USER MOD reduce.3.24.130724 H: found=0, std=0, add=1104, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 1100 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 93 HIS : no HD1:sc= -0.335 X(o=-0.38,f=-0.0012) USER MOD Set 1.2: A 95 THR OG1 : rot 180:sc= -0.0426 USER MOD Set 2.1: A 84 TYR OH : rot 153:sc= -0.858 USER MOD Set 2.2: A 121 SER OG : rot 180:sc= 0.0584 USER MOD Set 3.1: A 14 SER OG : rot -8:sc= 0.402 USER MOD Set 3.2: A 27 ASN : amide:sc= 0.521 K(o=0.92,f=-0.57) USER MOD Set 3.3: A 124 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 17 TYR OH : rot -7:sc= -0.987 USER MOD Single : A 18 ASN : amide:sc= -0.0346 X(o=-0.035,f=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 MET CE :methyl -140:sc= -1.65 (180deg=-3.6!) USER MOD Single : A 40 GLN : amide:sc=-0.00245 X(o=-0.0024,f=0) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 MET CE :methyl -114:sc= -5.12! (180deg=-8.08!) USER MOD Single : A 43 THR OG1 : rot 95:sc= -4.66! USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.0062) USER MOD Single : A 50 MET CE :methyl -112:sc= -3.13 (180deg=-4.43) USER MOD Single : A 51 THR OG1 : rot -24:sc= -0.533 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 HIS : no HD1:sc= -0.158 X(o=-0.16,f=-0.2) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.034) USER MOD Single : A 62 THR OG1 : rot -93:sc= 1.05 USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot -49:sc= -4.29 USER MOD Single : A 78 THR OG1 : rot -141:sc= -0.988 USER MOD Single : A 80 TYR OH : rot 180:sc= 0 USER MOD Single : A 85 THR OG1 : rot 180:sc= 0 USER MOD Single : A 86 GLN : amide:sc= -0.0337 K(o=-0.034,f=-1.8!) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 98 SER OG : rot -120:sc= -0.0347 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 125 MET CE :methyl -150:sc= -3.81 (180deg=-5.92!) USER MOD Single : A 127 MET CE :methyl -120:sc= -3.4! (180deg=-4.88!) USER MOD Single : A 128 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 133 SER OG : rot -58:sc= 0.257 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -13.765 -6.300 22.697 1.00 0.00 N ATOM 2 CA GLY A 1 -14.836 -5.938 21.783 1.00 0.00 C ATOM 3 C GLY A 1 -14.390 -6.093 20.328 1.00 0.00 C ATOM 4 O GLY A 1 -14.187 -5.102 19.628 1.00 0.00 O ATOM 0 H1 GLY A 1 -14.092 -6.186 23.678 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.491 -7.290 22.536 1.00 0.00 H new ATOM 0 H3 GLY A 1 -12.944 -5.683 22.532 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -15.706 -6.567 21.969 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.142 -4.908 21.966 1.00 0.00 H new ATOM 8 N SER A 2 -14.253 -7.344 19.915 1.00 0.00 N ATOM 9 CA SER A 2 -13.835 -7.642 18.555 1.00 0.00 C ATOM 10 C SER A 2 -15.048 -7.638 17.622 1.00 0.00 C ATOM 11 O SER A 2 -16.187 -7.729 18.079 1.00 0.00 O ATOM 12 CB SER A 2 -13.114 -8.989 18.483 1.00 0.00 C ATOM 13 OG SER A 2 -11.717 -8.861 18.732 1.00 0.00 O ATOM 0 H SER A 2 -14.424 -8.163 20.498 1.00 0.00 H new ATOM 0 HA SER A 2 -13.136 -6.869 18.235 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.551 -9.673 19.211 1.00 0.00 H new ATOM 0 HB3 SER A 2 -13.268 -9.430 17.498 1.00 0.00 H new ATOM 0 HG SER A 2 -11.293 -9.743 18.679 1.00 0.00 H new ATOM 19 N SER A 3 -14.763 -7.534 16.333 1.00 0.00 N ATOM 20 CA SER A 3 -15.816 -7.517 15.332 1.00 0.00 C ATOM 21 C SER A 3 -15.238 -7.862 13.958 1.00 0.00 C ATOM 22 O SER A 3 -14.304 -7.211 13.493 1.00 0.00 O ATOM 23 CB SER A 3 -16.513 -6.156 15.289 1.00 0.00 C ATOM 24 OG SER A 3 -17.894 -6.274 14.954 1.00 0.00 O ATOM 0 H SER A 3 -13.817 -7.461 15.958 1.00 0.00 H new ATOM 0 HA SER A 3 -16.559 -8.267 15.604 1.00 0.00 H new ATOM 0 HB2 SER A 3 -16.416 -5.668 16.259 1.00 0.00 H new ATOM 0 HB3 SER A 3 -16.016 -5.517 14.559 1.00 0.00 H new ATOM 0 HG SER A 3 -18.304 -5.384 14.938 1.00 0.00 H new ATOM 30 N GLY A 4 -15.818 -8.884 13.347 1.00 0.00 N ATOM 31 CA GLY A 4 -15.372 -9.323 12.036 1.00 0.00 C ATOM 32 C GLY A 4 -16.064 -10.626 11.629 1.00 0.00 C ATOM 33 O GLY A 4 -16.163 -11.556 12.427 1.00 0.00 O ATOM 0 H GLY A 4 -16.593 -9.421 13.736 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -15.583 -8.549 11.298 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.292 -9.468 12.045 1.00 0.00 H new ATOM 37 N SER A 5 -16.524 -10.651 10.387 1.00 0.00 N ATOM 38 CA SER A 5 -17.204 -11.824 9.864 1.00 0.00 C ATOM 39 C SER A 5 -17.491 -11.641 8.372 1.00 0.00 C ATOM 40 O SER A 5 -17.589 -10.514 7.889 1.00 0.00 O ATOM 41 CB SER A 5 -18.503 -12.093 10.626 1.00 0.00 C ATOM 42 OG SER A 5 -18.523 -13.394 11.206 1.00 0.00 O ATOM 0 H SER A 5 -16.439 -9.878 9.727 1.00 0.00 H new ATOM 0 HA SER A 5 -16.551 -12.686 9.998 1.00 0.00 H new ATOM 0 HB2 SER A 5 -18.625 -11.345 11.409 1.00 0.00 H new ATOM 0 HB3 SER A 5 -19.350 -11.985 9.948 1.00 0.00 H new ATOM 0 HG SER A 5 -19.368 -13.526 11.685 1.00 0.00 H new ATOM 48 N SER A 6 -17.619 -12.766 7.685 1.00 0.00 N ATOM 49 CA SER A 6 -17.893 -12.744 6.258 1.00 0.00 C ATOM 50 C SER A 6 -16.719 -12.111 5.509 1.00 0.00 C ATOM 51 O SER A 6 -16.141 -11.129 5.971 1.00 0.00 O ATOM 52 CB SER A 6 -19.186 -11.984 5.957 1.00 0.00 C ATOM 53 OG SER A 6 -20.294 -12.863 5.784 1.00 0.00 O ATOM 0 H SER A 6 -17.538 -13.699 8.090 1.00 0.00 H new ATOM 0 HA SER A 6 -18.020 -13.772 5.919 1.00 0.00 H new ATOM 0 HB2 SER A 6 -19.397 -11.291 6.771 1.00 0.00 H new ATOM 0 HB3 SER A 6 -19.053 -11.386 5.055 1.00 0.00 H new ATOM 0 HG SER A 6 -21.101 -12.339 5.595 1.00 0.00 H new ATOM 59 N GLY A 7 -16.401 -12.700 4.366 1.00 0.00 N ATOM 60 CA GLY A 7 -15.306 -12.206 3.548 1.00 0.00 C ATOM 61 C GLY A 7 -15.301 -10.677 3.505 1.00 0.00 C ATOM 62 O GLY A 7 -16.315 -10.058 3.187 1.00 0.00 O ATOM 0 H GLY A 7 -16.883 -13.515 3.987 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.358 -12.565 3.948 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.396 -12.602 2.536 1.00 0.00 H new ATOM 66 N LEU A 8 -14.148 -10.111 3.829 1.00 0.00 N ATOM 67 CA LEU A 8 -13.997 -8.666 3.831 1.00 0.00 C ATOM 68 C LEU A 8 -13.920 -8.164 2.388 1.00 0.00 C ATOM 69 O LEU A 8 -14.946 -7.904 1.761 1.00 0.00 O ATOM 70 CB LEU A 8 -12.801 -8.253 4.691 1.00 0.00 C ATOM 71 CG LEU A 8 -12.908 -8.568 6.184 1.00 0.00 C ATOM 72 CD1 LEU A 8 -11.524 -8.618 6.834 1.00 0.00 C ATOM 73 CD2 LEU A 8 -13.836 -7.576 6.889 1.00 0.00 C ATOM 0 H LEU A 8 -13.309 -10.628 4.092 1.00 0.00 H new ATOM 0 HA LEU A 8 -14.866 -8.193 4.288 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -11.910 -8.744 4.299 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -12.650 -7.180 4.576 1.00 0.00 H new ATOM 0 HG LEU A 8 -13.352 -9.558 6.293 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -11.628 -8.844 7.895 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -10.925 -9.393 6.355 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -11.031 -7.653 6.715 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -13.894 -7.823 7.949 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -13.444 -6.565 6.773 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -14.831 -7.632 6.448 1.00 0.00 H new ATOM 85 N GLY A 9 -12.693 -8.042 1.902 1.00 0.00 N ATOM 86 CA GLY A 9 -12.469 -7.576 0.544 1.00 0.00 C ATOM 87 C GLY A 9 -11.062 -7.939 0.065 1.00 0.00 C ATOM 88 O GLY A 9 -10.385 -8.761 0.681 1.00 0.00 O ATOM 0 H GLY A 9 -11.844 -8.258 2.424 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -13.209 -8.018 -0.123 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -12.605 -6.495 0.499 1.00 0.00 H new ATOM 92 N THR A 10 -10.663 -7.308 -1.029 1.00 0.00 N ATOM 93 CA THR A 10 -9.349 -7.555 -1.598 1.00 0.00 C ATOM 94 C THR A 10 -8.546 -6.254 -1.668 1.00 0.00 C ATOM 95 O THR A 10 -9.092 -5.171 -1.464 1.00 0.00 O ATOM 96 CB THR A 10 -9.541 -8.224 -2.960 1.00 0.00 C ATOM 97 OG1 THR A 10 -10.156 -9.472 -2.650 1.00 0.00 O ATOM 98 CG2 THR A 10 -8.213 -8.616 -3.613 1.00 0.00 C ATOM 0 H THR A 10 -11.226 -6.626 -1.537 1.00 0.00 H new ATOM 0 HA THR A 10 -8.766 -8.228 -0.969 1.00 0.00 H new ATOM 0 HB THR A 10 -10.086 -7.550 -3.621 1.00 0.00 H new ATOM 0 HG1 THR A 10 -10.318 -9.971 -3.478 1.00 0.00 H new ATOM 0 HG21 THR A 10 -8.406 -9.087 -4.577 1.00 0.00 H new ATOM 0 HG22 THR A 10 -7.603 -7.725 -3.760 1.00 0.00 H new ATOM 0 HG23 THR A 10 -7.683 -9.316 -2.967 1.00 0.00 H new ATOM 106 N LEU A 11 -7.261 -6.404 -1.958 1.00 0.00 N ATOM 107 CA LEU A 11 -6.378 -5.255 -2.057 1.00 0.00 C ATOM 108 C LEU A 11 -5.478 -5.414 -3.285 1.00 0.00 C ATOM 109 O LEU A 11 -4.701 -6.364 -3.371 1.00 0.00 O ATOM 110 CB LEU A 11 -5.606 -5.057 -0.751 1.00 0.00 C ATOM 111 CG LEU A 11 -4.470 -4.034 -0.791 1.00 0.00 C ATOM 112 CD1 LEU A 11 -3.106 -4.726 -0.742 1.00 0.00 C ATOM 113 CD2 LEU A 11 -4.602 -3.115 -2.007 1.00 0.00 C ATOM 0 H LEU A 11 -6.811 -7.304 -2.127 1.00 0.00 H new ATOM 0 HA LEU A 11 -6.956 -4.342 -2.200 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -6.312 -4.756 0.023 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -5.192 -6.019 -0.448 1.00 0.00 H new ATOM 0 HG LEU A 11 -4.545 -3.407 0.097 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -2.316 -3.976 -0.772 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -3.024 -5.303 0.179 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -3.005 -5.393 -1.598 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -3.782 -2.397 -2.011 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -4.567 -3.711 -2.919 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.551 -2.581 -1.958 1.00 0.00 H new ATOM 125 N PHE A 12 -5.612 -4.469 -4.204 1.00 0.00 N ATOM 126 CA PHE A 12 -4.821 -4.493 -5.422 1.00 0.00 C ATOM 127 C PHE A 12 -3.705 -3.447 -5.371 1.00 0.00 C ATOM 128 O PHE A 12 -3.915 -2.332 -4.896 1.00 0.00 O ATOM 129 CB PHE A 12 -5.767 -4.155 -6.576 1.00 0.00 C ATOM 130 CG PHE A 12 -7.027 -5.023 -6.622 1.00 0.00 C ATOM 131 CD1 PHE A 12 -6.948 -6.352 -6.344 1.00 0.00 C ATOM 132 CD2 PHE A 12 -8.225 -4.465 -6.941 1.00 0.00 C ATOM 133 CE1 PHE A 12 -8.117 -7.157 -6.387 1.00 0.00 C ATOM 134 CE2 PHE A 12 -9.394 -5.270 -6.984 1.00 0.00 C ATOM 135 CZ PHE A 12 -9.315 -6.599 -6.706 1.00 0.00 C ATOM 0 H PHE A 12 -6.257 -3.682 -4.129 1.00 0.00 H new ATOM 0 HA PHE A 12 -4.360 -5.473 -5.547 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -6.062 -3.109 -6.496 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -5.229 -4.264 -7.518 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -5.996 -6.795 -6.091 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -8.288 -3.410 -7.162 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -8.054 -8.212 -6.166 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -10.346 -4.827 -7.237 1.00 0.00 H new ATOM 0 HZ PHE A 12 -10.204 -7.211 -6.739 1.00 0.00 H new ATOM 145 N PHE A 13 -2.542 -3.845 -5.868 1.00 0.00 N ATOM 146 CA PHE A 13 -1.393 -2.956 -5.885 1.00 0.00 C ATOM 147 C PHE A 13 -0.315 -3.472 -6.841 1.00 0.00 C ATOM 148 O PHE A 13 -0.341 -4.635 -7.241 1.00 0.00 O ATOM 149 CB PHE A 13 -0.827 -2.930 -4.464 1.00 0.00 C ATOM 150 CG PHE A 13 -0.385 -4.300 -3.944 1.00 0.00 C ATOM 151 CD1 PHE A 13 -1.304 -5.285 -3.757 1.00 0.00 C ATOM 152 CD2 PHE A 13 0.926 -4.533 -3.669 1.00 0.00 C ATOM 153 CE1 PHE A 13 -0.895 -6.556 -3.275 1.00 0.00 C ATOM 154 CE2 PHE A 13 1.336 -5.804 -3.187 1.00 0.00 C ATOM 155 CZ PHE A 13 0.417 -6.789 -3.001 1.00 0.00 C ATOM 0 H PHE A 13 -2.371 -4.770 -6.261 1.00 0.00 H new ATOM 0 HA PHE A 13 -1.695 -1.964 -6.221 1.00 0.00 H new ATOM 0 HB2 PHE A 13 0.025 -2.250 -4.436 1.00 0.00 H new ATOM 0 HB3 PHE A 13 -1.582 -2.524 -3.791 1.00 0.00 H new ATOM 0 HD1 PHE A 13 -2.345 -5.100 -3.975 1.00 0.00 H new ATOM 0 HD2 PHE A 13 1.656 -3.751 -3.817 1.00 0.00 H new ATOM 0 HE1 PHE A 13 -1.625 -7.338 -3.126 1.00 0.00 H new ATOM 0 HE2 PHE A 13 2.377 -5.988 -2.968 1.00 0.00 H new ATOM 0 HZ PHE A 13 0.729 -7.756 -2.636 1.00 0.00 H new ATOM 165 N SER A 14 0.605 -2.582 -7.179 1.00 0.00 N ATOM 166 CA SER A 14 1.690 -2.932 -8.081 1.00 0.00 C ATOM 167 C SER A 14 3.011 -2.367 -7.555 1.00 0.00 C ATOM 168 O SER A 14 3.160 -1.154 -7.419 1.00 0.00 O ATOM 169 CB SER A 14 1.418 -2.418 -9.496 1.00 0.00 C ATOM 170 OG SER A 14 0.897 -1.091 -9.491 1.00 0.00 O ATOM 0 H SER A 14 0.622 -1.618 -6.845 1.00 0.00 H new ATOM 0 HA SER A 14 1.760 -4.019 -8.126 1.00 0.00 H new ATOM 0 HB2 SER A 14 2.341 -2.443 -10.074 1.00 0.00 H new ATOM 0 HB3 SER A 14 0.712 -3.083 -9.994 1.00 0.00 H new ATOM 0 HG SER A 14 0.691 -0.824 -8.571 1.00 0.00 H new ATOM 176 N LEU A 15 3.935 -3.274 -7.274 1.00 0.00 N ATOM 177 CA LEU A 15 5.239 -2.881 -6.767 1.00 0.00 C ATOM 178 C LEU A 15 6.104 -2.383 -7.926 1.00 0.00 C ATOM 179 O LEU A 15 5.941 -2.826 -9.062 1.00 0.00 O ATOM 180 CB LEU A 15 5.873 -4.026 -5.974 1.00 0.00 C ATOM 181 CG LEU A 15 5.303 -4.269 -4.575 1.00 0.00 C ATOM 182 CD1 LEU A 15 4.393 -3.116 -4.146 1.00 0.00 C ATOM 183 CD2 LEU A 15 4.591 -5.621 -4.500 1.00 0.00 C ATOM 0 H LEU A 15 3.807 -4.279 -7.388 1.00 0.00 H new ATOM 0 HA LEU A 15 5.140 -2.053 -6.064 1.00 0.00 H new ATOM 0 HB2 LEU A 15 5.768 -4.944 -6.552 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.941 -3.829 -5.880 1.00 0.00 H new ATOM 0 HG LEU A 15 6.133 -4.303 -3.869 1.00 0.00 H new ATOM 0 HD11 LEU A 15 4.001 -3.314 -3.148 1.00 0.00 H new ATOM 0 HD12 LEU A 15 4.963 -2.187 -4.134 1.00 0.00 H new ATOM 0 HD13 LEU A 15 3.565 -3.025 -4.849 1.00 0.00 H new ATOM 0 HD21 LEU A 15 4.195 -5.769 -3.495 1.00 0.00 H new ATOM 0 HD22 LEU A 15 3.772 -5.641 -5.219 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.298 -6.418 -4.732 1.00 0.00 H new ATOM 195 N GLU A 16 7.005 -1.467 -7.600 1.00 0.00 N ATOM 196 CA GLU A 16 7.896 -0.904 -8.600 1.00 0.00 C ATOM 197 C GLU A 16 9.096 -0.237 -7.926 1.00 0.00 C ATOM 198 O GLU A 16 8.934 0.533 -6.981 1.00 0.00 O ATOM 199 CB GLU A 16 7.153 0.085 -9.501 1.00 0.00 C ATOM 200 CG GLU A 16 8.133 1.019 -10.214 1.00 0.00 C ATOM 201 CD GLU A 16 7.455 1.735 -11.383 1.00 0.00 C ATOM 202 OE1 GLU A 16 6.840 2.792 -11.123 1.00 0.00 O ATOM 203 OE2 GLU A 16 7.568 1.210 -12.512 1.00 0.00 O ATOM 0 H GLU A 16 7.137 -1.101 -6.657 1.00 0.00 H new ATOM 0 HA GLU A 16 8.262 -1.714 -9.230 1.00 0.00 H new ATOM 0 HB2 GLU A 16 6.563 -0.461 -10.238 1.00 0.00 H new ATOM 0 HB3 GLU A 16 6.454 0.672 -8.905 1.00 0.00 H new ATOM 0 HG2 GLU A 16 8.520 1.754 -9.508 1.00 0.00 H new ATOM 0 HG3 GLU A 16 8.986 0.447 -10.579 1.00 0.00 H new ATOM 210 N TYR A 17 10.276 -0.559 -8.438 1.00 0.00 N ATOM 211 CA TYR A 17 11.503 0.000 -7.897 1.00 0.00 C ATOM 212 C TYR A 17 12.159 0.953 -8.898 1.00 0.00 C ATOM 213 O TYR A 17 12.315 0.617 -10.071 1.00 0.00 O ATOM 214 CB TYR A 17 12.437 -1.188 -7.656 1.00 0.00 C ATOM 215 CG TYR A 17 13.778 -0.808 -7.026 1.00 0.00 C ATOM 216 CD1 TYR A 17 13.884 -0.677 -5.656 1.00 0.00 C ATOM 217 CD2 TYR A 17 14.881 -0.596 -7.827 1.00 0.00 C ATOM 218 CE1 TYR A 17 15.147 -0.319 -5.063 1.00 0.00 C ATOM 219 CE2 TYR A 17 16.144 -0.238 -7.234 1.00 0.00 C ATOM 220 CZ TYR A 17 16.214 -0.117 -5.882 1.00 0.00 C ATOM 221 OH TYR A 17 17.406 0.221 -5.321 1.00 0.00 O ATOM 0 H TYR A 17 10.408 -1.199 -9.221 1.00 0.00 H new ATOM 0 HA TYR A 17 11.299 0.564 -6.987 1.00 0.00 H new ATOM 0 HB2 TYR A 17 11.934 -1.907 -7.009 1.00 0.00 H new ATOM 0 HB3 TYR A 17 12.623 -1.689 -8.606 1.00 0.00 H new ATOM 0 HD1 TYR A 17 13.020 -0.843 -5.029 1.00 0.00 H new ATOM 0 HD2 TYR A 17 14.798 -0.698 -8.899 1.00 0.00 H new ATOM 0 HE1 TYR A 17 15.244 -0.213 -3.993 1.00 0.00 H new ATOM 0 HE2 TYR A 17 17.015 -0.070 -7.850 1.00 0.00 H new ATOM 0 HH TYR A 17 17.283 0.378 -4.361 1.00 0.00 H new ATOM 231 N ASN A 18 12.525 2.125 -8.398 1.00 0.00 N ATOM 232 CA ASN A 18 13.161 3.129 -9.234 1.00 0.00 C ATOM 233 C ASN A 18 14.642 2.785 -9.401 1.00 0.00 C ATOM 234 O ASN A 18 15.464 3.133 -8.555 1.00 0.00 O ATOM 235 CB ASN A 18 13.067 4.516 -8.595 1.00 0.00 C ATOM 236 CG ASN A 18 12.516 5.541 -9.587 1.00 0.00 C ATOM 237 OD1 ASN A 18 11.386 5.992 -9.491 1.00 0.00 O ATOM 238 ND2 ASN A 18 13.373 5.884 -10.544 1.00 0.00 N ATOM 0 H ASN A 18 12.393 2.401 -7.425 1.00 0.00 H new ATOM 0 HA ASN A 18 12.650 3.139 -10.197 1.00 0.00 H new ATOM 0 HB2 ASN A 18 12.423 4.473 -7.716 1.00 0.00 H new ATOM 0 HB3 ASN A 18 14.053 4.830 -8.252 1.00 0.00 H new ATOM 0 HD21 ASN A 