USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 737 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 114 ASN : amide:sc= -2.14! K(o=-0.94!,f=0.95) USER MOD Set 1.2: A 116 SER OG : rot 112:sc= 1.2 USER MOD Set 2.1: A 94 ASN : amide:sc= -1.66 K(o=-1.6,f=-3.6!) USER MOD Set 2.2: A 95 THR OG1 : rot 53:sc= 0.0207 USER MOD Set 3.1: A 30 HIS : no HD1:sc= -0.763 K(o=-0.76,f=-0.067) USER MOD Set 3.2: A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -14:sc= 0.649! USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 45:sc= -0.479 USER MOD Single : A 39 THR OG1 : rot -72:sc= 1.1 USER MOD Single : A 43 GLN : amide:sc= -2.77 K(o=-2.8,f=-0.51) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= -0.24 X(o=-0.24,f=-0.098) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -0.781 K(o=-0.78,f=-1.4) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot 130:sc= -1.29 USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.417 USER MOD Single : A 61 ASN : amide:sc= -1.96 K(o=-2,f=-2.9) USER MOD Single : A 62 THR OG1 : rot 52:sc= 1.21 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc=-0.00121 X(o=-0.0012,f=-0.17) USER MOD Single : A 69 THR OG1 : rot -58:sc= 1.13 USER MOD Single : A 73 GLN : amide:sc= -2.81! C(o=-2.8!,f=-4.2!) USER MOD Single : A 74 SER OG : rot -91:sc= -0.393! USER MOD Single : A 87 TYR OH : rot 180:sc= -0.216 USER MOD Single : A 89 ASN : amide:sc= -3.91! C(o=-3.9!,f=-7.6!) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= -0.111 X(o=-0.11,f=-0.11) USER MOD Single : A 100 TYR OH : rot -24:sc= 0.45 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= 0.00789 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= -7.26! C(o=-7.3!,f=-16!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= -0.515 X(o=-0.52,f=-0.32) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 -14.290 66.863 14.119 1.00 0.00 N ATOM 2 CA GLY A 15 -15.212 65.752 14.278 1.00 0.00 C ATOM 3 C GLY A 15 -14.862 64.609 13.323 1.00 0.00 C ATOM 4 O GLY A 15 -14.618 64.836 12.139 1.00 0.00 O ATOM 0 HA2 GLY A 15 -15.181 65.393 15.307 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -16.231 66.090 14.089 1.00 0.00 H new ATOM 8 N SER A 16 -14.849 63.403 13.873 1.00 0.00 N ATOM 9 CA SER A 16 -14.534 62.224 13.084 1.00 0.00 C ATOM 10 C SER A 16 -14.866 60.960 13.879 1.00 0.00 C ATOM 11 O SER A 16 -14.281 60.712 14.933 1.00 0.00 O ATOM 12 CB SER A 16 -13.062 62.218 12.668 1.00 0.00 C ATOM 13 OG SER A 16 -12.233 61.594 13.645 1.00 0.00 O ATOM 0 H SER A 16 -15.052 63.217 14.855 1.00 0.00 H new ATOM 0 HA SER A 16 -15.140 62.246 12.178 1.00 0.00 H new ATOM 0 HB2 SER A 16 -12.956 61.697 11.717 1.00 0.00 H new ATOM 0 HB3 SER A 16 -12.726 63.243 12.509 1.00 0.00 H new ATOM 0 HG SER A 16 -12.735 61.488 14.480 1.00 0.00 H new ATOM 18 N GLY A 17 -15.804 60.192 13.343 1.00 0.00 N ATOM 19 CA GLY A 17 -16.221 58.959 13.990 1.00 0.00 C ATOM 20 C GLY A 17 -17.746 58.830 13.994 1.00 0.00 C ATOM 21 O GLY A 17 -18.281 57.745 13.779 1.00 0.00 O ATOM 0 H GLY A 17 -16.287 60.400 12.469 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -15.782 58.106 13.473 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -15.848 58.937 15.014 1.00 0.00 H new ATOM 25 N MET A 18 -18.402 59.955 14.241 1.00 0.00 N ATOM 26 CA MET A 18 -19.854 59.981 14.276 1.00 0.00 C ATOM 27 C MET A 18 -20.400 58.921 15.234 1.00 0.00 C ATOM 28 O MET A 18 -20.577 59.186 16.422 1.00 0.00 O ATOM 29 CB MET A 18 -20.403 59.728 12.869 1.00 0.00 C ATOM 30 CG MET A 18 -20.322 60.995 12.014 1.00 0.00 C ATOM 31 SD MET A 18 -21.323 62.285 12.736 1.00 0.00 S ATOM 32 CE MET A 18 -22.834 62.056 11.814 1.00 0.00 C ATOM 0 H MET A 18 -17.955 60.854 14.419 1.00 0.00 H new ATOM 0 HA MET A 18 -20.172 60.962 14.630 1.00 0.00 H new ATOM 0 HB2 MET A 18 -19.838 58.927 12.393 1.00 0.00 H new ATOM 0 HB3 MET A 18 -21.438 59.394 12.933 1.00 0.00 H new ATOM 0 HG2 MET A 18 -19.286 61.327 11.938 1.00 0.00 H new ATOM 0 HG3 MET A 18 -20.664 60.782 11.001 1.00 0.00 H new ATOM 0 HE1 MET A 18 -23.574 62.786 12.141 1.00 0.00 H new ATOM 0 HE2 MET A 18 -22.636 62.192 10.751 1.00 0.00 H new ATOM 0 HE3 MET A 18 -23.216 61.050 11.986 1.00 0.00 H new ATOM 40 N LYS A 19 -20.649 57.743 14.683 1.00 0.00 N ATOM 41 CA LYS A 19 -21.171 56.642 15.475 1.00 0.00 C ATOM 42 C LYS A 19 -20.110 55.544 15.575 1.00 0.00 C ATOM 43 O LYS A 19 -19.658 55.210 16.669 1.00 0.00 O ATOM 44 CB LYS A 19 -22.506 56.157 14.905 1.00 0.00 C ATOM 45 CG LYS A 19 -23.623 57.162 15.195 1.00 0.00 C ATOM 46 CD LYS A 19 -24.993 56.484 15.165 1.00 0.00 C ATOM 47 CE LYS A 19 -26.093 57.447 15.614 1.00 0.00 C ATOM 48 NZ LYS A 19 -27.058 57.680 14.516 1.00 0.00 N ATOM 0 H LYS A 19 -20.499 57.526 13.698 1.00 0.00 H new ATOM 0 HA LYS A 19 -21.386 56.972 16.491 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -22.414 56.010 13.829 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -22.761 55.190 15.338 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -23.461 57.619 16.171 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -23.595 57.965 14.458 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -25.205 56.130 14.156 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -24.984 55.609 15.815 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -26.611 57.037 16.481 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -25.651 58.394 15.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -27.798 58.336 14.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -26.562 58.091 13.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -27.493 56.777 14.238 1.00 0.00 H new ATOM 58 N GLU A 20 -19.744 55.012 14.417 1.00 0.00 N ATOM 59 CA GLU A 20 -18.745 53.959 14.361 1.00 0.00 C ATOM 60 C GLU A 20 -18.579 53.463 12.923 1.00 0.00 C ATOM 61 O GLU A 20 -19.360 53.822 12.044 1.00 0.00 O ATOM 62 CB GLU A 20 -19.108 52.807 15.300 1.00 0.00 C ATOM 63 CG GLU A 20 -18.133 52.730 16.476 1.00 0.00 C ATOM 64 CD GLU A 20 -17.158 51.564 16.303 1.00 0.00 C ATOM 65 OE1 GLU A 20 -17.604 50.414 16.509 1.00 0.00 O ATOM 66 OE2 GLU A 20 -15.986 51.849 15.970 1.00 0.00 O ATOM 0 H GLU A 20 -20.122 55.291 13.511 1.00 0.00 H new ATOM 0 HA GLU A 20 -17.793 54.370 14.696 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -20.123 52.943 15.673 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -19.094 51.866 14.749 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -17.578 53.665 16.555 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -18.688 52.610 17.406 1.00 0.00 H new ATOM 71 N THR A 21 -17.555 52.643 12.729 1.00 0.00 N ATOM 72 CA THR A 21 -17.276 52.094 11.413 1.00 0.00 C ATOM 73 C THR A 21 -17.681 50.619 11.354 1.00 0.00 C ATOM 74 O THR A 21 -17.900 49.991 12.388 1.00 0.00 O ATOM 75 CB THR A 21 -15.796 52.330 11.106 1.00 0.00 C ATOM 76 OG1 THR A 21 -15.660 51.950 9.739 1.00 0.00 O ATOM 77 CG2 THR A 21 -14.879 51.361 11.856 1.00 0.00 C ATOM 0 H THR A 21 -16.909 52.346 13.461 1.00 0.00 H new ATOM 0 HA THR A 21 -17.866 52.592 10.644 1.00 0.00 H new ATOM 0 HB THR A 21 -15.531 53.355 11.367 1.00 0.00 H new ATOM 0 HG1 THR A 21 -14.730 52.073 9.456 1.00 0.00 H new ATOM 0 HG21 THR A 21 -13.840 51.573 11.602 1.00 0.00 H new ATOM 0 HG22 THR A 21 -15.022 51.482 12.930 1.00 0.00 H new ATOM 0 HG23 THR A 21 -15.121 50.337 11.571 1.00 0.00 H new ATOM 85 N ALA A 22 -17.767 50.111 10.134 1.00 