 30 19.314 -17.034 -18.055 1.00 0.00 C ATOM 506 CD ARG A 30 19.780 -18.475 -17.910 1.00 0.00 C ATOM 507 NE ARG A 30 20.051 -18.825 -16.518 1.00 0.00 N ATOM 508 CZ ARG A 30 20.177 -20.075 -16.087 1.00 0.00 C ATOM 509 NH1 ARG A 30 20.058 -21.088 -16.934 1.00 0.00 N ATOM 510 NH2 ARG A 30 20.423 -20.314 -14.805 1.00 0.00 N ATOM 0 H ARG A 30 16.867 -16.623 -18.967 1.00 0.00 H new ATOM 0 HA ARG A 30 16.740 -15.268 -16.521 1.00 0.00 H new ATOM 0 HB2 ARG A 30 18.851 -16.454 -16.048 1.00 0.00 H new ATOM 0 HB3 ARG A 30 17.665 -17.517 -16.780 1.00 0.00 H new ATOM 0 HG2 ARG A 30 18.860 -16.894 -19.036 1.00 0.00 H new ATOM 0 HG3 ARG A 30 20.173 -16.365 -18.003 1.00 0.00 H new ATOM 0 HD2 ARG A 30 19.019 -19.144 -18.310 1.00 0.00 H new ATOM 0 HD3 ARG A 30 20.681 -18.626 -18.504 1.00 0.00 H new ATOM 0 HE ARG A 30 20.149 -18.069 -15.841 1.00 0.00 H new ATOM 0 HH11 ARG A 30 19.869 -20.909 -17.920 1.00 0.00 H new ATOM 0 HH12 ARG A 30 20.155 -22.047 -16.599 1.00 0.00 H new ATOM 0 HH21 ARG A 30 20.515 -19.538 -14.150 1.00 0.00 H new ATOM 0 HH22 ARG A 30 20.520 -21.274 -14.475 1.00 0.00 H new ATOM 524 N THR A 31 19.004 -14.123 -18.632 1.00 0.00 N ATOM 525 CA THR A 31 19.881 -12.992 -18.911 1.00 0.00 C ATOM 526 C THR A 31 19.140 -11.670 -18.754 1.00 0.00 C ATOM 527 O THR A 31 19.545 -10.809 -17.971 1.00 0.00 O ATOM 528 CB THR A 31 20.467 -13.074 -20.334 1.00 0.00 C ATOM 529 OG1 THR A 31 21.513 -14.050 -20.378 1.00 0.00 O ATOM 530 CG2 THR A 31 21.009 -11.722 -20.774 1.00 0.00 C ATOM 0 H THR A 31 18.961 -14.818 -19.378 1.00 0.00 H new ATOM 0 HA THR A 31 20.695 -13.037 -18.187 1.00 0.00 H new ATOM 0 HB THR A 31 19.669 -13.368 -21.016 1.00 0.00 H new ATOM 0 HG1 THR A 31 21.124 -14.948 -20.335 1.00 0.00 H new ATOM 0 HG21 THR A 31 21.418 -11.804 -21.781 1.00 0.00 H new ATOM 0 HG22 THR A 31 20.204 -10.988 -20.768 1.00 0.00 H new ATOM 0 HG23 THR A 31 21.795 -11.404 -20.089 1.00 0.00 H new ATOM 538 N LEU A 32 18.053 -11.514 -19.501 1.00 0.00 N ATOM 539 CA LEU A 32 17.254 -10.294 -19.443 1.00 0.00 C ATOM 540 C LEU A 32 16.704 -10.069 -18.038 1.00 0.00 C ATOM 541 O LEU A 32 16.953 -9.033 -17.422 1.00 0.00 O ATOM 542 CB LEU A 32 16.103 -10.368 -20.448 1.00 0.00 C ATOM 543 CG LEU A 32 16.455 -10.910 -21.834 1.00 0.00 C ATOM 544 CD1 LEU A 32 15.367 -10.558 -22.837 1.00 0.00 C ATOM 545 CD2 LEU A 32 17.801 -10.369 -22.292 1.00 0.00 C ATOM 0 H LEU A 32 17.704 -12.216 -20.154 1.00 0.00 H new ATOM 0 HA LEU A 32 17.899 -9.453 -19.699 1.00 0.00 H new ATOM 0 HB2 LEU A 32 15.317 -10.993 -20.024 1.00 0.00 H new ATOM 0 HB3 LEU A 32 15.686 -9.368 -20.566 1.00 0.00 H new ATOM 0 HG LEU A 32 16.525 -11.996 -21.772 1.00 0.00 H new ATOM 0 HD11 LEU A 32 15.635 -10.952 -23.817 1.00 0.00 H new ATOM 0 HD12 LEU A 32 14.421 -10.995 -22.516 1.00 0.00 H new ATOM 0 HD13 LEU A 32 15.264 -9.475 -22.897 1.00 0.00 H new ATOM 0 HD21 LEU A 32 18.035 -10.765 -23.280 1.00 0.00 H new ATOM 0 HD22 LEU A 32 17.759 -9.281 -22.338 1.00 0.00 H new ATOM 0 HD23 LEU A 32 18.574 -10.673 -21.587 1.00 0.00 H new ATOM 557 N VAL A 33 15.957 -11.048 -17.537 1.00 0.00 N ATOM 558 CA VAL A 33 15.374 -10.958 -16.203 1.00 0.00 C ATOM 559 C VAL A 33 16.421 -10.550 -15.173 1.00 0.00 C ATOM 560 O VAL A 33 16.408 -9.425 -14.670 1.00 0.00 O ATOM 561 CB VAL A 33 14.743 -12.296 -15.775 1.00 0.00 C ATOM 562 CG1 VAL A 33 14.256 -12.221 -14.337 1.00 0.00 C ATOM 563 CG2 VAL A 33 13.606 -12.673 -16.713 1.00 0.00 C ATOM 0 H VAL A 33 15.741 -11.912 -18.034 1.00 0.00 H new ATOM 0 HA VAL A 33 14.596 -10.196 -16.248 1.00 0.00 H new ATOM 0 HB VAL A 33 15.505 -13.073 -15.835 1.00 0.00 H new ATOM 0 HG11 VAL A 33 13.813 -13.176 -14.053 1.00 0.00 H new ATOM 0 HG12 VAL A 33 15.097 -12.001 -13.679 1.00 0.00 H new ATOM 0 HG13 VAL A 33 13.508 -11.433 -14.247 1.00 0.00 H new ATOM 0 HG21 VAL A 33 13.172 -13.621 -16.396 1.00 0.00 H new ATOM 0 HG22 VAL A 33 12.841 -11.897 -16.688 1.00 0.00 H new ATOM 0 HG23 VAL A 33 13.990 -12.772 -17.729 1.00 0.00 H new ATOM 573 N LEU A 34 17.328 -11.470 -14.862 1.00 0.00 N ATOM 574 CA LEU A 34 18.384 -11.206 -13.891 1.00 0.00 C ATOM 575 C LEU A 34 19.133 -9.924 -14.237 1.00 0.00 C ATOM 576 O LEU A 34 19.575 -9.193 -13.351 1.00 0.00 O ATOM 577 CB LEU A 34 19.360 -12.382 -13.838 1.00 0.00 C ATOM 578 CG LEU A 34 18.733 -13.769 -13.684 1.00 0.00 C ATOM 579 CD1 LEU A 34 19.782 -14.853 -13.877 1.00 0.00 C ATOM 580 CD2 LEU A 34 18.067 -13.905 -12.323 1.00 0.00 C ATOM 0 H LEU A 34 17.353 -12.405 -15.268 1.00 0.00 H new ATOM 0 HA LEU A 34 17.921 -11.081 -12.912 1.00 0.00 H new ATOM 0 HB2 LEU A 34 19.957 -12.374 -14.750 1.00 0.00 H new ATOM 0 HB3 LEU A 34 20.046 -12.221 -13.007 1.00 0.00 H new ATOM 0 HG LEU A 34 17.970 -13.889 -14.453 1.00 0.00 H new ATOM 0 HD11 LEU A 34 19.318 -15.833 -13.764 1.00 0.00 H new ATOM 0 HD12 LEU A 34 20.213 -14.769 -14.875 1.00 0.00 H new ATOM 0 HD13 LEU A 34 20.568 -14.736 -13.131 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.626 -14.898 -12.231 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.810 -13.764 -11.538 1.00 0.00 H new ATOM 0 HD23 LEU A 34 17.286 -13.151 -12.223 1.00 0.00 H new ATOM 592 N GLY A 35 19.272 -9.655 -15.532 1.00 0.00 N ATOM 593 CA GLY A 35 19.966 -8.460 -15.972 1.00 0.00 C ATOM 594 C GLY A 35 19.323 -7.190 -15.451 1.00 0.00 C ATOM 595 O GLY A 35 19.897 -6.492 -14.615 1.00 0.00 O ATOM 0 H GLY A 35 18.916 -10.245 -16.284 1.00 0.00 H new ATOM 0 HA2 GLY A 35 21.003 -8.502 -15.638 1.00 0.00 H new ATOM 0 HA3 GLY A 35 19.983 -8.434 -17.062 1.00 0.00 H new ATOM 599 N LEU A 36 18.128 -6.889 -15.946 1.00 0.00 N ATOM 600 CA LEU A 36 17.405 -5.693 -15.527 1.00 0.00 C ATOM 601 C LEU A 36 17.238 -5.661 -14.011 1.00 0.00 C ATOM 602 O LEU A 36 17.055 -4.598 -13.418 1.00 0.00 O ATOM 603 CB LEU A 36 16.034 -5.637 -16.204 1.00 0.00 C ATOM 604 CG LEU A 36 15.155 -6.878 -16.043 1.00 0.00 C ATOM 605 CD1 LEU A 36 14.364 -6.806 -14.746 1.00 0.00 C ATOM 606 CD2 LEU A 36 14.220 -7.027 -17.233 1.00 0.00 C ATOM 0 H LEU A 36 17.639 -7.456 -16.638 1.00 0.00 H new ATOM 0 HA LEU A 36 17.987 -4.822 -15.829 1.00 0.00 H new ATOM 0 HB2 LEU A 36 15.491 -4.778 -15.810 1.00 0.00 H new ATOM 0 HB3 LEU A 36 16.184 -5.458 -17.269 1.00 0.00 H new ATOM 0 HG LEU A 36 15.801 -7.755 -16.003 1.00 0.00 H new ATOM 0 HD11 LEU A 36 13.744 -7.697 -14.648 1.00 0.00 H new ATOM 0 HD12 LEU A 36 15.052 -6.748 -13.903 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.728 -5.921 -14.756 1.00 0.00 H new ATOM 0 HD21 LEU A 36 13.602 -7.915 -17.101 1.00 0.00 H new ATOM 0 HD22 LEU A 36 13.580 -6.147 -17.305 1.00 0.00 H new ATOM 0 HD23 LEU A 36 14.807 -7.125 -18.146 1.00 0.00 H new ATOM 618 N VAL A 37 17.304 -6.834 -13.389 1.00 0.00 N ATOM 619 CA VAL A 37 17.163 -6.941 -11.942 1.00 0.00 C ATOM 620 C VAL A 37 18.358 -6.321 -11.226 1.00 0.00 C ATOM 621 O VAL A 37 18.207 -5.387 -10.440 1.00 0.00 O ATOM 622 CB VAL A 37 17.019 -8.409 -11.499 1.00 0.00 C ATOM 623 CG1 VAL A 37 17.196 -8.533 -9.993 1.00 0.00 C ATOM 624 CG2 VAL A 37 15.672 -8.967 -11.933 1.00 0.00 C ATOM 0 H VAL A 37 17.454 -7.724 -13.865 1.00 0.00 H new ATOM 0 HA VAL A 37 16.258 -6.397 -11.671 1.00 0.00 H new ATOM 0 HB VAL A 37 17.802 -8.994 -11.982 1.00 0.00 H new ATOM 0 HG11 VAL A 37 17.091 -9.577 -9.699 1.00 0.00 H new ATOM 0 HG12 VAL A 37 18.187 -8.175 -9.712 1.00 0.00 H new ATOM 0 HG13 VAL A 37 16.438 -7.936 -9.487 1.00 0.00 H new ATOM 0 HG21 VAL A 37 15.588 -10.005 -11.612 1.00 0.00 H new ATOM 0 HG22 VAL A 37 14.872 -8.381 -11.480 1.00 0.00 H new ATOM 0 HG23 VAL A 37 15.590 -8.915 -13.019 1.00 0.00 H new ATOM 634 N ASN A 38 19.546 -6.846 -11.506 1.00 0.00 N ATOM 635 CA ASN A 38 20.768 -6.343 -10.889 1.00 0.00 C ATOM 636 C ASN A 38 21.684 -5.711 -11.932 1.00 0.00 C ATOM 637 O ASN A 38 22.185 -4.602 -11.743 1.00 0.00 O ATOM 638 CB ASN A 38 21.503 -7.476 -10.168 1.00 0.00 C ATOM 639 CG ASN A 38 21.693 -8.695 -11.049 1.00 0.00 C ATOM 640 OD1 ASN A 38 22.645 -8.771 -11.826 1.00 0.00 O ATOM 641 ND2 ASN A 38 20.784 -9.656 -10.933 1.00 0.00 N ATOM 0 H ASN A 38 19.689 -7.619 -12.156 1.00 0.00 H new ATOM 0 HA ASN A 38 20.491 -5.578 -10.164 1.00 0.00 H new ATOM 0 HB2 ASN A 38 22.477 -7.118 -9.833 1.00 0.00 H new ATOM 0 HB3 ASN A 38 20.943 -7.759 -9.277 1.00 0.00 H new ATOM 0 HD21 ASN A 38 20.859 -10.500 -11.501 1.00 0.00 H new ATOM 0 HD22 ASN A 38 20.011 -9.550 -10.276 1.00 0.00 H new ATOM 648 N SER A 39 21.898 -6.423 -13.034 1.00 0.00 N ATOM 649 CA SER A 39 22.756 -5.934 -14.106 1.00 0.00 C ATOM 650 C SER A 39 22.153 -4.695 -14.762 1.00 0.00 C ATOM 651 O SER A 39 20.984 -4.372 -14.550 1.00 0.00 O ATOM 652 CB SER A 39 22.972 -7.026 -15.155 1.00 0.00 C ATOM 653 OG SER A 39 24.323 -7.068 -15.578 1.00 0.00 O ATOM 0 H SER A 39 21.488 -7.341 -13.207 1.00 0.00 H new ATOM 0 HA SER