18 13.099 6.562 -11.255 1.00 0.00 H new ATOM 0 HD22 ASN A 18 14.304 5.469 -10.567 1.00 0.00 H new ATOM 245 N PHE A 19 14.938 2.104 -10.499 1.00 0.00 N ATOM 246 CA PHE A 19 16.305 1.709 -10.788 1.00 0.00 C ATOM 247 C PHE A 19 17.196 2.933 -11.005 1.00 0.00 C ATOM 248 O PHE A 19 18.316 2.989 -10.499 1.00 0.00 O ATOM 249 CB PHE A 19 16.270 0.884 -12.077 1.00 0.00 C ATOM 250 CG PHE A 19 16.283 -0.629 -11.848 1.00 0.00 C ATOM 251 CD1 PHE A 19 15.120 -1.290 -11.605 1.00 0.00 C ATOM 252 CD2 PHE A 19 17.458 -1.312 -11.888 1.00 0.00 C ATOM 253 CE1 PHE A 19 15.132 -2.694 -11.393 1.00 0.00 C ATOM 254 CE2 PHE A 19 17.471 -2.716 -11.676 1.00 0.00 C ATOM 255 CZ PHE A 19 16.307 -3.377 -11.433 1.00 0.00 C ATOM 0 H PHE A 19 14.254 1.816 -11.199 1.00 0.00 H new ATOM 0 HA PHE A 19 16.712 1.141 -9.952 1.00 0.00 H new ATOM 0 HB2 PHE A 19 15.375 1.148 -12.641 1.00 0.00 H new ATOM 0 HB3 PHE A 19 17.127 1.155 -12.693 1.00 0.00 H new ATOM 0 HD1 PHE A 19 14.187 -0.747 -11.573 1.00 0.00 H new ATOM 0 HD2 PHE A 19 18.382 -0.787 -12.081 1.00 0.00 H new ATOM 0 HE1 PHE A 19 14.208 -3.219 -11.200 1.00 0.00 H new ATOM 0 HE2 PHE A 19 18.404 -3.259 -11.708 1.00 0.00 H new ATOM 0 HZ PHE A 19 16.316 -4.445 -11.272 1.00 0.00 H new ATOM 265 N GLU A 20 16.666 3.885 -11.759 1.00 0.00 N ATOM 266 CA GLU A 20 17.399 5.106 -12.049 1.00 0.00 C ATOM 267 C GLU A 20 17.981 5.694 -10.762 1.00 0.00 C ATOM 268 O GLU A 20 19.188 5.909 -10.664 1.00 0.00 O ATOM 269 CB GLU A 20 16.508 6.124 -12.763 1.00 0.00 C ATOM 270 CG GLU A 20 17.341 7.264 -13.352 1.00 0.00 C ATOM 271 CD GLU A 20 17.310 7.233 -14.881 1.00 0.00 C ATOM 272 OE1 GLU A 20 16.204 7.425 -15.430 1.00 0.00 O ATOM 273 OE2 GLU A 20 18.394 7.018 -15.466 1.00 0.00 O ATOM 0 H GLU A 20 15.737 3.836 -12.178 1.00 0.00 H new ATOM 0 HA GLU A 20 18.223 4.861 -12.719 1.00 0.00 H new ATOM 0 HB2 GLU A 20 15.949 5.629 -13.557 1.00 0.00 H new ATOM 0 HB3 GLU A 20 15.777 6.527 -12.062 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.958 8.220 -12.996 1.00 0.00 H new ATOM 0 HG3 GLU A 20 18.371 7.184 -13.004 1.00 0.00 H new ATOM 280 N ARG A 21 17.095 5.938 -9.807 1.00 0.00 N ATOM 281 CA ARG A 21 17.506 6.497 -8.530 1.00 0.00 C ATOM 282 C ARG A 21 17.517 5.410 -7.454 1.00 0.00 C ATOM 283 O ARG A 21 17.470 5.712 -6.262 1.00 0.00 O ATOM 284 CB ARG A 21 16.569 7.626 -8.096 1.00 0.00 C ATOM 285 CG ARG A 21 16.315 8.601 -9.248 1.00 0.00 C ATOM 286 CD ARG A 21 15.004 9.363 -9.043 1.00 0.00 C ATOM 287 NE ARG A 21 15.125 10.734 -9.586 1.00 0.00 N ATOM 288 CZ ARG A 21 15.870 11.699 -9.032 1.00 0.00 C ATOM 289 NH1 ARG A 21 16.566 11.449 -7.914 1.00 0.00 N ATOM 290 NH2 ARG A 21 15.921 12.914 -9.594 1.00 0.00 N ATOM 0 H ARG A 21 16.094 5.759 -9.892 1.00 0.00 H new ATOM 0 HA ARG A 21 18.511 6.901 -8.653 1.00 0.00 H new ATOM 0 HB2 ARG A 21 15.623 7.207 -7.754 1.00 0.00 H new ATOM 0 HB3 ARG A 21 17.004 8.161 -7.252 1.00 0.00 H new ATOM 0 HG2 ARG A 21 17.142 9.307 -9.321 1.00 0.00 H new ATOM 0 HG3 ARG A 21 16.278 8.054 -10.190 1.00 0.00 H new ATOM 0 HD2 ARG A 21 14.187 8.838 -9.538 1.00 0.00 H new ATOM 0 HD3 ARG A 21 14.760 9.404 -7.982 1.00 0.00 H new ATOM 0 HE ARG A 21 14.608 10.958 -10.436 1.00 0.00 H new ATOM 0 HH11 ARG A 21 16.528 10.524 -7.486 1.00 0.00 H new ATOM 0 HH12 ARG A 21 17.134 12.184 -7.492 1.00 0.00 H new ATOM 0 HH21 ARG A 21 15.392 13.105 -10.445 1.00 0.00 H new ATOM 0 HH22 ARG A 21 16.489 13.648 -9.171 1.00 0.00 H new ATOM 304 N LYS A 22 17.578 4.168 -7.912 1.00 0.00 N ATOM 305 CA LYS A 22 17.595 3.035 -7.003 1.00 0.00 C ATOM 306 C LYS A 22 16.698 3.338 -5.801 1.00 0.00 C ATOM 307 O LYS A 22 17.187 3.512 -4.685 1.00 0.00 O ATOM 308 CB LYS A 22 19.033 2.675 -6.622 1.00 0.00 C ATOM 309 CG LYS A 22 19.658 1.743 -7.662 1.00 0.00 C ATOM 310 CD LYS A 22 20.155 0.451 -7.010 1.00 0.00 C ATOM 311 CE LYS A 22 20.732 -0.504 -8.058 1.00 0.00 C ATOM 312 NZ LYS A 22 22.087 -0.949 -7.663 1.00 0.00 N ATOM 0 H LYS A 22 17.616 3.922 -8.901 1.00 0.00 H new ATOM 0 HA LYS A 22 17.188 2.149 -7.490 1.00 0.00 H new ATOM 0 HB2 LYS A 22 19.629 3.584 -6.538 1.00 0.00 H new ATOM 0 HB3 LYS A 22 19.044 2.194 -5.644 1.00 0.00 H new ATOM 0 HG2 LYS A 22 18.924 1.507 -8.432 1.00 0.00 H new ATOM 0 HG3 LYS A 22 20.488 2.248 -8.156 1.00 0.00 H new ATOM 0 HD2 LYS A 22 20.917 0.684 -6.266 1.00 0.00 H new ATOM 0 HD3 LYS A 22 19.333 -0.034 -6.483 1.00 0.00 H new ATOM 0 HE2 LYS A 22 20.077 -1.368 -8.171 1.00 0.00 H new ATOM 0 HE3 LYS A 22 20.774 -0.007 -9.027 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 22.464 -1.596 -8.385 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 22.713 -0.123 -7.578 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 22.038 -1.441 -6.748 1.00 0.00 H new ATOM 326 N ALA A 23 15.402 3.391 -6.069 1.00 0.00 N ATOM 327 CA ALA A 23 14.432 3.669 -5.023 1.00 0.00 C ATOM 328 C ALA A 23 13.322 2.617 -5.069 1.00 0.00 C ATOM 329 O ALA A 23 13.241 1.836 -6.016 1.00 0.00 O ATOM 330 CB ALA A 23 13.894 5.091 -5.191 1.00 0.00 C ATOM 0 H ALA A 23 15.001 3.246 -6.995 1.00 0.00 H new ATOM 0 HA ALA A 23 14.900 3.611 -4.040 1.00 0.00 H new ATOM 0 HB1 ALA A 23 13.166 5.300 -4.407 1.00 0.00 H new ATOM 0 HB2 ALA A 23 14.717 5.802 -5.121 1.00 0.00 H new ATOM 0 HB3 ALA A 23 13.414 5.186 -6.165 1.00 0.00 H new ATOM 336 N PHE A 24 12.495 2.630 -4.035 1.00 0.00 N ATOM 337 CA PHE A 24 11.393 1.686 -3.945 1.00 0.00 C ATOM 338 C PHE A 24 10.046 2.405 -4.047 1.00 0.00 C ATOM 339 O PHE A 24 9.771 3.327 -3.280 1.00 0.00 O ATOM 340 CB PHE A 24 11.495 1.008 -2.578 1.00 0.00 C ATOM 341 CG PHE A 24 10.411 -0.041 -2.321 1.00 0.00 C ATOM 342 CD1 PHE A 24 9.868 -0.726 -3.363 1.00 0.00 C ATOM 343 CD2 PHE A 24 9.991 -0.288 -1.052 1.00 0.00 C ATOM 344 CE1 PHE A 24 8.862 -1.699 -3.125 1.00 0.00 C ATOM 345 CE2 PHE A 24 8.985 -1.262 -0.813 1.00 0.00 C ATOM 346 CZ PHE A 24 8.442 -1.947 -1.855 1.00 0.00 C ATOM 0 H PHE A 24 12.565 3.279 -3.251 1.00 0.00 H new ATOM 0 HA PHE A 24 11.452 0.966 -4.761 1.00 0.00 H new ATOM 0 HB2 PHE A 24 12.473 0.534 -2.491 1.00 0.00 H new ATOM 0 HB3 PHE A 24 11.440 1.770 -1.801 1.00 0.00 H new ATOM 0 HD1 PHE A 24 10.202 -0.530 -4.371 1.00 0.00 H new ATOM 0 HD2 PHE A 24 10.422 0.257 -0.225 1.00 0.00 H new ATOM 0 HE1 PHE A 24 8.430 -2.242 -3.952 1.00 0.00 H new ATOM 0 HE2 PHE A 24 8.652 -1.458 0.195 1.00 0.00 H new ATOM 0 HZ PHE A 24 7.677 -2.688 -1.674 1.00 0.00 H new ATOM 356 N VAL A 25 9.242 1.955 -4.999 1.00 0.00 N ATOM 357 CA VAL A 25 7.930 2.544 -5.210 1.00 0.00 C ATOM 358 C VAL A 25 6.853 1.506 -4.887 1.00 0.00 C ATOM 359 O VAL A 25 6.950 0.354 -5.306 1.00 0.00 O ATOM 360 CB VAL A 25 7.826 3.090 -6.635 1.00 0.00 C ATOM 361 CG1 VAL A 25 6.667 4.082 -6.758 1.00 0.00 C ATOM 362 CG2 VAL A 25 9.144 3.730 -7.075 1.00 0.00 C ATOM 0 H VAL A 25 9.473 1.190 -5.633 1.00 0.00 H new ATOM 0 HA VAL A 25 7.778 3.390 -4.540 1.00 0.00 H new ATOM 0 HB VAL A 25 7.622 2.252 -7.301 1.00 0.00 H new ATOM 0 HG11 VAL A 25 6.615 4.455 -7.781 1.00 0.00 H new ATOM 0 HG12 VAL A 25 5.732 3.582 -6.506 1.00 0.00 H new ATOM 0 HG13 VAL A 25 6.828 4.916 -6.075 1.00 0.00 H new ATOM 0 HG21 VAL A 25 9.042 4.110 -8.092 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.391 4.552 -6.403 1.00 0.00 H new ATOM 0 HG23 VAL A 25 9.939 2.985 -7.044 1.00 0.00 H new ATOM 372 N VAL A 26 5.851 1.953 -4.144 1.00 0.00 N ATOM 373 CA VAL A 26 4.756 1.078 -3.760 1.00 0.00 C ATOM 374 C VAL A 26 3.428 1.725 -4.156 1.00 0.00 C ATOM 375 O VAL A 26 2.875 2.527 -3.405 1.00 0.00 O ATOM 376 CB VAL A 26 4.842 0.757 -2.266 1.00 0.00 C ATOM 377 CG1 VAL A 26 3.674 -0.129 -1.828 1.00 0.00 C ATOM 378 CG2 VAL A 26 6.184 0.106 -1.922 1.00 0.00 C ATOM 0 H VAL A 26 5.774 2.909 -3.798 1.00 0.00 H new ATOM 0 HA VAL A 26 4.824 0.127 -4.288 1.00 0.00 H new ATOM 0 HB VAL A 26 4.774 1.696 -1.716 1.00 0.00 H new ATOM 0 HG11 VAL A 26 3.759 -0.342 -0.762 1.00 0.00 H new ATOM 0 HG12 VAL A 26 2.734 0.387 -2.021 1.00 0.00 H new ATOM 0 HG13 VAL A 26 3.696 -1.064 -2.388 1.00 0.00 H new ATOM 0 HG21 VAL A 26 6.220 -0.112 -0.855 1.00 0.00 H new ATOM 0 HG22 VAL A 26 6.294 -0.821 -2.486 1.00 0.00 H new ATOM 0 HG23 VAL A 26 6.995 0.786 -2.181 1.00 0.00 H new ATOM 388 N ASN A 27 2.954 1.353 -5.336 1.00 0.00 N ATOM 389 CA ASN A 27 1.701 1.888 -5.842 1.00 0.00 C ATOM 390 C ASN A 27 0.536 1.100 -5.241 1.00 0.00 C ATOM 391 O ASN A 27 0.451 -0.116 -5.410 1.00 0.00 O ATOM 392 CB ASN A 27 1.622 1.760 -7.364 1.00 0.00 C ATOM 393 CG ASN A 27 0.169 1.659 -7.832 1.00 0.00 C ATOM 394 OD1 ASN A 27 -0.319 0.604 -8.201 1.00 0.00 O ATOM 395 ND2 ASN A 27 -0.493 2.812 -7.795 1.00 0.00 N ATOM 0 H ASN A 27 3.415 0.687 -5.956 1.00 0.00 H new ATOM 0 HA ASN A 27 1.648 2.941 -5.565 1.00 0.00 H new ATOM 0 HB2 ASN A 27 2.099 2.622 -7.830 1.00 0.00 H new ATOM 0 HB3 ASN A 27 2.174 0.877 -7.687 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -1.470 2.849 -8.087 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -0.024 3.659 -7.475 1.00 0.00 H new ATOM 402 N ILE A 28 -0.333 1.824 -4.551 1.00 0.00 N ATOM 403 CA ILE A 28 -1.490 1.208 -3.923 1.00 0.00 C ATOM 404 C ILE A 28 -2.726 1.451 -4.792 1.00 0.00 C ATOM 405 O ILE A 28 -3.299 2.539 -4.771 1.00 0.00 O ATOM 406 CB ILE A 28 -1.644 1.699 -2.483 1.00 0.00 C ATOM 407 CG1 ILE A 28 -0.414 1.340 -1.646 1.00 0.00 C ATOM 408 CG2 ILE A 28 -2.936 1.171 -1.858 1.00 0.00 C ATOM 409 CD1 ILE A 28 -0.697 1.513 -0.153 1.00 0.00 C ATOM 0 H ILE A 28 -0.259 2.832 -4.413 1.00 0.00 H new ATOM 0 HA ILE A 28 -1.356 0.129 -3.853 1.00 0.00 H new ATOM 0 HB ILE A 28 -1.716 2.786 -2.500 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.121 0.310 -1.847 1.00 0.00 H new ATOM 0 HG13 ILE A 28 0.425 1.972 -1.936 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -3.020 1.535 -0.834 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -3.790 1.520 -2.439 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.920 0.081 -1.855 1.00 0.00 H new ATOM 0 HD11 ILE A 28 0.193 1.251 0.419 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -0.966 2.550 0.049 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.520 0.861 0.139 1.00 0.00 H new ATOM 421 N LYS A 29 -3.101 0.420 -5.534 1.00 0.00 N ATOM 422 CA LYS A 29 -4.258 0.508 -6.408 1.00 0.00 C ATOM 423 C LYS A 29 -5.507 0.777 -5.567 1.00 0.00 C ATOM 424 O LYS A 29 -5.485 1.616 -4.667 1.00 0.00 O ATOM 425 CB LYS A 29 -4.365 -0.741 -7.284 1.00 0.00 C ATOM 426 CG LYS A 29 -5.128 -0.442 -8.576 1.00 0.00 C ATOM 427 CD LYS A 29 -4.164 -0.232 -9.746 1.00 0.00 C ATOM 428 CE LYS A 29 -4.005 -1.517 -10.562 1.00 0.00 C ATOM 429 NZ LYS A 29 -4.593 -1.352 -11.910 1.00 0.00 N ATOM 0 H LYS A 29 -2.624 -0.481 -5.548 1.00 0.00 H new ATOM 0 HA LYS A 29 -4.151 1.345 -7.098 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.367 -1.108 -7.524 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.872 -1.533 -6.733 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.805 -1.266 -8.802 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -5.742 0.448 -8.442 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -4.534 0.567 -10.388 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.192 0.086 -9.369 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -2.949 -1.771 -10.648 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -4.491 -2.345 -10.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -4.476 -2.233 -12.450 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.605 -1.131 -11.822 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.111 -0.576 -12.406 1.00 0.00 H new ATOM 443 N GLU A 30 -6.567 0.051 -5.890 1.00 0.00 N ATOM 444 CA GLU A 30 -7.823 0.201 -5.175 1.00 0.00 C ATOM 445 C GLU A 30 -8.142 -1.072 -4.388 1.00 0.00 C ATOM 446 O GLU A 30 -7.461 -2.085 -4.538 1.00 0.00 O ATOM 447 CB GLU A 30 -8.962 0.551 -6.135 1.00 0.00 C ATOM 448 CG GLU A 30 -9.163 -0.554 -7.173 1.00 0.00 C ATOM 449 CD GLU A 30 -10.651 -0.845 -7.383 1.00 0.00 C ATOM 450 OE1 GLU A 30 -11.460 0.017 -6.979 1.00 0.00 O ATOM 451 OE2 GLU A 30 -10.945 -1.924 -7.943 1.00 0.00 O ATOM 0 H GLU A 30 -6.582 -0.643 -6.637 1.00 0.00 H new ATOM 0 HA GLU A 30 -7.720 1.025 -4.469 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -9.884 0.699 -5.573 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -8.742 1.492 -6.639 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -8.710 -0.256 -8.119 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -8.654 -1.461 -6.847 1.00 0.00 H new ATOM 458 N ALA A 31 -9.177 -0.978 -3.566 1.00 0.00 N ATOM 459 CA ALA A 31 -9.593 -2.109 -2.755 1.00 0.00 C ATOM 460 C ALA A 31 -11.095 -2.337 -2.938 1.00 0.00 C ATOM 461 O ALA A 31 -11.891 -1.412 -2.777 1.00 0.00 O ATOM 462 CB ALA A 31 -9.215 -1.858 -1.294 1.00 0.00 C ATOM 0 H ALA A 31 -9.740 -0.136 -3.444 1.00 0.00 H new ATOM 0 HA ALA A 31 -9.080 -3.017 -3.072 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -9.528 -2.707 -0.686 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -8.135 -1.732 -1.214 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -9.713 -0.955 -0.939 1.00 0.00 H new ATOM 468 N ARG A 32 -11.439 -3.572 -3.271 1.00 0.00 N ATOM 469 CA ARG A 32 -12.831 -3.932 -3.478 1.00 0.00 C ATOM 470 C ARG A 32 -13.280 -4.943 -2.420 1.00 0.00 C ATOM 471 O ARG A 32 -12.557 -5.890 -2.115 1.00 0.00 O ATOM 472 CB ARG A 32 -13.045 -4.531 -4.869 1.00 0.00 C ATOM 473 CG ARG A 32 -13.538 -3.469 -5.854 1.00 0.00 C ATOM 474 CD ARG A 32 -14.690 -4.004 -6.706 1.00 0.00 C ATOM 475 NE ARG A 32 -14.673 -3.362 -8.040 1.00 0.00 N ATOM 476 CZ ARG A 32 -15.325 -3.836 -9.110 1.00 0.00 C ATOM 477 NH1 ARG A 32 -16.049 -4.959 -9.010 1.00 0.00 N ATOM 478 NH2 ARG A 32 -15.253 -3.187 -10.280 1.00 0.00 N ATOM 0 H ARG A 32 -10.777 -4.337 -3.403 1.00 0.00 H new ATOM 0 HA ARG A 32 -13.425 -3.022 -3.392 1.00 0.00 H new ATOM 0 HB2 ARG A 32 -12.111 -4.962 -5.231 1.00 0.00 H new ATOM 0 HB3 ARG A 32 -13.770 -5.343 -4.811 1.00 0.00 H new ATOM 0 HG2 ARG A 32 -13.866 -2.585 -5.307 1.00 0.00 H new ATOM 0 HG3 ARG A 32 -12.717 -3.158 -6.500 1.00 0.00 H new ATOM 0 HD2 ARG A 32 -14.603 -5.085 -6.812 1.00 0.00 H new ATOM 0 HD3 ARG A 32 -15.641 -3.808 -6.211 1.00 0.00 H new ATOM 0 HE ARG A 32 -14.131 -2.505 -8.151 1.00 0.00 H new ATOM 0 HH11 ARG A 32 -16.104 -5.453 -8.119 1.00 0.00 H new ATOM 0 HH12 ARG A 32 -16.545 -5.320 -9.825 1.00 0.00 H new ATOM 0 HH21 ARG A 32 -14.702 -2.332 -10.356 1.00 0.00 H new ATOM 0 HH22 ARG A 32 -15.749 -3.548 -11.095 1.00 0.00 H new ATOM 492 N GLY A 33 -14.471 -4.707 -1.891 1.00 0.00 N ATOM 493 CA GLY A 33 -15.025 -5.585 -0.874 1.00 0.00 C ATOM 494 C GLY A 33 -14.864 -4.979 0.521 1.00 0.00 C ATOM 495 O GLY A 33 -14.372 -5.639 1.436 1.00 0.00 O ATOM 0 H GLY A 33 -15.068 -3.921 -2.147 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.081 -5.762 -1.078 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.526 -6.553 -0.913 1.00 0.00 H new ATOM 499 N LEU A 34 -15.287 -3.729 0.641 1.00 0.00 N ATOM 500 CA LEU A 34 -15.195 -3.026 1.910 1.00 0.00 C ATOM 501 C LEU A 34 -16.577 -2.985 2.566 1.00 0.00 C ATOM 502 O LEU A 34 -17.492 -2.341 2.056 1.00 0.00 O ATOM 503 CB LEU A 34 -14.567 -1.645 1.713 1.00 0.00 C ATOM 504 CG LEU A 34 -13.202 -1.622 1.021 1.00 0.00 C ATOM 505 CD1 LEU A 34 -12.362 -0.439 1.506 1.00 0.00 C ATOM 506 CD2 LEU A 34 -12.474 -2.955 1.200 1.00 0.00 C ATOM 0 H LEU A 34 -15.694 -3.185 -0.119 1.00 0.00 H new ATOM 0 HA LEU A 34 -14.532 -3.557 2.593 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -15.257 -1.033 1.132 1.00 0.00 H new ATOM 0 HB3 LEU A 34 -14.465 -1.171 2.689 1.00 0.00 H new ATOM 0 HG LEU A 34 -13.363 -1.485 -0.048 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -11.397 -0.446 0.999 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -12.883 0.492 1.283 1.00 0.00 H new ATOM 0 HD13 LEU A 34 -12.207 -0.520 2.582 1.00 0.00 H new ATOM 0 HD21 LEU A 34 -11.507 -2.912 0.699 1.00 0.00 H new ATOM 0 HD22 LEU A 34 -12.324 -3.148 2.262 1.00 0.00 H new ATOM 0 HD23 LEU A 34 -13.072 -3.757 0.767 1.00 0.00 H new ATOM 518 N PRO A 35 -16.687 -3.700 3.718 1.00 0.00 N ATOM 519 CA PRO A 35 -17.942 -3.751 4.449 1.00 0.00 C ATOM 520 C PRO A 35 -18.194 -2.441 5.198 1.00 0.00 C ATOM 521 O PRO A 35 -17.314 -1.942 5.897 1.00 0.00 O ATOM 522 CB PRO A 35 -17.808 -4.948 5.376 1.00 