0.00 N ATOM 86 CA ALA A 22 -18.141 48.722 9.927 1.00 0.00 C ATOM 87 C ALA A 22 -17.198 48.092 8.900 1.00 0.00 C ATOM 88 O ALA A 22 -17.096 48.569 7.770 1.00 0.00 O ATOM 89 CB ALA A 22 -19.607 48.647 9.494 1.00 0.00 C ATOM 0 H ALA A 22 -17.584 50.636 9.279 1.00 0.00 H new ATOM 0 HA ALA A 22 -18.045 48.157 10.854 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -19.888 47.605 9.339 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -20.238 49.081 10.269 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -19.741 49.201 8.565 1.00 0.00 H new ATOM 95 N ALA A 23 -16.532 47.030 9.329 1.00 0.00 N ATOM 96 CA ALA A 23 -15.600 46.330 8.462 1.00 0.00 C ATOM 97 C ALA A 23 -15.043 45.110 9.198 1.00 0.00 C ATOM 98 O ALA A 23 -14.539 45.230 10.313 1.00 0.00 O ATOM 99 CB ALA A 23 -14.500 47.292 8.011 1.00 0.00 C ATOM 0 H ALA A 23 -16.620 46.637 10.266 1.00 0.00 H new ATOM 0 HA ALA A 23 -16.106 45.971 7.566 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -13.801 46.766 7.361 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -14.946 48.125 7.467 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -13.968 47.672 8.884 1.00 0.00 H new ATOM 105 N ALA A 24 -15.152 43.963 8.544 1.00 0.00 N ATOM 106 CA ALA A 24 -14.665 42.722 9.123 1.00 0.00 C ATOM 107 C ALA A 24 -14.117 41.826 8.010 1.00 0.00 C ATOM 108 O ALA A 24 -14.533 41.935 6.858 1.00 0.00 O ATOM 109 CB ALA A 24 -15.791 42.050 9.911 1.00 0.00 C ATOM 0 H ALA A 24 -15.570 43.867 7.619 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.850 42.917 9.821 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -15.426 41.119 10.345 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -16.125 42.715 10.707 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -16.625 41.836 9.243 1.00 0.00 H new ATOM 115 N LYS A 25 -13.190 40.961 8.394 1.00 0.00 N ATOM 116 CA LYS A 25 -12.580 40.046 7.443 1.00 0.00 C ATOM 117 C LYS A 25 -12.969 38.611 7.801 1.00 0.00 C ATOM 118 O LYS A 25 -12.990 38.244 8.975 1.00 0.00 O ATOM 119 CB LYS A 25 -11.069 40.276 7.374 1.00 0.00 C ATOM 120 CG LYS A 25 -10.396 39.908 8.699 1.00 0.00 C ATOM 121 CD LYS A 25 -9.144 40.754 8.933 1.00 0.00 C ATOM 122 CE LYS A 25 -9.239 41.521 10.253 1.00 0.00 C ATOM 123 NZ LYS A 25 -7.971 41.409 11.009 1.00 0.00 N ATOM 0 H LYS A 25 -12.846 40.874 9.350 1.00 0.00 H new ATOM 0 HA LYS A 25 -12.954 40.235 6.437 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -10.643 39.679 6.568 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -10.867 41.321 7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -11.097 40.056 9.520 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -10.129 38.851 8.694 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.264 40.111 8.944 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -9.016 41.456 8.109 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.461 42.570 10.056 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.062 41.128 10.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.052 41.935 11.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -7.776 40.408 11.213 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.193 41.805 10.443 1.00 0.00 H new ATOM 133 N PHE A 26 -13.266 37.838 6.768 1.00 0.00 N ATOM 134 CA PHE A 26 -13.652 36.449 6.959 1.00 0.00 C ATOM 135 C PHE A 26 -12.520 35.504 6.556 1.00 0.00 C ATOM 136 O PHE A 26 -11.483 35.946 6.063 1.00 0.00 O ATOM 137 CB PHE A 26 -14.861 36.193 6.055 1.00 0.00 C ATOM 138 CG PHE A 26 -16.145 36.881 6.523 1.00 0.00 C ATOM 139 CD1 PHE A 26 -16.553 36.753 7.814 1.00 0.00 C ATOM 140 CD2 PHE A 26 -16.878 37.620 5.648 1.00 0.00 C ATOM 141 CE1 PHE A 26 -17.745 37.392 8.248 1.00 0.00 C ATOM 142 CE2 PHE A 26 -18.069 38.258 6.081 1.00 0.00 C ATOM 143 CZ PHE A 26 -18.478 38.131 7.373 1.00 0.00 C ATOM 0 H PHE A 26 -13.248 38.146 5.796 1.00 0.00 H new ATOM 0 HA PHE A 26 -13.883 36.268 8.009 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -14.626 36.533 5.046 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -15.037 35.119 5.997 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -15.971 36.166 8.509 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -16.553 37.721 4.623 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -18.069 37.291 9.273 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -18.651 38.844 5.385 1.00 0.00 H new ATOM 0 HZ PHE A 26 -19.384 38.617 7.703 1.00 0.00 H new ATOM 152 N GLU A 27 -12.755 34.220 6.782 1.00 0.00 N ATOM 153 CA GLU A 27 -11.767 33.208 6.449 1.00 0.00 C ATOM 154 C GLU A 27 -10.497 33.414 7.276 1.00 0.00 C ATOM 155 O GLU A 27 -10.302 34.474 7.869 1.00 0.00 O ATOM 156 CB GLU A 27 -11.453 33.220 4.951 1.00 0.00 C ATOM 157 CG GLU A 27 -12.646 32.715 4.137 1.00 0.00 C ATOM 158 CD GLU A 27 -12.364 31.328 3.554 1.00 0.00 C ATOM 159 OE1 GLU A 27 -11.746 30.522 4.283 1.00 0.00 O ATOM 160 OE2 GLU A 27 -12.772 31.107 2.394 1.00 0.00 O ATOM 0 H GLU A 27 -13.616 33.857 7.192 1.00 0.00 H new ATOM 0 HA GLU A 27 -12.182 32.230 6.692 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.197 34.232 4.638 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.582 32.595 4.753 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.532 32.674 4.771 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.863 33.415 3.330 1.00 0.00 H new ATOM 165 N ARG A 28 -9.664 32.383 7.291 1.00 0.00 N ATOM 166 CA ARG A 28 -8.418 32.436 8.035 1.00 0.00 C ATOM 167 C ARG A 28 -7.225 32.379 7.080 1.00 0.00 C ATOM 168 O ARG A 28 -7.176 31.527 6.194 1.00 0.00 O ATOM 169 CB ARG A 28 -8.321 31.280 9.032 1.00 0.00 C ATOM 170 CG ARG A 28 -8.100 31.798 10.454 1.00 0.00 C ATOM 171 CD ARG A 28 -6.830 31.200 11.065 1.00 0.00 C ATOM 172 NE ARG A 28 -6.883 31.300 12.540 1.00 0.00 N ATOM 173 CZ ARG A 28 -6.623 32.420 13.227 1.00 0.00 C ATOM 174 NH1 ARG A 28 -6.291 33.543 12.576 1.00 0.00 N ATOM 175 NH2 ARG A 28 -6.694 32.418 14.565 1.00 0.00 N ATOM 0 H ARG A 28 -9.829 31.505 6.799 1.00 0.00 H new ATOM 0 HA ARG A 28 -8.402 33.377 8.585 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -9.234 30.686 8.996 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -7.500 30.620 8.750 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -8.024 32.885 10.441 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -8.960 31.546 11.074 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -6.729 30.157 10.766 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -5.953 31.726 10.688 1.00 0.00 H new ATOM 0 HE ARG A 28 -7.133 30.463 13.067 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -6.236 33.545 11.557 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -6.093 34.396 13.099 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -6.946 31.563 15.061 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -6.496 33.271 15.088 1.00 0.00 H new ATOM 186 N GLN A 29 -6.292 33.295 7.292 1.00 0.00 N ATOM 187 CA GLN A 29 -5.102 33.359 6.460 1.00 0.00 C ATOM 188 C GLN A 29 -4.011 32.446 7.024 1.00 0.00 C ATOM 189 O GLN A 29 -3.769 31.362 6.495 1.00 0.00 O ATOM 190 CB GLN A 29 -4.599 34.798 6.330 1.00 0.00 C ATOM 191 CG GLN A 29 -4.296 35.143 4.871 1.00 0.00 C ATOM 192 CD GLN A 29 -4.267 36.659 4.661 1.00 0.00 C ATOM 193 OE1 GLN A 29 -3.286 37.330 4.932 1.00 0.00 O ATOM 194 NE2 GLN A 29 -5.396 37.157 4.166 1.00 0.00 N ATOM 0 H GLN A 29 -6.336 34.000 8.028 1.00 0.00 H