A 39 23.718 -5.663 -13.672 1.00 0.00 H new ATOM 0 HB2 SER A 39 22.687 -7.993 -14.741 1.00 0.00 H new ATOM 0 HB3 SER A 39 22.325 -6.843 -16.013 1.00 0.00 H new ATOM 0 HG SER A 39 24.434 -7.775 -16.247 1.00 0.00 H new ATOM 659 N THR A 40 22.960 -4.004 -15.561 1.00 0.00 N ATOM 660 CA THR A 40 22.508 -2.800 -16.248 1.00 0.00 C ATOM 661 C THR A 40 21.684 -3.148 -17.482 1.00 0.00 C ATOM 662 O THR A 40 22.227 -3.335 -18.571 1.00 0.00 O ATOM 663 CB THR A 40 23.696 -1.915 -16.670 1.00 0.00 C ATOM 664 OG1 THR A 40 24.377 -1.423 -15.511 1.00 0.00 O ATOM 665 CG2 THR A 40 23.224 -0.747 -17.522 1.00 0.00 C ATOM 0 H THR A 40 23.930 -4.257 -15.748 1.00 0.00 H new ATOM 0 HA THR A 40 21.886 -2.248 -15.543 1.00 0.00 H new ATOM 0 HB THR A 40 24.381 -2.522 -17.262 1.00 0.00 H new ATOM 0 HG1 THR A 40 25.132 -0.863 -15.788 1.00 0.00 H new ATOM 0 HG21 THR A 40 24.080 -0.136 -17.808 1.00 0.00 H new ATOM 0 HG22 THR A 40 22.733 -1.126 -18.418 1.00 0.00 H new ATOM 0 HG23 THR A 40 22.520 -0.141 -16.951 1.00 0.00 H new ATOM 673 N LEU A 41 20.370 -3.232 -17.305 1.00 0.00 N ATOM 674 CA LEU A 41 19.469 -3.557 -18.406 1.00 0.00 C ATOM 675 C LEU A 41 18.171 -2.763 -18.300 1.00 0.00 C ATOM 676 O LEU A 41 17.662 -2.527 -17.204 1.00 0.00 O ATOM 677 CB LEU A 41 19.164 -5.056 -18.416 1.00 0.00 C ATOM 678 CG LEU A 41 19.954 -5.895 -19.421 1.00 0.00 C ATOM 679 CD1 LEU A 41 21.097 -6.621 -18.729 1.00 0.00 C ATOM 680 CD2 LEU A 41 19.039 -6.885 -20.126 1.00 0.00 C ATOM 0 H LEU A 41 19.905 -3.080 -16.410 1.00 0.00 H new ATOM 0 HA LEU A 41 19.963 -3.287 -19.339 1.00 0.00 H new ATOM 0 HB2 LEU A 41 19.350 -5.451 -17.417 1.00 0.00 H new ATOM 0 HB3 LEU A 41 18.101 -5.189 -18.618 1.00 0.00 H new ATOM 0 HG LEU A 41 20.377 -5.226 -20.170 1.00 0.00 H new ATOM 0 HD11 LEU A 41 21.648 -7.213 -19.460 1.00 0.00 H new ATOM 0 HD12 LEU A 41 21.767 -5.893 -18.273 1.00 0.00 H new ATOM 0 HD13 LEU A 41 20.696 -7.279 -17.958 1.00 0.00 H new ATOM 0 HD21 LEU A 41 19.619 -7.473 -20.837 1.00 0.00 H new ATOM 0 HD22 LEU A 41 18.586 -7.549 -19.390 1.00 0.00 H new ATOM 0 HD23 LEU A 41 18.256 -6.343 -20.656 1.00 0.00 H new ATOM 692 N THR A 42 17.638 -2.353 -19.447 1.00 0.00 N ATOM 693 CA THR A 42 16.399 -1.587 -19.484 1.00 0.00 C ATOM 694 C THR A 42 15.235 -2.446 -19.963 1.00 0.00 C ATOM 695 O THR A 42 15.432 -3.435 -20.671 1.00 0.00 O ATOM 696 CB THR A 42 16.527 -0.357 -20.402 1.00 0.00 C ATOM 697 OG1 THR A 42 15.289 0.363 -20.431 1.00 0.00 O ATOM 698 CG2 THR A 42 16.911 -0.773 -21.814 1.00 0.00 C ATOM 0 H THR A 42 18.046 -2.539 -20.363 1.00 0.00 H new ATOM 0 HA THR A 42 16.204 -1.252 -18.465 1.00 0.00 H new ATOM 0 HB THR A 42 17.312 0.286 -20.004 1.00 0.00 H new ATOM 0 HG1 THR A 42 15.379 1.145 -21.015 1.00 0.00 H new ATOM 0 HG21 THR A 42 16.995 0.113 -22.444 1.00 0.00 H new ATOM 0 HG22 THR A 42 17.867 -1.295 -21.792 1.00 0.00 H new ATOM 0 HG23 THR A 42 16.146 -1.435 -22.219 1.00 0.00 H new ATOM 706 N ILE A 43 14.024 -2.063 -19.574 1.00 0.00 N ATOM 707 CA ILE A 43 12.828 -2.799 -19.967 1.00 0.00 C ATOM 708 C ILE A 43 12.820 -3.075 -21.466 1.00 0.00 C ATOM 709 O ILE A 43 12.639 -4.214 -21.896 1.00 0.00 O ATOM 710 CB ILE A 43 11.547 -2.032 -19.590 1.00 0.00 C ATOM 711 CG1 ILE A 43 11.537 -1.715 -18.093 1.00 0.00 C ATOM 712 CG2 ILE A 43 10.315 -2.838 -19.974 1.00 0.00 C ATOM 713 CD1 ILE A 43 10.845 -2.769 -17.257 1.00 0.00 C ATOM 0 H ILE A 43 13.845 -1.248 -18.987 1.00 0.00 H new ATOM 0 HA ILE A 43 12.848 -3.745 -19.427 1.00 0.00 H new ATOM 0 HB ILE A 43 11.529 -1.092 -20.141 1.00 0.00 H new ATOM 0 HG12 ILE A 43 12.564 -1.605 -17.746 1.00 0.00 H new ATOM 0 HG13 ILE A 43 11.043 -0.756 -17.936 1.00 0.00 H new ATOM 0 HG21 ILE A 43 9.417 -2.283 -19.701 1.00 0.00 H new ATOM 0 HG22 ILE A 43 10.318 -3.017 -21.049 1.00 0.00 H new ATOM 0 HG23 ILE A 43 10.326 -3.792 -19.447 1.00 0.00 H new ATOM 0 HD11 ILE A 43 10.876 -2.479 -16.207 1.00 0.00 H new ATOM 0 HD12 ILE A 43 9.807 -2.864 -17.577 1.00 0.00 H new ATOM 0 HD13 ILE A 43 11.353 -3.725 -17.384 1.00 0.00 H new ATOM 725 N GLU A 44 13.019 -2.025 -22.257 1.00 0.00 N ATOM 726 CA GLU A 44 13.035 -2.155 -23.709 1.00 0.00 C ATOM 727 C GLU A 44 13.982 -3.270 -24.145 1.00 0.00 C ATOM 728 O GLU A 44 13.589 -4.182 -24.872 1.00 0.00 O ATOM 729 CB GLU A 44 13.453 -0.834 -24.357 1.00 0.00 C ATOM 730 CG GLU A 44 13.661 -0.932 -25.859 1.00 0.00 C ATOM 731 CD GLU A 44 14.044 0.396 -26.483 1.00 0.00 C ATOM 732 OE1 GLU A 44 13.354 1.401 -26.212 1.00 0.00 O ATOM 733 OE2 GLU A 44 15.036 0.431 -27.242 1.00 0.00 O ATOM 0 H GLU A 44 13.171 -1.076 -21.917 1.00 0.00 H new ATOM 0 HA GLU A 44 12.027 -2.409 -24.036 1.00 0.00 H new ATOM 0 HB2 GLU A 44 12.691 -0.082 -24.152 1.00 0.00 H new ATOM 0 HB3 GLU A 44 14.376 -0.487 -23.893 1.00 0.00 H new ATOM 0 HG2 GLU A 44 14.440 -1.665 -26.067 1.00 0.00 H new ATOM 0 HG3 GLU A 44 12.746 -1.298 -26.326 1.00 0.00 H new ATOM 740 N GLU A 45 15.230 -3.188 -23.695 1.00 0.00 N ATOM 741 CA GLU A 45 16.233 -4.189 -24.039 1.00 0.00 C ATOM 742 C GLU A 45 15.797 -5.577 -23.578 1.00 0.00 C ATOM 743 O GLU A 45 16.040 -6.574 -24.258 1.00 0.00 O ATOM 744 CB GLU A 45 17.580 -3.831 -23.410 1.00 0.00 C ATOM 745 CG GLU A 45 18.658 -4.877 -23.641 1.00 0.00 C ATOM 746 CD GLU A 45 19.600 -4.504 -24.769 1.00 0.00 C ATOM 747 OE1 GLU A 45 19.144 -3.852 -25.731 1.00 0.00 O ATOM 748 OE2 GLU A 45 20.793 -4.865 -24.690 1.00 0.00 O ATOM 0 H GLU A 45 15.571 -2.439 -23.092 1.00 0.00 H new ATOM 0 HA GLU A 45 16.339 -4.202 -25.124 1.00 0.00 H new ATOM 0 HB2 GLU A 45 17.918 -2.877 -23.815 1.00 0.00 H new ATOM 0 HB3 GLU A 45 17.445 -3.692 -22.337 1.00 0.00 H new ATOM 0 HG2 GLU A 45 19.231 -5.012 -22.724 1.00 0.00 H new ATOM 0 HG3 GLU A 45 18.188 -5.834 -23.867 1.00 0.00 H new ATOM 755 N PHE A 46 15.151 -5.633 -22.418 1.00 0.00 N ATOM 756 CA PHE A 46 14.682 -6.898 -21.865 1.00 0.00 C ATOM 757 C PHE A 46 13.506 -7.442 -22.671 1.00 0.00 C ATOM 758 O PHE A 46 13.210 -8.637 -22.629 1.00 0.00 O ATOM 759 CB PHE A 46 14.271 -6.718 -20.402 1.00 0.00 C ATOM 760 CG PHE A 46 12.988 -7.414 -20.049 1.00 0.00 C ATOM 761 CD1 PHE A 46 12.990 -8.743 -19.658 1.00 0.00 C ATOM 762 CD2 PHE A 46 11.779 -6.739 -20.110 1.00 0.00 C ATOM 763 CE1 PHE A 46 11.810 -9.386 -19.333 1.00 0.00 C ATOM 764 CE2 PHE A 46 10.597 -7.377 -19.785 1.00 0.00 C ATOM 765 CZ PHE A 46 10.612 -8.703 -19.397 1.00 0.00 C ATOM 0 H PHE A 46 14.940 -4.817 -21.843 1.00 0.00 H new ATOM 0 HA PHE A 46 15.501 -7.615 -21.920 1.00 0.00 H new ATOM 0 HB2 PHE A 46 15.068 -7.095 -19.760 1.00 0.00 H new ATOM 0 HB3 PHE A 46 14.168 -5.654 -20.190 1.00 0.00 H new ATOM 0 HD1 PHE A 46 13.924 -9.283 -19.606 1.00 0.00 H new ATOM 0 HD2 PHE A 46 11.760 -5.703 -20.415 1.00 0.00 H new ATOM 0 HE1 PHE A 46 11.825 -10.422 -19.029 1.00 0.00 H new ATOM 0 HE2 PHE A 46 9.662 -6.839 -19.834 1.00 0.00 H new ATOM 0 HZ PHE A 46 9.689 -9.204 -19.144 1.00 0.00 H new ATOM 775 N HIS A 47 12.840 -6.557 -23.405 1.00 0.00 N ATOM 776 CA HIS A 47 11.696 -6.948 -24.222 1.00 0.00 C ATOM 777 C HIS A 47 12.138 -7.313 -25.636 1.00 0.00 C ATOM 778 O HIS A 47 11.440 -8.035 -26.348 1.00 0.00 O ATOM 779 CB HIS A 47 10.669 -5.816 -24.273 1.00 0.00 C ATOM 780 CG HIS A 47 10.121 -5.566 -25.644 1.00 0.00 C ATOM 781 ND1 HIS A 47 9.193 -6.391 -26.246 1.00 0.00 N ATOM 782 CD2 HIS A 47 10.373 -4.576 -26.532 1.00 0.00 C ATOM 783 CE1 HIS A 47 8.900 -5.919 -27.444 1.00 0.00 C ATOM 784 NE2 HIS A 47 9.602 -4.818 -27.642 1.00 0.00 N ATOM 0 H HIS A 47 13.072 -5.565 -23.451 1.00 0.00 H new ATOM 0 HA HIS A 47 11.237 -7.825 -23.766 1.00 0.00 H new ATOM 0 HB2 HIS A 47 9.846 -6.053 -23.599 1.00 0.00 H new ATOM 0 HB3 HIS A 47 11.131 -4.901 -23.903 1.00 0.00 H new ATOM 0 HD2 HIS A 47 11.054 -3.749 -26.393 1.00 0.00 H new ATOM 0 HE1 HIS A 47 8.204 -6.359 -28.143 1.00 0.00 H new ATOM 0 HE2 HIS A 47 9.576 -4.241 -28.483 1.00 0.00 H new ATOM 792 N SER A 48 13.301 -6.809 -26.036 1.00 0.00 N ATOM 793 CA SER A 48 13.834 -7.079 -27.367 1.00 0.00 C ATOM 794 C SER A 48 14.267 -8.536 -27.493 1.00 0.00 C ATOM 795 O SER A 48 13.614 -9.335 -28.165 1.00 0.00 O ATOM 796 CB SER A 48 15.018 -6.156 -27.662 1.00 0.00 C ATOM 797 OG SER A 48 15.948 -6.781 -28.529 1.00 0.00 O ATOM 0 H SER A 48 13.892 -6.212 -25.458 1.00 0.00 H new ATOM 0 HA SER A 48 13.044 -6.889 -28.094 1.00 0.00 H new ATOM 0 HB2 SER A 48 14.659 -5.232 -28.114 1.00 0.00 H new ATOM 0 HB3 SER A 48 15.512 -5.883 -26.729 1.00 0.00 H new ATOM 0 HG SER A 48 16.694 -6.170 -28.703 1.00 0.00 H new ATOM 803 N LYS A 49 15.374 -8.877 -26.842 1.00 0.00 N ATOM 804 CA LYS A 49 15.896 -10.237 -26.878 1.00 0.00 C ATOM 805 C LYS A 49 14.791 -11.252 -26.601 1.00 0.00 C ATOM 806 O LYS A 49 14.665 -12.256 -27.303 1.00 0.00 O ATOM 807 CB LYS A 49 17.022 -10.401 -25.855 1.00 0.00 C ATOM 808 CG LYS A 49 18.406 -10.149 -26.427 1.00 0.00 C ATOM 809 CD LYS A 49 18.653 -8.668 -26.658 1.00 0.00 C ATOM 810 CE LYS A 49 19.181 -7.989 -25.403 1.00 0.00 C ATOM 811 NZ LYS A 49 20.668 -8.026 -25.337 1.00 0.00 N ATOM 0 H LYS A 49 15.928 -8.228 -26.282 1.00 0.00 H new ATOM 0 HA LYS A 49 16.292 -10.421 -27.877 1.00 0.00 H new ATOM 0 HB2 LYS A 49 16.851 -9.715 -25.026 1.00 0.00 H new ATOM 0 HB3 LYS A 49 16.986 -11.411 -25.446 1.00 0.00 H new ATOM 0 HG2 LYS A 49 19.160 -10.542 -25.745 1.00 0.00 H new ATOM 0 HG3 LYS A 49 18.515 -10.688 -27.368 1.00 0.00 H new ATOM 0 HD2 LYS A 49 19.368 -8.540 -27.471 1.00 0.00 H new ATOM 0 HD3 LYS A 49 17.726 -8.188 -26.970 1.00 0.00 H new ATOM 0 HE2 LYS A 49 18.842 -6.953 -25.380 1.00 0.00 H new ATOM 0 HE3 LYS A 49 18.766 -8.480 -24.523 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 20.966 -8.685 -24.590 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 21.048 -8.344 -26.