0.00 C ATOM 523 CG PRO A 35 -16.319 -5.242 5.466 1.00 0.00 C ATOM 524 CD PRO A 35 -15.625 -4.476 4.352 1.00 0.00 C ATOM 0 HA PRO A 35 -18.806 -3.865 3.794 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -18.223 -4.728 6.360 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -18.353 -5.807 4.985 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.928 -4.940 6.438 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.134 -6.312 5.366 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -14.842 -3.828 4.745 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -15.151 -5.153 3.641 1.00 0.00 H new ATOM 532 N ALA A 36 -19.400 -1.920 5.025 1.00 0.00 N ATOM 533 CA ALA A 36 -19.779 -0.678 5.675 1.00 0.00 C ATOM 534 C ALA A 36 -19.504 -0.788 7.176 1.00 0.00 C ATOM 535 O ALA A 36 -19.426 -1.890 7.717 1.00 0.00 O ATOM 536 CB ALA A 36 -21.247 -0.370 5.372 1.00 0.00 C ATOM 0 H ALA A 36 -20.127 -2.336 4.444 1.00 0.00 H new ATOM 0 HA ALA A 36 -19.186 0.152 5.291 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -21.531 0.562 5.860 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -21.383 -0.272 4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -21.873 -1.180 5.745 1.00 0.00 H new ATOM 542 N MET A 37 -19.365 0.369 7.806 1.00 0.00 N ATOM 543 CA MET A 37 -19.100 0.416 9.234 1.00 0.00 C ATOM 544 C MET A 37 -20.267 1.058 9.987 1.00 0.00 C ATOM 545 O MET A 37 -20.546 0.699 11.131 1.00 0.00 O ATOM 546 CB MET A 37 -17.824 1.220 9.491 1.00 0.00 C ATOM 547 CG MET A 37 -16.581 0.345 9.314 1.00 0.00 C ATOM 548 SD MET A 37 -16.364 -0.703 10.743 1.00 0.00 S ATOM 549 CE MET A 37 -15.489 -2.068 9.996 1.00 0.00 C ATOM 0 H MET A 37 -19.431 1.281 7.354 1.00 0.00 H new ATOM 0 HA MET A 37 -18.976 -0.605 9.595 1.00 0.00 H new ATOM 0 HB2 MET A 37 -17.778 2.066 8.805 1.00 0.00 H new ATOM 0 HB3 MET A 37 -17.845 1.629 10.501 1.00 0.00 H new ATOM 0 HG2 MET A 37 -16.681 -0.266 8.417 1.00 0.00 H new ATOM 0 HG3 MET A 37 -15.701 0.973 9.176 1.00 0.00 H new ATOM 0 HE1 MET A 37 -15.857 -3.007 10.411 1.00 0.00 H new ATOM 0 HE2 MET A 37 -15.652 -2.059 8.918 1.00 0.00 H new ATOM 0 HE3 MET A 37 -14.423 -1.973 10.202 1.00 0.00 H new ATOM 559 N ASP A 38 -20.919 1.996 9.316 1.00 0.00 N ATOM 560 CA ASP A 38 -22.050 2.691 9.907 1.00 0.00 C ATOM 561 C ASP A 38 -23.339 1.941 9.565 1.00 0.00 C ATOM 562 O ASP A 38 -23.341 1.063 8.704 1.00 0.00 O ATOM 563 CB ASP A 38 -22.170 4.114 9.359 1.00 0.00 C ATOM 564 CG ASP A 38 -21.064 5.073 9.801 1.00 0.00 C ATOM 565 OD1 ASP A 38 -20.818 5.130 11.025 1.00 0.00 O ATOM 566 OD2 ASP A 38 -20.489 5.729 8.905 1.00 0.00 O ATOM 0 H ASP A 38 -20.685 2.291 8.368 1.00 0.00 H new ATOM 0 HA ASP A 38 -21.895 2.733 10.985 1.00 0.00 H new ATOM 0 HB2 ASP A 38 -22.177 4.068 8.270 1.00 0.00 H new ATOM 0 HB3 ASP A 38 -23.131 4.526 9.667 1.00 0.00 H new ATOM 571 N GLU A 39 -24.405 2.316 10.257 1.00 0.00 N ATOM 572 CA GLU A 39 -25.698 1.690 10.037 1.00 0.00 C ATOM 573 C GLU A 39 -26.676 2.695 9.425 1.00 0.00 C ATOM 574 O GLU A 39 -27.694 2.306 8.854 1.00 0.00 O ATOM 575 CB GLU A 39 -26.253 1.108 11.338 1.00 0.00 C ATOM 576 CG GLU A 39 -25.560 1.724 12.555 1.00 0.00 C ATOM 577 CD GLU A 39 -26.203 1.239 13.856 1.00 0.00 C ATOM 578 OE1 GLU A 39 -27.434 1.021 13.834 1.00 0.00 O ATOM 579 OE2 GLU A 39 -25.450 1.099 14.844 1.00 0.00 O ATOM 0 H GLU A 39 -24.400 3.045 10.970 1.00 0.00 H new ATOM 0 HA GLU A 39 -25.567 0.866 9.336 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -27.326 1.292 11.394 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -26.114 0.027 11.345 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -24.502 1.461 12.548 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -25.618 2.811 12.500 1.00 0.00 H new ATOM 586 N GLN A 40 -26.333 3.967 9.564 1.00 0.00 N ATOM 587 CA GLN A 40 -27.169 5.030 9.031 1.00 0.00 C ATOM 588 C GLN A 40 -27.115 5.031 7.502 1.00 0.00 C ATOM 589 O GLN A 40 -28.123 5.282 6.843 1.00 0.00 O ATOM 590 CB GLN A 40 -26.752 6.389 9.595 1.00 0.00 C ATOM 591 CG GLN A 40 -26.987 6.452 11.106 1.00 0.00 C ATOM 592 CD GLN A 40 -27.758 7.717 11.489 1.00 0.00 C ATOM 593 OE1 GLN A 40 -28.896 7.924 11.099 1.00 0.00 O ATOM 594 NE2 GLN A 40 -27.077 8.550 12.271 1.00 0.00 N ATOM 0 H GLN A 40 -25.488 4.286 10.038 1.00 0.00 H new ATOM 0 HA GLN A 40 -28.198 4.846 9.339 1.00 0.00 H new ATOM 0 HB2 GLN A 40 -25.699 6.568 9.380 1.00 0.00 H new ATOM 0 HB3 GLN A 40 -27.317 7.180 9.102 1.00 0.00 H new ATOM 0 HG2 GLN A 40 -27.543 5.572 11.428 1.00 0.00 H new ATOM 0 HG3 GLN A 40 -26.030 6.433 11.628 1.00 0.00 H new ATOM 0 HE21 GLN A 40 -26.128 8.316 12.561 1.00 0.00 H new ATOM 0 HE22 GLN A 40 -27.504 9.423 12.581 1.00 0.00 H new ATOM 603 N SER A 41 -25.930 4.747 6.983 1.00 0.00 N ATOM 604 CA SER A 41 -25.732 4.712 5.544 1.00 0.00 C ATOM 605 C SER A 41 -24.871 3.506 5.163 1.00 0.00 C ATOM 606 O SER A 41 -23.984 3.109 5.918 1.00 0.00 O ATOM 607 CB SER A 41 -25.085 6.006 5.045 1.00 0.00 C ATOM 608 OG SER A 41 -25.559 6.376 3.753 1.00 0.00 O ATOM 0 H SER A 41 -25.097 4.539 7.533 1.00 0.00 H new ATOM 0 HA SER A 41 -26.708 4.618 5.067 1.00 0.00 H new ATOM 0 HB2 SER A 41 -25.292 6.810 5.751 1.00 0.00 H new ATOM 0 HB3 SER A 41 -24.003 5.881 5.012 1.00 0.00 H new ATOM 0 HG SER A 41 -25.124 7.207 3.471 1.00 0.00 H new ATOM 614 N MET A 42 -25.161 2.958 3.993 1.00 0.00 N ATOM 615 CA MET A 42 -24.424 1.805 3.502 1.00 0.00 C ATOM 616 C MET A 42 -23.123 2.236 2.822 1.00 0.00 C ATOM 617 O MET A 42 -22.804 1.766 1.731 1.00 0.00 O ATOM 618 CB MET A 42 -25.290 1.031 2.506 1.00 0.00 C ATOM 619 CG MET A 42 -25.362 -0.451 2.878 1.00 0.00 C ATOM 620 SD MET A 42 -24.988 -1.457 1.452 1.00 0.00 S ATOM 621 CE MET A 42 -23.220 -1.229 1.367 1.00 0.00 C ATOM 0 H MET A 42 -25.897 3.291 3.370 1.00 0.00 H new ATOM 0 HA MET A 42 -24.175 1.168 4.351 1.00 0.00 H new ATOM 0 HB2 MET A 42 -26.294 1.454 2.487 1.00 0.00 H new ATOM 0 HB3 MET A 42 -24.880 1.138 1.502 1.00 0.00 H new ATOM 0 HG2 MET A 42 -24.657 -0.668 3.681 1.00 0.00 H new ATOM 0 HG3 MET A 42 -26.357 -0.692 3.253 1.00 0.00 H new ATOM 0 HE1 MET A 42 -22.967 -0.686 0.456 1.00 0.00 H new ATOM 0 HE2 MET A 42 -22.884 -0.660 2.234 1.00 0.00 H new ATOM 0 HE3 MET A 42 -22.728 -2.201 1.359 1.00 0.00 H new ATOM 631 N THR A 43 -22.407 3.125 3.495 1.00 0.00 N ATOM 632 CA THR A 43 -21.148 3.624 2.969 1.00 0.00 C ATOM 633 C THR A 43 -20.171 3.914 4.110 1.00 0.00 C ATOM 634 O THR A 43 -20.544 3.860 5.281 1.00 0.00 O ATOM 635 CB THR A 43 -21.449 4.847 2.101 1.00 0.00 C ATOM 636 OG1 THR A 43 -20.191 5.182 1.523 1.00 0.00 O ATOM 637 CG2 THR A 43 -21.817 6.078 2.932 1.00 0.00 C ATOM 0 H THR A 43 -22.675 3.512 4.400 1.00 0.00 H new ATOM 0 HA THR A 43 -20.657 2.878 2.344 1.00 0.00 H new ATOM 0 HB THR A 43 -22.264 4.614 1.416 1.00 0.00 H new ATOM 0 HG1 THR A 43 -20.117 4.768 0.638 1.00 0.00 H new ATOM 0 HG21 THR A 43 -22.021 6.918 2.268 1.00 0.00 H new ATOM 0 HG22 THR A 43 -22.704 5.863 3.528 1.00 0.00 H new ATOM 0 HG23 THR A 43 -20.988 6.332 3.593 1.00 0.00 H new ATOM 645 N SER A 44 -18.938 4.216 3.728 1.00 0.00 N ATOM 646 CA SER A 44 -17.905 4.515 4.705 1.00 0.00 C ATOM 647 C SER A 44 -16.710 5.177 4.017 1.00 0.00 C ATOM 648 O SER A 44 -16.686 5.304 2.793 1.00 0.00 O ATOM 649 CB SER A 44 -17.459 3.249 5.440 1.00 0.00 C ATOM 650 OG SER A 44 -17.445 2.111 4.583 1.00 0.00 O ATOM 0 H SER A 44 -18.632 4.260 2.756 1.00 0.00 H new ATOM 0 HA SER A 44 -18.320 5.203 5.441 1.00 0.00 H new ATOM 0 HB2 SER A 44 -16.463 3.403 5.855 1.00 0.00 H new ATOM 0 HB3 SER A 44 -18.129 3.062 6.280 1.00 0.00 H new ATOM 0 HG SER A 44 -17.153 1.324 5.089 1.00 0.00 H new ATOM 656 N ASP A 45 -15.748 5.583 4.832 1.00 0.00 N ATOM 657 CA ASP A 45 -14.553 6.230 4.317 1.00 0.00 C ATOM 658 C ASP A 45 -13.317 5.477 4.812 1.00 0.00 C ATOM 659 O ASP A 45 -12.568 5.986 5.645 1.00 0.00 O ATOM 660 CB ASP A 45 -14.454 7.676 4.807 1.00 0.00 C ATOM 661 CG ASP A 45 -15.731 8.503 4.643 1.00 0.00 C ATOM 662 OD1 ASP A 45 -16.376 8.346 3.584 1.00 0.00 O ATOM 663 OD2 ASP A 45 -16.032 9.274 5.580 1.00 0.00 O ATOM 0 H ASP A 45 -15.772 5.476 5.846 1.00 0.00 H new ATOM 0 HA ASP A 45 -14.608 6.222 3.228 1.00 0.00 H new ATOM 0 HB2 ASP A 45 -14.177 7.668 5.861 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -13.646 8.172 4.269 1.00 0.00 H new ATOM 668 N PRO A 46 -13.137 4.245 4.266 1.00 0.00 N ATOM 669 CA PRO A 46 -12.004 3.417 4.643 1.00 0.00 C ATOM 670 C PRO A 46 -10.713 3.928 4.002 1.00 0.00 C ATOM 671 O PRO A 46 -10.750 4.794 3.130 1.00 0.00 O ATOM 672 CB PRO A 46 -12.376 2.013 4.193 1.00 0.00 C ATOM 673 CG PRO A 46 -13.488 2.184 3.171 1.00 0.00 C ATOM 674 CD PRO A 46 -14.003 3.610 3.277 1.00 0.00 C ATOM 0 HA PRO A 46 -11.806 3.438 5.715 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -11.518 1.503 3.755 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -12.710 1.408 5.036 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -13.116 1.986 2.166 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -14.292 1.473 3.359 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -13.949 4.123 2.317 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -15.046 3.632 3.592 1.00 0.00 H new ATOM 682 N TYR A 47 -9.601 3.370 4.459 1.00 0.00 N ATOM 683 CA TYR A 47 -8.301 3.759 3.941 1.00 0.00 C ATOM 684 C TYR A 47 -7.233 2.727 4.310 1.00 0.00 C ATOM 685 O TYR A 47 -7.213 2.223 5.432 1.00 0.00 O ATOM 686 CB TYR A 47 -7.960 5.091 4.612 1.00 0.00 C ATOM 687 CG TYR A 47 -7.738 4.987 6.122 1.00 0.00 C ATOM 688 CD1 TYR A 47 -8.817 5.025 6.982 1.00 0.00 C ATOM 689 CD2 TYR A 47 -6.460 4.857 6.624 1.00 0.00 C ATOM 690 CE1 TYR A 47 -8.608 4.928 8.404 1.00 0.00 C ATOM 691 CE2 TYR A 47 -6.251 4.760 8.046 1.00 0.00 C ATOM 692 CZ TYR A 47 -7.335 4.800 8.865 1.00 0.00 C ATOM 693 OH TYR A 47 -7.138 4.708 10.208 1.00 0.00 O ATOM 0 H TYR A 47 -9.574 2.651 5.182 1.00 0.00 H new ATOM 0 HA TYR A 47 -8.328 3.834 2.854 1.00 0.00 H new ATOM 0 HB2 TYR A 47 -7.061 5.499 4.150 1.00 0.00 H new ATOM 0 HB3 TYR A 47 -8.766 5.799 4.421 1.00 0.00 H new ATOM 0 HD1 TYR A 47 -9.818 5.127 6.589 1.00 0.00 H new ATOM 0 HD2 TYR A 47 -5.616 4.828 5.951 1.00 0.00 H new ATOM 0 HE1 TYR A 47 -9.443 4.956 9.088 1.00 0.00 H new ATOM 0 HE2 TYR A 47 -5.256 4.658 8.452 1.00 0.00 H new ATOM 0 HH TYR A 47 -6.180 4.620 10.393 1.00 0.00 H new ATOM 703 N ILE A 48 -6.370 2.444 3.345 1.00 0.00 N ATOM 704 CA ILE A 48 -5.302 1.482 3.554 1.00 0.00 C ATOM 705 C ILE A 48 -4.043 2.218 4.018 1.00 0.00 C ATOM 706 O ILE A 48 -3.757 3.320 3.553 1.00 0.00 O ATOM 707 CB ILE A 48 -5.091 0.634 2.299 1.00 0.00 C ATOM 708 CG1 ILE A 48 -6.247 -0.349 2.101 1.00 0.00 C ATOM 709 CG2 ILE A 48 -3.736 -0.075 2.337 1.00 0.00 C ATOM 710 CD1 ILE A 48 -6.153 -1.040 0.739 1.00 0.00 C ATOM 0 H ILE A 48 -6.389 2.865 2.416 1.00 0.00 H new ATOM 0 HA ILE A 48 -5.571 0.780 4.343 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.082 1.299 1.435 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -6.233 -1.097 2.894 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -7.197 0.180 2.179 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -3.612 -0.671 1.433 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -2.939 0.666 2.395 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.690 -0.726 3.210 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -6.986 -1.733 0.624 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -6.192 -0.291 -0.052 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -5.213 -1.589 0.673 1.00 0.00 H new ATOM 722 N LYS A 49 -3.324 1.578 4.928 1.00 0.00 N ATOM 723 CA LYS A 49 -2.102 2.158 5.460 1.00 0.00 C ATOM 724 C LYS A 49 -0.903 1.332 4.988 1.00 0.00 C ATOM 725 O LYS A 49 -0.903 0.108 5.106 1.00 0.00 O ATOM 726 CB LYS A 49 -2.192 2.296 6.981 1.00 0.00 C ATOM 727 CG LYS A 49 -2.958 3.562 7.372 1.00 0.00 C ATOM 728 CD LYS A 49 -2.933 3.772 8.887 1.00 0.00 C ATOM 729 CE LYS A 49 -3.063 5.256 9.237 1.00 0.00 C ATOM 730 NZ LYS A 49 -1.787 5.774 9.778 1.00 0.00 N ATOM 0 H LYS A 49 -3.564 0.663 5.311 1.00 0.00 H new ATOM 0 HA LYS A 49 -1.963 3.170 5.079 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -2.689 1.421 7.400 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.189 2.327 7.407 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -2.518 4.426 6.874 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -3.990 3.488 7.029 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -3.747 3.213 9.349 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -2.003 3.378 9.297 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.345 5.822 8.349 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -3.858 5.395 9.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -1.902 6.773 10.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -1.517 5.223 10.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -1.044 5.690 9.055 1.00 0.00 H new ATOM 744 N MET A 50 0.089 2.035 4.462 1.00 0.00 N ATOM 745 CA MET A 50 1.291 1.383 3.971 1.00 0.00 C ATOM 746 C MET A 50 2.397 1.406 5.027 1.00 0.00 C ATOM 747 O MET A 50 2.466 2.328 5.839 1.00 0.00 O ATOM 748 CB MET A 50 1.777 2.092 2.706 1.00 0.00 C ATOM 749 CG MET A 50 2.373 1.094 1.712 1.00 0.00 C ATOM 750 SD MET A 50 4.037 0.668 2.197 1.00 0.00 S ATOM 751 CE MET A 50 4.922 2.067 1.529 1.00 0.00 C ATOM 0 H MET A 50 0.085 3.050 4.365 1.00 0.00 H new ATOM 0 HA MET A 50 1.052 0.344 3.745 1.00 0.00 H new ATOM 0 HB2 MET A 50 0.946 2.622 2.240 1.00 0.00 H new ATOM 0 HB3 MET A 50 2.525 2.840 2.969 1.00 0.00 H new ATOM 0 HG2 MET A 50 1.756 0.196 1.672 1.00 0.00 H new ATOM 0 HG3 MET A 50 2.376 1.524 0.710 1.00 0.00 H new ATOM 0 HE1 MET A 50 5.553 1.738 0.703 1.00 0.00 H new ATOM 0 HE2 MET A 50 4.210 2.809 1.168 1.00 0.00 H new ATOM 0 HE3 MET A 50 5.544 2.509 2.307 1.00 0.00 H new ATOM 761 N THR A 51 3.236 0.382 4.982 1.00 0.00 N ATOM 762 CA THR A 51 4.336 0.273 5.925 1.00 0.00 C ATOM 763 C THR A 51 5.454 -0.594 5.343 1.00 0.00 C ATOM 764 O THR A 51 5.201 -1.694 4.855 1.00 0.00 O ATOM 765 CB THR A 51 3.777 -0.262 7.245 1.00 0.00 C ATOM 766 OG1 THR A 51 2.865 0.747 7.670 1.00 0.00 O ATOM 767 CG2 THR A 51 4.831 -0.302 8.354 1.00 0.00 C ATOM 0 H THR A 51 3.176 -0.380 4.307 1.00 0.00 H new ATOM 0 HA THR A 51 4.789 1.246 6.118 1.00 0.00 H new ATOM 0 HB THR A 51 3.375 -1.263 7.090 1.00 0.00 H new ATOM 0 HG1 THR A 51 3.115 1.605 7.267 1.00 0.00 H new ATOM 0 HG21 THR A 51 4.382 -0.689 9.269 1.00 0.00 H new ATOM 0 HG22 THR A 51 5.654 -0.950 8.051 1.00 0.00 H new ATOM 0 HG23 THR A 51 5.209 0.705 8.533 1.00 0.00 H new ATOM 775 N ILE A 52 6.667 -0.065 5.413 1.00 0.00 N ATOM 776 CA ILE A 52 7.825 -0.777 4.899 1.00 0.00 C ATOM 777 C ILE A 52 8.422 -1.642 6.011 1.00 0.00 C ATOM 778 O ILE A 52 9.332 -1.210 6.717 1.00 0.00 O ATOM 779 CB ILE A 52 8.823 0.201 4.278 1.00 0.00 C ATOM 780 CG1 ILE A 52 8.172 1.009 3.153 1.00 0.00 C ATOM 781 CG2 ILE A 52 10.083 -0.527 3.805 1.00 0.00 C ATOM 782 CD1 ILE A 52 9.231 1.633 2.242 1.00 0.00 C ATOM 0 H ILE A 52 6.873 0.848 5.818 1.00 0.00 H new ATOM 0 HA ILE A 52 7.531 -1.451 4.094 1.00 0.00 H new ATOM 0 HB ILE A 52 9.130 0.909 5.047 1.00 0.00 H new ATOM 0 HG12 ILE A 52 7.519 0.362 2.567 1.00 0.00 H new ATOM 0 HG13 ILE A 52 7.546 1.793 3.579 1.00 0.00 H new ATOM 0 HG21 ILE A 52 10.776 0.192 3.368 1.00 0.00 H new ATOM 0 HG22 ILE A 52 10.559 -1.020 4.653 1.00 0.00 H new ATOM 0 HG23 ILE A 52 9.813 -1.272 3.057 1.00 0.00 H new ATOM 0 HD11 ILE A 52 8.741 2.201 1.451 1.00 0.00 H new ATOM 0 HD12 ILE A 52 9.867 2.298 2.826 1.00 0.00 H new ATOM 0 HD13 ILE A 52 9.840 0.845 1.799 1.00 0.00 H new ATOM 794 N LEU A 53 7.885 -2.847 6.133 1.00 0.00 N ATOM 795 CA LEU A 53 8.353 -3.776 7.148 1.00 0.00 C ATOM 796 C LEU A 53 9.596 -4.504 6.631 1.00 0.00 C ATOM 797 O LEU A 53 9.802 -4.608 5.423 1.00 0.00 O ATOM 798 CB LEU A 53 7.224 -4.715 7.577 1.00 0.00 C ATOM 799 CG LEU A 53 6.114 -4.087 8.422 1.00 0.00 C ATOM 800 CD1 LEU A 53 4.938 -5.051 8.587 1.00 0.00 C ATOM 801 CD2 LEU A 53 6.657 -3.608 9.770 1.00 0.00 C ATOM 0 H LEU A 53 7.130 -3.202 5.546 1.00 0.00 H new ATOM 0 HA LEU A 53 8.649 -3.239 8.049 1.00 0.00 H new ATOM 0 HB2 LEU A 53 6.774 -5.143 6.681 1.00 0.00 H new ATOM 0 HB3 LEU A 53 7.659 -5.541 8.140 1.00 0.00 H new ATOM 0 HG