new ATOM 0 HA GLN A 29 -5.362 33.009 5.461 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.348 35.486 6.722 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.700 34.929 6.933 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.336 34.714 4.584 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.051 34.697 4.224 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.180 36.538 3.961 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.478 38.158 3.991 1.00 0.00 H new ATOM 201 N HIS A 30 -3.382 32.918 8.090 1.00 0.00 N ATOM 202 CA HIS A 30 -2.323 32.157 8.731 1.00 0.00 C ATOM 203 C HIS A 30 -1.048 32.243 7.889 1.00 0.00 C ATOM 204 O HIS A 30 -1.110 32.243 6.660 1.00 0.00 O ATOM 205 CB HIS A 30 -2.767 30.716 8.989 1.00 0.00 C ATOM 206 CG HIS A 30 -1.915 29.981 9.996 1.00 0.00 C ATOM 207 ND1 HIS A 30 -2.435 29.417 11.148 1.00 0.00 N ATOM 208 CD2 HIS A 30 -0.576 29.723 10.012 1.00 0.00 C ATOM 209 CE1 HIS A 30 -1.444 28.850 11.819 1.00 0.00 C ATOM 210 NE2 HIS A 30 -0.292 29.040 11.113 1.00 0.00 N ATOM 0 H HIS A 30 -3.585 33.818 8.526 1.00 0.00 H new ATOM 0 HA HIS A 30 -2.102 32.587 9.708 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -3.800 30.722 9.338 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -2.752 30.168 8.047 1.00 0.00 H new ATOM 0 HD2 HIS A 30 0.134 30.024 9.256 1.00 0.00 H new ATOM 0 HE1 HIS A 30 -1.532 28.328 12.761 1.00 0.00 H new ATOM 0 HE2 HIS A 30 0.634 28.711 11.387 1.00 0.00 H new ATOM 217 N MET A 31 0.078 32.311 8.583 1.00 0.00 N ATOM 218 CA MET A 31 1.366 32.397 7.915 1.00 0.00 C ATOM 219 C MET A 31 1.802 31.028 7.388 1.00 0.00 C ATOM 220 O MET A 31 2.691 30.395 7.955 1.00 0.00 O ATOM 221 CB MET A 31 2.415 32.925 8.894 1.00 0.00 C ATOM 222 CG MET A 31 2.148 34.390 9.246 1.00 0.00 C ATOM 223 SD MET A 31 3.348 34.960 10.438 1.00 0.00 S ATOM 224 CE MET A 31 2.908 36.688 10.519 1.00 0.00 C ATOM 0 H MET A 31 0.126 32.308 9.602 1.00 0.00 H new ATOM 0 HA MET A 31 1.271 33.078 7.069 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.407 32.322 9.802 1.00 0.00 H new ATOM 0 HB3 MET A 31 3.408 32.828 8.456 1.00 0.00 H new ATOM 0 HG2 MET A 31 2.197 35.003 8.346 1.00 0.00 H new ATOM 0 HG3 MET A 31 1.142 34.498 9.651 1.00 0.00 H new ATOM 0 HE1 MET A 31 3.564 37.198 11.224 1.00 0.00 H new ATOM 0 HE2 MET A 31 3.016 37.138 9.532 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.874 36.785 10.850 1.00 0.00 H new ATOM 232 N ASP A 32 1.155 30.611 6.309 1.00 0.00 N ATOM 233 CA ASP A 32 1.466 29.328 5.701 1.00 0.00 C ATOM 234 C ASP A 32 1.191 28.210 6.708 1.00 0.00 C ATOM 235 O ASP A 32 1.360 28.398 7.911 1.00 0.00 O ATOM 236 CB ASP A 32 2.940 29.251 5.299 1.00 0.00 C ATOM 237 CG ASP A 32 3.352 27.955 4.598 1.00 0.00 C ATOM 238 OD1 ASP A 32 2.672 27.603 3.610 1.00 0.00 O ATOM 239 OD2 ASP A 32 4.338 27.346 5.067 1.00 0.00 O ATOM 0 H ASP A 32 0.418 31.138 5.841 1.00 0.00 H new ATOM 0 HA ASP A 32 0.844 29.217 4.813 1.00 0.00 H new ATOM 0 HB2 ASP A 32 3.166 30.090 4.641 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.552 29.373 6.193 1.00 0.00 H new ATOM 243 N SER A 33 0.770 27.070 6.179 1.00 0.00 N ATOM 244 CA SER A 33 0.470 25.922 7.017 1.00 0.00 C ATOM 245 C SER A 33 0.792 24.628 6.267 1.00 0.00 C ATOM 246 O SER A 33 0.730 24.586 5.039 1.00 0.00 O ATOM 247 CB SER A 33 -0.995 25.929 7.458 1.00 0.00 C ATOM 248 OG SER A 33 -1.148 26.407 8.791 1.00 0.00 O ATOM 0 H SER A 33 0.630 26.917 5.180 1.00 0.00 H new ATOM 0 HA SER A 33 1.091 25.980 7.911 1.00 0.00 H new ATOM 0 HB2 SER A 33 -1.575 26.555 6.780 1.00 0.00 H new ATOM 0 HB3 SER A 33 -1.400 24.920 7.386 1.00 0.00 H new ATOM 0 HG SER A 33 -2.097 26.398 9.035 1.00 0.00 H new ATOM 253 N PRO A 34 1.138 23.576 7.056 1.00 0.00 N ATOM 254 CA PRO A 34 1.469 22.285 6.479 1.00 0.00 C ATOM 255 C PRO A 34 0.210 21.558 6.003 1.00 0.00 C ATOM 256 O PRO A 34 -0.839 22.175 5.826 1.00 0.00 O ATOM 257 CB PRO A 34 2.204 21.539 7.581 1.00 0.00 C ATOM 258 CG PRO A 34 1.852 22.253 8.875 1.00 0.00 C ATOM 259 CD PRO A 34 1.222 23.589 8.513 1.00 0.00 C ATOM 0 HA PRO A 34 2.092 22.370 5.589 1.00 0.00 H new ATOM 0 HB2 PRO A 34 1.898 20.494 7.616 1.00 0.00 H new ATOM 0 HB3 PRO A 34 3.280 21.550 7.409 1.00 0.00 H new ATOM 0 HG2 PRO A 34 1.161 21.653 9.467 1.00 0.00 H new ATOM 0 HG3 PRO A 34 2.744 22.404 9.483 1.00 0.00 H new ATOM 0 HD2 PRO A 34 0.236 23.698 8.966 1.00 0.00 H new ATOM 0 HD3 PRO A 34 1.829 24.422 8.867 1.00 0.00 H new ATOM 264 N ASP A 35 0.355 20.255 5.809 1.00 0.00 N ATOM 265 CA ASP A 35 -0.757 19.437 5.355 1.00 0.00 C ATOM 266 C ASP A 35 -1.548 20.203 4.293 1.00 0.00 C ATOM 267 O ASP A 35 -1.028 21.129 3.674 1.00 0.00 O ATOM 268 CB ASP A 35 -1.708 19.112 6.510 1.00 0.00 C ATOM 269 CG ASP A 35 -1.039 18.973 7.880 1.00 0.00 C ATOM 270 OD1 ASP A 35 -0.669 20.028 8.440 1.00 0.00 O ATOM 271 OD2 ASP A 35 -0.913 17.816 8.334 1.00 0.00 O ATOM 0 H ASP A 35 1.226 19.746 5.958 1.00 0.00 H new ATOM 0 HA ASP A 35 -0.351 18.510 4.949 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -2.464 19.895 6.569 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -2.229 18.182 6.281 1.00 0.00 H new ATOM 275 N LEU A 36 -2.794 19.787 4.114 1.00 0.00 N ATOM 276 CA LEU A 36 -3.661 20.421 3.137 1.00 0.00 C ATOM 277 C LEU A 36 -4.983 19.656 3.062 1.00 0.00 C ATOM 278 O LEU A 36 -5.240 18.947 2.090 1.00 0.00 O ATOM 279 CB LEU A 36 -2.947 20.549 1.790 1.00 0.00 C ATOM 280 CG LEU A 36 -2.752 21.974 1.267 1.00 0.00 C ATOM 281 CD1 LEU A 36 -1.320 22.185 0.772 1.00 0.00 C ATOM 282 CD2 LEU A 36 -3.786 22.310 0.189 1.00 0.00 C ATOM 0 H LEU A 36 -3.223 19.018 4.630 1.00 0.00 H new ATOM 0 HA LEU A 36 -3.899 21.440 3.443 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -1.968 20.077 1.874 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -3.511 19.985 1.047 1.00 0.00 H new ATOM 0 HG LEU A 36 -2.913 22.666 2.094 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -1.208 23.206 0.406 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -0.623 22.016 1.592 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -1.107 21.484 -0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -3.625 23.328 -0.165 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -3.682 21.615 -0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -4.789 22.226 0.608 1.00 0.00 H new ATOM 293 N GLY A 37 -5.789 19.825 4.101 1.00 0.00 N ATOM 294 CA GLY A 37 -7.078 19.159 4.164 1.00 0.00 C ATOM 295 C GLY A 37 -7.385 18.697 5.591 1.00 0.00 C ATOM 296 O GLY A 37 -8.411 19.067 6.159 1.00 0.00 O ATOM 0 H GLY A 37 -5.573 20.414 4.906 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -7.859 19.837 3.821 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -7.082 18.302 3.491 1.00 0.00 H new ATOM 300 N THR A 38 -6.479 17.893 6.128 1.00 0.00 N ATOM 301 CA THR A 38 -6.641 17.377 7.477 1.00 0.00 C ATOM 302 C THR A 38 -8.103 17.004 7.732 1.00 0.00 C ATOM 303 O THR A 38 -8.735 17.545 8.638 1.00 0.00 O ATOM 304 CB THR A 38 -6.101 18.424 8.451 1.00 0.00 C ATOM 305 OG1 THR A 38 -6.888 19.582 8.187 1.00 0.00 O ATOM 306 CG2 THR A 38 -4.673 18.859 8.114 1.00 0.00 C ATOM 0 H THR A 38 -5.630 17.586 5.653 1.00 0.00 H new ATOM 0 HA THR A 38 -6.074 16.457 7.621 1.00 0.00 H new ATOM 0 HB THR A 38 -6.128 18.024 9.464 1.00 0.00 H new ATOM 0 HG1 THR A 38 -7.831 19.326 8.108 1.00 0.00 H new ATOM 0 HG21 THR A 38 -4.339 19.603 8.837 1.00 0.00 H