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 21.030 -7.075 -25.124 1.00 0.00 H new ATOM 825 N LEU A 50 13.991 -10.983 -25.575 1.00 0.00 N ATOM 826 CA LEU A 50 12.895 -11.872 -25.205 1.00 0.00 C ATOM 827 C LEU A 50 11.906 -12.024 -26.356 1.00 0.00 C ATOM 828 O LEU A 50 11.464 -13.130 -26.664 1.00 0.00 O ATOM 829 CB LEU A 50 12.175 -11.338 -23.966 1.00 0.00 C ATOM 830 CG LEU A 50 11.892 -12.357 -22.862 1.00 0.00 C ATOM 831 CD1 LEU A 50 12.084 -11.728 -21.492 1.00 0.00 C ATOM 832 CD2 LEU A 50 10.484 -12.917 -23.001 1.00 0.00 C ATOM 0 H LEU A 50 14.081 -10.156 -24.984 1.00 0.00 H new ATOM 0 HA LEU A 50 13.315 -12.852 -24.979 1.00 0.00 H new ATOM 0 HB2 LEU A 50 12.773 -10.531 -23.543 1.00 0.00 H new ATOM 0 HB3 LEU A 50 11.227 -10.901 -24.281 1.00 0.00 H new ATOM 0 HG LEU A 50 12.600 -13.179 -22.964 1.00 0.00 H new ATOM 0 HD11 LEU A 50 11.878 -12.469 -20.719 1.00 0.00 H new ATOM 0 HD12 LEU A 50 13.111 -11.377 -21.394 1.00 0.00 H new ATOM 0 HD13 LEU A 50 11.401 -10.886 -21.379 1.00 0.00 H new ATOM 0 HD21 LEU A 50 10.300 -13.641 -22.207 1.00 0.00 H new ATOM 0 HD22 LEU A 50 9.761 -12.105 -22.927 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.381 -13.407 -23.969 1.00 0.00 H new ATOM 844 N GLN A 51 11.566 -10.906 -26.989 1.00 0.00 N ATOM 845 CA GLN A 51 10.630 -10.916 -28.108 1.00 0.00 C ATOM 846 C GLN A 51 11.084 -11.892 -29.188 1.00 0.00 C ATOM 847 O GLN A 51 10.270 -12.599 -29.781 1.00 0.00 O ATOM 848 CB GLN A 51 10.492 -9.511 -28.698 1.00 0.00 C ATOM 849 CG GLN A 51 9.653 -9.463 -29.964 1.00 0.00 C ATOM 850 CD GLN A 51 9.519 -8.060 -30.522 1.00 0.00 C ATOM 851 OE1 GLN A 51 10.102 -7.112 -29.996 1.00 0.00 O ATOM 852 NE2 GLN A 51 8.747 -7.920 -31.594 1.00 0.00 N ATOM 0 H GLN A 51 11.924 -9.982 -26.747 1.00 0.00 H new ATOM 0 HA GLN A 51 9.659 -11.242 -27.734 1.00 0.00 H new ATOM 0 HB2 GLN A 51 10.046 -8.855 -27.951 1.00 0.00 H new ATOM 0 HB3 GLN A 51 11.485 -9.118 -28.915 1.00 0.00 H new ATOM 0 HG2 GLN A 51 10.103 -10.109 -30.718 1.00 0.00 H new ATOM 0 HG3 GLN A 51 8.661 -9.862 -29.753 1.00 0.00 H new ATOM 0 HE21 GLN A 51 8.282 -8.733 -31.998 1.00 0.00 H new ATOM 0 HE22 GLN A 51 8.619 -6.999 -32.013 1.00 0.00 H new ATOM 861 N GLU A 52 12.389 -11.924 -29.439 1.00 0.00 N ATOM 862 CA GLU A 52 12.950 -12.813 -30.450 1.00 0.00 C ATOM 863 C GLU A 52 13.393 -14.134 -29.827 1.00 0.00 C ATOM 864 O GLU A 52 13.845 -15.041 -30.526 1.00 0.00 O ATOM 865 CB GLU A 52 14.136 -12.144 -31.149 1.00 0.00 C ATOM 866 CG GLU A 52 15.314 -11.876 -30.227 1.00 0.00 C ATOM 867 CD GLU A 52 16.578 -11.519 -30.985 1.00 0.00 C ATOM 868 OE1 GLU A 52 16.467 -10.902 -32.065 1.00 0.00 O ATOM 869 OE2 GLU A 52 17.677 -11.855 -30.498 1.00 0.00 O ATOM 0 H GLU A 52 13.077 -11.345 -28.957 1.00 0.00 H new ATOM 0 HA GLU A 52 12.173 -13.020 -31.186 1.00 0.00 H new ATOM 0 HB2 GLU A 52 14.466 -12.778 -31.972 1.00 0.00 H new ATOM 0 HB3 GLU A 52 13.805 -11.202 -31.585 1.00 0.00 H new ATOM 0 HG2 GLU A 52 15.061 -11.063 -29.547 1.00 0.00 H new ATOM 0 HG3 GLU A 52 15.499 -12.758 -29.614 1.00 0.00 H new ATOM 876 N ALA A 53 13.260 -14.234 -28.509 1.00 0.00 N ATOM 877 CA ALA A 53 13.645 -15.443 -27.792 1.00 0.00 C ATOM 878 C ALA A 53 12.454 -16.380 -27.617 1.00 0.00 C ATOM 879 O ALA A 53 12.556 -17.583 -27.860 1.00 0.00 O ATOM 880 CB ALA A 53 14.241 -15.087 -26.438 1.00 0.00 C ATOM 0 H ALA A 53 12.888 -13.492 -27.916 1.00 0.00 H new ATOM 0 HA ALA A 53 14.399 -15.962 -28.384 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.524 -16.000 -25.914 1.00 0.00 H new ATOM 0 HB2 ALA A 53 15.123 -14.463 -26.581 1.00 0.00 H new ATOM 0 HB3 ALA A 53 13.504 -14.543 -25.848 1.00 0.00 H new ATOM 886 N THR A 54 11.324 -15.821 -27.195 1.00 0.00 N ATOM 887 CA THR A 54 10.114 -16.607 -26.987 1.00 0.00 C ATOM 888 C THR A 54 9.351 -16.799 -28.292 1.00 0.00 C ATOM 889 O THR A 54 9.172 -15.855 -29.061 1.00 0.00 O ATOM 890 CB THR A 54 9.184 -15.942 -25.955 1.00 0.00 C ATOM 891 OG1 THR A 54 8.617 -14.747 -26.504 1.00 0.00 O ATOM 892 CG2 THR A 54 9.941 -15.610 -24.678 1.00 0.00 C ATOM 0 H THR A 54 11.222 -14.827 -26.991 1.00 0.00 H new ATOM 0 HA THR A 54 10.430 -17.579 -26.608 1.00 0.00 H new ATOM 0 HB THR A 54 8.386 -16.644 -25.713 1.00 0.00 H new ATOM 0 HG1 THR A 54 9.322 -14.077 -26.628 1.00 0.00 H new ATOM 0 HG21 THR A 54 9.263 -15.141 -23.965 1.00 0.00 H new ATOM 0 HG22 THR A 54 10.346 -16.525 -24.246 1.00 0.00 H new ATOM 0 HG23 THR A 54 10.757 -14.925 -24.907 1.00 0.00 H new ATOM 900 N ASN A 55 8.904 -18.026 -28.536 1.00 0.00 N ATOM 901 CA ASN A 55 8.160 -18.341 -29.750 1.00 0.00 C ATOM 902 C ASN A 55 6.877 -17.520 -29.830 1.00 0.00 C ATOM 903 O ASN A 55 6.684 -16.574 -29.066 1.00 0.00 O ATOM 904 CB ASN A 55 7.826 -19.834 -29.796 1.00 0.00 C ATOM 905 CG ASN A 55 9.028 -20.705 -29.482 1.00 0.00 C ATOM 906 OD1 ASN A 55 10.112 -20.508 -30.031 1.00 0.00 O ATOM 907 ND2 ASN A 55 8.840 -21.674 -28.593 1.00 0.00 N ATOM 0 H ASN A 55 9.044 -18.819 -27.909 1.00 0.00 H new ATOM 0 HA ASN A 55 8.786 -18.089 -30.606 1.00 0.00 H new ATOM 0 HB2 ASN A 55 7.030 -20.048 -29.083 1.00 0.00 H new ATOM 0 HB3 ASN A 55 7.445 -20.088 -30.785 1.00 0.00 H new ATOM 0 HD21 ASN A 55 9.612 -22.291 -28.341 1.00 0.00 H new ATOM 0 HD22 ASN A 55 7.924 -21.801 -28.163 1.00 0.00 H new ATOM 914 N PHE A 56 6.002 -17.888 -30.760 1.00 0.00 N ATOM 915 CA PHE A 56 4.737 -17.185 -30.941 1.00 0.00 C ATOM 916 C PHE A 56 4.972 -15.703 -31.214 1.00 0.00 C ATOM 917 O PHE A 56 6.083 -15.190 -31.079 1.00 0.00 O ATOM 918 CB PHE A 56 3.854 -17.354 -29.703 1.00 0.00 C ATOM 919 CG PHE A 56 4.292 -18.473 -28.802 1.00 0.00 C ATOM 920 CD1 PHE A 56 4.192 -19.792 -29.214 1.00 0.00 C ATOM 921 CD2 PHE A 56 4.805 -18.206 -27.543 1.00 0.00 C ATOM 922 CE1 PHE A 56 4.594 -20.824 -28.388 1.00 0.00 C ATOM 923 CE2 PHE A 56 5.209 -19.234 -26.712 1.00 0.00 C ATOM 924 CZ PHE A 56 5.103 -20.545 -27.135 1.00 0.00 C ATOM 0 H PHE A 56 6.146 -18.669 -31.400 1.00 0.00 H new ATOM 0 HA PHE A 56 4.229 -17.618 -31.803 1.00 0.00 H new ATOM 0 HB2 PHE A 56 3.853 -16.422 -29.137 1.00 0.00 H new ATOM 0 HB3 PHE A 56 2.827 -17.535 -30.021 1.00 0.00 H new ATOM 0 HD1 PHE A 56 3.795 -20.016 -30.193 1.00 0.00 H new ATOM 0 HD2 PHE A 56 4.890 -17.183 -27.207 1.00 0.00 H new ATOM 0 HE1 PHE A 56 4.510 -21.848 -28.722 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.607 -19.013 -25.733 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.418 -21.350 -26.487 1.00 0.00 H new ATOM 934 N PRO A 57 3.902 -14.997 -31.607 1.00 0.00 N ATOM 935 CA PRO A 57 3.966 -13.563 -31.907 1.00 0.00 C ATOM 936 C PRO A 57 4.186 -12.718 -30.657 1.00 0.00 C ATOM 937 O PRO A 57 3.701 -13.055 -29.575 1.00 0.00 O ATOM 938 CB PRO A 57 2.594 -13.267 -32.518 1.00 0.00 C ATOM 939 CG PRO A 57 1.696 -14.315 -31.958 1.00 0.00 C ATOM 940 CD PRO A 57 2.547 -15.543 -31.789 1.00 0.00 C ATOM 0 HA PRO A 57 4.802 -13.321 -32.564 1.00 0.00 H new ATOM 0 HB2 PRO A 57 2.250 -12.267 -32.252 1.00 0.00 H new ATOM 0 HB3 PRO A 57 2.627 -13.314 -33.606 1.00 0.00 H new ATOM 0 HG2 PRO A 57 1.274 -13.998 -31.004 1.00 0.00 H new ATOM 0 HG3 PRO A 57 0.859 -14.510 -32.628 1.00 0.00 H new ATOM 0 HD2 PRO A 57 2.233 -16.134 -30.929 1.00 0.00 H new ATOM 0 HD3 PRO A 57 2.490 -16.194 -32.661 1.00 0.00 H new ATOM 948 N LEU A 58 4.917 -11.621 -30.811 1.00 0.00 N ATOM 949 CA LEU A 58 5.201 -10.727 -29.694 1.00 0.00 C ATOM 950 C LEU A 58 3.987 -10.597 -28.779 1.00 0.00 C ATOM 951 O LEU A 58 2.857 -10.459 -29.247 1.00 0.00 O ATOM 952 CB LEU A 58 5.614 -9.348 -30.211 1.00 0.00 C ATOM 953 CG LEU A 58 5.579 -8.210 -29.190 1.00 0.00 C ATOM 954 CD1 LEU A 58 6.635 -8.423 -28.116 1.00 0.00 C ATOM 955 CD2 LEU A 58 5.780 -6.868 -29.879 1.00 0.00 C ATOM 0 H LEU A 58 5.325 -11.328 -31.699 1.00 0.00 H new ATOM 0 HA LEU A 58 6.023 -11.154 -29.119 1.00 0.00 H new ATOM 0 HB2 LEU