LEU A 53 5.738 -3.210 7.896 1.00 0.00 H new ATOM 0 HD11 LEU A 53 4.163 -4.580 9.192 1.00 0.00 H new ATOM 0 HD12 LEU A 53 4.532 -5.300 7.607 1.00 0.00 H new ATOM 0 HD13 LEU A 53 5.280 -5.961 9.080 1.00 0.00 H new ATOM 0 HD21 LEU A 53 5.848 -3.166 10.352 1.00 0.00 H new ATOM 0 HD22 LEU A 53 7.075 -4.454 10.315 1.00 0.00 H new ATOM 0 HD23 LEU A 53 7.435 -2.863 9.605 1.00 0.00 H new ATOM 813 N PRO A 54 10.413 -5.002 7.598 1.00 0.00 N ATOM 814 CA PRO A 54 10.095 -4.835 9.006 1.00 0.00 C ATOM 815 C PRO A 54 10.371 -3.402 9.463 1.00 0.00 C ATOM 816 O PRO A 54 9.805 -2.943 10.455 1.00 0.00 O ATOM 817 CB PRO A 54 10.951 -5.864 9.726 1.00 0.00 C ATOM 818 CG PRO A 54 12.052 -6.248 8.751 1.00 0.00 C ATOM 819 CD PRO A 54 11.656 -5.735 7.376 1.00 0.00 C ATOM 0 HA PRO A 54 9.038 -4.994 9.222 1.00 0.00 H new ATOM 0 HB2 PRO A 54 11.369 -5.450 10.644 1.00 0.00 H new ATOM 0 HB3 PRO A 54 10.359 -6.735 10.009 1.00 0.00 H new ATOM 0 HG2 PRO A 54 13.004 -5.816 9.060 1.00 0.00 H new ATOM 0 HG3 PRO A 54 12.184 -7.330 8.731 1.00 0.00 H new ATOM 0 HD2 PRO A 54 12.427 -5.089 6.957 1.00 0.00 H new ATOM 0 HD3 PRO A 54 11.512 -6.556 6.673 1.00 0.00 H new ATOM 827 N GLU A 55 11.241 -2.734 8.720 1.00 0.00 N ATOM 828 CA GLU A 55 11.598 -1.362 9.037 1.00 0.00 C ATOM 829 C GLU A 55 10.460 -0.679 9.797 1.00 0.00 C ATOM 830 O GLU A 55 10.593 -0.377 10.982 1.00 0.00 O ATOM 831 CB GLU A 55 11.957 -0.582 7.770 1.00 0.00 C ATOM 832 CG GLU A 55 13.474 -0.499 7.588 1.00 0.00 C ATOM 833 CD GLU A 55 13.878 -0.895 6.167 1.00 0.00 C ATOM 834 OE1 GLU A 55 13.692 -0.048 5.267 1.00 0.00 O ATOM 835 OE2 GLU A 55 14.363 -2.037 6.012 1.00 0.00 O ATOM 0 H GLU A 55 11.709 -3.118 7.899 1.00 0.00 H new ATOM 0 HA GLU A 55 12.480 -1.376 9.678 1.00 0.00 H new ATOM 0 HB2 GLU A 55 11.509 -1.066 6.902 1.00 0.00 H new ATOM 0 HB3 GLU A 55 11.538 0.423 7.827 1.00 0.00 H new ATOM 0 HG2 GLU A 55 13.814 0.515 7.797 1.00 0.00 H new ATOM 0 HG3 GLU A 55 13.966 -1.155 8.306 1.00 0.00 H new ATOM 842 N LYS A 56 9.365 -0.455 9.085 1.00 0.00 N ATOM 843 CA LYS A 56 8.204 0.187 9.678 1.00 0.00 C ATOM 844 C LYS A 56 8.453 1.693 9.774 1.00 0.00 C ATOM 845 O LYS A 56 7.657 2.421 10.364 1.00 0.00 O ATOM 846 CB LYS A 56 7.857 -0.466 11.017 1.00 0.00 C ATOM 847 CG LYS A 56 6.400 -0.195 11.398 1.00 0.00 C ATOM 848 CD LYS A 56 5.658 -1.501 11.691 1.00 0.00 C ATOM 849 CE LYS A 56 4.492 -1.266 12.653 1.00 0.00 C ATOM 850 NZ LYS A 56 4.451 -2.325 13.685 1.00 0.00 N ATOM 0 H LYS A 56 9.257 -0.707 8.102 1.00 0.00 H new ATOM 0 HA LYS A 56 7.327 0.049 9.046 1.00 0.00 H new ATOM 0 HB2 LYS A 56 8.027 -1.541 10.956 1.00 0.00 H new ATOM 0 HB3 LYS A 56 8.517 -0.082 11.795 1.00 0.00 H new ATOM 0 HG2 LYS A 56 6.364 0.452 12.274 1.00 0.00 H new ATOM 0 HG3 LYS A 56 5.901 0.337 10.588 1.00 0.00 H new ATOM 0 HD2 LYS A 56 5.285 -1.928 10.760 1.00 0.00 H new ATOM 0 HD3 LYS A 56 6.348 -2.227 12.121 1.00 0.00 H new ATOM 0 HE2 LYS A 56 4.596 -0.291 13.128 1.00 0.00 H new ATOM 0 HE3 LYS A 56 3.553 -1.253 12.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 3.654 -2.151 14.330 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 4.330 -3.251 13.227 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 5.340 -2.319 14.224 1.00 0.00 H new ATOM 864 N LYS A 57 9.562 2.116 9.185 1.00 0.00 N ATOM 865 CA LYS A 57 9.926 3.523 9.196 1.00 0.00 C ATOM 866 C LYS A 57 8.974 4.299 8.284 1.00 0.00 C ATOM 867 O LYS A 57 7.914 4.744 8.721 1.00 0.00 O ATOM 868 CB LYS A 57 11.402 3.698 8.836 1.00 0.00 C ATOM 869 CG LYS A 57 12.259 3.856 10.093 1.00 0.00 C ATOM 870 CD LYS A 57 12.542 5.332 10.382 1.00 0.00 C ATOM 871 CE LYS A 57 11.283 6.045 10.877 1.00 0.00 C ATOM 872 NZ LYS A 57 11.634 7.092 11.863 1.00 0.00 N ATOM 0 H LYS A 57 10.221 1.509 8.697 1.00 0.00 H new ATOM 0 HA LYS A 57 9.816 3.937 10.198 1.00 0.00 H new ATOM 0 HB2 LYS A 57 11.745 2.836 8.264 1.00 0.00 H new ATOM 0 HB3 LYS A 57 11.523 4.573 8.197 1.00 0.00 H new ATOM 0 HG2 LYS A 57 11.748 3.406 10.945 1.00 0.00 H new ATOM 0 HG3 LYS A 57 13.199 3.320 9.966 1.00 0.00 H new ATOM 0 HD2 LYS A 57 13.329 5.415 11.131 1.00 0.00 H new ATOM 0 HD3 LYS A 57 12.909 5.819 9.479 1.00 0.00 H new ATOM 0 HE2 LYS A 57 10.756 6.493 10.034 1.00 0.00 H new ATOM 0 HE3 LYS A 57 10.604 5.323 11.330 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 10.768 7.566 12.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 12.117 6.657 12.675 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 12.265 7.790 11.419 1.00 0.00 H new ATOM 886 N HIS A 58 9.386 4.437 7.032 1.00 0.00 N ATOM 887 CA HIS A 58 8.584 5.152 6.054 1.00 0.00 C ATOM 888 C HIS A 58 7.130 4.685 6.144 1.00 0.00 C ATOM 889 O HIS A 58 6.756 3.686 5.531 1.00 0.00 O ATOM 890 CB HIS A 58 9.171 4.995 4.650 1.00 0.00 C ATOM 891 CG HIS A 58 10.654 5.268 4.571 1.00 0.00 C ATOM 892 ND1 HIS A 58 11.274 6.265 5.304 1.00 0.00 N ATOM 893 CD2 HIS A 58 11.634 4.662 3.840 1.00 0.00 C ATOM 894 CE1 HIS A 58 12.567 6.252 5.018 1.00 0.00 C ATOM 895 NE2 HIS A 58 12.788 5.259 4.110 1.00 0.00 N ATOM 0 H HIS A 58 10.265 4.065 6.673 1.00 0.00 H new ATOM 0 HA HIS A 58 8.601 6.219 6.274 1.00 0.00 H new ATOM 0 HB2 HIS A 58 8.979 3.981 4.298 1.00 0.00 H new ATOM 0 HB3 HIS A 58 8.651 5.671 3.972 1.00 0.00 H new ATOM 0 HD2 HIS A 58 11.494 3.837 3.158 1.00 0.00 H new ATOM 0 HE1 HIS A 58 13.315 6.912 5.431 1.00 0.00 H new ATOM 0 HE2 HIS A 58 13.692 5.015 3.705 1.00 0.00 H new ATOM 903 N LYS A 59 6.349 5.429 6.913 1.00 0.00 N ATOM 904 CA LYS A 59 4.944 5.104 7.091 1.00 0.00 C ATOM 905 C LYS A 59 4.092 6.085 6.285 1.00 0.00 C ATOM 906 O LYS A 59 4.180 7.297 6.481 1.00 0.00 O ATOM 907 CB LYS A 59 4.589 5.060 8.579 1.00 0.00 C ATOM 908 CG LYS A 59 4.785 3.653 9.148 1.00 0.00 C ATOM 909 CD LYS A 59 3.843 3.402 10.327 1.00 0.00 C ATOM 910 CE LYS A 59 2.403 3.213 9.848 1.00 0.00 C ATOM 911 NZ LYS A 59 1.486 3.077 11.001 1.00 0.00 N ATOM 0 H LYS A 59 6.663 6.256 7.420 1.00 0.00 H new ATOM 0 HA LYS A 59 4.732 4.106 6.706 1.00 0.00 H new ATOM 0 HB2 LYS A 59 5.212 5.768 9.126 1.00 0.00 H new ATOM 0 HB3 LYS A 59 3.554 5.372 8.719 1.00 0.00 H new ATOM 0 HG2 LYS A 59 4.603 2.913 8.369 1.00 0.00 H new ATOM 0 HG3 LYS A 59 5.819 3.528 9.471 1.00 0.00 H new ATOM 0 HD2 LYS A 59 4.167 2.517 10.874 1.00 0.00 H new ATOM 0 HD3 LYS A 59 3.892 4.241 11.021 1.00 0.00 H new ATOM 0 HE2 LYS A 59 2.103 4.063 9.236 1.00 0.00 H new ATOM 0 HE3 LYS A 59 2.337 2.327 9.217 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 0.513 2.949 10.657 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 1.763 2.252 11.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 1.536 3.934 11.588 1.00 0.00 H new ATOM 925 N VAL A 60 3.286 5.526 5.394 1.00 0.00 N ATOM 926 CA VAL A 60 2.418 6.337 4.557 1.00 0.00 C ATOM 927 C VAL A 60 1.022 5.712 4.521 1.00 0.00 C ATOM 928 O VAL A 60 0.871 4.508 4.722 1.00 0.00 O ATOM 929 CB VAL A 60 3.036 6.499 3.166 1.00 0.00 C ATOM 930 CG1 VAL A 60 4.224 7.462 3.204 1.00 0.00 C ATOM 931 CG2 VAL A 60 3.445 5.144 2.586 1.00 0.00 C ATOM 0 H VAL A 60 3.216 4.521 5.234 1.00 0.00 H new ATOM 0 HA VAL A 60 2.315 7.340 4.972 1.00 0.00 H new ATOM 0 HB VAL A 60 2.278 6.928 2.510 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.645 7.560 2.203 1.00 0.00 H new ATOM 0 HG12 VAL A 60 3.890 8.439 3.554 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.985 7.075 3.882 1.00 0.00 H new ATOM 0 HG21 VAL A 60 3.881 5.288 1.597 1.00 0.00 H new ATOM 0 HG22 VAL A 60 4.178 4.674 3.241 1.00 0.00 H new ATOM 0 HG23 VAL A 60 2.567 4.503 2.505 1.00 0.00 H new ATOM 941 N LYS A 61 0.036 6.559 4.264 1.00 0.00 N ATOM 942 CA LYS A 61 -1.343 6.105 4.200 1.00 0.00 C ATOM 943 C LYS A 61 -1.989 6.630 2.916 1.00 0.00 C ATOM 944 O LYS A 61 -1.528 7.616 2.344 1.00 0.00 O ATOM 945 CB LYS A 61 -2.096 6.499 5.472 1.00 0.00 C ATOM 946 CG LYS A 61 -2.238 8.019 5.578 1.00 0.00 C ATOM 947 CD LYS A 61 -2.703 8.430 6.977 1.00 0.00 C ATOM 948 CE LYS A 61 -1.508 8.680 7.900 1.00 0.00 C ATOM 949 NZ LYS A 61 -0.896 9.996 7.610 1.00 0.00 N ATOM 0 H LYS A 61 0.165 7.557 4.098 1.00 0.00 H new ATOM 0 HA LYS A 61 -1.384 5.017 4.157 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -3.083 6.037 5.472 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -1.566 6.118 6.345 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -1.283 8.494 5.354 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -2.952 8.374 4.835 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -3.312 9.332 6.912 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -3.335 7.649 7.398 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -1.831 8.644 8.941 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -0.768 7.891 7.768 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -0.200 10.225 8.348 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -0.421 9.962 6.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -1.636 10.727 7.593 1.00 0.00 H new ATOM 963 N THR A 62 -3.045 5.946 2.501 1.00 0.00 N ATOM 964 CA THR A 62 -3.759 6.331 1.295 1.00 0.00 C ATOM 965 C THR A 62 -4.982 7.180 1.647 1.00 0.00 C ATOM 966 O THR A 62 -5.760 6.818 2.529 1.00 0.00 O ATOM 967 CB THR A 62 -4.105 5.056 0.524 1.00 0.00 C ATOM 968 OG1 THR A 62 -4.717 4.216 1.499 1.00 0.00 O ATOM 969 CG2 THR A 62 -2.862 4.278 0.089 1.00 0.00 C ATOM 0 H THR A 62 -3.423 5.128 2.978 1.00 0.00 H new ATOM 0 HA THR A 62 -3.142 6.959 0.653 1.00 0.00 H new ATOM 0 HB THR A 62 -4.697 5.313 -0.354 1.00 0.00 H new ATOM 0 HG1 THR A 62 -4.038 3.638 1.906 1.00 0.00 H new ATOM 0 HG21 THR A 62 -3.165 3.383 -0.454 1.00 0.00 H new ATOM 0 HG22 THR A 62 -2.248 4.905 -0.558 1.00 0.00 H new ATOM 0 HG23 THR A 62 -2.286 3.991 0.969 1.00 0.00 H new ATOM 977 N ARG A 63 -5.114 8.292 0.940 1.00 0.00 N ATOM 978 CA ARG A 63 -6.229 9.196 1.166 1.00 0.00 C ATOM 979 C ARG A 63 -7.536 8.408 1.274 1.00 0.00 C ATOM 980 O ARG A 63 -7.863 7.616 0.392 1.00 0.00 O ATOM 981 CB ARG A 63 -6.349 10.217 0.034 1.00 0.00 C ATOM 982 CG ARG A 63 -6.231 9.538 -1.332 1.00 0.00 C ATOM 983 CD ARG A 63 -7.312 10.042 -2.290 1.00 0.00 C ATOM 984 NE ARG A 63 -6.735 11.030 -3.230 1.00 0.00 N ATOM 985 CZ ARG A 63 -7.464 11.810 -4.040 1.00 0.00 C ATOM 986 NH1 ARG A 63 -8.801 11.721 -4.031 1.00 0.00 N ATOM 987 NH2 ARG A 63 -6.855 12.678 -4.859 1.00 0.00 N ATOM 0 H ARG A 63 -4.467 8.588 0.209 1.00 0.00 H new ATOM 0 HA ARG A 63 -6.042 9.727 2.099 1.00 0.00 H new ATOM 0 HB2 ARG A 63 -7.306 10.734 0.106 1.00 0.00 H new ATOM 0 HB3 ARG A 63 -5.570 10.973 0.137 1.00 0.00 H new ATOM 0 HG2 ARG A 63 -5.246 9.733 -1.755 1.00 0.00 H new ATOM 0 HG3 ARG A 63 -6.319 8.458 -1.214 1.00 0.00 H new ATOM 0 HD2 ARG A 63 -7.737 9.205 -2.844 1.00 0.00 H new ATOM 0 HD3 ARG A 63 -8.126 10.497 -1.726 1.00 0.00 H new ATOM 0 HE ARG A 63 -5.720 11.123 -3.263 1.00 0.00 H new ATOM 0 HH11 ARG A 63 -9.264 11.060 -3.408 1.00 0.00 H new ATOM 0 HH12 ARG A 63 -9.356 12.315 -4.648 1.00 0.00 H new ATOM 0 HH21 ARG A 63 -5.837 12.745 -4.866 1.00 0.00 H new ATOM 0 HH22 ARG A 63 -7.409 13.272 -5.476 1.00 0.00 H new ATOM 1001 N VAL A 64 -8.249 8.653 2.364 1.00 0.00 N ATOM 1002 CA VAL A 64 -9.514 7.976 2.599 1.00 0.00 C ATOM 1003 C VAL A 64 -10.590 8.590 1.701 1.00 0.00 C ATOM 1004 O VAL A 64 -10.779 9.806 1.696 1.00 0.00 O ATOM 1005 CB VAL A 64 -9.870 8.034 4.085 1.00 0.00 C ATOM 1006 CG1 VAL A 64 -8.610 8.117 4.949 1.00 0.00 C ATOM 1007 CG2 VAL A 64 -10.813 9.203 4.378 1.00 0.00 C ATOM 0 H VAL A 64 -7.975 9.311 3.094 1.00 0.00 H new ATOM 0 HA VAL A 64 -9.437 6.920 2.339 1.00 0.00 H new ATOM 0 HB VAL A 64 -10.391 7.111 4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 64 -8.892 8.157 6.001 1.00 0.00 H new ATOM 0 HG12 VAL A 64 -7.990 7.238 4.773 1.00 0.00 H new ATOM 0 HG13 VAL A 64 -8.049 9.015 4.689 1.00 0.00 H new ATOM 0 HG21 VAL A 64 -11.050 9.221 5.442 1.00 0.00 H new ATOM 0 HG22 VAL A 64 -10.330 10.139 4.098 1.00 0.00 H new ATOM 0 HG23 VAL A 64 -11.731 9.082 3.803 1.00 0.00 H new ATOM 1017 N LEU A 65 -11.267 7.722 0.964 1.00 0.00 N ATOM 1018 CA LEU A 65 -12.319 8.164 0.065 1.00 0.00 C ATOM 1019 C LEU A 65 -13.525 8.626 0.886 1.00 0.00 C ATOM 1020 O LEU A 65 -13.567 8.429 2.099 1.00 0.00 O ATOM 1021 CB LEU A 65 -12.651 7.069 -0.951 1.00 0.00 C ATOM 1022 CG LEU A 65 -11.659 6.902 -2.104 1.00 0.00 C ATOM 1023 CD1 LEU A 65 -11.429 8.231 -2.826 1.00 0.00 C ATOM 1024 CD2 LEU A 65 -10.350 6.280 -1.616 1.00 0.00 C ATOM 0 H LEU A 65 -11.107 6.715 0.971 1.00 0.00 H new ATOM 0 HA LEU A 65 -11.984 9.020 -0.521 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -12.725 6.119 -0.421 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -13.635 7.277 -1.371 1.00 0.00 H new ATOM 0 HG LEU A 65 -12.091 6.213 -2.829 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -10.720 8.084 -3.641 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -12.374 8.595 -3.228 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -11.028 8.962 -2.124 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -9.663 6.173 -2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -9.901 6.924 -0.860 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -10.552 5.300 -1.184 1.00 0.00 H new ATOM 1036 N ARG A 66 -14.476 9.233 0.191 1.00 0.00 N ATOM 1037 CA ARG A 66 -15.679 9.725 0.841 1.00 0.00 C ATOM 1038 C ARG A 66 -16.892 8.902 0.405 1.00 0.00 C ATOM 1039 O ARG A 66 -17.170 8.782 -0.788 1.00 0.00 O ATOM 1040 CB ARG A 66 -15.923 11.198 0.505 1.00 0.00 C ATOM 1041 CG ARG A 66 -14.748 12.066 0.958 1.00 0.00 C ATOM 1042 CD ARG A 66 -14.193 11.581 2.299 1.00 0.00 C ATOM 1043 NE ARG A 66 -13.394 12.653 2.934 1.00 0.00 N ATOM 1044 CZ ARG A 66 -12.176 13.027 2.520 1.00 0.00 C ATOM 1045 NH1 ARG A 66 -11.609 12.419 1.469 1.00 0.00 N ATOM 1046 NH2 ARG A 66 -11.525 14.010 3.157 1.00 0.00 N ATOM 0 H ARG A 66 -14.438 9.395 -0.815 1.00 0.00 H new ATOM 0 HA ARG A 66 -15.538 9.628 1.917 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -16.069 11.310 -0.569 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -16.839 11.538 0.989 1.00 0.00 H new ATOM 0 HG2 ARG A 66 -13.961 12.041 0.204 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -15.071 13.103 1.048 1.00 0.00 H new ATOM 0 HD2 ARG A 66 -15.012 11.289 2.956 1.00 0.00 H new ATOM 0 HD3 ARG A 66 -13.574 10.696 2.147 1.00 0.00 H new ATOM 0 HE ARG A 66 -13.796 13.137 3.737 1.00 0.00 H new ATOM 0 HH11 ARG A 66 -12.105 11.671 0.984 1.00 0.00 H new ATOM 0 HH12 ARG A 66 -10.682 12.704 1.154 1.00 0.00 H new ATOM 0 HH21 ARG A 66 -11.957 14.473 3.957 1.00 0.00 H new ATOM 0 HH22 ARG A 66 -10.598 14.295 2.842 1.00 0.00 H new ATOM 1060 N LYS A 67 -17.583 8.355 1.394 1.00 0.00 N ATOM 1061 CA LYS A 67 -18.761 7.546 1.128 1.00 0.00 C ATOM 1062 C LYS A 67 -18.495 6.652 -0.085 1.00 0.00 C ATOM 1063 O LYS A 67 -18.734 7.054 -1.222 1.00 0.00 O ATOM 1064 CB LYS A 67 -19.998 8.434 0.978 1.00 0.00 C ATOM 1065 CG LYS A 67 -20.275 9.211 2.267 1.00 0.00 C ATOM 1066 CD LYS A 67 -21.752 9.595 2.368 1.00 0.00 C ATOM 1067 CE LYS A 67 -22.259 9.451 3.805 1.00 0.00 C ATOM 1068 NZ LYS A 67 -22.268 10.765 4.486 1.00 0.00 N ATOM 0 H LYS A 67 -17.350 8.456 2.382 1.00 0.00 H new ATOM 0 HA LYS A 67 -18.970 6.888 1.971 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -19.852 9.131 0.153 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -20.863 7.820 0.726 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -19.993 8.606 3.129 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -19.659 10.110 2.294 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -21.888 10.623 2.032 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -22.342 8.962 1.705 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -23.264 9.030 3.802 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -21.624 8.755 4.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -22.615 10.649 5.460 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -21.303 11.152 4.