new ATOM 0 HG22 THR A 38 -4.011 17.994 8.151 1.00 0.00 H new ATOM 0 HG23 THR A 38 -4.651 19.290 7.113 1.00 0.00 H new ATOM 314 N THR A 39 -8.596 16.082 6.919 1.00 0.00 N ATOM 315 CA THR A 39 -9.971 15.631 7.046 1.00 0.00 C ATOM 316 C THR A 39 -10.240 14.464 6.093 1.00 0.00 C ATOM 317 O THR A 39 -11.251 14.451 5.392 1.00 0.00 O ATOM 318 CB THR A 39 -10.887 16.833 6.809 1.00 0.00 C ATOM 319 OG1 THR A 39 -12.198 16.273 6.795 1.00 0.00 O ATOM 320 CG2 THR A 39 -10.722 17.429 5.410 1.00 0.00 C ATOM 0 H THR A 39 -8.068 15.635 6.170 1.00 0.00 H new ATOM 0 HA THR A 39 -10.170 15.245 8.046 1.00 0.00 H new ATOM 0 HB THR A 39 -10.680 17.599 7.556 1.00 0.00 H new ATOM 0 HG1 THR A 39 -12.329 15.769 5.965 1.00 0.00 H new ATOM 0 HG21 THR A 39 -11.395 18.279 5.295 1.00 0.00 H new ATOM 0 HG22 THR A 39 -9.692 17.760 5.275 1.00 0.00 H new ATOM 0 HG23 THR A 39 -10.961 16.673 4.662 1.00 0.00 H new ATOM 328 N LEU A 40 -9.317 13.514 6.096 1.00 0.00 N ATOM 329 CA LEU A 40 -9.442 12.346 5.241 1.00 0.00 C ATOM 330 C LEU A 40 -8.243 11.423 5.467 1.00 0.00 C ATOM 331 O LEU A 40 -7.292 11.792 6.154 1.00 0.00 O ATOM 332 CB LEU A 40 -9.626 12.768 3.782 1.00 0.00 C ATOM 333 CG LEU A 40 -8.729 13.908 3.295 1.00 0.00 C ATOM 334 CD1 LEU A 40 -7.722 13.409 2.259 1.00 0.00 C ATOM 335 CD2 LEU A 40 -9.565 15.076 2.766 1.00 0.00 C ATOM 0 H LEU A 40 -8.479 13.529 6.677 1.00 0.00 H new ATOM 0 HA LEU A 40 -10.335 11.778 5.500 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -9.451 11.899 3.148 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -10.665 13.063 3.638 1.00 0.00 H new ATOM 0 HG LEU A 40 -8.158 14.280 4.146 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -7.097 14.239 1.930 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -7.094 12.637 2.704 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -8.255 12.995 1.403 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -8.903 15.873 2.426 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -10.180 14.735 1.933 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -10.208 15.453 3.561 1.00 0.00 H new ATOM 346 N LEU A 41 -8.327 10.240 4.876 1.00 0.00 N ATOM 347 CA LEU A 41 -7.261 9.262 5.004 1.00 0.00 C ATOM 348 C LEU A 41 -6.906 8.716 3.620 1.00 0.00 C ATOM 349 O LEU A 41 -6.151 7.752 3.503 1.00 0.00 O ATOM 350 CB LEU A 41 -7.648 8.177 6.013 1.00 0.00 C ATOM 351 CG LEU A 41 -8.965 7.448 5.740 1.00 0.00 C ATOM 352 CD1 LEU A 41 -8.763 6.302 4.747 1.00 0.00 C ATOM 353 CD2 LEU A 41 -9.607 6.969 7.045 1.00 0.00 C ATOM 0 H LEU A 41 -9.118 9.937 4.307 1.00 0.00 H new ATOM 0 HA LEU A 41 -6.361 9.730 5.403 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.847 7.438 6.048 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -7.705 8.632 7.002 1.00 0.00 H new ATOM 0 HG LEU A 41 -9.657 8.154 5.280 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -9.715 5.801 4.571 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.382 6.699 3.806 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -8.048 5.588 5.156 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -10.542 6.454 6.823 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -8.928 6.285 7.555 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -9.809 7.826 7.687 1.00 0.00 H new ATOM 364 N GLU A 42 -7.469 9.356 2.605 1.00 0.00 N ATOM 365 CA GLU A 42 -7.221 8.946 1.232 1.00 0.00 C ATOM 366 C GLU A 42 -6.604 10.099 0.439 1.00 0.00 C ATOM 367 O GLU A 42 -6.539 10.048 -0.789 1.00 0.00 O ATOM 368 CB GLU A 42 -8.506 8.448 0.569 1.00 0.00 C ATOM 369 CG GLU A 42 -9.477 9.604 0.317 1.00 0.00 C ATOM 370 CD GLU A 42 -10.742 9.450 1.163 1.00 0.00 C ATOM 371 OE1 GLU A 42 -10.668 9.797 2.362 1.00 0.00 O ATOM 372 OE2 GLU A 42 -11.755 8.992 0.593 1.00 0.00 O ATOM 0 H GLU A 42 -8.095 10.155 2.705 1.00 0.00 H new ATOM 0 HA GLU A 42 -6.513 8.118 1.241 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -8.266 7.958 -0.374 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.981 7.701 1.205 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -8.990 10.551 0.552 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -9.743 9.637 -0.739 1.00 0.00 H new ATOM 377 N GLN A 43 -6.168 11.114 1.170 1.00 0.00 N ATOM 378 CA GLN A 43 -5.559 12.278 0.549 1.00 0.00 C ATOM 379 C GLN A 43 -6.428 12.778 -0.607 1.00 0.00 C ATOM 380 O GLN A 43 -7.330 13.589 -0.403 1.00 0.00 O ATOM 381 CB GLN A 43 -4.139 11.966 0.072 1.00 0.00 C ATOM 382 CG GLN A 43 -3.536 13.157 -0.673 1.00 0.00 C ATOM 383 CD GLN A 43 -3.351 14.353 0.265 1.00 0.00 C ATOM 384 OE1 GLN A 43 -2.264 14.644 0.735 1.00 0.00 O ATOM 385 NE2 GLN A 43 -4.472 15.028 0.508 1.00 0.00 N ATOM 0 H GLN A 43 -6.224 11.155 2.188 1.00 0.00 H new ATOM 0 HA GLN A 43 -5.490 13.069 1.295 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -3.512 11.712 0.927 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -4.155 11.094 -0.582 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -2.575 12.874 -1.101 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -4.184 13.438 -1.503 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -5.349 14.730 0.082 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -4.454 15.843 1.121 1.00 0.00 H new ATOM 392 N TYR A 44 -6.126 12.274 -1.793 1.00 0.00 N ATOM 393 CA TYR A 44 -6.869 12.660 -2.982 1.00 0.00 C ATOM 394 C TYR A 44 -6.427 11.839 -4.195 1.00 0.00 C ATOM 395 O TYR A 44 -7.230 11.119 -4.788 1.00 0.00 O ATOM 396 CB TYR A 44 -6.533 14.132 -3.228 1.00 0.00 C ATOM 397 CG TYR A 44 -7.760 15.022 -3.439 1.00 0.00 C ATOM 398 CD1 TYR A 44 -8.611 14.783 -4.500 1.00 0.00 C ATOM 399 CD2 TYR A 44 -8.015 16.063 -2.570 1.00 0.00 C ATOM 400 CE1 TYR A 44 -9.765 15.620 -4.698 1.00 0.00 C ATOM 401 CE2 TYR A 44 -9.170 16.900 -2.769 1.00 0.00 C ATOM 402 CZ TYR A 44 -9.988 16.638 -3.823 1.00 0.00 C ATOM 403 OH TYR A 44 -11.078 17.429 -4.011 1.00 0.00 O ATOM 0 H TYR A 44 -5.377 11.601 -1.958 1.00 0.00 H new ATOM 0 HA TYR A 44 -7.937 12.492 -2.840 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -5.963 14.511 -2.380 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -5.888 14.206 -4.104 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -8.411 13.969 -5.181 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -7.349 16.250 -1.741 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -10.439 15.444 -5.523 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -9.382 17.718 -2.096 1.00 0.00 H new ATOM 0 HH TYR A 44 -11.111 18.113 -3.310 1.00 0.00 H new ATOM 412 N CYS A 45 -5.152 11.973 -4.528 1.00 0.00 N ATOM 413 CA CYS A 45 -4.594 11.253 -5.660 1.00 0.00 C ATOM 414 C CYS A 45 -5.582 11.349 -6.825 1.00 0.00 C ATOM 415 O CYS A 45 -6.258 10.376 -7.151 1.00 0.00 O ATOM 416 CB CYS A 45 -4.272 9.800 -5.303 1.00 0.00 C ATOM 417 SG CYS A 45 -2.558 9.512 -4.730 1.00 0.00 S ATOM 0 H CYS A 45 -4.489 12.570 -4.034 1.00 0.00 H new ATOM 0 HA CYS A 45 -3.646 11.706 -5.951 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -4.960 9.471 -4.525 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -4.457 9.176 -6.177 1.00 0.00 H new ATOM 421 N HIS A 46 -5.632 12.532 -7.419 1.00 0.00 N ATOM 422 CA HIS A 46 -6.526 12.768 -8.541 1.00 0.00 C ATOM 423 C HIS A 46 -5.722 12.781 -9.844 1.00 0.00 C ATOM 424 O HIS A 46 -4.855 13.633 -10.033 1.00 0.00 O ATOM 425 CB HIS A 46 -7.334 14.049 -8.331 1.00 0.00 C ATOM 426 CG HIS A 46 -8.735 13.991 -8.891 1.00 0.00 C ATOM 427 ND1 HIS A 46 -9.647 15.021 -8.742 1.00 0.00 N ATOM 428 CD2 HIS A 46 -9.370 13.015 -9.603 1.00 0.00 C ATOM 429 CE1 HIS A 46 -10.776 14.671 -9.340 1.00 0.00 C ATOM 430 NE2 HIS A 46 -10.603 13.427 -9.873 1.00 0.00 N ATOM 0 H HIS A 46 -5.069 13.337 -7.145 1.00 0.00 H new ATOM 0 HA HIS A 46 -7.251 11.957 -8.610 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -7.389 14.260 -7.263 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -6.803 14.881 -8.794 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -8.942 12.068 -9.897 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -11.676 15.266 -9.396 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -11.305 12.900 -10.393 1.00 0.00 H new ATOM 437 N ARG A 47 -6.039 11.827 -10.706 1.00 0.00 N ATOM 438 CA ARG A 47 -5.357 11.718 -11.985 1.00 0.00 C ATOM 439 C ARG A 47 -6.347 11.925 -13.132 1.00 0.00 C ATOM 440 O ARG A 47 -5.952 11.969 -14.297 1.00 0.00 O ATOM 441 CB ARG A 47 -4.689 10.350 -12.137 1.00 0.00 C ATOM 442 CG ARG A 47 -5.732 9.231 -12.181 1.00 0.00 C ATOM 443 CD ARG A 47 -5.177 7.991 -12.885 1.00 0.00 C ATOM 444 NE ARG A 47 -5.590 7.988 -14.305 1.00 0.00 N ATOM 445 CZ ARG A 47 -5.089 7.160 -15.231 1.00 0.00 C ATOM 446 NH1 ARG A 47 -4.155 6.262 -14.892 1.00 0.00 N ATOM 447 NH2 ARG A 47 -5.524 7.228 -16.497 1.00 0.00 N ATOM 0 H ARG A 47 -6.759 11.122 -10.545 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.589 12.491 -12.019 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -4.093 10.332 -13.049 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.005 10.181 -11.306 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.036 8.972 -11.167 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.624 9.580 -12.701 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.089 7.979 -12.814 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -5.539 7.089 -12.391 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.301 8.658 -14.598 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -3.825 6.208 -13.928 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -3.774 5.632 -15.597 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -6.237 7.910 -16.755 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -5.142 6.597 -17.202 1.00 0.00 H new ATOM 458 N THR A 48 -7.614 12.048 -12.765 1.00 0.00 N ATOM 459 CA THR A 48 -8.663 12.250 -13.749 1.00 0.00 C ATOM 460 C THR A 48 -8.829 11.000 -14.616 1.00 0.00 C ATOM 461 O THR A 48 -7.863 10.517 -15.206 1.00 0.00 O ATOM 462 CB THR A 48 -8.321 13.506 -14.554 1.00 0.00 C ATOM 463 OG1 THR A 48 -9.558 14.209 -14.641 1.00 0.00 O ATOM 464 CG2 THR A 48 -7.967 13.192 -16.008 1.00 0.00 C ATOM 0 H THR A 48 -7.938 12.012 -11.798 1.00 0.00 H new ATOM 0 HA THR A 48 -9.630 12.406 -13.270 1.00 0.00 H new ATOM 0 HB THR A 48 -7.486 14.024 -14.082 1.00 0.00 H new ATOM 0 HG1 THR A 48 -9.428 15.039 -15.146 1.00 0.00 H new ATOM 0 HG21 THR A 48 -7.733 14.118 -16.534 1.00 0.00 H new ATOM 0 HG22 THR A 48 -7.102 12.530 -16.037 1.00 0.00 H new ATOM 0 HG23 THR A 48 -8.814 12.704 -16.491 1.00 0.00 H new ATOM 472 N THR A 49 -10.059 10.512 -14.666 1.00 0.00 N ATOM 473 CA THR A 49 -10.364 9.327 -15.451 1.00 0.00 C ATOM 474 C THR A 49 -11.831 9.338 -15.885 1.00 0.00 C ATOM 475 O THR A 49 -12.701 9.777 -15.135 1.00 0.00 O ATOM 476 CB THR A 49 -9.985 8.100 -14.620 1.00 0.00 C ATOM 477 OG1 THR A 49 -10.261 6.999 -15.482 1.00 0.00 O ATOM 478 CG2 THR A 49 -10.923 7.887 -13.430 1.00 0.00 C ATOM 0 H THR A 49 -10.857 10.915 -14.176 1.00 0.00 H new ATOM 0 HA THR A 49 -9.785 9.304 -16.374 1.00 0.00 H new ATOM 0 HB THR A 49 -8.961 8.206 -14.261 1.00 0.00 H new ATOM 0 HG1 THR A 49 -10.042 6.161 -15.023 1.00 0.00 H new ATOM 0 HG21 THR A 49 -10.610 7.004 -12.874 1.00 0.00 H new ATOM 0 HG22 THR A 49 -10.886 8.759 -12.777 1.00 0.00 H new ATOM 0 HG23 THR A 49 -11.942 7.746 -13.791 1.00 0.00 H new ATOM 486 N ILE A 50 -12.060 8.851 -17.096 1.00 0.00 N ATOM 487 CA ILE A 50 -13.406 8.798 -17.639 1.00 0.00 C ATOM 488 C ILE A 50 -14.042 10.188 -17.549 1.00 0.00 C ATOM 489 O ILE A 50 -14.507 10.593 -16.484 1.00 0.00 O ATOM 490 CB ILE A 50 -14.221 7.704 -16.948 1.00 0.00 C ATOM 491 CG1 ILE A 50 -13.712 6.314 -17.337 1.00 0.00 C ATOM 492 CG2 ILE A 50 -15.715 7.868 -17.235 1.00 0.00 C ATOM 493 CD1 ILE A 50 -13.612 5.403 -16.112 1.00 0.00 C ATOM 0 H ILE A 50 -11.335 8.490 -17.716 1.00 0.00 H new ATOM 0 HA ILE A 50 -13.380 8.525 -18.694 1.00 0.00 H new ATOM 0 HB ILE A 50 -14.087 7.807 -15.871 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -14.384 5.869 -18.071 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -12.734 6.401 -17.811 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -16.271 7.077 -16.732 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -16.052 8.838 -16.869 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -15.888 7.806 -18.309 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.248 4.422 -16.417 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -12.921 5.838 -15.390 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -14.596 5.299 -15.655 1.00 0.00 H new ATOM 504 N GLY A 51 -14.042 10.878 -18.680 1.00 0.00 N ATOM 505 CA GLY A 51 -14.613 12.213 -18.742 1.00 0.00 C ATOM 506 C GLY A 51 -16.098 12.191 -18.374 1.00 0.00 C ATOM 507 O GLY A 51 -16.960 12.200 -19.253 1.00 0.00 O ATOM 0 H GLY A 51 -13.656 10.538 -19.561 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -14.076 12.874 -18.062 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -14.489 12.619 -19.746 1.00 0.00 H new ATOM 511 N ASN A 52 -16.354 12.162 -17.074 1.00 0.00 N ATOM 512 CA ASN A 52 -17.720 12.139 -16.579 1.00 0.00 C ATOM 513 C ASN A 52 -17.714 12.370 -15.067 1.00 0.00 C ATOM 514 O ASN A 52 -18.558 11.835 -14.351 1.00 0.00 O ATOM 515 CB ASN A 52 -18.380 10.786 -16.848 1.00 0.00 C ATOM 516 CG ASN A 52 -19.888 10.852 -16.597 1.00 0.00 C ATOM 517 OD1 ASN A 52 -20.384 10.487 -15.544 1.00 0.00 O ATOM 518 ND2 ASN A 52 -20.586 11.336 -17.620 1.00 0.00 N ATOM 0 H ASN A 52 -15.638 12.154 -16.348 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.278 12.921 -17.093 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -18.192 10.484 -17.878 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -17.934 10.026 -16.207 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -21.600 11.420 -17.551 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -20.107 11.623 -18.474 1.00 0.00 H new ATOM 524 N PHE A 53 -16.752 13.167 -14.626 1.00 0.00 N ATOM 525 CA PHE A 53 -16.625 13.476 -13.213 1.00 0.00 C ATOM 526 C PHE A 53 -16.963 12.256 -12.353 1.00 0.00 C ATOM 527 O PHE A 53 -17.739 12.356 -11.404 1.00 0.00 O ATOM 528 CB PHE A 53 -17.625 14.593 -12.905 1.00 0.00 C ATOM 529 CG PHE A 53 -17.141 15.589 -11.851 1.00 0.00 C ATOM 530 CD1 PHE A 53 -16.444 15.149 -10.769 1.00 0.00 C ATOM 531 CD2 PHE A 53 -17.409 16.915 -11.994 1.00 0.00 C ATOM 532 CE1 PHE A 53 -15.995 16.074 -9.790 1.00 0.00 C ATOM 533 CE2 PHE A 53 -16.960 17.840 -11.015 1.00 0.00 C ATOM 534 CZ PHE A 53 -16.263 17.400 -9.933 1.00 0.00 C ATOM 0 H PHE A 53 -16.053 13.608 -15.223 1.00 0.00 H new ATOM 0 HA PHE A 53 -15.601 13.774 -12.989 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -17.846 15.133 -13.826 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -18.560 14.146 -12.566 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -16.232 