A 58 6.626 -9.420 -30.610 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.961 -9.083 -31.043 1.00 0.00 H new ATOM 0 HG LEU A 58 4.599 -8.207 -28.712 1.00 0.00 H new ATOM 0 HD11 LEU A 58 6.595 -7.603 -27.399 1.00 0.00 H new ATOM 0 HD12 LEU A 58 6.446 -9.365 -27.601 1.00 0.00 H new ATOM 0 HD13 LEU A 58 7.622 -8.453 -28.577 1.00 0.00 H new ATOM 0 HD21 LEU A 58 5.752 -6.070 -29.137 1.00 0.00 H new ATOM 0 HD22 LEU A 58 6.746 -6.860 -30.385 1.00 0.00 H new ATOM 0 HD23 LEU A 58 4.986 -6.712 -30.610 1.00 0.00 H new ATOM 967 N ARG A 59 4.230 -10.639 -27.473 1.00 0.00 N ATOM 968 CA ARG A 59 3.157 -10.526 -26.492 1.00 0.00 C ATOM 969 C ARG A 59 2.707 -9.075 -26.345 1.00 0.00 C ATOM 970 O ARG A 59 3.403 -8.140 -26.740 1.00 0.00 O ATOM 971 CB ARG A 59 3.616 -11.068 -25.138 1.00 0.00 C ATOM 972 CG ARG A 59 5.053 -10.712 -24.794 1.00 0.00 C ATOM 973 CD ARG A 59 5.199 -10.338 -23.328 1.00 0.00 C ATOM 974 NE ARG A 59 6.309 -11.042 -22.691 1.00 0.00 N ATOM 975 CZ ARG A 59 6.230 -12.294 -22.253 1.00 0.00 C ATOM 976 NH1 ARG A 59 5.100 -12.976 -22.383 1.00 0.00 N ATOM 977 NH2 ARG A 59 7.283 -12.867 -21.684 1.00 0.00 N ATOM 0 H ARG A 59 5.160 -10.750 -27.070 1.00 0.00 H new ATOM 0 HA ARG A 59 2.312 -11.117 -26.844 1.00 0.00 H new ATOM 0 HB2 ARG A 59 2.959 -10.681 -24.360 1.00 0.00 H new ATOM 0 HB3 ARG A 59 3.509 -12.153 -25.135 1.00 0.00 H new ATOM 0 HG2 ARG A 59 5.703 -11.557 -25.021 1.00 0.00 H new ATOM 0 HG3 ARG A 59 5.382 -9.880 -25.417 1.00 0.00 H new ATOM 0 HD2 ARG A 59 5.355 -9.263 -23.242 1.00 0.00 H new ATOM 0 HD3 ARG A 59 4.273 -10.569 -22.801 1.00 0.00 H new ATOM 0 HE ARG A 59 7.193 -10.546 -22.576 1.00 0.00 H new ATOM 0 HH11 ARG A 59 4.288 -12.540 -22.820 1.00 0.00 H new ATOM 0 HH12 ARG A 59 5.043 -13.937 -22.046 1.00 0.00 H new ATOM 0 HH21 ARG A 59 8.154 -12.346 -21.582 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.221 -13.828 -21.348 1.00 0.00 H new ATOM 991 N PRO A 60 1.513 -8.882 -25.765 1.00 0.00 N ATOM 992 CA PRO A 60 0.943 -7.548 -25.552 1.00 0.00 C ATOM 993 C PRO A 60 1.698 -6.758 -24.489 1.00 0.00 C ATOM 994 O PRO A 60 2.620 -6.004 -24.800 1.00 0.00 O ATOM 995 CB PRO A 60 -0.485 -7.843 -25.086 1.00 0.00 C ATOM 996 CG PRO A 60 -0.413 -9.204 -24.484 1.00 0.00 C ATOM 997 CD PRO A 60 0.629 -9.950 -25.270 1.00 0.00 C ATOM 0 HA PRO A 60 0.994 -6.934 -26.451 1.00 0.00 H new ATOM 0 HB2 PRO A 60 -0.824 -7.106 -24.358 1.00 0.00 H new ATOM 0 HB3 PRO A 60 -1.187 -7.815 -25.919 1.00 0.00 H new ATOM 0 HG2 PRO A 60 -0.142 -9.150 -23.430 1.00 0.00 H new ATOM 0 HG3 PRO A 60 -1.378 -9.707 -24.540 1.00 0.00 H new ATOM 0 HD2 PRO A 60 1.169 -10.662 -24.646 1.00 0.00 H new ATOM 0 HD3 PRO A 60 0.185 -10.516 -26.089 1.00 0.00 H new ATOM 1005 N PHE A 61 1.300 -6.934 -23.234 1.00 0.00 N ATOM 1006 CA PHE A 61 1.939 -6.236 -22.124 1.00 0.00 C ATOM 1007 C PHE A 61 3.338 -6.789 -21.867 1.00 0.00 C ATOM 1008 O PHE A 61 3.537 -7.620 -20.980 1.00 0.00 O ATOM 1009 CB PHE A 61 1.089 -6.361 -20.858 1.00 0.00 C ATOM 1010 CG PHE A 61 -0.287 -5.776 -21.000 1.00 0.00 C ATOM 1011 CD1 PHE A 61 -0.459 -4.419 -21.220 1.00 0.00 C ATOM 1012 CD2 PHE A 61 -1.410 -6.584 -20.914 1.00 0.00 C ATOM 1013 CE1 PHE A 61 -1.724 -3.878 -21.352 1.00 0.00 C ATOM 1014 CE2 PHE A 61 -2.677 -6.049 -21.046 1.00 0.00 C ATOM 1015 CZ PHE A 61 -2.834 -4.694 -21.263 1.00 0.00 C ATOM 0 H PHE A 61 0.538 -7.554 -22.960 1.00 0.00 H new ATOM 0 HA PHE A 61 2.027 -5.183 -22.392 1.00 0.00 H new ATOM 0 HB2 PHE A 61 1.002 -7.414 -20.591 1.00 0.00 H new ATOM 0 HB3 PHE A 61 1.603 -5.865 -20.035 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.406 -3.776 -21.289 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -1.293 -7.644 -20.742 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -1.844 -2.819 -21.524 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.544 -6.690 -20.980 1.00 0.00 H new ATOM 0 HZ PHE A 61 -3.824 -4.273 -21.363 1.00 0.00 H new ATOM 1025 N VAL A 62 4.305 -6.323 -22.651 1.00 0.00 N ATOM 1026 CA VAL A 62 5.686 -6.770 -22.509 1.00 0.00 C ATOM 1027 C VAL A 62 6.495 -5.795 -21.662 1.00 0.00 C ATOM 1028 O VAL A 62 7.043 -6.166 -20.623 1.00 0.00 O ATOM 1029 CB VAL A 62 6.368 -6.928 -23.881 1.00 0.00 C ATOM 1030 CG1 VAL A 62 7.499 -7.942 -23.801 1.00 0.00 C ATOM 1031 CG2 VAL A 62 5.351 -7.334 -24.938 1.00 0.00 C ATOM 0 H VAL A 62 4.158 -5.636 -23.391 1.00 0.00 H new ATOM 0 HA VAL A 62 5.655 -7.740 -22.012 1.00 0.00 H new ATOM 0 HB VAL A 62 6.793 -5.967 -24.169 1.00 0.00 H new ATOM 0 HG11 VAL A 62 7.969 -8.041 -24.779 1.00 0.00 H new ATOM 0 HG12 VAL A 62 8.239 -7.605 -23.075 1.00 0.00 H new ATOM 0 HG13 VAL A 62 7.100 -8.908 -23.491 1.00 0.00 H new ATOM 0 HG21 VAL A 62 5.850 -7.441 -25.901 1.00 0.00 H new ATOM 0 HG22 VAL A 62 4.895 -8.284 -24.658 1.00 0.00 H new ATOM 0 HG23 VAL A 62 4.579 -6.568 -25.013 1.00 0.00 H new ATOM 1041 N ILE A 63 6.565 -4.546 -22.111 1.00 0.00 N ATOM 1042 CA ILE A 63 7.306 -3.517 -21.392 1.00 0.00 C ATOM 1043 C ILE A 63 6.711 -3.277 -20.008 1.00 0.00 C ATOM 1044 O ILE A 63 7.412 -3.276 -18.996 1.00 0.00 O ATOM 1045 CB ILE A 63 7.320 -2.187 -22.169 1.00 0.00 C ATOM 1046 CG1 ILE A 63 7.985 -2.377 -23.534 1.00 0.00 C ATOM 1047 CG2 ILE A 63 8.041 -1.113 -21.368 1.00 0.00 C ATOM 1048 CD1 ILE A 63 7.004 -2.659 -24.651 1.00 0.00 C ATOM 0 H ILE A 63 6.118 -4.223 -22.969 1.00 0.00 H new ATOM 0 HA ILE A 63 8.329 -3.879 -21.288 1.00 0.00 H new ATOM 0 HB ILE A 63 6.291 -1.865 -22.328 1.00 0.00 H new ATOM 0 HG12 ILE A 63 8.555 -1.481 -23.779 1.00 0.00 H new ATOM 0 HG13 ILE A 63 8.697 -3.200 -23.471 1.00 0.00 H new ATOM 0 HG21 ILE A 63 8.043 -0.179 -21.930 1.00 0.00 H new ATOM 0 HG22 ILE A 63 7.529 -0.963 -20.417 1.00 0.00 H new ATOM 0 HG23 ILE A 63 9.068 -1.426 -21.182 1.00 0.00 H new ATOM 0 HD11 ILE A 63 7.546 -2.782 -25.589 1.00 0.00 H new ATOM 0 HD12 ILE A 63 6.452 -3.572 -24.428 1.00 0.00 H new ATOM 0 HD13 ILE A 63 6.307 -1.826 -24.742 1.00 0.00 H new ATOM 1060 N PRO A 64 5.387 -3.070 -19.961 1.00 0.00 N ATOM 1061 CA PRO A 64 4.668 -2.827 -18.706 1.00 0.00 C ATOM 1062 C PRO A 64 4.604 -4.070 -17.825 1.00 0.00 C ATOM 1063 O PRO A 64 4.159 -4.009 -16.679 1.00 0.00 O ATOM 1064 CB PRO A 64 3.265 -2.430 -19.173 1.00 0.00 C ATOM 1065 CG PRO A 64 3.117 -3.064 -20.512 1.00 0.00 C ATOM 1066 CD PRO A 64 4.489 -3.057 -21.128 1.00 0.00 C ATOM 0 HA PRO A 64 5.159 -2.070 -18.094 1.00 0.00 H new ATOM 0 HB2 PRO A 64 2.502 -2.785 -18.480 1.00 0.00 H new ATOM 0 HB3 PRO A 64 3.160 -1.347 -19.234 1.00 0.00 H new ATOM 0 HG2 PRO A 64 2.735 -4.081 -20.422 1.00 0.00 H new ATOM 0 HG3 PRO A 64 2.409 -2.511 -21.129 1.00 0.00 H new ATOM 0 HD2 PRO A 64 4.647 -3.926 -21.766 1.00 0.00 H new ATOM 0 HD3 PRO A 64 4.647 -2.174 -21.747 1.00 0.00 H new ATOM 1074 N PHE A 65 5.052 -5.198 -18.368 1.00 0.00 N ATOM 1075 CA PHE A 65 5.046 -6.456 -17.630 1.00 0.00 C ATOM 1076 C PHE A 65 6.070 -6.429 -16.499 1.00 0.00 C ATOM 1077 O PHE A 65 5.739 -6.682 -15.340 1.00 0.00 O ATOM 1078 CB PHE A 65 5.340 -7.625 -18.572 1.00 0.00 C ATOM 1079 CG PHE A 65 4.376 -8.768 -18.429 1.00 0.00 C ATOM 1080 CD1 PHE A 65 3.013 -8.534 -18.333 1.00 0.00 C ATOM 1081 CD2 PHE A 65 4.832 -10.076 -18.390 1.00 0.00 C ATOM 1082 CE1 PHE A 65 2.124 -9.584 -18.200 1.00 0.00 C ATOM 1083 CE2 PHE A 65 3.947 -11.130 -18.258 1.00 0.00 C ATOM 1084 CZ PHE A 65 2.592 -10.883 -18.164 1.00 0.00 C ATOM 0 H PHE A 65 5.423 -5.266 -19.316 1.00 0.00 H new ATOM 0 HA PHE A 65 4.055 -6.589 -17.195 1.00 0.00 H new ATOM 0 HB2 PHE A 65 5.316 -7.267 -19.601 1.00 0.00 H new ATOM 0 HB3 PHE A 65 6.351 -7.987 -18.384 1.00 0.00 H new ATOM 0 HD1 PHE A 65 2.642 -7.520 -18.362 1.00 0.00 H new ATOM 0 HD2 PHE A 65 5.891 -10.274 -18.464 1.00 0.00 H new ATOM 0 HE1 PHE A 65 1.064 -9.389 -18.124 1.00 0.00 H new ATOM 0 HE2 PHE A 65 4.315 -12.145 -18.228 1.00 0.00 H new ATOM 0 HZ PHE A 65 1.899 -11.705 -18.062 1.00 0.00 H new ATOM 1094 N LEU A 66 7.315 -6.122 -16.845 1.00 0.00 N ATOM 1095 CA LEU A 66 8.390 -6.062 -15.860 1.00 0.00 C ATOM 1096 C LEU A 66 8.537 -4.651 -15.300 1.00 0.00 C ATOM 1097 O LEU A 66 9.106 -4.454 -14.226 1.00 0.00 O ATOM 1098 CB LEU A 66 9.709 -6.515 -16.487 1.00 0.00 C ATOM 1099 CG LEU A 66 10.427 -7.666 -15.782 1.00 0.00 C ATOM 1100 CD1 LEU A 66 10.598 -7.362 -14.302 1.00 0.00 C ATOM 1101 CD2 LEU A 66 9.666 -8.969 -15.977 1.00 0.00 C ATOM 0 H LEU A 66 7.605 -5.911 -17.800 1.00 0.00 H new ATOM 0 HA LEU A 66 8.136 -6.734 -15.040 1.00 0.00 H new ATOM 0 HB2 LEU A 66 9.515 -6.811 -17.518 1.00 0.00 H new ATOM 0 HB3 LEU A 66 10.384 -5.660 -16.523 1.00 0.00 H new ATOM 0 HG LEU A 66 11.417 -7.777 -16.225 1.00 0.00 H new ATOM 0 HD11 LEU A 66 11.111 -8.192 -13.817 1.00 0.00 H new ATOM 0 HD12 LEU A 66 11.187 -6.453 -14.183 1.00 0.00 H new ATOM 0 HD13 LEU A 66 9.619 -7.223 -13.844 1.00 0.00 H new ATOM 0 HD21 LEU A 66 10.192 -9.777 -15.468 1.00 0.00 H new ATOM 0 HD22 LEU A 66 8.663 -8.870 -15.561 1.00 0.00 H new ATOM 0 HD23 LEU A 66 9.597 -9.194 -17.041 1.00 0.00 H new ATOM 1113 N LYS A 67 8.020 -3.672 -16.034 1.00 0.00 N ATOM 1114 CA LYS A 67 8.090 -2.278 -15.611 1.00 0.00 C ATOM 1115 C LYS A 67 7.469 -2.097 -14.229 1.00 0.00 C ATOM 1116 O LYS A 67 7.931 -1.281 -13.433 1.00 0.00 O ATOM 1117 CB LYS A 67 7.378 -1.379 -16.624 1.00 0.00 C ATOM 1118 CG LYS A 67 8.323 -0.505 -17.431 1.00 0.00 C ATOM 1119 CD LYS A 67 7.892 0.952 -17.406 1.00 0.00 C ATOM 1120 CE LYS A 67 6.495 1.130 -17.981 1.00 0.00 C ATOM 1121 NZ LYS A 67 6.167 2.565 -18.206 1.00 0.00 N ATOM 0 H LYS A 67 7.547 -3.818 -16.926 1.00 0.00 H new ATOM 0 HA LYS A 67 9.141 -1.993 -15.558 1.00 0.00 H new ATOM 0 HB2 LYS A 67 6.800 -2.002 -17.307 1.00 0.00 H new ATOM 0 HB3 LYS A 67 6.669 -0.742 -16.096 1.00 0.00 H new ATOM 0 HG2 LYS A 67 9.333 -0.594 -17.031 1.00 0.00 H new ATOM 0 HG3 LYS A 67 8.356 -0.858 -18.462 1.00 0.00 H new ATOM 0 HD2 LYS A 67 7.914 1.322 -16.381 1.00 0.00 H new ATOM 0 HD3 LYS A 67 8.601 1.552 -17.977 1.00 0.00 H new ATOM 0 HE2 LYS A 67 6.418 0.588 -18.923 1.00 0.00 H new ATOM 0 HE3 LYS A 67 5.764 0.693 -17.301 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 5.207 2.644 -18.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 6.215 3.078 -17.303 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 6.849 2.976 -18.875 1.00 0.00 H new ATOM 1135 N ALA A 68 6.420 -2.865 -13.952 1.00 0.00 N ATOM 1136 CA ALA A 68 5.738 -2.791 -12.666 1.00 0.00 C ATOM 1137 C ALA A 68 6.047 -4.014 -11.810 1.00 0.00 C ATOM 1138 O ALA A 68 5.444 -4.215 -10.757 1.00 0.00 O ATOM 1139 CB ALA A 68 4.237 -2.654 -12.872 1.00 0.00 C ATOM 0 H ALA A 68 6.024 -3.545 -14.601 1.00 0.00 H new ATOM 0 HA ALA A 68 6.103 -1.910 -12.139 1.00 0.00 H new ATOM 0 HB1 ALA A 68 3.740 -2.600 -11.903 1.00 0.00 H new ATOM 0 HB2 ALA A 68 4.029 -1.746 -13.438 1.00 0.00 H new ATOM 0 HB3 ALA A 68 3.865 -3.518 -13.423 1.00 0.00 H new ATOM 1145 N ASN A 69 6.991 -4.830 -12.270 1.00 0.00 N ATOM 1146 CA ASN A 69 7.379 -6.035 -11.546 1.00 0.00 C ATOM 1147 C ASN A 69 8.874 -6.030 -11.244 1.00 0.00 C ATOM 1148 O ASN A 69 9.387 -6.931 -10.578 1.00 0.00 O ATOM 1149 CB ASN A 69 7.015 -7.281 -12.356 1.00 0.00 C ATOM 1150 CG ASN A 69 5.612 -7.774 -12.059 1.00 0.00 C ATOM 1151 OD1 ASN A 69 5.382 -8.464 -11.065 1.00 0.00 O ATOM 1152 ND2 ASN A 69 4.666 -7.423 -12.922 1.00 0.00 N ATOM 0 H ASN A 69 7.501 -4.678 -13.140 1.00 0.00 H new ATOM 0 HA ASN A 69 6.836 -6.052 -10.601 1.00 0.00 H new ATOM 0 HB2 ASN A 69 7.101 -7.058 -13.419 1.00 0.00 H new ATOM 0 HB3 ASN A 69 7.730 -8.074 -12.138 1.00 0.00 H new ATOM 0 HD21 ASN A 69 3.703 -7.726 -12.775 1.00 0.00 H new ATOM 0 HD22 ASN A 69 4.902 -6.850 -13.732 1.00 0.00 H new ATOM 1159 N LEU A 70 9.568 -5.010 -11.737 1.00 0.00 N ATOM 1160 CA LEU A 70 11.005 -4.887 -11.519 1.00 0.00 C ATOM 1161 C LEU A 70 11.343 -4.994 -10.035 1.00 0.00 C ATOM 1162 O LEU A 70 12.160 -5.815 -9.617 1.00 0.00 O ATOM 1163 CB LEU A 70 11.513 -3.555 -12.074 1.00 0.00 C ATOM 1164 CG LEU A 70 12.845 -3.603 -12.822 1.00 0.00 C ATOM 1165 CD1 LEU A 70 13.862 -4.427 -12.049 1.00 0.00 C ATOM 1166 CD2 LEU A 70 12.651 -4.169 -14.222 1.00 0.00 C ATOM 0 H LEU A 70 9.159 -4.257 -12.290 1.00 0.00 H new ATOM 0 HA LEU A 70 11.498 -5.705 -12.045 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.756 -3.152 -12.747 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.609 -2.853 -11.246 1.00 0.00 H new ATOM 0 HG LEU A 70 13.225 -2.586 -12.912 1.00 0.00 H new ATOM 0 HD11 LEU A 70 14.804 -4.450 -12.597 1.00 0.00 H new ATOM 0 HD12 LEU A 70 14.023 -3.979 -11.068 1.00 0.00 H new ATOM 0 HD13 LEU A 70 13.489 -5.444 -11.926 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.610 -4.196 -14.740 1.00 0.00 H new ATOM 0 HD22 LEU A 70 12.247 -5.179 -14.153 1.00 0.00 H new ATOM 0 HD23 LEU A 70 11.957 -3.538 -14.777 1.00 0.00 H new ATOM 1178 N PRO A 71 10.698 -4.147 -9.219 1.00 0.00 N ATOM 1179 CA PRO A 71 10.912 -4.129 -7.769 1.00 0.00 C ATOM 1180 C PRO A 71 10.350 -5.371 -7.085 1.00 0.00 C ATOM 1181 O PRO A 71 10.688 -5.667 -5.938 1.00 0.00 O ATOM 1182 CB PRO A 71 10.154 -2.879 -7.315 1.00 0.00 C ATOM 1183 CG PRO A 71 9.108 -2.671 -8.355 1.00 0.00 C ATOM 1184 CD PRO A 71 9.711 -3.142 -9.649 1.00 0.00 C ATOM 0 HA PRO A 71 11.971 -4.119 -7.513 1.00 0.00 H new ATOM 0 HB2 PRO A 71 9.710 -3.022 -6.330 1.00 0.00 H new ATOM 0 HB3 PRO A 71 10.818 -2.018 -7.244 1.00 0.00 H new ATOM 0 HG2 PRO A 71 8.205 -3.233 -8.118 1.00 0.00 H new ATOM 0 HG3 PRO A 71 8.823 -1.621 -8.417 1.00 0.00 H new ATOM 0 HD2 PRO A 71 8.959 -3.574 -10.309 1.00 0.00 H new ATOM 0 HD3 PRO A 71 10.182 -2.324 -10.194 1.00 0.00 H new ATOM 1192 N LEU A 72 9.491 -6.094 -7.795 1.00 0.00 N ATOM 1193 CA LEU A 72 8.882 -7.305 -7.256 1.00 0.00 C ATOM 1194 C LEU A 72 9.690 -8.539 -7.642 1.00 0.00 C ATOM 1195 O LEU A 72 9.595 -9.584 -6.997 1.00 0.00 O ATOM 1196 CB LEU A 72 7.444 -7.444 -7.759 1.00 0.00 C ATOM 1197 CG LEU A 72 6.361 -6.817 -6.880 1.00 0.00 C ATOM 1198 CD1 LEU A 72 6.561 -7.211 -5.425 1.00 0.00 C ATOM 1199 CD2 LEU A 72 6.363 -5.303 -7.030 1.00 0.00 C ATOM 0 H LEU A 72 9.201 -5.863 -8.745 1.00 0.00 H new ATOM 0 HA LEU A 72 8.874 -7.225 -6.169 1.00 0.00 H new ATOM 0 HB2 LEU A 72 7.383 -6.996 -8.751 1.00 0.00 H new ATOM 0 HB3 LEU A 72 7.221 -8.505 -7.874 1.00 0.00 H new ATOM 0 HG LEU A 72 5.391 -7.193 -7.207 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.781 -6.756 -4.814 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.508 -8.296 -5.331 1.00 0.00 H new ATOM 0 HD13 LEU A 72 7.537 -6.864 -5.085 1.00 0.00 H new ATOM 0 HD21 LEU A 72 5.586 -4.874 -6.397 1.00 0.00 H new ATOM 0 HD22 LEU A 72 7.334 -4.909 -6.730 1.00 0.00 H new ATOM 0 HD23 LEU A 72 6.170 -5.040 -8.070 1.00 0.00 H new ATOM 1211 N LEU A 73 10.485 -8.412 -8.699 1.00 0.00 N ATOM 1212 CA LEU A 73 11.313 -9.516 -9.171 1.00 0.00 C ATOM 1213 C LEU A 73 12.656 -9.538 -8.449 1.00 0.00 C ATOM 1214 O LEU A 73 13.235 -10.601 -8.227 1.00 0.00 O ATOM 1215 CB LEU A 73 11.534 -9.405 -10.680 1.00 0.00 C ATOM 1216 CG LEU A 73 10.874 -10.486 -11.537 1.00 0.00 C ATOM 1217 CD1 LEU A 73 11.438 -11.856 -11.196 1.00 0.00 C ATOM 1218 CD2 LEU A 73 9.364 -10.467 -11.349 1.00 0.00 C ATOM 0 H LEU A 73 10.574 -7.555 -9.245 1.00 0.00 H new ATOM 0 HA LEU A 73 10.790 -10.448 -8.954 1.00 0.00 H new ATOM 0 HB2 LEU A 73 11.167 -8.433 -11.010 1.00 0.00 H new ATOM 0 HB3 LEU A 73 12.607 -9.422 -10.872 1.00 0.00 H new ATOM 0 HG LEU A 73 11.093 -10.276 -12.584 1.00 0.00 H new ATOM 0 HD11 LEU A 73 10.956 -12.612 -11.816 1.00 0.00 H new ATOM 0 HD12 LEU A 73 12.512 -11.864 -11.382 1.00 0.00 H new ATOM 0 HD13 LEU A 73 11.251 -12.075 -10.145 1.00 0.00 H new ATOM 0 HD21 LEU A 73 8.911 -11.243 -11.966 1.00 0.00 H new ATOM 0 HD22 LEU A 73 9.125 -10.651 -10.302 1.00 0.00 H new ATOM 0 HD23 LEU A 73 8.973 -9.493 -11.644 1.00 0.00 H new ATOM 1230 N GLN A 74 13.145 -8.357 -8.083 1.00 0.00 N ATOM 1231 CA GLN A 74 14.419 -8.241 -7.384 1.00 0.00 C ATOM 1232 C GLN A 74 14.301 -8.745 -5.950 1.00 0.00 C ATOM 1233 O GLN A 74 15.294 -8.825 -5.226 1.00 0.00 O ATOM 1234 CB GLN A 74 14.898 -6.788 -7.389 1.00 0.00 C ATOM 1235 CG GLN A 74 13.873 -5.809 -6.840 1.00 0.00 C ATOM 1236 CD GLN A 74 14.127 -5.452 -5.388 1.00 0.00 C ATOM 1237 OE1 GLN A 74 15.021 -6.006 -4.748 1.00 0.00 O ATOM 1238 NE2 GLN A 74 13.339 -4.523 -4.860 1.00 0.00 N ATOM 0 H GLN A 74 12.678 -7.467 -8.259 1.00 0.00 H new ATOM 0 HA GLN A 74 15.149 -8.858 -7.908 1.00 0.00 H new ATOM 0 HB2 GLN A 74 15.812 -6.713 -6.800 1.00 0.00 H new ATOM 0 HB3 GLN A 74 15.152 -6.501 -8.409 1.00 0.00 H new ATOM 0 HG2 GLN A 74 13.886 -4.900 -7.441 1.00 0.00 H new ATOM 0 HG3 GLN A 74 12.877 -6.240 -6.935 1.00 0.00 H new ATOM 0 HE21 GLN A 74 12.610 -4.090 -5.427 1.00 0.00 H new ATOM 0 HE22 GLN A 74 13.462 -4.242 -3.887 1.00 0.00 H new ATOM 1247 N ARG A 75 13.081 -9.083 -5.545 1.00 0.00 N ATOM 1248 CA ARG A 75 12.834 -9.577 -4.196 1.00 0.00 C ATOM 1249 C ARG A 75 13.144 -11.068 -4.098 1.00 0.00 C ATOM 1250 O ARG A 75 13.938 -11.492 -3.259 1.00 0.00 O ATOM 1251 CB ARG A 75 11.380 -9.321 -3.795 1.00 0.00 C ATOM 1252 CG ARG A 75 10.846 -7.978 -4.266 1.00 0.00 C ATOM 1253 CD ARG A 75 11.224 -6.860 -3.306 1.00 0.00 C ATOM 1254 NE ARG A 75 12.670 -6.754 -3.133 1.00 0.00 N ATOM 1255 CZ ARG A 75 13.244 -6.189 -2.076 1.00 0.00 C ATOM 1256 NH1 ARG A 75 12.497 -5.682 -1.104 1.00 0.00 N ATOM 1257 NH2 ARG A 75 14.566 -6.130 -1.990 1.00 0.00 N ATOM 0 H ARG A 75 12.249 -9.024 -6.132 1.00 0.00 H new ATOM 0 HA ARG A 75 13.493 -9.040 -3.513 1.00 0.00 H new ATOM 0 HB2 ARG A 75 10.754 -10.115 -4.203 1.00 0.00 H