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -22.893 11.418 3.972 1.00 0.00 H new ATOM 1082 N THR A 68 -18.005 5.454 0.200 1.00 0.00 N ATOM 1083 CA THR A 68 -17.705 4.499 -0.853 1.00 0.00 C ATOM 1084 C THR A 68 -17.260 3.164 -0.251 1.00 0.00 C ATOM 1085 O THR A 68 -16.636 3.134 0.808 1.00 0.00 O ATOM 1086 CB THR A 68 -16.660 5.127 -1.777 1.00 0.00 C ATOM 1087 OG1 THR A 68 -16.776 4.385 -2.988 1.00 0.00 O ATOM 1088 CG2 THR A 68 -15.228 4.857 -1.311 1.00 0.00 C ATOM 0 H THR A 68 -17.808 5.123 1.145 1.00 0.00 H new ATOM 0 HA THR A 68 -18.591 4.273 -1.446 1.00 0.00 H new ATOM 0 HB THR A 68 -16.827 6.203 -1.834 1.00 0.00 H new ATOM 0 HG1 THR A 68 -16.134 4.728 -3.644 1.00 0.00 H new ATOM 0 HG21 THR A 68 -14.526 5.325 -2.002 1.00 0.00 H new ATOM 0 HG22 THR A 68 -15.086 5.272 -0.313 1.00 0.00 H new ATOM 0 HG23 THR A 68 -15.050 3.782 -1.286 1.00 0.00 H new ATOM 1096 N LEU A 69 -17.599 2.093 -0.954 1.00 0.00 N ATOM 1097 CA LEU A 69 -17.242 0.759 -0.502 1.00 0.00 C ATOM 1098 C LEU A 69 -16.078 0.234 -1.345 1.00 0.00 C ATOM 1099 O LEU A 69 -15.496 -0.802 -1.028 1.00 0.00 O ATOM 1100 CB LEU A 69 -18.469 -0.156 -0.511 1.00 0.00 C ATOM 1101 CG LEU A 69 -19.532 0.138 0.549 1.00 0.00 C ATOM 1102 CD1 LEU A 69 -20.316 -1.127 0.905 1.00 0.00 C ATOM 1103 CD2 LEU A 69 -18.910 0.793 1.784 1.00 0.00 C ATOM 0 H LEU A 69 -18.117 2.122 -1.832 1.00 0.00 H new ATOM 0 HA LEU A 69 -16.900 0.786 0.533 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -18.937 -0.094 -1.493 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -18.132 -1.185 -0.383 1.00 0.00 H new ATOM 0 HG LEU A 69 -20.243 0.851 0.131 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -21.065 -0.890 1.661 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -20.810 -1.512 0.013 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -19.632 -1.881 1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -19.688 0.991 2.521 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -18.164 0.124 2.214 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -18.434 1.731 1.498 1.00 0.00 H new ATOM 1115 N ASP A 70 -15.774 0.973 -2.401 1.00 0.00 N ATOM 1116 CA ASP A 70 -14.689 0.596 -3.291 1.00 0.00 C ATOM 1117 C ASP A 70 -13.801 1.814 -3.551 1.00 0.00 C ATOM 1118 O ASP A 70 -13.917 2.461 -4.590 1.00 0.00 O ATOM 1119 CB ASP A 70 -15.227 0.107 -4.638 1.00 0.00 C ATOM 1120 CG ASP A 70 -16.316 0.986 -5.257 1.00 0.00 C ATOM 1121 OD1 ASP A 70 -17.449 0.939 -4.732 1.00 0.00 O ATOM 1122 OD2 ASP A 70 -15.990 1.684 -6.241 1.00 0.00 O ATOM 0 H ASP A 70 -16.260 1.831 -2.661 1.00 0.00 H new ATOM 0 HA ASP A 70 -14.125 -0.206 -2.814 1.00 0.00 H new ATOM 0 HB2 ASP A 70 -14.396 0.036 -5.340 1.00 0.00 H new ATOM 0 HB3 ASP A 70 -15.623 -0.900 -4.510 1.00 0.00 H new ATOM 1127 N PRO A 71 -12.909 2.096 -2.564 1.00 0.00 N ATOM 1128 CA PRO A 71 -12.001 3.225 -2.675 1.00 0.00 C ATOM 1129 C PRO A 71 -10.869 2.922 -3.659 1.00 0.00 C ATOM 1130 O PRO A 71 -10.424 1.780 -3.767 1.00 0.00 O ATOM 1131 CB PRO A 71 -11.507 3.474 -1.260 1.00 0.00 C ATOM 1132 CG PRO A 71 -11.791 2.195 -0.488 1.00 0.00 C ATOM 1133 CD PRO A 71 -12.743 1.351 -1.319 1.00 0.00 C ATOM 0 HA PRO A 71 -12.484 4.116 -3.076 1.00 0.00 H new ATOM 0 HB2 PRO A 71 -10.442 3.706 -1.253 1.00 0.00 H new ATOM 0 HB3 PRO A 71 -12.021 4.324 -0.811 1.00 0.00 H new ATOM 0 HG2 PRO A 71 -10.866 1.651 -0.297 1.00 0.00 H new ATOM 0 HG3 PRO A 71 -12.232 2.425 0.482 1.00 0.00 H new ATOM 0 HD2 PRO A 71 -12.333 0.358 -1.503 1.00 0.00 H new ATOM 0 HD3 PRO A 71 -13.697 1.213 -0.810 1.00 0.00 H new ATOM 1141 N ALA A 72 -10.435 3.965 -4.351 1.00 0.00 N ATOM 1142 CA ALA A 72 -9.363 3.825 -5.322 1.00 0.00 C ATOM 1143 C ALA A 72 -8.296 4.889 -5.054 1.00 0.00 C ATOM 1144 O ALA A 72 -8.399 6.013 -5.541 1.00 0.00 O ATOM 1145 CB ALA A 72 -9.939 3.921 -6.736 1.00 0.00 C ATOM 0 H ALA A 72 -10.806 4.911 -4.259 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.887 2.849 -5.229 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -9.135 3.816 -7.464 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -10.670 3.127 -6.886 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -10.423 4.889 -6.867 1.00 0.00 H new ATOM 1151 N PHE A 73 -7.295 4.495 -4.280 1.00 0.00 N ATOM 1152 CA PHE A 73 -6.211 5.401 -3.941 1.00 0.00 C ATOM 1153 C PHE A 73 -5.211 5.514 -5.094 1.00 0.00 C ATOM 1154 O PHE A 73 -4.702 6.599 -5.374 1.00 0.00 O ATOM 1155 CB PHE A 73 -5.500 4.811 -2.721 1.00 0.00 C ATOM 1156 CG PHE A 73 -6.448 4.295 -1.637 1.00 0.00 C ATOM 1157 CD1 PHE A 73 -7.266 5.161 -0.982 1.00 0.00 C ATOM 1158 CD2 PHE A 73 -6.473 2.971 -1.329 1.00 0.00 C ATOM 1159 CE1 PHE A 73 -8.147 4.683 0.025 1.00 0.00 C ATOM 1160 CE2 PHE A 73 -7.353 2.492 -0.323 1.00 0.00 C ATOM 1161 CZ PHE A 73 -8.171 3.359 0.333 1.00 0.00 C ATOM 0 H PHE A 73 -7.212 3.561 -3.878 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.607 6.396 -3.739 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.859 3.993 -3.048 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.850 5.572 -2.289 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -7.246 6.213 -1.227 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -5.823 2.283 -1.850 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -8.797 5.371 0.545 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -7.373 1.440 -0.079 1.00 0.00 H new ATOM 0 HZ PHE A 73 -8.840 2.995 1.099 1.00 0.00 H new ATOM 1171 N ASP A 74 -4.959 4.380 -5.730 1.00 0.00 N ATOM 1172 CA ASP A 74 -4.030 4.339 -6.846 1.00 0.00 C ATOM 1173 C ASP A 74 -2.845 5.261 -6.552 1.00 0.00 C ATOM 1174 O ASP A 74 -2.254 5.830 -7.469 1.00 0.00 O ATOM 1175 CB ASP A 74 -4.696 4.821 -8.136 1.00 0.00 C ATOM 1176 CG ASP A 74 -3.771 4.897 -9.353 1.00 0.00 C ATOM 1177 OD1 ASP A 74 -2.798 4.112 -9.376 1.00 0.00 O ATOM 1178 OD2 ASP A 74 -4.057 5.739 -10.231 1.00 0.00 O ATOM 0 H ASP A 74 -5.382 3.482 -5.494 1.00 0.00 H new ATOM 0 HA ASP A 74 -3.702 3.307 -6.974 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -5.525 4.154 -8.370 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.122 5.809 -7.960 1.00 0.00 H new ATOM 1183 N GLU A 75 -2.533 5.381 -5.270 1.00 0.00 N ATOM 1184 CA GLU A 75 -1.430 6.224 -4.844 1.00 0.00 C ATOM 1185 C GLU A 75 -0.168 5.384 -4.637 1.00 0.00 C ATOM 1186 O GLU A 75 -0.244 4.248 -4.172 1.00 0.00 O ATOM 1187 CB GLU A 75 -1.789 6.996 -3.572 1.00 0.00 C ATOM 1188 CG GLU A 75 -0.552 7.224 -2.701 1.00 0.00 C ATOM 1189 CD GLU A 75 0.467 8.113 -3.417 1.00 0.00 C ATOM 1190 OE1 GLU A 75 0.202 8.447 -4.593 1.00 0.00 O ATOM 1191 OE2 GLU A 75 1.487 8.440 -2.773 1.00 0.00 O ATOM 0 H GLU A 75 -3.025 4.908 -4.512 1.00 0.00 H new ATOM 0 HA GLU A 75 -1.232 6.954 -5.629 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -2.233 7.955 -3.838 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -2.539 6.443 -3.007 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -0.846 7.688 -1.760 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -0.094 6.266 -2.455 1.00 0.00 H new ATOM 1198 N THR A 76 0.963 5.976 -4.992 1.00 0.00 N ATOM 1199 CA THR A 76 2.240 5.296 -4.852 1.00 0.00 C ATOM 1200 C THR A 76 3.219 6.160 -4.055 1.00 0.00 C ATOM 1201 O THR A 76 3.246 7.379 -4.211 1.00 0.00 O ATOM 1202 CB THR A 76 2.743 4.940 -6.252 1.00 0.00 C ATOM 1203 OG1 THR A 76 3.613 3.832 -6.037 1.00 0.00 O ATOM 1204 CG2 THR A 76 3.654 6.021 -6.839 1.00 0.00 C ATOM 0 H THR A 76 1.022 6.919 -5.376 1.00 0.00 H new ATOM 0 HA THR A 76 2.136 4.371 -4.285 1.00 0.00 H new ATOM 0 HB THR A 76 1.892 4.783 -6.915 1.00 0.00 H new ATOM 0 HG1 THR A 76 4.238 4.043 -5.312 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.983 5.719 -7.833 1.00 0.00 H new ATOM 0 HG22 THR A 76 3.106 6.961 -6.908 1.00 0.00 H new ATOM 0 HG23 THR A 76 4.523 6.154 -6.194 1.00 0.00 H new ATOM 1212 N PHE A 77 4.001 5.493 -3.218 1.00 0.00 N ATOM 1213 CA PHE A 77 4.980 6.185 -2.397 1.00 0.00 C ATOM 1214 C PHE A 77 6.389 5.648 -2.654 1.00 0.00 C ATOM 1215 O PHE A 77 6.632 4.448 -2.529 1.00 0.00 O ATOM 1216 CB PHE A 77 4.605 5.922 -0.937 1.00 0.00 C ATOM 1217 CG PHE A 77 3.109 6.057 -0.644 1.00 0.00 C ATOM 1218 CD1 PHE A 77 2.493 7.260 -0.795 1.00 0.00 C ATOM 1219 CD2 PHE A 77 2.396 4.975 -0.233 1.00 0.00 C ATOM 1220 CE1 PHE A 77 1.105 7.386 -0.524 1.00 0.00 C ATOM 1221 CE2 PHE A 77 1.007 5.100 0.038 1.00 0.00 C ATOM 1222 CZ PHE A 77 0.391 6.303 -0.113 1.00 0.00 C ATOM 0 H PHE A 77 3.976 4.481 -3.091 1.00 0.00 H new ATOM 0 HA PHE A 77 4.978 7.249 -2.633 1.00 0.00 H new ATOM 0 HB2 PHE A 77 4.929 4.917 -0.665 1.00 0.00 H new ATOM 0 HB3 PHE A 77 5.153 6.617 -0.301 1.00 0.00 H new ATOM 0 HD1 PHE A 77 3.060 8.120 -1.121 1.00 0.00 H new ATOM 0 HD2 PHE A 77 2.886 4.020 -0.112 1.00 0.00 H new ATOM 0 HE1 PHE A 77 0.616 8.341 -0.644 1.00 0.00 H new ATOM 0 HE2 PHE A 77 0.441 4.240 0.364 1.00 0.00 H new ATOM 0 HZ PHE A 77 -0.665 6.399 0.093 1.00 0.00 H new ATOM 1232 N THR A 78 7.281 6.562 -3.007 1.00 0.00 N ATOM 1233 CA THR A 78 8.659 6.195 -3.283 1.00 0.00 C ATOM 1234 C THR A 78 9.478 6.190 -1.991 1.00 0.00 C ATOM 1235 O THR A 78 9.032 6.706 -0.967 1.00 0.00 O ATOM 1236 CB THR A 78 9.201 7.156 -4.343 1.00 0.00 C ATOM 1237 OG1 THR A 78 8.835 6.551 -5.580 1.00 0.00 O ATOM 1238 CG2 THR A 78 10.731 7.184 -4.381 1.00 0.00 C ATOM 0 H THR A 78 7.076 7.556 -3.108 1.00 0.00 H new ATOM 0 HA THR A 78 8.727 5.181 -3.678 1.00 0.00 H new ATOM 0 HB THR A 78 8.824 8.160 -4.149 1.00 0.00 H new ATOM 0 HG1 THR A 78 9.562 6.664 -6.227 1.00 0.00 H new ATOM 0 HG21 THR A 78 11.063 7.881 -5.150 1.00 0.00 H new ATOM 0 HG22 THR A 78 11.113 7.504 -3.412 1.00 0.00 H new ATOM 0 HG23 THR A 78 11.108 6.187 -4.609 1.00 0.00 H new ATOM 1246 N PHE A 79 10.662 5.603 -2.080 1.00 0.00 N ATOM 1247 CA PHE A 79 11.548 5.524 -0.931 1.00 0.00 C ATOM 1248 C PHE A 79 12.997 5.305 -1.370 1.00 0.00 C ATOM 1249 O PHE A 79 13.357 4.216 -1.815 1.00 0.00 O ATOM 1250 CB PHE A 79 11.093 4.325 -0.097 1.00 0.00 C ATOM 1251 CG PHE A 79 9.604 4.340 0.254 1.00 0.00 C ATOM 1252 CD1 PHE A 79 9.120 5.265 1.127 1.00 0.00 C ATOM 1253 CD2 PHE A 79 8.764 3.429 -0.307 1.00 0.00 C ATOM 1254 CE1 PHE A 79 7.738 5.279 1.452 1.00 0.00 C ATOM 1255 CE2 PHE A 79 7.382 3.443 0.019 1.00 0.00 C ATOM 1256 CZ PHE A 79 6.898 4.368 0.892 1.00 0.00 C ATOM 0 H PHE A 79 11.029 5.177 -2.931 1.00 0.00 H new ATOM 0 HA PHE A 79 11.505 6.454 -0.364 1.00 0.00 H new ATOM 0 HB2 PHE A 79 11.318 3.409 -0.644 1.00 0.00 H new ATOM 0 HB3 PHE A 79 11.673 4.296 0.825 1.00 0.00 H new ATOM 0 HD1 PHE A 79 9.787 5.988 1.572 1.00 0.00 H new ATOM 0 HD2 PHE A 79 9.148 2.695 -1.000 1.00 0.00 H new ATOM 0 HE1 PHE A 79 7.354 6.013 2.144 1.00 0.00 H new ATOM 0 HE2 PHE A 79 6.715 2.719 -0.426 1.00 0.00 H new ATOM 0 HZ PHE A 79 5.847 4.379 1.140 1.00 0.00 H new ATOM 1266 N TYR A 80 13.791 6.357 -1.228 1.00 0.00 N ATOM 1267 CA TYR A 80 15.193 6.293 -1.604 1.00 0.00 C ATOM 1268 C TYR A 80 16.045 5.758 -0.452 1.00 0.00 C ATOM 1269 O TYR A 80 15.769 6.040 0.713 1.00 0.00 O ATOM 1270 CB TYR A 80 15.613 7.732 -1.909 1.00 0.00 C ATOM 1271 CG TYR A 80 14.621 8.498 -2.787 1.00 0.00 C ATOM 1272 CD1 TYR A 80 14.556 8.241 -4.141 1.00 0.00 C ATOM 1273 CD2 TYR A 80 13.791 9.446 -2.223 1.00 0.00 C ATOM 1274 CE1 TYR A 80 13.622 8.962 -4.966 1.00 0.00 C ATOM 1275 CE2 TYR A 80 12.857 10.166 -3.049 1.00 0.00 C ATOM 1276 CZ TYR A 80 12.819 9.889 -4.380 1.00 0.00 C ATOM 1277 OH TYR A 80 11.937 10.570 -5.160 1.00 0.00 O ATOM 0 H TYR A 80 13.490 7.258 -0.858 1.00 0.00 H new ATOM 0 HA TYR A 80 15.333 5.627 -2.456 1.00 0.00 H new ATOM 0 HB2 TYR A 80 15.740 8.269 -0.969 1.00 0.00 H new ATOM 0 HB3 TYR A 80 16.585 7.719 -2.403 1.00 0.00 H new ATOM 0 HD1 TYR A 80 15.206 7.499 -4.582 1.00 0.00 H new ATOM 0 HD2 TYR A 80 13.842 9.647 -1.163 1.00 0.00 H new ATOM 0 HE1 TYR A 80 13.561 8.771 -6.027 1.00 0.00 H new ATOM 0 HE2 TYR A 80 12.201 10.910 -2.621 1.00 0.00 H new ATOM 0 HH TYR A 80 11.428 11.199 -4.606 1.00 0.00 H new ATOM 1287 N GLY A 81 17.065 4.995 -0.818 1.00 0.00 N ATOM 1288 CA GLY A 81 17.961 4.418 0.171 1.00 0.00 C ATOM 1289 C GLY A 81 18.054 2.900 0.007 1.00 0.00 C ATOM 1290 O GLY A 81 19.137 2.326 0.109 1.00 0.00 O ATOM 0 H GLY A 81 17.291 4.763 -1.785 1.00 0.00 H new ATOM 0 HA2 GLY A 81 18.952 4.860 0.070 1.00 0.00 H new ATOM 0 HA3 GLY A 81 17.605 4.658 1.173 1.00 0.00 H new ATOM 1294 N ILE A 82 16.904 2.293 -0.246 1.00 0.00 N ATOM 1295 CA ILE A 82 16.842 0.852 -0.425 1.00 0.00 C ATOM 1296 C ILE A 82 17.875 0.428 -1.470 1.00 0.00 C ATOM 1297 O ILE A 82 17.803 0.845 -2.625 1.00 0.00 O ATOM 1298 CB ILE A 82 15.414 0.415 -0.760 1.00 0.00 C ATOM 1299 CG1 ILE A 82 14.422 0.943 0.278 1.00 0.00 C ATOM 1300 CG2 ILE A 82 15.328 -1.105 -0.913 1.00 0.00 C ATOM 1301 CD1 ILE A 82 13.552 2.056 -0.312 1.00 0.00 C ATOM 0 H ILE A 82 16.008 2.772 -0.331 1.00 0.00 H new ATOM 0 HA ILE A 82 17.098 0.341 0.503 1.00 0.00 H new ATOM 0 HB ILE A 82 15.139 0.852 -1.720 1.00 0.00 H new ATOM 0 HG12 ILE A 82 13.788 0.128 0.628 1.00 0.00 H new ATOM 0 HG13 ILE A 82 14.964 1.321 1.145 1.00 0.00 H new ATOM 0 HG21 ILE A 82 14.303 -1.389 -1.151 1.00 0.00 H new ATOM 0 HG22 ILE A 82 15.990 -1.428 -1.717 1.00 0.00 H new ATOM 0 HG23 ILE A 82 15.630 -1.582 0.019 1.00 0.00 H new ATOM 0 HD11 ILE A 82 12.855 2.414 0.446 1.00 0.00 H new ATOM 0 HD12 ILE A 82 14.187 2.879 -0.639 1.00 0.00 H new ATOM 0 HD13 ILE A 82 12.993 1.668 -1.164 1.00 0.00 H new ATOM 1313 N PRO A 83 18.839 -0.418 -1.016 1.00 0.00 N ATOM 1314 CA PRO A 83 19.886 -0.903 -1.899 1.00 0.00 C ATOM 1315 C PRO A 83 19.348 -1.972 -2.852 1.00 0.00 C ATOM 1316 O PRO A 83 20.119 -2.717 -3.454 1.00 0.00 O ATOM 1317 CB PRO A 83 20.971 -1.425 -0.972 1.00 0.00 C ATOM 1318 CG PRO A 83 20.301 -1.640 0.375 1.00 0.00 C ATOM 1319 CD PRO A 83 18.956 -0.933 0.345 1.00 0.00 C ATOM 0 HA PRO A 83 20.280 -0.125 -2.553 1.00 0.00 H new ATOM 0 HB2 PRO A 83 21.394 -2.356 -1.351 1.00 0.00 H new ATOM 0 HB3 PRO A 83 21.791 -0.712 -0.891 1.00 0.00 H new ATOM 0 HG2 PRO A 83 20.168 -2.704 0.570 1.00 0.00 H new ATOM 0 HG3 PRO A 83 20.923 -1.244 1.178 1.00 0.00 H new ATOM 0 HD2 PRO A 83 18.142 -1.619 0.580 1.00 0.00 H new ATOM 0 HD3 PRO A 83 18.915 -0.127 1.078 1.00 0.00 H new ATOM 1327 N TYR A 84 18.028 -2.014 -2.959 1.00 0.00 N ATOM 1328 CA TYR A 84 17.378 -2.980 -3.828 1.00 0.00 C ATOM 1329 C TYR A 84 17.542 -4.402 -3.288 1.00 0.00 C ATOM 1330 O TYR A 84 16.556 -5.103 -3.065 1.00 0.00 O ATOM 1331 CB TYR A 84 18.087 -2.875 -5.179 1.00 0.00 C ATOM 1332 CG TYR A 84 17.373 -3.609 -6.316 1.00 0.00 C ATOM 1333 CD1 TYR A 84 16.096 -3.235 -6.683 1.00 0.00 C ATOM 1334 CD2 TYR A 84 18.004 -4.645 -6.973 1.00 0.00 C ATOM 1335 CE1 TYR A 84 15.423 -3.926 -7.753 1.00 0.00 C ATOM 1336 CE2 TYR A 84 17.332 -5.336 -8.043 1.00 0.00 C ATOM 1337 CZ TYR A 84 16.074 -4.942 -8.380 1.00 0.00 C ATOM 1338 OH TYR A 84 15.439 -5.594 -9.390 1.00 0.00 O ATOM 0 H TYR A 84 17.391 -1.394 -2.458 1.00 0.00 H new ATOM 0 HA TYR A 84 16.310 -2.774 -3.899 1.00 0.00 H new ATOM 0 HB2 TYR A 84 18.185 -1.823 -5.445 1.00 0.00 H new ATOM 0 HB3 TYR A 84 19.096 -3.274 -5.080 1.00 0.00 H new ATOM 0 HD1 TYR A 84 15.602 -2.425 -6.168 1.00 0.00 H new ATOM 0 HD2 TYR A 84 19.003 -4.938 -6.685 1.00 0.00 H new ATOM 0 HE1 TYR A 84 14.424 -3.643 -8.050 1.00 0.00 H new ATOM 0 HE2 TYR A 84 17.815 -6.148 -8.566 1.00 0.00 H new ATOM 0 HH TYR A 84 16.103 -5.963 -10.010 1.00 0.00 H new ATOM 1348 N THR A 85 18.795 -4.785 -3.092 1.00 0.00 N ATOM 1349 CA THR A 85 19.101 -6.111 -2.582 1.00 0.00 C ATOM 1350 C THR A 85 18.429 -6.328 -1.225 1.00 0.00 C ATOM 1351 O THR A 85 18.317 -7.461 -0.758 1.00 0.00 O ATOM 1352 CB THR A 85 20.623 -6.261 -2.537 1.00 0.00 C ATOM 1353 OG1 THR A 85 21.048 -5.223 -1.657 1.00 0.00 O ATOM 1354 CG2 THR A 85 21.285 -5.912 -3.872 1.00 0.00 C ATOM 0 H THR A 85 19.610 -4.201 -3.277 1.00 0.00 H new ATOM 0 HA THR A 85 18.703 -6.888 -3.235 1.00 0.00 H new ATOM 0 HB THR A 85 20.879 -7.284 -2.261 1.00 0.00 H new ATOM 0 HG1 THR A 85 22.024 -5.248 -1.569 1.00 0.00 H new ATOM 0 HG21 THR A 85 22.365 -6.035 -3.786 1.00 0.00 H new ATOM 0 HG22 THR A 85 20.905 -6.574 -4.650 1.00 0.00 H new ATOM 0 HG23 THR A 85 21.057 -4.878 -4.132 1.00 0.00 H new ATOM 1362 N GLN A 86 17.999 -5.225 -0.629 1.00 0.00 N ATOM 1363 CA GLN A 86 17.342 -5.281 0.665 1.00 0.00 C ATOM 1364 C GLN A 86 15.828 -5.413 0.486 1.00 0.00 C ATOM 1365 O GLN A 86 15.105 -5.664 1.449 1.00 0.00 O ATOM 1366 CB GLN A 86 17.689 -4.054 1.510 1.00 0.00 C ATOM 1367 CG GLN A 86 17.389 -4.304 2.989 1.00 0.00 C ATOM 1368 CD GLN A 86 18.033 -3.230 3.868 1.00 0.00 C ATOM 1369 OE1 