14.096 -10.655 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -17.963 17.264 -12.853 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -15.441 15.725 -8.931 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -17.172 18.893 -11.129 1.00 0.00 H new ATOM 0 HZ PHE A 53 -15.922 18.103 -9.188 1.00 0.00 H new ATOM 543 N SER A 54 -16.363 11.131 -12.715 1.00 0.00 N ATOM 544 CA SER A 54 -16.590 9.894 -11.989 1.00 0.00 C ATOM 545 C SER A 54 -15.813 8.752 -12.647 1.00 0.00 C ATOM 546 O SER A 54 -15.146 8.952 -13.661 1.00 0.00 O ATOM 547 CB SER A 54 -18.081 9.556 -11.929 1.00 0.00 C ATOM 548 OG SER A 54 -18.517 9.297 -10.598 1.00 0.00 O ATOM 0 H SER A 54 -15.720 11.051 -13.502 1.00 0.00 H new ATOM 0 HA SER A 54 -16.234 10.026 -10.967 1.00 0.00 H new ATOM 0 HB2 SER A 54 -18.657 10.383 -12.345 1.00 0.00 H new ATOM 0 HB3 SER A 54 -18.280 8.684 -12.552 1.00 0.00 H new ATOM 0 HG SER A 54 -19.474 9.087 -10.602 1.00 0.00 H new ATOM 553 N GLY A 55 -15.923 7.577 -12.042 1.00 0.00 N ATOM 554 CA GLY A 55 -15.240 6.403 -12.555 1.00 0.00 C ATOM 555 C GLY A 55 -16.186 5.202 -12.620 1.00 0.00 C ATOM 556 O GLY A 55 -16.262 4.417 -11.678 1.00 0.00 O ATOM 0 H GLY A 55 -16.476 7.414 -11.200 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -14.845 6.613 -13.549 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -14.389 6.166 -11.917 1.00 0.00 H new ATOM 560 N PRO A 56 -16.901 5.096 -13.772 1.00 0.00 N ATOM 561 CA PRO A 56 -17.839 4.004 -13.973 1.00 0.00 C ATOM 562 C PRO A 56 -17.102 2.696 -14.269 1.00 0.00 C ATOM 563 O PRO A 56 -15.910 2.574 -13.991 1.00 0.00 O ATOM 564 CB PRO A 56 -18.729 4.457 -15.119 1.00 0.00 C ATOM 565 CG PRO A 56 -17.971 5.571 -15.822 1.00 0.00 C ATOM 566 CD PRO A 56 -16.836 6.008 -14.911 1.00 0.00 C ATOM 0 HA PRO A 56 -18.433 3.790 -13.085 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -18.935 3.633 -15.802 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -19.691 4.812 -14.749 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -17.581 5.223 -16.778 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -18.634 6.409 -16.035 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -15.873 5.940 -15.418 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -16.958 7.044 -14.596 1.00 0.00 H new ATOM 571 N TYR A 57 -17.843 1.750 -14.827 1.00 0.00 N ATOM 572 CA TYR A 57 -17.276 0.456 -15.163 1.00 0.00 C ATOM 573 C TYR A 57 -16.604 -0.182 -13.944 1.00 0.00 C ATOM 574 O TYR A 57 -16.412 0.475 -12.922 1.00 0.00 O ATOM 575 CB TYR A 57 -16.215 0.725 -16.232 1.00 0.00 C ATOM 576 CG TYR A 57 -15.314 -0.475 -16.530 1.00 0.00 C ATOM 577 CD1 TYR A 57 -15.842 -1.603 -17.126 1.00 0.00 C ATOM 578 CD2 TYR A 57 -13.973 -0.430 -16.205 1.00 0.00 C ATOM 579 CE1 TYR A 57 -14.994 -2.733 -17.407 1.00 0.00 C ATOM 580 CE2 TYR A 57 -13.126 -1.560 -16.487 1.00 0.00 C ATOM 581 CZ TYR A 57 -13.678 -2.655 -17.073 1.00 0.00 C ATOM 582 OH TYR A 57 -12.877 -3.723 -17.339 1.00 0.00 O ATOM 0 H TYR A 57 -18.832 1.854 -15.055 1.00 0.00 H new ATOM 0 HA TYR A 57 -18.054 -0.226 -15.508 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -16.711 1.031 -17.153 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -15.594 1.562 -15.911 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -16.891 -1.638 -17.382 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -13.559 0.452 -15.739 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -15.394 -3.622 -17.872 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -12.075 -1.538 -16.238 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.075 -3.420 -17.813 1.00 0.00 H new ATOM 591 N THR A 58 -16.266 -1.454 -14.093 1.00 0.00 N ATOM 592 CA THR A 58 -15.621 -2.187 -13.017 1.00 0.00 C ATOM 593 C THR A 58 -14.124 -1.872 -12.980 1.00 0.00 C ATOM 594 O THR A 58 -13.293 -2.759 -13.174 1.00 0.00 O ATOM 595 CB THR A 58 -15.924 -3.674 -13.210 1.00 0.00 C ATOM 596 OG1 THR A 58 -17.333 -3.717 -13.413 1.00 0.00 O ATOM 597 CG2 THR A 58 -15.706 -4.487 -11.932 1.00 0.00 C ATOM 0 H THR A 58 -16.427 -1.996 -14.942 1.00 0.00 H new ATOM 0 HA THR A 58 -16.009 -1.885 -12.044 1.00 0.00 H new ATOM 0 HB THR A 58 -15.294 -4.073 -14.005 1.00 0.00 H new ATOM 0 HG1 THR A 58 -17.616 -4.645 -13.548 1.00 0.00 H new ATOM 0 HG21 THR A 58 -15.935 -5.535 -12.124 1.00 0.00 H new ATOM 0 HG22 THR A 58 -14.667 -4.395 -11.615 1.00 0.00 H new ATOM 0 HG23 THR A 58 -16.360 -4.111 -11.145 1.00 0.00 H new ATOM 605 N TYR A 59 -13.824 -0.606 -12.730 1.00 0.00 N ATOM 606 CA TYR A 59 -12.442 -0.162 -12.665 1.00 0.00 C ATOM 607 C TYR A 59 -11.953 -0.101 -11.216 1.00 0.00 C ATOM 608 O TYR A 59 -12.754 -0.163 -10.285 1.00 0.00 O ATOM 609 CB TYR A 59 -12.423 1.248 -13.258 1.00 0.00 C ATOM 610 CG TYR A 59 -11.118 1.605 -13.973 1.00 0.00 C ATOM 611 CD1 TYR A 59 -10.840 1.063 -15.211 1.00 0.00 C ATOM 612 CD2 TYR A 59 -10.221 2.469 -13.379 1.00 0.00 C ATOM 613 CE1 TYR A 59 -9.611 1.399 -15.884 1.00 0.00 C ATOM 614 CE2 TYR A 59 -8.992 2.806 -14.052 1.00 0.00 C ATOM 615 CZ TYR A 59 -8.749 2.254 -15.271 1.00 0.00 C ATOM 616 OH TYR A 59 -7.589 2.571 -15.907 1.00 0.00 O ATOM 0 H TYR A 59 -14.515 0.127 -12.570 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.792 -0.851 -13.205 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -13.250 1.346 -13.962 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -12.597 1.969 -12.459 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -11.543 0.387 -15.675 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.440 2.893 -12.410 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -9.380 0.982 -16.853 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -8.281 3.481 -13.599 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.071 3.192 -15.353 1.00 0.00 H new ATOM 625 N CYS A 60 -10.642 0.023 -11.072 1.00 0.00 N ATOM 626 CA CYS A 60 -10.038 0.094 -9.753 1.00 0.00 C ATOM 627 C CYS A 60 -10.259 1.503 -9.198 1.00 0.00 C ATOM 628 O CYS A 60 -10.544 2.432 -9.952 1.00 0.00 O ATOM 629 CB CYS A 60 -8.554 -0.278 -9.790 1.00 0.00 C ATOM 630 SG CYS A 60 -8.184 -1.880 -10.593 1.00 0.00 S ATOM 0 H CYS A 60 -9.981 0.076 -11.847 1.00 0.00 H new ATOM 0 HA CYS A 60 -10.512 -0.633 -9.094 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -8.010 0.509 -10.313 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -8.175 -0.304 -8.768 1.00 0.00 H new ATOM 634 N ASN A 61 -10.118 1.616 -7.886 1.00 0.00 N ATOM 635 CA ASN A 61 -10.299 2.897 -7.222 1.00 0.00 C ATOM 636 C ASN A 61 -8.987 3.310 -6.554 1.00 0.00 C ATOM 637 O ASN A 61 -8.065 2.502 -6.435 1.00 0.00 O ATOM 638 CB ASN A 61 -11.375 2.807 -6.138 1.00 0.00 C ATOM 639 CG ASN A 61 -11.726 4.196 -5.599 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.200 4.653 -4.598 1.00 0.00 O ATOM 641 ND2 ASN A 61 -12.644 4.837 -6.316 1.00 0.00 N ATOM 0 H ASN A 61 -9.881 0.843 -7.265 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.603 3.627 -7.972 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.269 2.334 -6.546 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.023 2.175 -5.323 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -12.948 5.770 -6.038 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.044 4.396 -7.144 1.00 0.00 H new ATOM 647 N THR A 62 -8.943 4.565 -6.135 1.00 0.00 N ATOM 648 CA THR A 62 -7.758 5.096 -5.482 1.00 0.00 C ATOM 649 C THR