new ATOM 0 HB3 ARG A 75 11.296 -9.375 -2.710 1.00 0.00 H new ATOM 0 HG2 ARG A 75 11.240 -7.756 -5.258 1.00 0.00 H new ATOM 0 HG3 ARG A 75 9.761 -8.029 -4.358 1.00 0.00 H new ATOM 0 HD2 ARG A 75 10.833 -5.914 -3.680 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.755 -7.039 -2.338 1.00 0.00 H new ATOM 0 HE ARG A 75 13.272 -7.134 -3.863 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.480 -5.725 -1.167 1.00 0.00 H new ATOM 0 HH12 ARG A 75 12.940 -5.249 -0.294 1.00 0.00 H new ATOM 0 HH21 ARG A 75 15.143 -6.519 -2.736 1.00 0.00 H new ATOM 0 HH22 ARG A 75 15.005 -5.696 -1.178 1.00 0.00 H new ATOM 1271 N GLU A 76 12.512 -11.857 -4.961 1.00 0.00 N ATOM 1272 CA GLU A 76 12.720 -13.300 -4.970 1.00 0.00 C ATOM 1273 C GLU A 76 14.193 -13.636 -5.184 1.00 0.00 C ATOM 1274 O GLU A 76 14.654 -14.719 -4.820 1.00 0.00 O ATOM 1275 CB GLU A 76 11.873 -13.953 -6.063 1.00 0.00 C ATOM 1276 CG GLU A 76 12.494 -13.867 -7.447 1.00 0.00 C ATOM 1277 CD GLU A 76 13.454 -15.006 -7.728 1.00 0.00 C ATOM 1278 OE1 GLU A 76 13.530 -15.937 -6.900 1.00 0.00 O ATOM 1279 OE2 GLU A 76 14.131 -14.966 -8.777 1.00 0.00 O ATOM 0 H GLU A 76 11.852 -11.521 -5.663 1.00 0.00 H new ATOM 0 HA GLU A 76 12.413 -13.691 -4.000 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.714 -15.001 -5.810 1.00 0.00 H new ATOM 0 HB3 GLU A 76 10.892 -13.478 -6.084 1.00 0.00 H new ATOM 0 HG2 GLU A 76 11.703 -13.870 -8.197 1.00 0.00 H new ATOM 0 HG3 GLU A 76 13.023 -12.919 -7.546 1.00 0.00 H new ATOM 1286 N LEU A 77 14.927 -12.700 -5.776 1.00 0.00 N ATOM 1287 CA LEU A 77 16.348 -12.896 -6.040 1.00 0.00 C ATOM 1288 C LEU A 77 17.104 -13.201 -4.751 1.00 0.00 C ATOM 1289 O LEU A 77 18.159 -13.838 -4.772 1.00 0.00 O ATOM 1290 CB LEU A 77 16.939 -11.653 -6.709 1.00 0.00 C ATOM 1291 CG LEU A 77 17.724 -11.894 -7.999 1.00 0.00 C ATOM 1292 CD1 LEU A 77 16.777 -12.068 -9.176 1.00 0.00 C ATOM 1293 CD2 LEU A 77 18.693 -10.749 -8.255 1.00 0.00 C ATOM 0 H LEU A 77 14.562 -11.798 -6.082 1.00 0.00 H new ATOM 0 HA LEU A 77 16.453 -13.748 -6.712 1.00 0.00 H new ATOM 0 HB2 LEU A 77 16.126 -10.961 -6.926 1.00 0.00 H new ATOM 0 HB3 LEU A 77 17.597 -11.158 -5.994 1.00 0.00 H new ATOM 0 HG LEU A 77 18.300 -12.812 -7.885 1.00 0.00 H new ATOM 0 HD11 LEU A 77 17.354 -12.238 -10.085 1.00 0.00 H new ATOM 0 HD12 LEU A 77 16.124 -12.922 -8.995 1.00 0.00 H new ATOM 0 HD13 LEU A 77 16.173 -11.168 -9.293 1.00 0.00 H new ATOM 0 HD21 LEU A 77 19.243 -10.937 -9.177 1.00 0.00 H new ATOM 0 HD22 LEU A 77 18.137 -9.816 -8.348 1.00 0.00 H new ATOM 0 HD23 LEU A 77 19.394 -10.673 -7.424 1.00 0.00 H new ATOM 1305 N LEU A 78 16.559 -12.744 -3.629 1.00 0.00 N ATOM 1306 CA LEU A 78 17.180 -12.970 -2.329 1.00 0.00 C ATOM 1307 C LEU A 78 17.040 -14.428 -1.904 1.00 0.00 C ATOM 1308 O LEU A 78 17.640 -14.860 -0.919 1.00 0.00 O ATOM 1309 CB LEU A 78 16.551 -12.057 -1.275 1.00 0.00 C ATOM 1310 CG LEU A 78 17.152 -10.656 -1.155 1.00 0.00 C ATOM 1311 CD1 LEU A 78 18.529 -10.719 -0.513 1.00 0.00 C ATOM 1312 CD2 LEU A 78 17.229 -9.990 -2.522 1.00 0.00 C ATOM 0 H LEU A 78 15.688 -12.215 -3.594 1.00 0.00 H new ATOM 0 HA LEU A 78 18.241 -12.737 -2.416 1.00 0.00 H new ATOM 0 HB2 LEU A 78 15.489 -11.957 -1.497 1.00 0.00 H new ATOM 0 HB3 LEU A 78 16.629 -12.548 -0.305 1.00 0.00 H new ATOM 0 HG LEU A 78 16.503 -10.057 -0.516 1.00 0.00 H new ATOM 0 HD11 LEU A 78 18.941 -9.713 -0.436 1.00 0.00 H new ATOM 0 HD12 LEU A 78 18.447 -11.155 0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 78 19.188 -11.335 -1.125 1.00 0.00 H new ATOM 0 HD21 LEU A 78 17.659 -8.994 -2.418 1.00 0.00 H new ATOM 0 HD22 LEU A 78 17.856 -10.588 -3.183 1.00 0.00 H new ATOM 0 HD23 LEU A 78 16.228 -9.910 -2.945 1.00 0.00 H new ATOM 1324 N HIS A 79 16.244 -15.184 -2.654 1.00 0.00 N ATOM 1325 CA HIS A 79 16.027 -16.595 -2.357 1.00 0.00 C ATOM 1326 C HIS A 79 17.093 -17.461 -3.022 1.00 0.00 C ATOM 1327 O HIS A 79 17.682 -18.334 -2.386 1.00 0.00 O ATOM 1328 CB HIS A 79 14.637 -17.029 -2.824 1.00 0.00 C ATOM 1329 CG HIS A 79 14.369 -18.490 -2.633 1.00 0.00 C ATOM 1330 ND1 HIS A 79 14.973 -19.243 -1.648 1.00 0.00 N ATOM 1331 CD2 HIS A 79 13.556 -19.336 -3.306 1.00 0.00 C ATOM 1332 CE1 HIS A 79 14.544 -20.490 -1.725 1.00 0.00 C ATOM 1333 NE2 HIS A 79 13.682 -20.573 -2.723 1.00 0.00 N ATOM 0 H HIS A 79 15.739 -14.843 -3.472 1.00 0.00 H new ATOM 0 HA HIS A 79 16.097 -16.728 -1.277 1.00 0.00 H new ATOM 0 HB2 HIS A 79 13.885 -16.456 -2.281 1.00 0.00 H new ATOM 0 HB3 HIS A 79 14.524 -16.783 -3.880 1.00 0.00 H new ATOM 0 HD2 HIS A 79 12.925 -19.085 -4.146 1.00 0.00 H new ATOM 0 HE1 HIS A 79 14.846 -21.303 -1.082 1.00 0.00 H new ATOM 0 HE2 HIS A 79 13.190 -21.418 -3.013 1.00 0.00 H new ATOM 1341 N ALA A 80 17.335 -17.212 -4.304 1.00 0.00 N ATOM 1342 CA ALA A 80 18.330 -17.968 -5.055 1.00 0.00 C ATOM 1343 C ALA A 80 19.657 -18.023 -4.305 1.00 0.00 C ATOM 1344 O ALA A 80 20.277 -19.080 -4.198 1.00 0.00 O ATOM 1345 CB ALA A 80 18.527 -17.357 -6.434 1.00 0.00 C ATOM 0 H ALA A 80 16.856 -16.492 -4.845 1.00 0.00 H new ATOM 0 HA ALA A 80 17.964 -18.988 -5.171 1.00 0.00 H new ATOM 0 HB1 ALA A 80 19.273 -17.932 -6.983 1.00 0.00 H new ATOM 0 HB2 ALA A 80 17.583 -17.374 -6.978 1.00 0.00 H new ATOM 0 HB3 ALA A 80 18.867 -16.327 -6.330 1.00 0.00 H new ATOM 1351 N ALA A 81 20.088 -16.876 -3.788 1.00 0.00 N ATOM 1352 CA ALA A 81 21.340 -16.795 -3.047 1.00 0.00 C ATOM 1353 C ALA A 81 21.379 -17.822 -1.921 1.00 0.00 C ATOM 1354 O ALA A 81 22.401 -18.472 -1.696 1.00 0.00 O ATOM 1355 CB ALA A 81 21.535 -15.392 -2.492 1.00 0.00 C ATOM 0 H ALA A 81 19.588 -15.991 -3.869 1.00 0.00 H new ATOM 0 HA ALA A 81 22.156 -17.018 -3.735 1.00 0.00 H new ATOM 0 HB1 ALA A 81 22.474 -15.346 -1.941 1.00 0.00 H new ATOM 0 HB2 ALA A 81 21.561 -14.676 -3.314 1.00 0.00 H new ATOM 0 HB3 ALA A 81 20.710 -15.147 -1.823 1.00 0.00 H new ATOM 1361 N ARG A 82 20.262 -17.962 -1.215 1.00 0.00 N ATOM 1362 CA ARG A 82 20.170 -18.909 -0.110 1.00 0.00 C ATOM 1363 C ARG A 82 20.524 -20.319 -0.572 1.00 0.00 C ATOM 1364 O ARG A 82 21.526 -20.892 -0.142 1.00 0.00 O ATOM 1365 CB ARG A 82 18.761 -18.894 0.485 1.00 0.00 C ATOM 1366 CG ARG A 82 18.269 -17.504 0.853 1.00 0.00 C ATOM 1367 CD ARG A 82 19.214 -16.819 1.828 1.00 0.00 C ATOM 1368 NE ARG A 82 19.538 -17.672 2.968 1.00 0.00 N ATOM 1369 CZ ARG A 82 20.490 -17.391 3.850 1.00 0.00 C ATOM 1370 NH1 ARG A 82 21.209 -16.284 3.724 1.00 0.00 N ATOM 1371 NH2 ARG A 82 20.725 -18.217 4.861 1.00 0.00 N ATOM 0 H ARG A 82 19.408 -17.432 -1.388 1.00 0.00 H new ATOM 0 HA ARG A 82 20.884 -18.607 0.656 1.00 0.00 H new ATOM 0 HB2 ARG A 82 18.069 -19.337 -0.231 1.00 0.00 H new ATOM 0 HB3 ARG A 82 18.745 -19.523 1.375 1.00 0.00 H new ATOM 0 HG2 ARG A 82 18.174 -16.900 -0.049 1.00 0.00 H new ATOM 0 HG3 ARG A 82 17.275 -17.574 1.296 1.00 0.00 H new ATOM 0 HD2 ARG A 82 20.132 -16.543 1.309 1.00 0.00 H new ATOM 0 HD3 ARG A 82 18.759 -15.895 2.185 1.00 0.00 H new ATOM 0 HE ARG A 82 19.003 -18.531 3.094 1.00 0.00 H new ATOM 0 HH11 ARG A 82 21.031 -15.646 2.948 1.00 0.00 H new ATOM 0 HH12 ARG A 82 21.940 -16.070 4.403 1.00 0.00 H new ATOM 0 HH21 ARG A 82 20.174 -19.069 4.962 1.00 0.00 H new ATOM 0 HH22 ARG A 82 21.457 -18.000 5.538 1.00 0.00 H new ATOM 1385 N LEU A 83 19.695 -20.875 -1.449 1.00 0.00 N ATOM 1386 CA LEU A 83 19.920 -22.219 -1.970 1.00 0.00 C ATOM 1387 C LEU A 83 21.296 -22.328 -2.619 1.00 0.00 C ATOM 1388 O LEU A 83 21.963 -23.358 -2.514 1.00 0.00 O ATOM 1389 CB LEU A 83 18.835 -22.583 -2.984 1.00 0.00 C ATOM 1390 CG LEU A 83 18.949 -23.968 -3.621 1.00 0.00 C ATOM 1391 CD1 LEU A 83 19.920 -23.940 -4.791 1.00 0.00 C ATOM 1392 CD2 LEU A 83 19.386 -24.996 -2.588 1.00 0.00 C ATOM 0 H LEU A 83 18.861 -20.416 -1.814 1.00 0.00 H new ATOM 0 HA LEU A 83 19.876 -22.918 -1.134 1.00 0.00 H new ATOM 0 HB2 LEU A 83 17.866 -22.511 -2.491 1.00 0.00 H new ATOM 0 HB3 LEU A 83 18.844 -21.838 -3.779 1.00 0.00 H new ATOM 0 HG LEU A 83 17.967 -24.255 -3.997 1.00 0.00 H new ATOM 0 HD11 LEU A 83 19.988 -24.935 -5.231 1.00 0.00 H new ATOM 0 HD12 LEU A 83 19.565 -23.234 -5.542 1.00 0.00 H new ATOM 0 HD13 LEU A 83 20.904 -23.631 -4.440 1.00 0.00 H new ATOM 0 HD21 LEU A 83 19.462 -25.976 -3.059 1.00 0.00 H new ATOM 0 HD22 LEU A 83 20.357 -24.713 -2.181 1.00 0.00 H new ATOM 0 HD23 LEU A 83 18.653 -25.037 -1.782 1.00 0.00 H new ATOM 1404 N ALA A 84 21.716 -21.259 -3.287 1.00 0.00 N ATOM 1405 CA ALA A 84 23.015 -21.234 -3.950 1.00 0.00 C ATOM 1406 C ALA A 84 24.147 -21.124 -2.934 1.00 0.00 C ATOM 1407 O ALA A 84 25.318 -21.295 -3.273 1.00 0.00 O ATOM 1408 CB ALA A 84 23.078 -20.082 -4.941 1.00 0.00 C ATOM 0 H ALA A 84 21.176 -20.399 -3.384 1.00 0.00 H new ATOM 0 HA ALA A 84 23.138 -22.172 -4.492 1.00 0.00 H new ATOM 0 HB1 ALA A 84 24.053 -20.075 -5.429 1.00 0.00 H new ATOM 0 HB2 ALA A 84 22.297 -20.205 -5.692 1.00 0.00 H new ATOM 0 HB3 ALA A 84 22.929 -19.140 -4.414 1.00 0.00 H new ATOM 1414 N LYS A 85 23.791 -20.836 -1.687 1.00 0.00 N ATOM 1415 CA LYS A 85 24.776 -20.703 -0.621 1.00 0.00 C ATOM 1416 C LYS A 85 25.719 -19.535 -0.893 1.00 0.00 C ATOM 1417 O LYS A 85 26.904 -19.594 -0.566 1.00 0.00 O ATOM 1418 CB LYS A 85 25.579 -21.998 -0.476 1.00 0.00 C ATOM 1419 CG LYS A 85 24.721 -23.251 -0.495 1.00 0.00 C ATOM 1420 CD LYS A 85 23.750 -23.279 0.674 1.00 0.00 C ATOM 1421 CE LYS A 85 24.477 -23.443 1.999 1.00 0.00 C ATOM 1422 NZ LYS A 85 25.345 -24.653 2.010 1.00 0.00 N ATOM 0 H LYS A 85 22.826 -20.690 -1.390 1.00 0.00 H new ATOM 0 HA LYS A 85 24.243 -20.507 0.309 1.00 0.00 H new ATOM 0 HB2 LYS A 85 26.309 -22.055 -1.283 1.00 0.00 H new ATOM 0 HB3 LYS A 85 26.139 -21.966 0.458 1.00 0.00 H new ATOM 0 HG2 LYS A 85 24.166 -23.299 -1.432 1.00 0.00 H new ATOM 0 HG3 LYS A 85 25.361 -24.132 -0.459 1.00 0.00 H new ATOM 0 HD2 LYS A 85 23.169 -22.357 0.688 1.00 0.00 H new ATOM 0 HD3 LYS A 85 23.043 -24.098 0.542 1.00 0.00 H new ATOM 0 HE2 LYS A 85 25.084 -22.559 2.192 1.00 0.00 H new ATOM 0 HE3 LYS A 85 23.748 -23.511 2.807 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 25.578 -24.904 2.992 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 24.842 -25.445 1.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 26.221 -24.457 1.485 1.00 0.00 H new ATOM 1436 N GLN A 86 25.184 -18.477 -1.493 1.00 0.00 N ATOM 1437 CA GLN A 86 25.979 -17.295 -1.808 1.00 0.00 C ATOM 1438 C GLN A 86 25.174 -16.021 -1.578 1.00 0.00 C ATOM 1439 O GLN A 86 24.011 -16.073 -1.182 1.00 0.00 O ATOM 1440 CB GLN A 86 26.463 -17.353 -3.258 1.00 0.00 C ATOM 1441 CG GLN A 86 26.728 -18.765 -3.755 1.00 0.00 C ATOM 1442 CD GLN A 86 27.712 -18.802 -4.908 1.00 0.00 C ATOM 1443 OE1 GLN A 86 28.920 -18.664 -4.712 1.00 0.00 O ATOM 1444 NE2 GLN A 86 27.200 -18.990 -6.118 1.00 0.00 N ATOM 0 H GLN A 86 24.205 -18.413 -1.771 1.00 0.00 H new ATOM 0 HA GLN A 86 26.843 -17.281 -1.144 1.00 0.00 H new ATOM 0 HB2 GLN A 86 25.717 -16.885 -3.900 1.00 0.00 H new ATOM 0 HB3 GLN A 86 27.377 -16.767 -3.351 1.00 0.00 H new ATOM 0 HG2 GLN A 86 27.114 -19.369 -2.934 1.00 0.00 H new ATOM 0 HG3 GLN A 86 25.788 -19.218 -4.070 1.00 0.00 H new ATOM 0 HE21 GLN A 86 26.193 -19.100 -6.234 1.00 0.00 H new ATOM 0 HE22 GLN A 86 27.814 -19.025 -6.932 1.00 0.00 H new ATOM 1453 N ASN A 87 25.802 -14.877 -1.830 1.00 0.00 N ATOM 1454 CA ASN A 87 25.144 -13.588 -1.649 1.00 0.00 C ATOM 1455 C ASN A 87 24.185 -13.301 -2.801 1.00 0.00 C ATOM 1456 O ASN A 87 24.360 -13.779 -3.921 1.00 0.00 O ATOM 1457 CB ASN A 87 26.185 -12.470 -1.547 1.00 0.00 C ATOM 1458 CG ASN A 87 26.685 -12.274 -0.129 1.00 0.00 C ATOM 1459 OD1 ASN A 87 25.758 -12.157 0.814 1.00 0.00 O flip ATOM 1460 ND2 ASN A 87 27.891 -12.229 0.115 1.00 0.00 N flip ATOM 0 H ASN A 87 26.765 -14.816 -2.160 1.00 0.00 H new ATOM 0 HA ASN A 87 24.571 -13.627 -0.723 1.00 0.00 H new ATOM 0 HB2 ASN A 87 27.028 -12.702 -2.198 1.00 0.00 H new ATOM 0 HB3 ASN A 87 25.750 -11.538 -1.908 1.00 0.00 H new ATOM 0 HD21 ASN A 87 28.568 -12.324 -0.642 1.00 0.00 H new ATOM 0 HD22 ASN A 87 28.213 -12.097 1.074 1.00 0.00 H new ATOM 1467 N PRO A 88 23.146 -12.501 -2.520 1.00 0.00 N ATOM 1468 CA PRO A 88 22.139 -12.131 -3.518 1.00 0.00 C ATOM 1469 C PRO A 88 22.697 -11.195 -4.586 1.00 0.00 C ATOM 1470 O PRO A 88 22.123 -11.059 -5.666 1.00 0.00 O ATOM 1471 CB PRO A 88 21.064 -11.419 -2.692 1.00 0.00 C ATOM 1472 CG PRO A 88 21.788 -10.898 -1.499 1.00 0.00 C ATOM 1473 CD PRO A 88 22.875 -11.895 -1.205 1.00 0.00 C ATOM 0 HA PRO A 88 21.770 -12.999 -4.065 1.00 0.00 H new ATOM 0 HB2 PRO A 88 20.600 -10.611 -3.258 1.00 0.00 H new ATOM 0 HB3 PRO A 88 20.267 -12.105 -2.404 1.00 0.00 H new ATOM 0 HG2 PRO A 88 22.207 -9.911 -1.697 1.00 0.00 H new ATOM 0 HG3 PRO A 88 21.114 -10.793 -0.649 1.00 0.00 H new ATOM 0 HD2 PRO A 88 23.762 -11.413 -0.794 1.00 0.00 H new ATOM 0 HD3 PRO A 88 22.551 -12.640 -0.478 1.00 0.00 H new ATOM 1481 N ALA A 89 23.818 -10.554 -4.275 1.00 0.00 N ATOM 1482 CA ALA A 89 24.455 -9.633 -5.209 1.00 0.00 C ATOM 1483 C ALA A 89 25.519 -10.342 -6.040 1.00 0.00 C ATOM 1484 O ALA A 89 25.591 -10.162 -7.256 1.00 0.00 O ATOM 1485 CB ALA A 89 25.065 -8.458 -4.459 1.00 0.00 C ATOM 0 H ALA A 89 24.304 -10.655 -3.384 1.00 0.00 H new ATOM 0 HA ALA A 89 23.690 -9.258 -5.889 1.00 0.00 H new ATOM 0 HB1 ALA A 89 25.537 -7.779 -5.169 1.00 0.00 H new ATOM 0 HB2 ALA A 89 24.283 -7.928 -3.915 1.00 0.00 H new ATOM 0 HB3 ALA A 89 25.813 -8.824 -3.755 1.00 0.00 H new ATOM 1491 N GLN A 90 26.341 -11.148 -5.377 1.00 0.00 N ATOM 1492 CA GLN A 90 27.402 -11.883 -6.056 1.00 0.00 C ATOM 1493 C GLN A 90 26.862 -13.166 -6.680 1.00 0.00 C ATOM 1494 O GLN A 90 27.548 -13.824 -7.462 1.00 0.00 O ATOM 1495 CB GLN A 90 28.530 -12.213 -5.077 1.00 0.00 C ATOM 1496 CG GLN A 90 28.275 -13.467 -4.256 1.00 0.00 C ATOM 1497 CD GLN A 90 28.996 -14.682 -4.807 1.00 0.00 C ATOM 1498 OE1 GLN A 90 28.245 -15.587 -5.424 1.00 0.00 O flip ATOM 1499 NE2 GLN A 90 30.214 -14.806 -4.679 1.00 0.00 N flip ATOM 0 H GLN A 90 26.293 -11.309 -4.371 1.00 0.00 H new ATOM 0 HA GLN A 90 27.795 -11.251 -6.852 1.00 0.00 H new ATOM 0 HB2 GLN A 90 29.459 -12.336 -5.634 1.00 0.00 H new ATOM 0 HB3 GLN A 90 28.672 -11.369 -4.402 1.00 0.00 H new ATOM 0 HG2 GLN A 90 28.594 -13.295 -3.228 1.00 0.00 H new ATOM 0 HG3 GLN A 90 27.204 -13.667 -4.228 1.00 0.00 H new ATOM 0 HE21 GLN A 90 30.752 -14.086 -4.197 1.00 0.00 H new ATOM 0 HE22 GLN A 90 30.685 -15.629 -5.054 1.00 0.00 H new ATOM 1508 N TYR A 91 25.630 -13.515 -6.329 1.00 0.00 N ATOM 1509 CA TYR A 91 24.999 -14.721 -6.852 1.00 0.00 C ATOM 1510 C TYR A 91 25.209 -14.836 -8.359 1.00 0.00 C ATOM 1511 O TYR A 91 25.827 -15.786 -8.841 1.00 0.00 O ATOM 1512 CB TYR A 91 23.503 -14.718 -6.534 1.00 0.00 C ATOM 1513 CG TYR A 91 22.695 -15.649 -7.410 1.00 0.00 C ATOM 1514 CD1 TYR A 91 22.962 -17.013 -7.439 1.00 0.00 C ATOM 1515 CD2 TYR A 91 21.667 -15.166 -8.209 1.00 0.00 C ATOM 1516 CE1 TYR A 91 22.227 -17.867 -8.238 1.00 0.00 C ATOM 1517 CE2 TYR A 91 20.927 -16.013 -9.010 1.00 0.00 C ATOM 1518 CZ TYR A 91 21.210 -17.363 -9.022 1.00 0.00 C ATOM 1519 OH TYR A 91 20.476 -18.210 -9.820 1.00 0.00 O ATOM 0 H TYR A 91 25.048 -12.980 -5.684 1.00 0.00 H new ATOM 0 HA TYR A 91 25.465 -15.581 -6.371 1.00 0.00 H new ATOM 0 HB2 TYR A 91 23.361 -15.000 -5.491 1.00 0.00 H new ATOM 0 HB3 TYR A 91 23.119 -13.704 -6.645 1.00 0.00 H new ATOM 0 HD1 TYR A 91 23.757 -17.412 -6.827 1.00 0.00 H new ATOM 0 HD2 TYR A 91 21.442 -14.110 -8.204 1.00 0.00 H new ATOM 0 HE1 TYR A 91 22.447 -18.924 -8.249 1.00 0.00 H new ATOM 0 HE2 TYR A 91 20.130 -15.620 -9.624 1.00 0.00 H new ATOM 0 HH TYR A 91 19.798 -17.696 -10.307 1.00 0.00 H new ATOM 1529 N LEU A 92 24.691 -13.861 -9.098 1.00 0.00 N ATOM 1530 CA LEU A 92 24.822 -13.851 -10.551 1.00 0.00 C ATOM 1531 C LEU A 92 26.062 -13.074 -10.980 1.00 0.00 C ATOM 1532 O LEU A 92 26.843 -13.541 -11.808 1.00 0.00 O ATOM 1533 CB LEU A 92 23.575 -13.237 -11.190 1.00 0.00 C ATOM 1534 CG LEU A 92 23.711 -12.812 -12.653 1.00 0.00 C ATOM 1535 CD1 LEU A 92 22.443 -13.144 -13.425 1.00 0.00 C ATOM 1536 CD2 LEU A 92 24.023 -11.326 -12.750 1.00 0.00 C ATOM 0 H LEU A 92 24.177 -13.068 -8.715 1.00 0.00 H new ATOM 0 HA LEU A 92 24.927 -14.882 -10.890 1.00 0.00 H new ATOM 0 HB2 LEU A 92 22.761 -13.958 -11.116 1.00 0.00 H new ATOM 0 HB3 LEU A 92 23.283 -12.365 -10.605 1.00 0.00 H new ATOM 0 HG LEU A 92 24.538 -13.366 -13.097 1.00 0.00 H new ATOM 0 HD11 LEU A 92 22.558 -12.835 -14.464 1.00 0.00 H new ATOM 0 HD12 LEU A 92 22.263 -14.218 -13.384 1.00 0.00 H new ATOM 0 HD13 LEU A 92 21.598 -12.617 -12.981 1.00 0.00 H new ATOM 0 HD21 LEU A 92 24.116 -11.041 -13.798 1.00 0.00 H new ATOM 0 HD22 LEU A 92 23.218 -10.754 -12.289 1.00 0.00 H new ATOM 0 HD23 LEU A 92 24.959 -11.116 -12.232 1.00 0.00 H new ATOM 1548 N ALA A 93 26.237 -11.886 -10.409 1.00 0.00 N ATOM 1549 CA ALA A 93 27.385 -11.046 -10.730 1.00 0.00 C ATOM 1550 C ALA A 93 28.689 -11.826 -10.599 1.00 0.00 C ATOM 1551 O ALA A 93 29.517 -11.823 -11.509 1.00 0.00 O ATOM 1552 CB ALA A 93 27.409 -9.820 -9.830 1.00 0.00 C ATOM 0 H ALA A 93 25.599 -11.484 -9.722 1.00 0.00 H new ATOM 0 HA ALA A 93 27.289 -10.721 -11.766 1.00 0.00 H new ATOM 0 HB1 ALA A 93 28.271 -9.202 -10.080 1.00 0.00 H new ATOM 0 HB2 ALA A 93 26.495 -9.244 -9.975 1.00 0.00 H new ATOM 0 HB3 ALA A 93 27.478 -10.134 -8.789 1.00 0.00 H new ATOM 1558 N GLN A 94 28.864 -12.491 -9.462 1.00 0.00 N ATOM 1559 CA GLN A 94 30.069 -13.274 -9.214 1.00 0.00 C ATOM 1560 C GLN A 94 31.309 -12.386 -9.237 1.00 0.00 C ATOM 1561 O GLN A 94 32.345 -12.764 -9.785 