GLN A 86 18.824 -2.416 3.420 1.00 0.00 O ATOM 1370 NE2 GLN A 86 17.651 -3.272 5.142 1.00 0.00 N ATOM 0 H GLN A 86 18.093 -4.287 -1.019 1.00 0.00 H new ATOM 0 HA GLN A 86 17.704 -6.161 1.196 1.00 0.00 H new ATOM 0 HB2 GLN A 86 18.744 -3.809 1.386 1.00 0.00 H new ATOM 0 HB3 GLN A 86 17.118 -3.194 1.160 1.00 0.00 H new ATOM 0 HG2 GLN A 86 16.311 -4.312 3.149 1.00 0.00 H new ATOM 0 HG3 GLN A 86 17.761 -5.287 3.278 1.00 0.00 H new ATOM 0 HE21 GLN A 86 16.985 -3.980 5.452 1.00 0.00 H new ATOM 0 HE22 GLN A 86 18.024 -2.596 5.809 1.00 0.00 H new ATOM 1379 N ILE A 87 15.393 -5.237 -0.753 1.00 0.00 N ATOM 1380 CA ILE A 87 13.979 -5.333 -1.071 1.00 0.00 C ATOM 1381 C ILE A 87 13.448 -6.692 -0.610 1.00 0.00 C ATOM 1382 O ILE A 87 12.308 -6.797 -0.161 1.00 0.00 O ATOM 1383 CB ILE A 87 13.743 -5.053 -2.557 1.00 0.00 C ATOM 1384 CG1 ILE A 87 14.310 -3.689 -2.954 1.00 0.00 C ATOM 1385 CG2 ILE A 87 12.260 -5.183 -2.911 1.00 0.00 C ATOM 1386 CD1 ILE A 87 13.311 -2.570 -2.649 1.00 0.00 C ATOM 0 H ILE A 87 15.996 -5.028 -1.549 1.00 0.00 H new ATOM 0 HA ILE A 87 13.416 -4.570 -0.533 1.00 0.00 H new ATOM 0 HB ILE A 87 14.279 -5.805 -3.136 1.00 0.00 H new ATOM 0 HG12 ILE A 87 15.240 -3.507 -2.416 1.00 0.00 H new ATOM 0 HG13 ILE A 87 14.551 -3.687 -4.017 1.00 0.00 H new ATOM 0 HG21 ILE A 87 12.120 -4.979 -3.973 1.00 0.00 H new ATOM 0 HG22 ILE A 87 11.920 -6.194 -2.688 1.00 0.00 H new ATOM 0 HG23 ILE A 87 11.682 -4.468 -2.325 1.00 0.00 H new ATOM 0 HD11 ILE A 87 13.739 -1.611 -2.941 1.00 0.00 H new ATOM 0 HD12 ILE A 87 12.391 -2.742 -3.207 1.00 0.00 H new ATOM 0 HD13 ILE A 87 13.091 -2.560 -1.581 1.00 0.00 H new ATOM 1398 N GLN A 88 14.300 -7.699 -0.736 1.00 0.00 N ATOM 1399 CA GLN A 88 13.932 -9.046 -0.338 1.00 0.00 C ATOM 1400 C GLN A 88 13.923 -9.165 1.187 1.00 0.00 C ATOM 1401 O GLN A 88 13.591 -10.218 1.730 1.00 0.00 O ATOM 1402 CB GLN A 88 14.871 -10.079 -0.963 1.00 0.00 C ATOM 1403 CG GLN A 88 15.012 -9.852 -2.469 1.00 0.00 C ATOM 1404 CD GLN A 88 16.410 -10.243 -2.954 1.00 0.00 C ATOM 1405 OE1 GLN A 88 17.028 -11.173 -2.462 1.00 0.00 O ATOM 1406 NE2 GLN A 88 16.871 -9.484 -3.944 1.00 0.00 N ATOM 0 H GLN A 88 15.245 -7.608 -1.109 1.00 0.00 H new ATOM 0 HA GLN A 88 12.926 -9.250 -0.705 1.00 0.00 H new ATOM 0 HB2 GLN A 88 15.851 -10.019 -0.489 1.00 0.00 H new ATOM 0 HB3 GLN A 88 14.489 -11.083 -0.777 1.00 0.00 H new ATOM 0 HG2 GLN A 88 14.262 -10.438 -3.000 1.00 0.00 H new ATOM 0 HG3 GLN A 88 14.822 -8.804 -2.702 1.00 0.00 H new ATOM 0 HE21 GLN A 88 16.301 -8.721 -4.309 1.00 0.00 H new ATOM 0 HE22 GLN A 88 17.794 -9.665 -4.338 1.00 0.00 H new ATOM 1415 N GLU A 89 14.291 -8.071 1.837 1.00 0.00 N ATOM 1416 CA GLU A 89 14.330 -8.039 3.289 1.00 0.00 C ATOM 1417 C GLU A 89 13.276 -7.069 3.827 1.00 0.00 C ATOM 1418 O GLU A 89 13.309 -6.699 5.000 1.00 0.00 O ATOM 1419 CB GLU A 89 15.726 -7.667 3.792 1.00 0.00 C ATOM 1420 CG GLU A 89 16.654 -8.883 3.784 1.00 0.00 C ATOM 1421 CD GLU A 89 17.076 -9.260 5.206 1.00 0.00 C ATOM 1422 OE1 GLU A 89 16.161 -9.465 6.034 1.00 0.00 O ATOM 1423 OE2 GLU A 89 18.302 -9.336 5.433 1.00 0.00 O ATOM 0 H GLU A 89 14.565 -7.199 1.384 1.00 0.00 H new ATOM 0 HA GLU A 89 14.100 -9.037 3.661 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.145 -6.881 3.164 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.657 -7.264 4.803 1.00 0.00 H new ATOM 0 HG2 GLU A 89 16.149 -9.727 3.315 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.538 -8.667 3.184 1.00 0.00 H new ATOM 1430 N LEU A 90 12.367 -6.684 2.944 1.00 0.00 N ATOM 1431 CA LEU A 90 11.306 -5.763 3.315 1.00 0.00 C ATOM 1432 C LEU A 90 9.973 -6.515 3.349 1.00 0.00 C ATOM 1433 O LEU A 90 9.949 -7.744 3.306 1.00 0.00 O ATOM 1434 CB LEU A 90 11.302 -4.547 2.387 1.00 0.00 C ATOM 1435 CG LEU A 90 12.602 -3.742 2.331 1.00 0.00 C ATOM 1436 CD1 LEU A 90 12.472 -2.556 1.374 1.00 0.00 C ATOM 1437 CD2 LEU A 90 13.037 -3.304 3.731 1.00 0.00 C ATOM 0 H LEU A 90 12.343 -6.993 1.972 1.00 0.00 H new ATOM 0 HA LEU A 90 11.477 -5.369 4.317 1.00 0.00 H new ATOM 0 HB2 LEU A 90 11.064 -4.885 1.379 1.00 0.00 H new ATOM 0 HB3 LEU A 90 10.498 -3.880 2.698 1.00 0.00 H new ATOM 0 HG LEU A 90 13.387 -4.388 1.938 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.410 -2.001 1.353 1.00 0.00 H new ATOM 0 HD12 LEU A 90 12.243 -2.920 0.372 1.00 0.00 H new ATOM 0 HD13 LEU A 90 11.670 -1.901 1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 90 13.963 -2.734 3.662 1.00 0.00 H new ATOM 0 HD22 LEU A 90 12.260 -2.682 4.175 1.00 0.00 H new ATOM 0 HD23 LEU A 90 13.198 -4.184 4.354 1.00 0.00 H new ATOM 1449 N ALA A 91 8.898 -5.745 3.426 1.00 0.00 N ATOM 1450 CA ALA A 91 7.565 -6.323 3.466 1.00 0.00 C ATOM 1451 C ALA A 91 6.535 -5.206 3.650 1.00 0.00 C ATOM 1452 O ALA A 91 6.613 -4.438 4.607 1.00 0.00 O ATOM 1453 CB ALA A 91 7.496 -7.370 4.579 1.00 0.00 C ATOM 0 H ALA A 91 8.922 -4.726 3.462 1.00 0.00 H new ATOM 0 HA ALA A 91 7.337 -6.830 2.528 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.496 -7.804 4.609 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.227 -8.155 4.385 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.716 -6.898 5.537 1.00 0.00 H new ATOM 1459 N LEU A 92 5.595 -5.153 2.719 1.00 0.00 N ATOM 1460 CA LEU A 92 4.551 -4.143 2.767 1.00 0.00 C ATOM 1461 C LEU A 92 3.372 -4.673 3.585 1.00 0.00 C ATOM 1462 O LEU A 92 2.882 -5.773 3.334 1.00 0.00 O ATOM 1463 CB LEU A 92 4.168 -3.701 1.353 1.00 0.00 C ATOM 1464 CG LEU A 92 5.331 -3.371 0.415 1.00 0.00 C ATOM 1465 CD1 LEU A 92 4.856 -3.275 -1.036 1.00 0.00 C ATOM 1466 CD2 LEU A 92 6.057 -2.102 0.866 1.00 0.00 C ATOM 0 H LEU A 92 5.534 -5.793 1.927 1.00 0.00 H new ATOM 0 HA LEU A 92 4.912 -3.246 3.270 1.00 0.00 H new ATOM 0 HB2 LEU A 92 3.572 -4.491 0.896 1.00 0.00 H new ATOM 0 HB3 LEU A 92 3.528 -2.822 1.429 1.00 0.00 H new ATOM 0 HG LEU A 92 6.051 -4.188 0.464 1.00 0.00 H new ATOM 0 HD11 LEU A 92 5.702 -3.040 -1.681 1.00 0.00 H new ATOM 0 HD12 LEU A 92 4.422 -4.227 -1.340 1.00 0.00 H new ATOM 0 HD13 LEU A 92 4.105 -2.490 -1.122 1.00 0.00 H new ATOM 0 HD21 LEU A 92 6.879 -1.890 0.182 1.00 0.00 H new ATOM 0 HD22 LEU A 92 5.360 -1.264 0.865 1.00 0.00 H new ATOM 0 HD23 LEU A 92 6.450 -2.246 1.872 1.00 0.00 H new ATOM 1478 N HIS A 93 2.951 -3.866 4.548 1.00 0.00 N ATOM 1479 CA HIS A 93 1.839 -4.240 5.405 1.00 0.00 C ATOM 1480 C HIS A 93 0.639 -3.339 5.110 1.00 0.00 C ATOM 1481 O HIS A 93 0.627 -2.170 5.492 1.00 0.00 O ATOM 1482 CB HIS A 93 2.255 -4.211 6.878 1.00 0.00 C ATOM 1483 CG HIS A 93 1.187 -4.699 7.827 1.00 0.00 C ATOM 1484 ND1 HIS A 93 0.588 -3.879 8.768 1.00 0.00 N ATOM 1485 CD2 HIS A 93 0.616 -5.930 7.970 1.00 0.00 C ATOM 1486 CE1 HIS A 93 -0.300 -4.595 9.441 1.00 0.00 C ATOM 1487 NE2 HIS A 93 -0.281 -5.866 8.946 1.00 0.00 N ATOM 0 H HIS A 93 3.360 -2.955 4.754 1.00 0.00 H new ATOM 0 HA HIS A 93 1.540 -5.266 5.192 1.00 0.00 H new ATOM 0 HB2 HIS A 93 3.147 -4.824 7.005 1.00 0.00 H new ATOM 0 HB3 HIS A 93 2.528 -3.191 7.148 1.00 0.00 H new ATOM 0 HD2 HIS A 93 0.854 -6.808 7.388 1.00 0.00 H new ATOM 0 HE1 HIS A 93 -0.929 -4.235 10.242 1.00 0.00 H new ATOM 0 HE2 HIS A 93 -0.860 -6.639 9.272 1.00 0.00 H new ATOM 1495 N PHE A 94 -0.343 -3.918 4.434 1.00 0.00 N ATOM 1496 CA PHE A 94 -1.546 -3.182 4.083 1.00 0.00 C ATOM 1497 C PHE A 94 -2.647 -3.405 5.122 1.00 0.00 C ATOM 1498 O PHE A 94 -3.182 -4.507 5.238 1.00 0.00 O ATOM 1499 CB PHE A 94 -2.020 -3.718 2.731 1.00 0.00 C ATOM 1500 CG PHE A 94 -1.019 -3.508 1.593 1.00 0.00 C ATOM 1501 CD1 PHE A 94 -0.472 -2.280 1.387 1.00 0.00 C ATOM 1502 CD2 PHE A 94 -0.677 -4.548 0.787 1.00 0.00 C ATOM 1503 CE1 PHE A 94 0.457 -2.084 0.330 1.00 0.00 C ATOM 1504 CE2 PHE A 94 0.251 -4.353 -0.270 1.00 0.00 C ATOM 1505 CZ PHE A 94 0.798 -3.125 -0.476 1.00 0.00 C ATOM 0 H PHE A 94 -0.330 -4.888 4.120 1.00 0.00 H new ATOM 0 HA PHE A 94 -1.331 -2.114 4.044 1.00 0.00 H new ATOM 0 HB2 PHE A 94 -2.227 -4.784 2.827 1.00 0.00 H new ATOM 0 HB3 PHE A 94 -2.960 -3.233 2.469 1.00 0.00 H new ATOM 0 HD1 PHE A 94 -0.744 -1.454 2.027 1.00 0.00 H new ATOM 0 HD2 PHE A 94 -1.111 -5.523 0.951 1.00 0.00 H new ATOM 0 HE1 PHE A 94 0.892 -1.109 0.167 1.00 0.00 H new ATOM 0 HE2 PHE A 94 0.522 -5.180 -0.910 1.00 0.00 H new ATOM 0 HZ PHE A 94 1.504 -2.976 -1.280 1.00 0.00 H new ATOM 1515 N THR A 95 -2.953 -2.342 5.850 1.00 0.00 N ATOM 1516 CA THR A 95 -3.981 -2.407 6.875 1.00 0.00 C ATOM 1517 C THR A 95 -5.267 -1.740 6.384 1.00 0.00 C ATOM 1518 O THR A 95 -5.256 -0.572 5.998 1.00 0.00 O ATOM 1519 CB THR A 95 -3.419 -1.778 8.150 1.00 0.00 C ATOM 1520 OG1 THR A 95 -2.194 -2.472 8.369 1.00 0.00 O ATOM 1521 CG2 THR A 95 -4.259 -2.106 9.386 1.00 0.00 C ATOM 0 H THR A 95 -2.507 -1.430 5.751 1.00 0.00 H new ATOM 0 HA THR A 95 -4.252 -3.439 7.097 1.00 0.00 H new ATOM 0 HB THR A 95 -3.364 -0.696 8.026 1.00 0.00 H new ATOM 0 HG1 THR A 95 -1.762 -2.125 9.177 1.00 0.00 H new ATOM 0 HG21 THR A 95 -3.815 -1.635 10.263 1.00 0.00 H new ATOM 0 HG22 THR A 95 -5.273 -1.731 9.247 1.00 0.00 H new ATOM 0 HG23 THR A 95 -4.288 -3.186 9.530 1.00 0.00 H new ATOM 1529 N ILE A 96 -6.345 -2.510 6.415 1.00 0.00 N ATOM 1530 CA ILE A 96 -7.637 -2.007 5.977 1.00 0.00 C ATOM 1531 C ILE A 96 -8.402 -1.461 7.185 1.00 0.00 C ATOM 1532 O ILE A 96 -9.193 -2.175 7.798 1.00 0.00 O ATOM 1533 CB ILE A 96 -8.397 -3.086 5.204 1.00 0.00 C ATOM 1534 CG1 ILE A 96 -7.626 -3.511 3.953 1.00 0.00 C ATOM 1535 CG2 ILE A 96 -9.818 -2.625 4.873 1.00 0.00 C ATOM 1536 CD1 ILE A 96 -6.318 -4.210 4.326 1.00 0.00 C ATOM 0 H ILE A 96 -6.351 -3.478 6.736 1.00 0.00 H new ATOM 0 HA ILE A 96 -7.508 -1.179 5.280 1.00 0.00 H new ATOM 0 HB ILE A 96 -8.484 -3.966 5.842 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -8.242 -4.180 3.352 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -7.413 -2.636 3.338 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.337 -3.411 4.323 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -10.356 -2.413 5.797 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -9.775 -1.723 4.263 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.790 -4.502 3.418 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.694 -3.530 4.906 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -6.536 -5.098 4.920 1.00 0.00 H new ATOM 1548 N LEU A 97 -8.138 -0.199 7.490 1.00 0.00 N ATOM 1549 CA LEU A 97 -8.792 0.452 8.613 1.00 0.00 C ATOM 1550 C LEU A 97 -10.019 1.216 8.110 1.00 0.00 C ATOM 1551 O LEU A 97 -10.455 1.020 6.977 1.00 0.00 O ATOM 1552 CB LEU A 97 -7.797 1.323 9.381 1.00 0.00 C ATOM 1553 CG LEU A 97 -6.497 0.638 9.809 1.00 0.00 C ATOM 1554 CD1 LEU A 97 -5.366 0.945 8.826 1.00 0.00 C ATOM 1555 CD2 LEU A 97 -6.126 1.015 11.245 1.00 0.00 C ATOM 0 H LEU A 97 -7.480 0.390 6.979 1.00 0.00 H new ATOM 0 HA LEU A 97 -9.149 -0.289 9.328 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -7.544 2.184 8.762 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -8.293 1.707 10.273 1.00 0.00 H new ATOM 0 HG LEU A 97 -6.657 -0.440 9.790 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -4.454 0.446 9.154 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -5.639 0.587 7.834 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -5.198 2.021 8.789 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.199 0.515 11.524 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -5.992 2.094 11.315 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -6.923 0.704 11.920 1.00 0.00 H new ATOM 1567 N SER A 98 -10.539 2.071 8.978 1.00 0.00 N ATOM 1568 CA SER A 98 -11.707 2.866 8.636 1.00 0.00 C ATOM 1569 C SER A 98 -11.710 4.165 9.444 1.00 0.00 C ATOM 1570 O SER A 98 -11.646 4.136 10.672 1.00 0.00 O ATOM 1571 CB SER A 98 -12.998 2.083 8.884 1.00 0.00 C ATOM 1572 OG SER A 98 -14.153 2.820 8.491 1.00 0.00 O ATOM 0 H SER A 98 -10.174 2.231 9.917 1.00 0.00 H new ATOM 0 HA SER A 98 -11.659 3.106 7.574 1.00 0.00 H new ATOM 0 HB2 SER A 98 -12.963 1.143 8.334 1.00 0.00 H new ATOM 0 HB3 SER A 98 -13.071 1.831 9.942 1.00 0.00 H new ATOM 0 HG SER A 98 -14.737 2.950 9.267 1.00 0.00 H new ATOM 1578 N PHE A 99 -11.786 5.274 8.723 1.00 0.00 N ATOM 1579 CA PHE A 99 -11.799 6.581 9.358 1.00 0.00 C ATOM 1580 C PHE A 99 -13.158 6.865 9.999 1.00 0.00 C ATOM 1581 O PHE A 99 -14.197 6.687 9.366 1.00 0.00 O ATOM 1582 CB PHE A 99 -11.541 7.614 8.259 1.00 0.00 C ATOM 1583 CG PHE A 99 -11.703 9.064 8.719 1.00 0.00 C ATOM 1584 CD1 PHE A 99 -12.937 9.635 8.747 1.00 0.00 C ATOM 1585 CD2 PHE A 99 -10.612 9.783 9.099 1.00 0.00 C ATOM 1586 CE1 PHE A 99 -13.087 10.981 9.174 1.00 0.00 C ATOM 1587 CE2 PHE A 99 -10.763 11.129 9.525 1.00 0.00 C ATOM 1588 CZ PHE A 99 -11.997 11.700 9.554 1.00 0.00 C ATOM 0 H PHE A 99 -11.839 5.294 7.705 1.00 0.00 H new ATOM 0 HA PHE A 99 -11.042 6.622 10.141 1.00 0.00 H new ATOM 0 HB2 PHE A 99 -10.530 7.476 7.875 1.00 0.00 H new ATOM 0 HB3 PHE A 99 -12.225 7.427 7.431 1.00 0.00 H new ATOM 0 HD1 PHE A 99 -13.803 9.065 8.444 1.00 0.00 H new ATOM 0 HD2 PHE A 99 -9.632 9.330 9.077 1.00 0.00 H new ATOM 0 HE1 PHE A 99 -14.067 11.434 9.197 1.00 0.00 H new ATOM 0 HE2 PHE A 99 -9.897 11.700 9.826 1.00 0.00 H new ATOM 0 HZ PHE A 99 -12.111 12.724 9.879 1.00 0.00 H new ATOM 1598 N ASP A 100 -13.107 7.303 11.249 1.00 0.00 N ATOM 1599 CA ASP A 100 -14.321 7.614 11.983 1.00 0.00 C ATOM 1600 C ASP A 100 -14.270 9.069 12.453 1.00 0.00 C ATOM 1601 O ASP A 100 -13.191 9.615 12.679 1.00 0.00 O ATOM 1602 CB ASP A 100 -14.460 6.723 13.220 1.00 0.00 C ATOM 1603 CG ASP A 100 -15.866 6.667 13.821 1.00 0.00 C ATOM 1604 OD1 ASP A 100 -16.478 7.751 13.937 1.00 0.00 O ATOM 1605 OD2 ASP A 100 -16.297 5.541 14.151 1.00 0.00 O ATOM 0 H ASP A 100 -12.243 7.450 11.772 1.00 0.00 H new ATOM 0 HA ASP A 100 -15.169 7.445 11.319 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -14.153 5.711 12.957 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -13.768 7.077 13.984 1.00 0.00 H new ATOM 1610 N ARG A 101 -15.450 9.657 12.584 1.00 0.00 N ATOM 1611 CA ARG A 101 -15.553 11.039 13.022 1.00 0.00 C ATOM 1612 C ARG A 101 -15.184 11.155 14.503 1.00 0.00 C ATOM 1613 O ARG A 101 -15.996 11.594 15.316 1.00 0.00 O ATOM 1614 CB ARG A 101 -16.969 11.579 12.813 1.00 0.00 C ATOM 1615 CG ARG A 101 -18.011 10.631 13.409 1.00 0.00 C ATOM 1616 CD ARG A 101 -19.130 11.412 14.102 1.00 0.00 C ATOM 1617 NE ARG A 101 -20.402 11.233 13.368 1.00 0.00 N ATOM 1618 CZ ARG A 101 -20.708 11.868 12.228 1.00 0.00 C ATOM 1619 NH1 ARG A 101 -19.835 12.728 11.686 1.00 0.00 N ATOM 1620 NH2 ARG A 101 -21.887 11.643 11.631 1.00 0.00 N ATOM 0 H ARG A 101 -16.343 9.202 12.395 1.00 0.00 H new ATOM 0 HA ARG A 101 -14.859 11.629 12.423 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -17.059 12.562 13.276 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -17.159 11.710 11.748 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -18.432 10.006 12.621 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -17.532 9.962 14.124 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -19.242 11.067 15.130 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -18.872 12.470 14.147 1.00 0.00 H new ATOM 0 HE ARG A 101 -21.089 10.586 13.754 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -18.938 12.899 12.141 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -20.067 13.212 10.818 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -22.551 10.989 12.044 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -22.120 12.126 10.763 1.00 0.00 H new ATOM 1634 N PHE A 102 -13.959 10.755 14.808 1.00 0.00 N ATOM 1635 CA PHE A 102 -13.472 10.809 16.176 1.00 0.00 C ATOM 1636 C PHE A 102 -11.956 10.613 16.227 1.00 0.00 C ATOM 1637 O PHE A 102 -11.202 11.584 16.279 1.00 0.00 O ATOM 1638 CB PHE A 102 -14.148 9.666 16.936 1.00 0.00 C ATOM 1639 CG PHE A 102 -15.518 10.026 17.513 1.00 0.00 C ATOM 1640 CD1 PHE A 102 -15.618 10.967 18.491 1.00 0.00 C ATOM 1641 CD2 PHE A 102 -16.636 9.407 17.049 1.00 0.00 C ATOM 1642 CE1 PHE A 102 -16.890 11.302 19.026 1.00 0.00 C ATOM 1643 CE2 PHE A 102 -17.908 9.742 17.584 1.00 0.00 C ATOM 1644 CZ PHE A 102 -18.008 10.682 18.562 1.00 0.00 C ATOM 0 H PHE A 102 -13.288 10.392 14.131 1.00 0.00 H new ATOM 0 HA PHE A 102 -13.700 11.781 16.614 1.00 0.00 H