A 62 -7.883 4.965 -3.962 1.00 0.00 C ATOM 650 O THR A 62 -8.929 5.275 -3.393 1.00 0.00 O ATOM 651 CB THR A 62 -7.562 6.538 -5.954 1.00 0.00 C ATOM 652 OG1 THR A 62 -6.359 6.953 -5.314 1.00 0.00 O ATOM 653 CG2 THR A 62 -8.627 7.485 -5.396 1.00 0.00 C ATOM 0 H THR A 62 -9.709 5.231 -6.235 1.00 0.00 H new ATOM 0 HA THR A 62 -6.869 4.527 -5.754 1.00 0.00 H new ATOM 0 HB THR A 62 -7.582 6.569 -7.043 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.653 6.296 -5.487 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.443 8.495 -5.761 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.614 7.156 -5.722 1.00 0.00 H new ATOM 0 HG23 THR A 62 -8.584 7.479 -4.307 1.00 0.00 H new ATOM 661 N THR A 63 -6.803 4.505 -3.349 1.00 0.00 N ATOM 662 CA THR A 63 -6.778 4.329 -1.906 1.00 0.00 C ATOM 663 C THR A 63 -5.343 4.407 -1.383 1.00 0.00 C ATOM 664 O THR A 63 -4.392 4.396 -2.165 1.00 0.00 O ATOM 665 CB THR A 63 -7.474 3.007 -1.580 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.079 3.237 -0.310 1.00 0.00 O ATOM 667 CG2 THR A 63 -6.481 1.872 -1.318 1.00 0.00 C ATOM 0 H THR A 63 -5.938 4.248 -3.825 1.00 0.00 H new ATOM 0 HA THR A 63 -7.317 5.130 -1.400 1.00 0.00 H new ATOM 0 HB THR A 63 -8.133 2.731 -2.403 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.554 2.429 -0.023 1.00 0.00 H new ATOM 0 HG21 THR A 63 -7.027 0.956 -1.091 1.00 0.00 H new ATOM 0 HG22 THR A 63 -5.864 1.717 -2.203 1.00 0.00 H new ATOM 0 HG23 THR A 63 -5.844 2.133 -0.473 1.00 0.00 H new ATOM 675 N LEU A 64 -5.230 4.483 -0.066 1.00 0.00 N ATOM 676 CA LEU A 64 -3.926 4.562 0.570 1.00 0.00 C ATOM 677 C LEU A 64 -4.008 3.946 1.969 1.00 0.00 C ATOM 678 O LEU A 64 -5.092 3.836 2.540 1.00 0.00 O ATOM 679 CB LEU A 64 -3.412 6.003 0.561 1.00 0.00 C ATOM 680 CG LEU A 64 -3.246 6.665 1.931 1.00 0.00 C ATOM 681 CD1 LEU A 64 -1.912 6.276 2.570 1.00 0.00 C ATOM 682 CD2 LEU A 64 -3.413 8.182 1.830 1.00 0.00 C ATOM 0 H LEU A 64 -6.020 4.492 0.579 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.192 3.983 0.009 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.448 6.021 0.052 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -4.097 6.608 -0.032 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.036 6.297 2.586 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -1.819 6.760 3.542 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -1.871 5.194 2.698 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -1.093 6.596 1.926 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.290 8.628 2.817 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.661 8.587 1.153 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.407 8.414 1.448 1.00 0.00 H new ATOM 693 N ASP A 65 -2.848 3.563 2.481 1.00 0.00 N ATOM 694 CA ASP A 65 -2.774 2.964 3.802 1.00 0.00 C ATOM 695 C ASP A 65 -1.307 2.771 4.190 1.00 0.00 C ATOM 696 O ASP A 65 -0.417 3.350 3.568 1.00 0.00 O ATOM 697 CB ASP A 65 -3.451 1.591 3.821 1.00 0.00 C ATOM 698 CG ASP A 65 -4.407 1.358 4.993 1.00 0.00 C ATOM 699 OD1 ASP A 65 -5.032 2.352 5.421 1.00 0.00 O ATOM 700 OD2 ASP A 65 -4.491 0.192 5.434 1.00 0.00 O ATOM 0 H ASP A 65 -1.951 3.656 2.004 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.281 3.628 4.502 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -4.003 1.462 2.890 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -2.679 0.822 3.843 1.00 0.00 H new ATOM 704 N GLN A 66 -1.100 1.958 5.215 1.00 0.00 N ATOM 705 CA GLN A 66 0.244 1.684 5.693 1.00 0.00 C ATOM 706 C GLN A 66 1.216 1.588 4.516 1.00 0.00 C ATOM 707 O GLN A 66 2.278 2.209 4.531 1.00 0.00 O ATOM 708 CB GLN A 66 0.276 0.407 6.537 1.00 0.00 C ATOM 709 CG GLN A 66 0.907 0.670 7.905 1.00 0.00 C ATOM 710 CD GLN A 66 -0.133 1.192 8.897 1.00 0.00 C ATOM 711 OE1 GLN A 66 -0.548 2.339 8.857 1.00 0.00 O ATOM 712 NE2 GLN A 66 -0.531 0.289 9.790 1.00 0.00 N ATOM 0 H GLN A 66 -1.841 1.480 5.728 1.00 0.00 H new ATOM 0 HA GLN A 66 0.558 2.510 6.331 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.737 0.027 6.667 1.00 0.00 H new ATOM 0 HB3 GLN A 66 0.841 -0.365 6.014 1.00 0.00 H new ATOM 0 HG2 GLN A 66 1.350 -0.249 8.288 1.00 0.00 H new ATOM 0 HG3 GLN A 66 1.714 1.395 7.804 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -0.144 -0.654 9.769 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -1.223 0.540 10.496 1.00 0.00 H new ATOM 719 N ILE A 67 0.820 0.805 3.524 1.00 0.00 N ATOM 720 CA ILE A 67 1.643 0.620 2.341 1.00 0.00 C ATOM 721 C ILE A 67 0.777 0.787 1.091 1.00 0.00 C ATOM 722 O ILE A 67 0.983 0.100 0.092 1.00 0.00 O ATOM 723 CB ILE A 67 2.378 -0.721 2.404 1.00 0.00 C ATOM 724 CG1 ILE A 67 1.450 -1.874 2.017 1.00 0.00 C ATOM 725 CG2 ILE A 67 3.013 -0.934 3.780 1.00 0.00 C ATOM 726 CD1 ILE A 67 0.195 -1.886 2.892 1.00 0.00 C ATOM 0 H ILE A 67 -0.061 0.291 3.515 1.00 0.00 H new ATOM 0 HA ILE A 67 2.421 1.383 2.295 1.00 0.00 H new ATOM 0 HB ILE A 67 3.188 -0.701 1.675 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.166 -1.781 0.969 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.979 -2.821 2.121 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.529 -1.894 3.798 1.00 0.00 H new ATOM 0 HG22 ILE A 67 3.727 -0.135 3.979 1.00 0.00 H new ATOM 0 HG23 ILE A 67 2.236 -0.925 4.545 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -0.447 -2.715 2.596 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.481 -2.004 3.937 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -0.344 -0.947 2.767 1.00 0.00 H new ATOM 737 N GLY A 68 -0.173 1.707 1.187 1.00 0.00 N ATOM 738 CA GLY A 68 -1.071 1.973 0.077 1.00 0.00 C ATOM 739 C GLY A 68 -0.389 2.841 -0.983 1.00 0.00 C ATOM 740 O GLY A 68 -0.852 2.916 -2.120 1.00 0.00 O ATOM 0 H GLY A 68 -0.339 2.277 2.016 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.392 1.032 -0.370 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -1.967 2.475 0.442 1.00 0.00 H new ATOM 744 N THR A 69 0.699 3.475 -0.572 1.00 0.00 N ATOM 745 CA THR A 69 1.450 4.334 -1.471 1.00 0.00 C ATOM 746 C THR A 69 0.497 5.132 -2.365 1.00 0.00 C ATOM 747 O THR A 69 0.848 5.491 -3.488 1.00 0.00 O ATOM 748 CB THR A 69 2.428 3.458 -2.257 1.00 0.00 C ATOM 749 OG1 THR A 69 3.019 4.353 -3.195 1.00 0.00 O ATOM 750 CG2 THR A 69 1.717 2.421 -3.127 1.00 0.00 C ATOM 0 H THR A 69 1.079 3.411 0.373 1.00 0.00 H new ATOM 0 HA THR A 69 2.027 5.075 -0.919 1.00 0.00 H new ATOM 0 HB THR A 69 3.098 2.950 -1.563 1.00 0.00 H new ATOM 0 HG1 THR A 69 2.318 4.758 -3.747 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.457 1.827 -3.663 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.115 1.768 -2.496 1.00 0.00 H new ATOM 0 HG23 THR A 69 1.071 2.929 -3.844 1.00 0.00 H new ATOM 758 N CYS A 70 -0.689 5.386 -1.833 1.00 0.00 N ATOM 759 CA CYS A 70 -1.694 6.134 -2.568 1.00 0.00 C ATOM 760 C CYS A 70 -1.756 5.583 -3.994 1.00 0.00 C ATOM 761 O CYS A 70 -1.139 6.135 -4.903 1.00 0.00 O ATOM 762 CB CYS A 70 -1.407 7.637 -2.548 1.00 0.00 C ATOM 763 SG CYS A 70 -2.855 8.699 -2.905 1.00 0.00 S ATOM 0 H CYS A 70 -0.977 5.087 -0.901 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.666 6.010 -2.090 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -1.011 7.904 -1.568 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -0.626 7.854 -3.277 1.00 0.00 H new ATOM 767 N TRP A 71 -2.507 4.502 -4.145 1.00 0.00 N ATOM 768 CA TRP A 71 -2.657 3.871 -5.445 