1.00 0.00 O ATOM 1562 CB GLN A 94 30.204 -14.386 -10.255 1.00 0.00 C ATOM 1563 CG GLN A 94 28.983 -15.288 -10.343 1.00 0.00 C ATOM 1564 CD GLN A 94 28.909 -16.042 -11.656 1.00 0.00 C ATOM 1565 OE1 GLN A 94 29.661 -15.762 -12.590 1.00 0.00 O ATOM 1566 NE2 GLN A 94 27.999 -17.006 -11.734 1.00 0.00 N ATOM 0 H GLN A 94 28.188 -12.503 -8.699 1.00 0.00 H new ATOM 0 HA GLN A 94 29.983 -13.722 -8.224 1.00 0.00 H new ATOM 0 HB2 GLN A 94 30.386 -13.938 -11.232 1.00 0.00 H new ATOM 0 HB3 GLN A 94 31.077 -14.993 -10.015 1.00 0.00 H new ATOM 0 HG2 GLN A 94 29.003 -16.001 -9.519 1.00 0.00 H new ATOM 0 HG3 GLN A 94 28.082 -14.687 -10.222 1.00 0.00 H new ATOM 0 HE21 GLN A 94 27.396 -17.204 -10.935 1.00 0.00 H new ATOM 0 HE22 GLN A 94 27.903 -17.548 -12.593 1.00 0.00 H new ATOM 1575 N HIS A 95 31.196 -11.205 -8.639 1.00 0.00 N ATOM 1576 CA HIS A 95 32.309 -10.263 -8.591 1.00 0.00 C ATOM 1577 C HIS A 95 32.372 -9.564 -7.236 1.00 0.00 C ATOM 1578 O HIS A 95 31.492 -8.775 -6.893 1.00 0.00 O ATOM 1579 CB HIS A 95 32.176 -9.226 -9.707 1.00 0.00 C ATOM 1580 CG HIS A 95 33.236 -9.339 -10.758 1.00 0.00 C ATOM 1581 ND1 HIS A 95 34.560 -9.596 -10.469 1.00 0.00 N ATOM 1582 CD2 HIS A 95 33.162 -9.229 -12.105 1.00 0.00 C ATOM 1583 CE1 HIS A 95 35.254 -9.638 -11.592 1.00 0.00 C ATOM 1584 NE2 HIS A 95 34.429 -9.419 -12.600 1.00 0.00 N ATOM 0 H HIS A 95 30.346 -10.877 -8.181 1.00 0.00 H new ATOM 0 HA HIS A 95 33.233 -10.823 -8.734 1.00 0.00 H new ATOM 0 HB2 HIS A 95 31.198 -9.332 -10.176 1.00 0.00 H new ATOM 0 HB3 HIS A 95 32.213 -8.228 -9.271 1.00 0.00 H new ATOM 0 HD2 HIS A 95 32.272 -9.029 -12.683 1.00 0.00 H new ATOM 0 HE1 HIS A 95 36.315 -9.820 -11.672 1.00 0.00 H new ATOM 0 HE2 HIS A 95 34.690 -9.395 -13.586 1.00 0.00 H new ATOM 1592 N GLU A 96 33.417 -9.861 -6.470 1.00 0.00 N ATOM 1593 CA GLU A 96 33.592 -9.262 -5.152 1.00 0.00 C ATOM 1594 C GLU A 96 33.538 -7.739 -5.235 1.00 0.00 C ATOM 1595 O GLU A 96 33.094 -7.072 -4.301 1.00 0.00 O ATOM 1596 CB GLU A 96 34.922 -9.704 -4.539 1.00 0.00 C ATOM 1597 CG GLU A 96 36.129 -8.992 -5.126 1.00 0.00 C ATOM 1598 CD GLU A 96 37.435 -9.687 -4.792 1.00 0.00 C ATOM 1599 OE1 GLU A 96 37.414 -10.915 -4.570 1.00 0.00 O ATOM 1600 OE2 GLU A 96 38.479 -9.002 -4.753 1.00 0.00 O ATOM 0 H GLU A 96 34.155 -10.512 -6.739 1.00 0.00 H new ATOM 0 HA GLU A 96 32.776 -9.603 -4.515 1.00 0.00 H new ATOM 0 HB2 GLU A 96 34.894 -9.527 -3.464 1.00 0.00 H new ATOM 0 HB3 GLU A 96 35.039 -10.778 -4.682 1.00 0.00 H new ATOM 0 HG2 GLU A 96 36.020 -8.932 -6.209 1.00 0.00 H new ATOM 0 HG3 GLU A 96 36.160 -7.969 -4.752 1.00 0.00 H new ATOM 1607 N GLN A 97 33.996 -7.198 -6.359 1.00 0.00 N ATOM 1608 CA GLN A 97 34.001 -5.754 -6.564 1.00 0.00 C ATOM 1609 C GLN A 97 32.583 -5.194 -6.530 1.00 0.00 C ATOM 1610 O GLN A 97 32.373 -4.026 -6.198 1.00 0.00 O ATOM 1611 CB GLN A 97 34.667 -5.409 -7.897 1.00 0.00 C ATOM 1612 CG GLN A 97 36.165 -5.174 -7.786 1.00 0.00 C ATOM 1613 CD GLN A 97 36.659 -4.100 -8.735 1.00 0.00 C ATOM 1614 OE1 GLN A 97 36.124 -3.929 -9.831 1.00 0.00 O ATOM 1615 NE2 GLN A 97 37.685 -3.368 -8.318 1.00 0.00 N ATOM 0 H GLN A 97 34.368 -7.737 -7.141 1.00 0.00 H new ATOM 0 HA GLN A 97 34.571 -5.300 -5.753 1.00 0.00 H new ATOM 0 HB2 GLN A 97 34.486 -6.218 -8.604 1.00 0.00 H new ATOM 0 HB3 GLN A 97 34.197 -4.516 -8.308 1.00 0.00 H new ATOM 0 HG2 GLN A 97 36.409 -4.890 -6.763 1.00 0.00 H new ATOM 0 HG3 GLN A 97 36.691 -6.106 -7.992 1.00 0.00 H new ATOM 0 HE21 GLN A 97 38.098 -3.544 -7.402 1.00 0.00 H new ATOM 0 HE22 GLN A 97 38.060 -2.630 -8.913 1.00 0.00 H new ATOM 1624 N LEU A 98 31.613 -6.033 -6.876 1.00 0.00 N ATOM 1625 CA LEU A 98 30.213 -5.621 -6.886 1.00 0.00 C ATOM 1626 C LEU A 98 29.435 -6.312 -5.772 1.00 0.00 C ATOM 1627 O LEU A 98 28.203 -6.305 -5.763 1.00 0.00 O ATOM 1628 CB LEU A 98 29.577 -5.939 -8.241 1.00 0.00 C ATOM 1629 CG LEU A 98 28.709 -4.838 -8.850 1.00 0.00 C ATOM 1630 CD1 LEU A 98 29.518 -3.564 -9.039 1.00 0.00 C ATOM 1631 CD2 LEU A 98 28.116 -5.297 -10.174 1.00 0.00 C ATOM 0 H LEU A 98 31.770 -7.002 -7.153 1.00 0.00 H new ATOM 0 HA LEU A 98 30.175 -4.545 -6.717 1.00 0.00 H new ATOM 0 HB2 LEU A 98 30.373 -6.178 -8.946 1.00 0.00 H new ATOM 0 HB3 LEU A 98 28.967 -6.836 -8.132 1.00 0.00 H new ATOM 0 HG LEU A 98 27.890 -4.625 -8.163 1.00 0.00 H new ATOM 0 HD11 LEU A 98 28.884 -2.791 -9.474 1.00 0.00 H new ATOM 0 HD12 LEU A 98 29.893 -3.225 -8.074 1.00 0.00 H new ATOM 0 HD13 LEU A 98 30.357 -3.762 -9.706 1.00 0.00 H new ATOM 0 HD21 LEU A 98 27.501 -4.500 -10.593 1.00 0.00 H new ATOM 0 HD22 LEU A 98 28.920 -5.538 -10.869 1.00 0.00 H new ATOM 0 HD23 LEU A 98 27.501 -6.182 -10.010 1.00 0.00 H new ATOM 1643 N LEU A 99 30.160 -6.907 -4.831 1.00 0.00 N ATOM 1644 CA LEU A 99 29.538 -7.601 -3.709 1.00 0.00 C ATOM 1645 C LEU A 99 28.792 -6.621 -2.809 1.00 0.00 C ATOM 1646 O LEU A 99 28.626 -5.449 -3.151 1.00 0.00 O ATOM 1647 CB LEU A 99 30.596 -8.352 -2.898 1.00 0.00 C ATOM 1648 CG LEU A 99 30.185 -9.727 -2.370 1.00 0.00 C ATOM 1649 CD1 LEU A 99 30.950 -10.826 -3.092 1.00 0.00 C ATOM 1650 CD2 LEU A 99 30.416 -9.812 -0.869 1.00 0.00 C ATOM 0 H LEU A 99 31.180 -6.923 -4.823 1.00 0.00 H new ATOM 0 HA LEU A 99 28.820 -8.317 -4.109 1.00 0.00 H new ATOM 0 HB2 LEU A 99 31.483 -8.474 -3.520 1.00 0.00 H new ATOM 0 HB3 LEU A 99 30.884 -7.730 -2.050 1.00 0.00 H new ATOM 0 HG LEU A 99 29.121 -9.866 -2.562 1.00 0.00 H new ATOM 0 HD11 LEU A 99 30.645 -11.798 -2.703 1.00 0.00 H new ATOM 0 HD12 LEU A 99 30.735 -10.778 -4.159 1.00 0.00 H new ATOM 0 HD13 LEU A 99 32.020 -10.691 -2.931 1.00 0.00 H new ATOM 0 HD21 LEU A 99 30.118 -10.797 -0.510 1.00 0.00 H new ATOM 0 HD22 LEU A 99 31.472 -9.652 -0.654 1.00 0.00 H new ATOM 0 HD23 LEU A 99 29.823 -9.048 -0.366 1.00 0.00 H new ATOM 1662 N LEU A 100 28.346 -7.107 -1.655 1.00 0.00 N ATOM 1663 CA LEU A 100 27.620 -6.273 -0.704 1.00 0.00 C ATOM 1664 C LEU A 100 28.537 -5.220 -0.091 1.00 0.00 C ATOM 1665 O LEU A 100 29.111 -5.428 0.979 1.00 0.00 O ATOM 1666 CB LEU A 100 27.010 -7.139 0.400 1.00 0.00 C ATOM 1667 CG LEU A 100 25.696 -7.840 0.054 1.00 0.00 C ATOM 1668 CD1 LEU A 100 24.627 -6.822 -0.311 1.00 0.00 C ATOM 1669 CD2 LEU A 100 25.903 -8.830 -1.083 1.00 0.00 C ATOM 0 H LEU A 100 28.475 -8.074 -1.356 1.00 0.00 H new ATOM 0 HA LEU A 100 26.821 -5.763 -1.242 1.00 0.00 H new ATOM 0 HB2 LEU A 100 27.739 -7.898 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 100 26.844 -6.512 1.276 1.00 0.00 H new ATOM 0 HG LEU A 100 25.359 -8.391 0.932 1.00 0.00 H new ATOM 0 HD11 LEU A 100 23.699 -7.340 -0.554 1.00 0.00 H new ATOM 0 HD12 LEU A 100 24.459 -6.153 0.533 1.00 0.00 H new ATOM 0 HD13 LEU A 100 24.956 -6.243 -1.174 1.00 0.00 H new ATOM 0 HD21 LEU A 100 24.957 -9.320 -1.316 1.00 0.00 H new ATOM 0 HD22 LEU A 100 26.265 -8.301 -1.965 1.00 0.00 H new ATOM 0 HD23 LEU A 100 26.636 -9.580 -0.784 1.00 0.00 H new ATOM 1681 N ASP A 101 28.670 -4.089 -0.774 1.00 0.00 N ATOM 1682 CA ASP A 101 29.515 -3.001 -0.296 1.00 0.00 C ATOM 1683 C ASP A 101 28.688 -1.957 0.447 1.00 0.00 C ATOM 1684 O ASP A 101 29.021 -0.772 0.448 1.00 0.00 O ATOM 1685 CB ASP A 101 30.252 -2.347 -1.466 1.00 0.00 C ATOM 1686 CG ASP A 101 31.670 -1.947 -1.106 1.00 0.00 C ATOM 1687 OD1 ASP A 101 31.847 -0.860 -0.517 1.00 0.00 O ATOM 1688 OD2 ASP A 101 32.601 -2.720 -1.413 1.00 0.00 O ATOM 0 H ASP A 101 28.203 -3.901 -1.661 1.00 0.00 H new ATOM 0 HA ASP A 101 30.246 -3.419 0.396 1.00 0.00 H new ATOM 0 HB2 ASP A 101 30.275 -3.038 -2.309 1.00 0.00 H new ATOM 0 HB3 ASP A 101 29.700 -1.465 -1.792 1.00 0.00 H new ATOM 1693 N ALA A 102 27.607 -2.405 1.078 1.00 0.00 N ATOM 1694 CA ALA A 102 26.733 -1.509 1.826 1.00 0.00 C ATOM 1695 C ALA A 102 27.520 -0.710 2.859 1.00 0.00 C ATOM 1696 O ALA A 102 27.698 0.500 2.717 1.00 0.00 O ATOM 1697 CB ALA A 102 25.622 -2.299 2.501 1.00 0.00 C ATOM 0 H ALA A 102 27.316 -3.383 1.086 1.00 0.00 H new ATOM 0 HA ALA A 102 26.288 -0.805 1.123 1.00 0.00 H new ATOM 0 HB1 ALA A 102 24.977 -1.618 3.056 1.00 0.00 H new ATOM 0 HB2 ALA A 102 25.035 -2.820 1.745 1.00 0.00 H new ATOM 0 HB3 ALA A 102 26.057 -3.026 3.187 1.00 0.00 H new ATOM 1703 N SER A 103 27.988 -1.394 3.898 1.00 0.00 N ATOM 1704 CA SER A 103 28.751 -0.746 4.958 1.00 0.00 C ATOM 1705 C SER A 103 30.018 -0.104 4.400 1.00 0.00 C ATOM 1706 O SER A 103 30.424 -0.386 3.274 1.00 0.00 O ATOM 1707 CB SER A 103 29.116 -1.759 6.045 1.00 0.00 C ATOM 1708 OG SER A 103 28.194 -2.834 6.070 1.00 0.00 O ATOM 0 H SER A 103 27.852 -2.396 4.028 1.00 0.00 H new ATOM 0 HA SER A 103 28.129 0.036 5.394 1.00 0.00 H new ATOM 0 HB2 SER A 103 30.121 -2.142 5.867 1.00 0.00 H new ATOM 0 HB3 SER A 103 29.130 -1.265 7.017 1.00 0.00 H new ATOM 0 HG SER A 103 28.450 -3.468 6.772 1.00 0.00 H new TER 1714 SER A 103