new ATOM 0 HB2 PHE A 102 -14.260 8.814 16.265 1.00 0.00 H new ATOM 0 HB3 PHE A 102 -13.495 9.348 17.749 1.00 0.00 H new ATOM 0 HD1 PHE A 102 -14.730 11.459 18.860 1.00 0.00 H new ATOM 0 HD2 PHE A 102 -16.557 8.660 16.273 1.00 0.00 H new ATOM 0 HE1 PHE A 102 -16.970 12.049 19.802 1.00 0.00 H new ATOM 0 HE2 PHE A 102 -18.796 9.251 17.214 1.00 0.00 H new ATOM 0 HZ PHE A 102 -18.975 10.936 18.970 1.00 0.00 H new ATOM 1654 N SER A 103 -11.553 9.351 16.210 1.00 0.00 N ATOM 1655 CA SER A 103 -10.140 9.015 16.254 1.00 0.00 C ATOM 1656 C SER A 103 -9.956 7.504 16.100 1.00 0.00 C ATOM 1657 O SER A 103 -9.056 7.054 15.393 1.00 0.00 O ATOM 1658 CB SER A 103 -9.499 9.498 17.557 1.00 0.00 C ATOM 1659 OG SER A 103 -8.310 10.247 17.321 1.00 0.00 O ATOM 0 H SER A 103 -12.181 8.548 16.166 1.00 0.00 H new ATOM 0 HA SER A 103 -9.642 9.521 15.427 1.00 0.00 H new ATOM 0 HB2 SER A 103 -10.212 10.113 18.106 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.268 8.639 18.187 1.00 0.00 H new ATOM 0 HG SER A 103 -7.932 10.539 18.177 1.00 0.00 H new ATOM 1665 N ARG A 104 -10.823 6.763 16.774 1.00 0.00 N ATOM 1666 CA ARG A 104 -10.768 5.312 16.721 1.00 0.00 C ATOM 1667 C ARG A 104 -10.624 4.839 15.273 1.00 0.00 C ATOM 1668 O ARG A 104 -11.068 5.517 14.347 1.00 0.00 O ATOM 1669 CB ARG A 104 -12.025 4.690 17.331 1.00 0.00 C ATOM 1670 CG ARG A 104 -12.046 4.873 18.850 1.00 0.00 C ATOM 1671 CD ARG A 104 -11.438 3.661 19.557 1.00 0.00 C ATOM 1672 NE ARG A 104 -11.617 3.785 21.021 1.00 0.00 N ATOM 1673 CZ ARG A 104 -12.723 3.407 21.677 1.00 0.00 C ATOM 1674 NH1 ARG A 104 -13.753 2.877 21.004 1.00 0.00 N ATOM 1675 NH2 ARG A 104 -12.797 3.558 23.006 1.00 0.00 N ATOM 0 H ARG A 104 -11.568 7.140 17.360 1.00 0.00 H new ATOM 0 HA ARG A 104 -9.901 4.992 17.299 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -12.911 5.149 16.894 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -12.064 3.628 17.089 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -11.491 5.772 19.119 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -13.072 5.019 19.188 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -11.912 2.746 19.201 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -10.377 3.584 19.317 1.00 0.00 H new ATOM 0 HE ARG A 104 -10.851 4.183 21.564 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -13.696 2.761 19.992 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -14.595 2.589 21.503 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -12.012 3.960 23.518 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -13.638 3.271 23.506 1.00 0.00 H new ATOM 1689 N ASP A 105 -10.002 3.679 15.122 1.00 0.00 N ATOM 1690 CA ASP A 105 -9.795 3.107 13.802 1.00 0.00 C ATOM 1691 C ASP A 105 -10.198 1.631 13.821 1.00 0.00 C ATOM 1692 O ASP A 105 -9.484 0.796 14.373 1.00 0.00 O ATOM 1693 CB ASP A 105 -8.323 3.189 13.392 1.00 0.00 C ATOM 1694 CG ASP A 105 -7.550 4.368 13.987 1.00 0.00 C ATOM 1695 OD1 ASP A 105 -8.012 5.511 13.782 1.00 0.00 O ATOM 1696 OD2 ASP A 105 -6.516 4.099 14.635 1.00 0.00 O ATOM 0 H ASP A 105 -9.635 3.120 15.892 1.00 0.00 H new ATOM 0 HA ASP A 105 -10.400 3.670 13.092 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -7.828 2.264 13.686 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -8.267 3.249 12.305 1.00 0.00 H new ATOM 1701 N ASP A 106 -11.342 1.356 13.212 1.00 0.00 N ATOM 1702 CA ASP A 106 -11.849 -0.005 13.152 1.00 0.00 C ATOM 1703 C ASP A 106 -11.119 -0.768 12.046 1.00 0.00 C ATOM 1704 O ASP A 106 -11.434 -0.613 10.867 1.00 0.00 O ATOM 1705 CB ASP A 106 -13.345 -0.021 12.830 1.00 0.00 C ATOM 1706 CG ASP A 106 -14.250 -0.452 13.986 1.00 0.00 C ATOM 1707 OD1 ASP A 106 -14.382 0.352 14.934 1.00 0.00 O ATOM 1708 OD2 ASP A 106 -14.791 -1.575 13.895 1.00 0.00 O ATOM 0 H ASP A 106 -11.932 2.052 12.756 1.00 0.00 H new ATOM 0 HA ASP A 106 -11.684 -0.470 14.124 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -13.643 0.977 12.508 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -13.513 -0.692 11.987 1.00 0.00 H new ATOM 1713 N ILE A 107 -10.156 -1.577 12.465 1.00 0.00 N ATOM 1714 CA ILE A 107 -9.378 -2.365 11.524 1.00 0.00 C ATOM 1715 C ILE A 107 -10.282 -3.417 10.878 1.00 0.00 C ATOM 1716 O ILE A 107 -10.631 -4.413 11.510 1.00 0.00 O ATOM 1717 CB ILE A 107 -8.143 -2.952 12.210 1.00 0.00 C ATOM 1718 CG1 ILE A 107 -7.073 -1.880 12.424 1.00 0.00 C ATOM 1719 CG2 ILE A 107 -7.603 -4.154 11.432 1.00 0.00 C ATOM 1720 CD1 ILE A 107 -6.116 -2.277 13.550 1.00 0.00 C ATOM 0 H ILE A 107 -9.897 -1.703 13.443 1.00 0.00 H new ATOM 0 HA ILE A 107 -8.998 -1.734 10.721 1.00 0.00 H new ATOM 0 HB ILE A 107 -8.439 -3.313 13.195 1.00 0.00 H new ATOM 0 HG12 ILE A 107 -6.512 -1.731 11.501 1.00 0.00 H new ATOM 0 HG13 ILE A 107 -7.549 -0.929 12.665 1.00 0.00 H new ATOM 0 HG21 ILE A 107 -6.725 -4.552 11.941 1.00 0.00 H new ATOM 0 HG22 ILE A 107 -8.371 -4.925 11.375 1.00 0.00 H new ATOM 0 HG23 ILE A 107 -7.328 -3.842 10.425 1.00 0.00 H new ATOM 0 HD11 ILE A 107 -5.365 -1.498 13.681 1.00 0.00 H new ATOM 0 HD12 ILE A 107 -6.676 -2.401 14.477 1.00 0.00 H new ATOM 0 HD13 ILE A 107 -5.624 -3.216 13.295 1.00 0.00 H new ATOM 1732 N ILE A 108 -10.634 -3.161 9.627 1.00 0.00 N ATOM 1733 CA ILE A 108 -11.490 -4.073 8.889 1.00 0.00 C ATOM 1734 C ILE A 108 -10.740 -5.384 8.644 1.00 0.00 C ATOM 1735 O ILE A 108 -11.324 -6.463 8.728 1.00 0.00 O ATOM 1736 CB ILE A 108 -12.003 -3.410 7.609 1.00 0.00 C ATOM 1737 CG1 ILE A 108 -12.923 -2.231 7.933 1.00 0.00 C ATOM 1738 CG2 ILE A 108 -12.681 -4.433 6.695 1.00 0.00 C ATOM 1739 CD1 ILE A 108 -12.815 -1.142 6.864 1.00 0.00 C ATOM 0 H ILE A 108 -10.342 -2.334 9.106 1.00 0.00 H new ATOM 0 HA ILE A 108 -12.378 -4.317 9.472 1.00 0.00 H new ATOM 0 HB ILE A 108 -11.147 -3.010 7.065 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -13.954 -2.578 8.001 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -12.661 -1.817 8.907 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -13.036 -3.935 5.793 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -11.965 -5.209 6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -13.525 -4.884 7.217 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -13.479 -0.316 7.118 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -11.788 -0.781 6.815 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -13.101 -1.553 5.896 1.00 0.00 H new ATOM 1751 N GLY A 109 -9.456 -5.247 8.346 1.00 0.00 N ATOM 1752 CA GLY A 109 -8.620 -6.407 8.089 1.00 0.00 C ATOM 1753 C GLY A 109 -7.152 -6.002 7.940 1.00 0.00 C ATOM 1754 O GLY A 109 -6.844 -4.826 7.753 1.00 0.00 O ATOM 0 H GLY A 109 -8.975 -4.350 8.277 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -8.723 -7.122 8.905 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -8.957 -6.909 7.182 1.00 0.00 H new ATOM 1758 N GLU A 110 -6.284 -7.000 8.029 1.00 0.00 N ATOM 1759 CA GLU A 110 -4.856 -6.763 7.907 1.00 0.00 C ATOM 1760 C GLU A 110 -4.278 -7.584 6.752 1.00 0.00 C ATOM 1761 O GLU A 110 -4.543 -8.781 6.644 1.00 0.00 O ATOM 1762 CB GLU A 110 -4.134 -7.077 9.219 1.00 0.00 C ATOM 1763 CG GLU A 110 -4.922 -6.548 10.419 1.00 0.00 C ATOM 1764 CD GLU A 110 -4.005 -6.332 11.624 1.00 0.00 C ATOM 1765 OE1 GLU A 110 -3.321 -5.286 11.637 1.00 0.00 O ATOM 1766 OE2 GLU A 110 -4.009 -7.218 12.506 1.00 0.00 O ATOM 0 H GLU A 110 -6.543 -7.974 8.184 1.00 0.00 H new ATOM 0 HA GLU A 110 -4.700 -5.706 7.689 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.998 -8.154 9.315 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.140 -6.630 9.207 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -5.408 -5.609 10.154 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -5.711 -7.253 10.680 1.00 0.00 H new ATOM 1773 N VAL A 111 -3.500 -6.909 5.919 1.00 0.00 N ATOM 1774 CA VAL A 111 -2.883 -7.562 4.777 1.00 0.00 C ATOM 1775 C VAL A 111 -1.363 -7.402 4.864 1.00 0.00 C ATOM 1776 O VAL A 111 -0.869 -6.410 5.397 1.00 0.00 O ATOM 1777 CB VAL A 111 -3.469 -7.006 3.478 1.00 0.00 C ATOM 1778 CG1 VAL A 111 -2.487 -7.176 2.317 1.00 0.00 C ATOM 1779 CG2 VAL A 111 -4.814 -7.662 3.158 1.00 0.00 C ATOM 0 H VAL A 111 -3.283 -5.917 6.012 1.00 0.00 H new ATOM 0 HA VAL A 111 -3.099 -8.630 4.784 1.00 0.00 H new ATOM 0 HB VAL A 111 -3.641 -5.939 3.618 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.928 -6.773 1.405 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.563 -6.642 2.540 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -2.269 -8.235 2.177 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -5.209 -7.249 2.230 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -4.677 -8.738 3.047 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -5.516 -7.467 3.969 1.00 0.00 H new ATOM 1789 N LEU A 112 -0.665 -8.395 4.332 1.00 0.00 N ATOM 1790 CA LEU A 112 0.788 -8.377 4.343 1.00 0.00 C ATOM 1791 C LEU A 112 1.310 -8.950 3.024 1.00 0.00 C ATOM 1792 O LEU A 112 0.672 -9.811 2.421 1.00 0.00 O ATOM 1793 CB LEU A 112 1.323 -9.099 5.581 1.00 0.00 C ATOM 1794 CG LEU A 112 2.846 -9.193 5.697 1.00 0.00 C ATOM 1795 CD1 LEU A 112 3.426 -7.932 6.340 1.00 0.00 C ATOM 1796 CD2 LEU A 112 3.262 -10.461 6.445 1.00 0.00 C ATOM 0 H LEU A 112 -1.078 -9.217 3.891 1.00 0.00 H new ATOM 0 HA LEU A 112 1.156 -7.354 4.415 1.00 0.00 H new ATOM 0 HB2 LEU A 112 0.942 -8.591 6.467 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.915 -10.110 5.593 1.00 0.00 H new ATOM 0 HG LEU A 112 3.261 -9.262 4.692 1.00 0.00 H new ATOM 0 HD11 LEU A 112 4.510 -8.025 6.410 1.00 0.00 H new ATOM 0 HD12 LEU A 112 3.175 -7.064 5.730 1.00 0.00 H new ATOM 0 HD13 LEU A 112 3.007 -7.807 7.338 1.00 0.00 H new ATOM 0 HD21 LEU A 112 4.349 -10.503 6.513 1.00 0.00 H new ATOM 0 HD22 LEU A 112 2.836 -10.448 7.448 1.00 0.00 H new ATOM 0 HD23 LEU A 112 2.898 -11.337 5.907 1.00 0.00 H new ATOM 1808 N ILE A 113 2.466 -8.448 2.614 1.00 0.00 N ATOM 1809 CA ILE A 113 3.081 -8.898 1.378 1.00 0.00 C ATOM 1810 C ILE A 113 4.602 -8.789 1.500 1.00 0.00 C ATOM 1811 O ILE A 113 5.168 -7.712 1.316 1.00 0.00 O ATOM 1812 CB ILE A 113 2.504 -8.136 0.183 1.00 0.00 C ATOM 1813 CG1 ILE A 113 2.484 -9.014 -1.070 1.00 0.00 C ATOM 1814 CG2 ILE A 113 3.260 -6.826 -0.048 1.00 0.00 C ATOM 1815 CD1 ILE A 113 1.221 -9.877 -1.113 1.00 0.00 C ATOM 0 H ILE A 113 2.993 -7.734 3.117 1.00 0.00 H new ATOM 0 HA ILE A 113 2.850 -9.948 1.199 1.00 0.00 H new ATOM 0 HB ILE A 113 1.470 -7.876 0.411 1.00 0.00 H new ATOM 0 HG12 ILE A 113 2.530 -8.386 -1.960 1.00 0.00 H new ATOM 0 HG13 ILE A 113 3.367 -9.653 -1.085 1.00 0.00 H new ATOM 0 HG21 ILE A 113 2.830 -6.304 -0.903 1.00 0.00 H new ATOM 0 HG22 ILE A 113 3.179 -6.198 0.839 1.00 0.00 H new ATOM 0 HG23 ILE A 113 4.310 -7.042 -0.245 1.00 0.00 H new ATOM 0 HD11 ILE A 113 1.231 -10.492 -2.013 1.00 0.00 H new ATOM 0 HD12 ILE A 113 1.190 -10.521 -0.234 1.00 0.00 H new ATOM 0 HD13 ILE A 113 0.341 -9.234 -1.122 1.00 0.00 H new ATOM 1827 N PRO A 114 5.238 -9.948 1.819 1.00 0.00 N ATOM 1828 CA PRO A 114 6.683 -9.993 1.969 1.00 0.00 C ATOM 1829 C PRO A 114 7.377 -9.946 0.606 1.00 0.00 C ATOM 1830 O PRO A 114 7.150 -10.810 -0.240 1.00 0.00 O ATOM 1831 CB PRO A 114 6.960 -11.277 2.733 1.00 0.00 C ATOM 1832 CG PRO A 114 5.712 -12.132 2.577 1.00 0.00 C ATOM 1833 CD PRO A 114 4.601 -11.242 2.045 1.00 0.00 C ATOM 0 HA PRO A 114 7.077 -9.132 2.509 1.00 0.00 H new ATOM 0 HB2 PRO A 114 7.836 -11.788 2.334 1.00 0.00 H new ATOM 0 HB3 PRO A 114 7.163 -11.070 3.784 1.00 0.00 H new ATOM 0 HG2 PRO A 114 5.899 -12.959 1.892 1.00 0.00 H new ATOM 0 HG3 PRO A 114 5.426 -12.569 3.534 1.00 0.00 H new ATOM 0 HD2 PRO A 114 4.180 -11.643 1.123 1.00 0.00 H new ATOM 0 HD3 PRO A 114 3.782 -11.161 2.760 1.00 0.00 H new ATOM 1841 N LEU A 115 8.209 -8.929 0.436 1.00 0.00 N ATOM 1842 CA LEU A 115 8.937 -8.759 -0.810 1.00 0.00 C ATOM 1843 C LEU A 115 10.113 -9.737 -0.846 1.00 0.00 C ATOM 1844 O LEU A 115 10.873 -9.764 -1.812 1.00 0.00 O ATOM 1845 CB LEU A 115 9.348 -7.297 -0.995 1.00 0.00 C ATOM 1846 CG LEU A 115 8.236 -6.260 -0.820 1.00 0.00 C ATOM 1847 CD1 LEU A 115 8.683 -4.886 -1.323 1.00 0.00 C ATOM 1848 CD2 LEU A 115 6.943 -6.724 -1.495 1.00 0.00 C ATOM 0 H LEU A 115 8.395 -8.215 1.140 1.00 0.00 H new ATOM 0 HA LEU A 115 8.298 -8.997 -1.660 1.00 0.00 H new ATOM 0 HB2 LEU A 115 10.143 -7.071 -0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 115 9.770 -7.183 -1.993 1.00 0.00 H new ATOM 0 HG LEU A 115 8.026 -6.160 0.245 1.00 0.00 H new ATOM 0 HD11 LEU A 115 7.874 -4.168 -1.187 1.00 0.00 H new ATOM 0 HD12 LEU A 115 9.557 -4.559 -0.760 1.00 0.00 H new ATOM 0 HD13 LEU A 115 8.937 -4.951 -2.381 1.00 0.00 H new ATOM 0 HD21 LEU A 115 6.169 -5.969 -1.356 1.00 0.00 H new ATOM 0 HD22 LEU A 115 7.121 -6.869 -2.561 1.00 0.00 H new ATOM 0 HD23 LEU A 115 6.617 -7.664 -1.050 1.00 0.00 H new ATOM 1860 N SER A 116 10.225 -10.517 0.220 1.00 0.00 N ATOM 1861 CA SER A 116 11.296 -11.494 0.322 1.00 0.00 C ATOM 1862 C SER A 116 11.141 -12.556 -0.769 1.00 0.00 C ATOM 1863 O SER A 116 10.410 -13.529 -0.593 1.00 0.00 O ATOM 1864 CB SER A 116 11.311 -12.151 1.704 1.00 0.00 C ATOM 1865 OG SER A 116 12.287 -13.186 1.792 1.00 0.00 O ATOM 0 H SER A 116 9.592 -10.492 1.020 1.00 0.00 H new ATOM 0 HA SER A 116 12.246 -10.977 0.184 1.00 0.00 H new ATOM 0 HB2 SER A 116 11.514 -11.395 2.463 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.325 -12.563 1.921 1.00 0.00 H new ATOM 0 HG SER A 116 12.267 -13.579 2.689 1.00 0.00 H new ATOM 1871 N GLY A 117 11.841 -12.332 -1.871 1.00 0.00 N ATOM 1872 CA GLY A 117 11.791 -13.257 -2.990 1.00 0.00 C ATOM 1873 C GLY A 117 11.258 -12.568 -4.248 1.00 0.00 C ATOM 1874 O GLY A 117 11.564 -12.983 -5.365 1.00 0.00 O ATOM 0 H GLY A 117 12.446 -11.523 -2.013 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.788 -13.654 -3.183 1.00 0.00 H new ATOM 0 HA3 GLY A 117 11.154 -14.105 -2.738 1.00 0.00 H new ATOM 1878 N ILE A 118 10.471 -11.526 -4.025 1.00 0.00 N ATOM 1879 CA ILE A 118 9.893 -10.775 -5.127 1.00 0.00 C ATOM 1880 C ILE A 118 11.003 -10.021 -5.862 1.00 0.00 C ATOM 1881 O ILE A 118 11.914 -9.483 -5.235 1.00 0.00 O ATOM 1882 CB ILE A 118 8.765 -9.872 -4.625 1.00 0.00 C ATOM 1883 CG1 ILE A 118 7.509 -10.687 -4.309 1.00 0.00 C ATOM 1884 CG2 ILE A 118 8.481 -8.745 -5.621 1.00 0.00 C ATOM 1885 CD1 ILE A 118 6.593 -10.779 -5.532 1.00 0.00 C ATOM 0 H ILE A 118 10.220 -11.184 -3.098 1.00 0.00 H new ATOM 0 HA ILE A 118 9.433 -11.450 -5.849 1.00 0.00 H new ATOM 0 HB ILE A 118 9.089 -9.406 -3.694 1.00 0.00 H new ATOM 0 HG12 ILE A 118 7.793 -11.689 -3.986 1.00 0.00 H new ATOM 0 HG13 ILE A 118 6.971 -10.226 -3.481 1.00 0.00 H new ATOM 0 HG21 ILE A 118 7.675 -8.118 -5.240 1.00 0.00 H new ATOM 0 HG22 ILE A 118 9.379 -8.142 -5.753 1.00 0.00 H new ATOM 0 HG23 ILE A 118 8.186 -9.172 -6.580 1.00 0.00 H new ATOM 0 HD11 ILE A 118 5.708 -11.363 -5.281 1.00 0.00 H new ATOM 0 HD12 ILE A 118 6.292 -9.777 -5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 118 7.126 -11.262 -6.351 1.00 0.00 H new ATOM 1897 N GLU A 119 10.891 -10.007 -7.182 1.00 0.00 N ATOM 1898 CA GLU A 119 11.873 -9.329 -8.010 1.00 0.00 C ATOM 1899 C GLU A 119 11.193 -8.274 -8.885 1.00 0.00 C ATOM 1900 O GLU A 119 10.406 -8.609 -9.769 1.00 0.00 O ATOM 1901 CB GLU A 119 12.655 -10.329 -8.865 1.00 0.00 C ATOM 1902 CG GLU A 119 11.816 -10.810 -10.050 1.00 0.00 C ATOM 1903 CD GLU A 119 12.070 -9.947 -11.288 1.00 0.00 C ATOM 1904 OE1 GLU A 119 12.468 -8.778 -11.093 1.00 0.00 O ATOM 1905 OE2 GLU A 119 11.861 -10.476 -12.401 1.00 0.00 O ATOM 0 H GLU A 119 10.134 -10.455 -7.699 1.00 0.00 H new ATOM 0 HA GLU A 119 12.585 -8.826 -7.356 1.00 0.00 H new ATOM 0 HB2 GLU A 119 13.571 -9.864 -9.228 1.00 0.00 H new ATOM 0 HB3 GLU A 119 12.951 -11.182 -8.254 1.00 0.00 H new ATOM 0 HG2 GLU A 119 12.056 -11.850 -10.272 1.00 0.00 H new ATOM 0 HG3 GLU A 119 10.758 -10.776 -9.789 1.00 0.00 H new ATOM 1912 N LEU A 120 11.521 -7.020 -8.607 1.00 0.00 N ATOM 1913 CA LEU A 120 10.952 -5.914 -9.358 1.00 0.00 C ATOM 1914 C LEU A 120 11.878 -5.564 -10.524 1.00 0.00 C ATOM 1915 O LEU A 120 11.638 -4.596 -11.243 1.00 0.00 O ATOM 1916 CB LEU A 120 10.657 -4.733 -8.431 1.00 0.00 C ATOM 1917 CG LEU A 120 9.651 -4.997 -7.308 1.00 0.00 C ATOM 1918 CD1 LEU A 120 9.771 -3.943 -6.206 1.00 0.00 C ATOM 1919 CD2 LEU A 120 8.227 -5.091 -7.859 1.00 0.00 C ATOM 0 H LEU A 120 12.173 -6.746 -7.872 1.00 0.00 H new ATOM 0 HA LEU A 120 9.992 -6.200 -9.788 1.00 0.00 H new ATOM 0 HB2 LEU A 120 11.595 -4.406 -7.982 1.00 0.00 H new ATOM 0 HB3 LEU A 120 10.287 -3.905 -9.036 1.00 0.00 H new ATOM 0 HG LEU A 120 9.886 -5.961 -6.858 1.00 0.00 H new ATOM 0 HD11 LEU A 120 9.045 -4.154 -5.420 1.00 0.00 H new ATOM 0 HD12 LEU A 120 10.777 -3.968 -5.787 1.00 0.00 H new ATOM 0 HD13 LEU A 120 9.576 -2.955 -6.624 1.00 0.00 H new ATOM 0 HD21 LEU A 120 7.532 -5.279 -7.041 1.00 0.00 H new ATOM 0 HD22 LEU A 120 7.964 -4.154 -8.350 1.00 0.00 H new ATOM 0 HD23 LEU A 120 8.169 -5.907 -8.579 1.00 0.00 H new ATOM 1931 N SER A 121 12.918 -6.371 -10.675 1.00 0.00 N ATOM 1932 CA SER A 121 13.882 -6.159 -11.741 1.00 0.00 C ATOM 1933 C SER A 121 13.153 -5.921 -13.066 1.00 0.00 C ATOM 1934 O SER A 121 13.284 -4.857 -13.668 1.00 0.00 O ATOM 1935 CB SER A 121 14.836 -7.349 -11.867 1.00 0.00 C ATOM 1936 OG SER A 121 16.186 -6.933 -12.054 1.00 0.00 O ATOM 0 H SER A 121 13.114 -7.173 -10.076 1.00 0.00 H new ATOM 0 HA SER A 121 14.475 -5.278 -11.495 1.00 0.00 H new ATOM 0 HB2 SER A 121 14.767 -7.965 -10.971 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.529 -7.972 -12.707 1.00 0.00 H new ATOM 0 HG SER A 121 16.764 -7.721 -12.128 1.00 0.00 H new ATOM 1942 N GLU A 122 12.401 -6.931 -13.480 1.00 0.00 N ATOM 1943 CA GLU A 122 11.651 -6.845 -14.722 1.00 0.00 C ATOM 1944 C GLU A 122 11.013 -5.461 -14.862 1.00 0.00 C ATOM 1945 O GLU A 122 11.151 -4.812 -15.898 1.00 0.00 O ATOM 1946 CB GLU A 122 10.594 -7.947 -14.801 1.00 0.00 C ATOM 1947 CG GLU A 122 11.246 -9.325 -14.928 1.00 0.00 C ATOM 1948 CD GLU A 122 10.266 -10.434 -14.540 1.00 0.00 C ATOM 1949 OE1 GLU A 122 9.541 -10.228 -13.543 1.00 0.00 O ATOM 1950 OE2 GLU A 122 10.263 -11.463 -15.250 1.00 0.00 O ATOM 0 H GLU A 122 12.295 -7.812 -12.978 1.00 0.00 H new ATOM 0 HA GLU A 122 12.342 -6.990 -15.552 1.00 0.00 H new ATOM 0 HB2 GLU A 122 9.967 -7.918 -13.910 1.00 0.00 H new ATOM 0 HB3 GLU A 122 9.942 -7.769 -15.656 1.00 0.00 H new ATOM 0 HG2 GLU A 122 11.586 -9.477 -15.952 1.00 0.00 H new ATOM 0 HG3 GLU A 122 12.128 -9.374 -14.289 1.00 0.00 H new ATOM 1957 N GLY A 123 10.329 -5.051 -13.804 1.00 0.00 N ATOM 1958 CA GLY A 123 9.669 -3.756 -13.797 1.00 0.00 C ATOM 1959 C GLY A 123 8.557 -3.714 -12.746 1.00 0.00 C ATOM 1960 O GLY A 123 8.731 -4.208 -11.633 1.00 0.00 O ATOM 0 H GLY A 123 10.217 -5.592 -12.946 1.00 0.00 H new ATOM 0 HA2 GLY A 123 10.399 -2.973 -13.591 1.00 0.00 H new ATOM 0 HA3 GLY A 123 9.251 -3.551 -14.783 1.00 0.00 H new ATOM 1964 N LYS A 124 7.440 -3.118 -13.137 1.00 0.00 N ATOM 1965 CA LYS A 124 6.300 -3.005 -12.243 1.00 0.00 C ATOM 1966 C LYS A 124 5.416 -4.245 -12.390 1.00 0.00 C ATOM 1967 O LYS A 124 4.995 -4.584 -13.495 1.00 0.00 O ATOM 1968 CB LYS A 124 5.558 -1.689 -12.485 1.00 0.00 C ATOM 1969 CG LYS A 124 4.298 -1.603 -11.621 1.00 0.00 C ATOM 1970 CD LYS A 124 3.242 -0.714 -12.280 1.00 0.00 C ATOM 1971 CE LYS A 124 2.048 -1.543 -12.758 1.00 0.00 C ATOM 1972 NZ LYS A 124 0.912 -0.662 -13.109 1.00 0.00 N ATOM 0 H LYS A 124 7.300 -2.708 -14.061 1.00 0.00 H new ATOM 0 HA LYS A 124 6.632 -2.971 -11.205 1.00 0.00 H new ATOM 0 HB2 LYS A 124 6.216 -0.850 -12.259 1.00 0.00 H new ATOM 0 HB3 LYS A 124 5.288 -1.608 -13.538 1.00 0.00 H new ATOM 0 HG2 LYS A 124 3.891 -2.602 -11.464 1.00 0.00 H new ATOM 0 HG3 LYS A 124 4.553 -1.205 -10.639 1.00 0.00 H new ATOM 0 HD2 LYS A 124 2.904 0.042 -11.571 1.00 0.00 H new ATOM 0 HD3 LYS A 124 3.683 -0.184 -13.124 1.00 0.00 H new ATOM 0 HE2 LYS A 124 2.335 -2.139 -13.625 1.00 0.00 H new ATOM 0 HE3 LYS A 124 1.747 -2.241 -11.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 124 0.110 -1.241 -13.431 1.00 0.00 H new ATOM 0 HZ2 LYS A 124 0.628 -0.112 -12.273 1.00 0.00 H new ATOM 0 HZ3 LYS A 124 1.198 -0.013 -13.870 1.00 0.00 H new ATOM 1986 N MET A 125 5.162 -4.889 -11.261 1.00 0.00 N ATOM 1987 CA MET A 125 4.336 -6.084 -11.250 1.00 0.00 C ATOM 1988 C MET A 125 3.019 -5.834 -10.511 1.00 0.00 C ATOM 1989 O MET A 125 2.955 -4.991 -9.618 1.00 0.00 O ATOM 1990 CB MET A 125 5.096 -7.224 -10.569 1.00 0.00 C ATOM 1991 CG MET A 125 5.194 -6.993 -9.060 1.00 0.00 C ATOM 1992 SD MET A 125 5.791 -8.469 -8.254 1.00 0.00 S ATOM 1993 CE MET A 125 7.477 -8.482 -8.840 1.00 0.00 C ATOM 0 H MET A 125 5.514 -4.606 -10.347 1.00 0.00 H new ATOM 0 HA MET A 125 4.106 -6.354 -12.281 1.00 0.00 H new ATOM 0 HB2 MET A 125 4.591 -8.170 -10.764 1.00 0.00 H new ATOM 0 HB3 MET A 125 6.097 -7.304 -10.994 1.00 0.00 H new ATOM 0 HG2 MET A 125 5.866 -6.159 -8.854 1.00 0.00 H new ATOM 0 HG3 MET A 125 4.217 -6.721 -8.661 1.00 0.00 H new ATOM 0 HE1 MET A 125 7.831 -9.511 -8.906 1.00 0.00 H new ATOM 0 HE2 MET A 125 7.523 -8.018 -9.825 1.00 0.00 H new ATOM 0 HE3 MET A 125 8.107 -7.925 -8.147 1.00 0.00 H new ATOM 2003 N LEU A 126 2.002 -6.584 -10.910 1.00 0.00 N ATOM 2004 CA LEU A 126 0.691 -6.454 -10.296 1.00 0.00 C ATOM 2005 C LEU A 126 0.490 -7.590 -9.291 1.00 0.00 C ATOM 2006 O LEU A 126 0.792 -8.745 -9.585 1.00 0.00 O ATOM 2007 CB LEU A 126 -0.397 -6.382 -11.369 1.00 0.00 C ATOM 2008 CG LEU A 126 -1.731 -5.772 -10.931 1.00 0.00 C ATOM 2009 CD1 LEU A 126 -2.301 -6.514 -9.720 1.00 0.00 C ATOM 2010 CD2 LEU A 126 -1.588 -4.272 -10.669 1.00 0.00 C ATOM 0 H LEU A 126 2.059 -7.283 -11.650 1.00 0.00 H new ATOM 0 HA LEU A 126 0.620 -5.519 -9.740 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -0.014 -5.803 -12.209 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -0.585 -7.391 -11.737 1.00 0.00 H new ATOM 0 HG LEU A 126 -2.445 -5.889 -11.746 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -3.249 -6.061 -9.429 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -2.463 -7.561 -9.978 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -1.598 -6.450 -8.890 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -2.550 -3.863 -10.359 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -0.854 -4.109 -9.880 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -1.258 -3.773 -11.580 1.00 0.00 H new ATOM 2022 N MET A 127 -0.020 -7.221 -8.125 1.00 0.00 N ATOM 2023 CA MET A 127 -0.266 -8.194 -7.074 1.00 0.00 C ATOM 2024 C MET A 127 -1.553 -7.867 -6.314 1.00 0.00 C ATOM 2025 O MET A 127 -1.978 -6.713 -6.274 1.00 0.00 O ATOM 2026 CB MET A 127 0.914 -8.204 -6.101 1.00 0.00 C ATOM 2027 CG MET A 127 2.209 -8.601 -6.813 1.00 0.00 C ATOM 2028 SD MET A 127 3.121 -9.768 -5.817 1.00 0.00 S ATOM 2029 CE MET A 127 3.345 -8.800 -4.334 1.00 0.00 C ATOM 0 H MET A 127 -0.270 -6.262 -7.885 1.00 0.00 H new ATOM 0 HA MET A 127 -0.378 -9.176 -7.533 1.00 0.00 H new ATOM 0 HB2 MET A 127 1.029 -7.217 -5.653 1.00 0.00 H new ATOM 0 HB3 MET A 127 0.713 -8.902 -5.288 1.00 0.00 H new ATOM 0 HG2 MET A 127 1.980 -9.040 -7.784 1.00 0.00 H new ATOM 0 HG3 MET A 127 2.817 -7.716 -6.999 1.00 0.00 H new ATOM 0 HE1 MET A 127 4.410 -8.672 -4.140 1.00 0.00 H new ATOM 0 HE2 MET A 127 2.880 -7.823 -4.464 1.00 0.00 H new ATOM 0 HE3 MET A 127 2.882 -9.313 -3.491 1.00 0.00 H new ATOM 2039 N ASN A 128 -2.136 -8.903 -5.729 1.00 0.00 N ATOM 2040 CA ASN A 128 -3.366 -8.740 -4.972 1.00 0.00 C ATOM 2041 C ASN A 128 -3.262 -9.527 -3.664 1.00 0.00 C ATOM 2042 O ASN A 128 -2.388 -10.379 -3.516 1.00 0.00 O ATOM 2043 CB ASN A 128 -4.568 -9.275 -5.752 1.00 0.00 C ATOM 2044 CG ASN A 128 -4.167 -10.459 -6.634 1.00 0.00 C ATOM 2045 OD1 ASN A 128 -3.894 -10.322 -7.815 1.00 0.00 O ATOM 2046 ND2 ASN A 128 -4.146 -11.626 -5.996 1.00 0.00 N ATOM 0 H ASN A 128 -1.780 -9.858 -5.764 1.00 0.00 H new ATOM 0 HA ASN A 128 -3.506 -7.676 -4.780 1.00 0.00 H new ATOM 0 HB2 ASN A 128 -5.349 -9.583 -5.057 1.00 0.00 H new ATOM 0 HB3 ASN A 128 -4.987 -8.481 -6.371 1.00 0.00 H new ATOM 0 HD21 ASN A 128 -3.890 -12.477 -6.497 1.00 0.00 H new ATOM 0 HD22 ASN A 128 -4.386 -11.670 -5.006 1.00 0.00 H new ATOM 2053 N ARG A 129 -4.168 -9.214 -2.749 1.00 0.00 N ATOM 2054 CA ARG A 129 -4.190 -9.882 -1.459 1.00 0.00 C ATOM 2055 C ARG A 129 -5.608 -9.878 -0.883 1.00 0.00 C ATOM 2056 O ARG A 129 -6.363 -8.930 -1.090 1.00 0.00 O ATOM 2057 CB ARG A 129 -3.244 -9.199 -0.469 1.00 0.00 C ATOM 2058 CG ARG A 129 -1.851 -9.830 -0.518 1.00 0.00 C ATOM 2059 CD ARG A 129 -1.856 -11.220 0.121 1.00 0.00 C ATOM 2060 NE ARG A 129 -0.963 -12.128 -0.634 1.00 0.00 N ATOM 2061 CZ ARG A 129 -0.747 -13.410 -0.310 1.00 0.00 C ATOM 2062 NH1 ARG A 129 -1.358 -13.943 0.757 1.00 0.00 N ATOM 2063 NH2 ARG A 129 0.079 -14.159 -1.052 1.00 0.00 N ATOM 0 H ARG A 129 -4.892 -8.507 -2.876 1.00 0.00 H new ATOM 0 HA ARG A 129 -3.859 -10.909 -1.612 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -3.174 -8.136 -0.701 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -3.648 -9.279 0.540 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -1.517 -9.903 -1.553 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -1.139 -9.189 0.002 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -1.528 -11.154 1.158 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -2.870 -11.620 0.132 1.00 0.00 H new ATOM 0 HE ARG A 129 -0.482 -11.754 -1.452 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -1.987 -13.373 1.322 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -1.194 -14.919 1.004 1.00 0.00 H new ATOM 0 HH21 ARG A 129 0.544 -13.753 -1.864 1.00 0.00 H new ATOM 0 HH22 ARG A 129 0.243 -15.135 -0.805 1.00 0.00 H new ATOM 2077 N GLU A 130 -5.926 -10.950 -0.172 1.00 0.00 N ATOM 2078 CA GLU A 130 -7.240 -11.083 0.434 1.00 0.00 C ATOM 2079 C GLU A 130 -7.247 -10.448 1.827 1.00 0.00 C ATOM 2080 O GLU A 130 -6.280 -10.574 2.576 1.00 0.00 O ATOM 2081 CB GLU A 130 -7.669 -12.550 0.498 1.00 0.00 C ATOM 2082 CG GLU A 130 -7.067 -13.245 1.720 1.00 0.00 C ATOM 2083 CD GLU A 130 -6.732 -14.706 1.410 1.00 0.00 C ATOM 2084 OE1 GLU A 130 -7.695 -15.485 1.244 1.00 0.00 O ATOM 2085 OE2 GLU A 130 -5.522 -15.010 1.347 1.00 0.00 O ATOM 0 H GLU A 130 -5.296 -11.734 -0.002 1.00 0.00 H new ATOM 0 HA GLU A 130 -7.962 -10.555 -0.189 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -8.756 -12.613 0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -7.353 -13.065 -0.410 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -6.165 -12.720 2.034 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -7.769 -13.198 2.552 1.00 0.00 H new ATOM 2092 N ILE A 131 -8.350 -9.780 2.132 1.00 0.00 N ATOM 2093 CA ILE A 131 -8.497 -9.126 3.421 1.00 0.00 C ATOM 2094 C ILE A 131 -9.299 -10.031 4.358 1.00 0.00 C ATOM 2095 O ILE A 131 -10.450 -10.360 4.075 1.00 0.00 O ATOM 2096 CB ILE A 131 -9.099 -7.730 3.248 1.00 0.00 C ATOM 2097 CG1 ILE A 131 -8.115 -6.792 2.548 1.00 0.00 C ATOM 2098 CG2 ILE A 131 -9.572 -7.168 4.590 1.00 0.00 C ATOM 2099 CD1 ILE A 131 -8.804 -6.013 1.425 1.00 0.00 C ATOM 0 H ILE A 131 -9.151 -9.678 1.508 1.00 0.00 H new ATOM 0 HA ILE A 131 -7.522 -8.972 3.884 1.00 0.00 H new ATOM 0 HB ILE A 131 -9.976 -7.812 2.606 1.00 0.00 H new ATOM 0 HG12 ILE A 131 -7.693 -6.096 3.273 1.00 0.00 H new ATOM 0 HG13 ILE A 131 -7.285 -7.369 2.139 1.00 0.00 H new ATOM 0 HG21 ILE A 131 -9.996 -6.175 4.440 1.00 0.00 H new ATOM 0 HG22 ILE A 131 -10.331 -7.826 5.013 1.00 0.00 H new ATOM 0 HG23 ILE A 131 -8.727 -7.102 5.275 1.00 0.00 H new ATOM 0 HD11 ILE A 131 -8.082 -5.353 0.944 1.00 0.00 H new ATOM 0 HD12 ILE A 131 -9.204 -6.711 0.690 1.00 0.00 H new ATOM 0 HD13 ILE A 131 -9.618 -5.419 1.841 1.00 0.00 H new ATOM 2111 N ILE A 132 -8.660 -10.407 5.456 1.00 0.00 N ATOM 2112 CA ILE A 132 -9.300 -11.267 6.437 1.00 0.00 C ATOM 2113 C ILE A 132 -9.083 -10.686 7.836 1.00 0.00 C ATOM 2114 O ILE A 132 -8.595 -9.566 7.979 1.00 0.00 O ATOM 2115 CB ILE A 132 -8.810 -12.708 6.287 1.00 0.00 C ATOM 2116 CG1 ILE A 132 -7.298 -12.753 6.061 1.00 0.00 C ATOM 2117 CG2 ILE A 132 -9.577 -13.435 5.180 1.00 0.00 C ATOM 2118 CD1 ILE A 132 -6.541 -12.488 7.364 1.00 0.00 C ATOM 0 H ILE A 132 -7.706 -10.132 5.688 1.00 0.00 H new ATOM 0 HA ILE A 132 -10.376 -11.302 6.269 1.00 0.00 H new ATOM 0 HB ILE A 132 -9.011 -13.236 7.219 1.00 0.00 H new ATOM 0 HG12 ILE A 132 -7.015 -13.728 5.664 1.00 0.00 H new ATOM 0 HG13 ILE A 132 -7.016 -12.010 5.315 1.00 0.00 H new ATOM 0 HG21 ILE A 132 -9.209 -14.458 5.094 1.00 0.00 H new ATOM 0 HG22 ILE A 132 -10.639 -13.451 5.423 1.00 0.00 H new ATOM 0 HG23 ILE A 132 -9.429 -12.915 4.233 1.00 0.00 H new ATOM 0 HD11 ILE A 132 -5.468 -12.526 7.176 1.00 0.00 H new ATOM 0 HD12 ILE A 132 -6.808 -11.503 7.746 1.00 0.00 H new ATOM 0 HD13 ILE A 132 -6.807 -13.247 8.100 1.00 0.00 H new ATOM 2130 N SER A 133 -9.457 -11.475 8.834 1.00 0.00 N ATOM 2131 CA SER A 133 -9.309 -11.054 10.216 1.00 0.00 C ATOM 2132 C SER A 133 -8.022 -11.634 10.806 1.00 0.00 C ATOM 2133 O SER A 133 -8.068 -12.545 11.630 1.00 0.00 O ATOM 2134 CB SER A 133 -10.516 -11.481 11.054 1.00 0.00 C ATOM 2135 OG SER A 133 -10.306 -11.257 12.446 1.00 0.00 O ATOM 0 H SER A 133 -9.862 -12.403 8.712 1.00 0.00 H new ATOM 0 HA SER A 133 -9.252 -9.966 10.237 1.00 0.00 H new ATOM 0 HB2 SER A 133 -11.398 -10.930 10.727 1.00 0.00 H new ATOM 0 HB3 SER A 133 -10.720 -12.538 10.884 1.00 0.00 H new ATOM 0 HG SER A 133 -9.508 -11.745 12.739 1.00 0.00 H new ATOM 2141 N GLY A 134 -6.903 -11.081 10.360 1.00 0.00 N ATOM 2142 CA GLY A 134 -5.605 -11.533 10.832 1.00 0.00 C ATOM 2143 C GLY A 134 -5.249 -12.897 10.239 1.00 0.00 C ATOM 2144 O GLY A 134 -6.135 -13.677 9.891 1.00 0.00 O ATOM 0 H GLY A 134 -6.869 -10.324 9.677 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -4.842 -10.804 10.560 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -5.612 -11.596 11.920 1.00 0.00 H new ATOM 2148 N PRO A 135 -3.917 -13.151 10.138 1.00 0.00 N ATOM 2149 CA PRO A 135 -3.433 -14.407 9.593 1.00 0.00 C ATOM 2150 C PRO A 135 -3.609 -15.546 10.599 1.00 0.00 C ATOM 2151 O PRO A 135 -3.867 -15.304 11.777 1.00 0.00 O ATOM 2152 CB PRO A 135 -1.978 -14.148 9.238 1.00 0.00 C ATOM 2153 CG PRO A 135 -1.573 -12.910 10.021 1.00 0.00 C ATOM 2154 CD PRO A 135 -2.840 -12.251 10.540 1.00 0.00 C ATOM 0 HA PRO A 135 -3.993 -14.727 8.714 1.00 0.00 H new ATOM 0 HB2 PRO A 135 -1.353 -15.000 9.504 1.00 0.00 H new ATOM 0 HB3 PRO A 135 -1.860 -13.989 8.166 1.00 0.00 H new ATOM 0 HG2 PRO A 135 -0.917 -13.180 10.848 1.00 0.00 H new ATOM 0 HG3 PRO A 135 -1.017 -12.221 9.385 1.00 0.00 H new ATOM 0 HD2 PRO A 135 -2.808 -12.130 11.623 1.00 0.00 H new ATOM 0 HD3 PRO A 135 -2.974 -11.257 10.112 1.00 0.00 H new ATOM 2162 N SER A 136 -3.463 -16.764 10.098 1.00 0.00 N ATOM 2163 CA SER A 136 -3.603 -17.941 10.939 1.00 0.00 C ATOM 2164 C SER A 136 -3.463 -19.208 10.092 1.00 0.00 C ATOM 2165 O SER A 136 -4.134 -19.354 9.072 1.00 0.00 O ATOM 2166 CB SER A 136 -4.945 -17.937 11.672 1.00 0.00 C ATOM 2167 OG SER A 136 -4.826 -18.424 13.006 1.00 0.00 O ATOM 0 H SER A 136 -3.249 -16.961 9.120 1.00 0.00 H new ATOM 0 HA SER A 136 -2.811 -17.923 11.688 1.00 0.00 H new ATOM 0 HB2 SER A 136 -5.345 -16.923 11.690 1.00 0.00 H new ATOM 0 HB3 SER A 136 -5.659 -18.552 11.124 1.00 0.00 H new ATOM 0 HG SER A 136 -5.704 -18.404 13.441 1.00 0.00 H new ATOM 2173 N SER A 137 -2.587 -20.092 10.547 1.00 0.00 N ATOM 2174 CA SER A 137 -2.352 -21.341 9.845 1.00 0.00 C ATOM 2175 C SER A 137 -2.874 -22.515 10.675 1.00 0.00 C ATOM 2176 O SER A 137 -3.720 -23.279 10.214 1.00 0.00 O ATOM 2177 CB SER A 137 -0.864 -21.528 9.538 1.00 0.00 C ATOM 2178 OG SER A 137 -0.349 -20.474 8.729 1.00 0.00 O ATOM 0 H SER A 137 -2.032 -19.967 11.393 1.00 0.00 H new ATOM 0 HA SER A 137 -2.890 -21.307 8.898 1.00 0.00 H new ATOM 0 HB2 SER A 137 -0.304 -21.575 10.472 1.00 0.00 H new ATOM 0 HB3 SER A 137 -0.716 -22.481 9.030 1.00 0.00 H new ATOM 0 HG SER A 137 0.603 -20.629 8.557 1.00 0.00 H new ATOM 2184 N GLY A 138 -2.347 -22.622 11.887 1.00 0.00 N ATOM 2185 CA GLY A 138 -2.750 -23.690 12.786 1.00 0.00 C ATOM 2186 C GLY A 138 -3.380 -23.125 14.061 1.00 0.00 C ATOM 2187 O GLY A 138 -4.525 -23.437 14.383 1.00 0.00 O ATOM 0 H GLY A 138 -1.645 -21.987 12.267 1.00 0.00 H new ATOM 0 HA2 GLY A 138 -3.462 -24.344 12.283 1.00 0.00 H new ATOM 0 HA3 GLY A 138 -1.884 -24.300 13.043 1.00 0.00 H new TER 2191 GLY A 138