1.00 0.00 C ATOM 769 C TRP A 71 -3.674 4.683 -6.249 1.00 0.00 C ATOM 770 O TRP A 71 -4.849 4.745 -5.890 1.00 0.00 O ATOM 771 CB TRP A 71 -3.049 2.399 -5.297 1.00 0.00 C ATOM 772 CG TRP A 71 -2.053 1.568 -4.486 1.00 0.00 C ATOM 773 CD1 TRP A 71 -2.194 1.097 -3.240 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.749 1.127 -4.918 1.00 0.00 C ATOM 775 NE1 TRP A 71 -1.081 0.386 -2.838 1.00 0.00 N ATOM 776 CE2 TRP A 71 -0.174 0.406 -3.892 1.00 0.00 C ATOM 777 CE3 TRP A 71 -0.076 1.330 -6.136 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.099 -0.171 -3.978 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.195 0.748 -6.208 1.00 0.00 C ATOM 780 CH2 TRP A 71 1.788 0.019 -5.183 1.00 0.00 C ATOM 0 H TRP A 71 -3.018 4.047 -3.389 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.710 3.867 -5.985 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -4.028 2.340 -4.821 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -3.150 1.959 -6.289 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -3.069 1.254 -2.627 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.948 -0.070 -1.935 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.506 1.891 -6.952 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 1.526 -0.732 -3.160 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 1.754 0.874 -7.123 1.00 0.00 H new ATOM 0 HH2 TRP A 71 2.775 -0.399 -5.315 1.00 0.00 H new ATOM 790 N PRO A 72 -3.173 5.300 -7.352 1.00 0.00 N ATOM 791 CA PRO A 72 -4.023 6.105 -8.212 1.00 0.00 C ATOM 792 C PRO A 72 -4.927 5.220 -9.074 1.00 0.00 C ATOM 793 O PRO A 72 -4.803 5.208 -10.298 1.00 0.00 O ATOM 794 CB PRO A 72 -3.066 6.954 -9.032 1.00 0.00 C ATOM 795 CG PRO A 72 -1.714 6.266 -8.937 1.00 0.00 C ATOM 796 CD PRO A 72 -1.787 5.248 -7.810 1.00 0.00 C ATOM 0 HA PRO A 72 -4.711 6.737 -7.650 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -3.396 7.025 -10.068 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.015 7.971 -8.643 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -1.468 5.776 -9.879 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -0.927 6.995 -8.742 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.523 4.250 -8.160 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.095 5.497 -7.006 1.00 0.00 H new ATOM 801 N GLN A 73 -5.814 4.502 -8.402 1.00 0.00 N ATOM 802 CA GLN A 73 -6.736 3.616 -9.092 1.00 0.00 C ATOM 803 C GLN A 73 -6.020 2.887 -10.231 1.00 0.00 C ATOM 804 O GLN A 73 -4.793 2.886 -10.298 1.00 0.00 O ATOM 805 CB GLN A 73 -7.951 4.387 -9.611 1.00 0.00 C ATOM 806 CG GLN A 73 -7.680 4.964 -11.003 1.00 0.00 C ATOM 807 CD GLN A 73 -8.014 6.457 -11.052 1.00 0.00 C ATOM 808 OE1 GLN A 73 -8.689 6.939 -11.946 1.00 0.00 O ATOM 809 NE2 GLN A 73 -7.506 7.158 -10.043 1.00 0.00 N ATOM 0 H GLN A 73 -5.914 4.515 -7.387 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.096 2.872 -8.381 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -8.817 3.726 -9.650 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.197 5.194 -8.920 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -6.633 4.813 -11.266 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -8.275 4.430 -11.744 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -6.949 6.691 -9.327 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.673 8.163 -9.985 1.00 0.00 H new ATOM 816 N SER A 74 -6.819 2.284 -11.099 1.00 0.00 N ATOM 817 CA SER A 74 -6.278 1.553 -12.232 1.00 0.00 C ATOM 818 C SER A 74 -7.379 0.721 -12.892 1.00 0.00 C ATOM 819 O SER A 74 -8.526 0.737 -12.448 1.00 0.00 O ATOM 820 CB SER A 74 -5.118 0.652 -11.802 1.00 0.00 C ATOM 821 OG SER A 74 -5.087 0.457 -10.392 1.00 0.00 O ATOM 0 H SER A 74 -7.837 2.287 -11.040 1.00 0.00 H new ATOM 0 HA SER A 74 -5.895 2.275 -12.954 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.206 -0.314 -12.299 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.176 1.094 -12.127 1.00 0.00 H new ATOM 0 HG SER A 74 -4.523 1.144 -9.979 1.00 0.00 H new ATOM 826 N ALA A 75 -6.991 0.012 -13.943 1.00 0.00 N ATOM 827 CA ALA A 75 -7.931 -0.825 -14.669 1.00 0.00 C ATOM 828 C ALA A 75 -7.777 -2.276 -14.208 1.00 0.00 C ATOM 829 O ALA A 75 -6.763 -2.637 -13.614 1.00 0.00 O ATOM 830 CB ALA A 75 -7.703 -0.663 -16.174 1.00 0.00 C ATOM 0 H ALA A 75 -6.039 0.000 -14.309 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.957 -0.520 -14.461 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -8.408 -1.291 -16.718 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.854 0.379 -16.455 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.685 -0.962 -16.422 1.00 0.00 H new ATOM 836 N PRO A 76 -8.824 -3.089 -14.509 1.00 0.00 N ATOM 837 CA PRO A 76 -8.815 -4.493 -14.134 1.00 0.00 C ATOM 838 C PRO A 76 -7.883 -5.298 -15.042 1.00 0.00 C ATOM 839 O PRO A 76 -7.762 -5.001 -16.230 1.00 0.00 O ATOM 840 CB PRO A 76 -10.266 -4.935 -14.227 1.00 0.00 C ATOM 841 CG PRO A 76 -10.962 -3.899 -15.095 1.00 0.00 C ATOM 842 CD PRO A 76 -10.042 -2.695 -15.213 1.00 0.00 C ATOM 0 HA PRO A 76 -8.427 -4.657 -13.129 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -10.344 -5.929 -14.667 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.723 -4.987 -13.239 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -11.180 -4.311 -16.080 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.915 -3.609 -14.653 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.836 -2.454 -16.256 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.490 -1.809 -14.764 1.00 0.00 H new ATOM 847 N GLY A 77 -7.252 -6.299 -14.451 1.00 0.00 N ATOM 848 CA GLY A 77 -6.336 -7.149 -15.193 1.00 0.00 C ATOM 849 C GLY A 77 -5.094 -6.368 -15.628 1.00 0.00 C ATOM 850 O GLY A 77 -4.375 -6.793 -16.531 1.00 0.00 O ATOM 0 H GLY A 77 -7.356 -6.542 -13.466 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -6.039 -7.996 -14.575 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.840 -7.555 -16.070 1.00 0.00 H new ATOM 854 N ALA A 78 -4.881 -5.240 -14.968 1.00 0.00 N ATOM 855 CA ALA A 78 -3.740 -4.396 -15.276 1.00 0.00 C ATOM 856 C ALA A 78 -2.527 -4.873 -14.475 1.00 0.00 C ATOM 857 O ALA A 78 -2.460 -6.035 -14.077 1.00 0.00 O ATOM 858 CB ALA A 78 -4.092 -2.935 -14.985 1.00 0.00 C ATOM 0 H ALA A 78 -5.480 -4.890 -14.220 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.486 -4.466 -16.334 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.236 -2.301 -15.216 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.941 -2.636 -15.600 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.350 -2.826 -13.932 1.00 0.00 H new ATOM 864 N LEU A 79 -1.598 -3.952 -14.263 1.00 0.00 N ATOM 865 CA LEU A 79 -0.391 -4.266 -13.517 1.00 0.00 C ATOM 866 C LEU A 79 0.290 -2.964 -13.088 1.00 0.00 C ATOM 867 O LEU A 79 0.777 -2.208 -13.927 1.00 0.00 O ATOM 868 CB LEU A 79 0.514 -5.195 -14.328 1.00 0.00 C ATOM 869 CG LEU A 79 0.657 -6.623 -13.797 1.00 0.00 C ATOM 870 CD1 LEU A 79 -0.102 -7.614 -14.680 1.00 0.00 C ATOM 871 CD2 LEU A 79 2.131 -7.004 -13.643 1.00 0.00 C ATOM 0 H LEU A 79 -1.657 -2.989 -14.594 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.637 -4.814 -12.607 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.131 -5.244 -15.347 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.506 -4.747 -14.382 1.00 0.00 H new ATOM 0 HG LEU A 79 0.207 -6.666 -12.805 1.00 0.00 H new ATOM 0 HD11 LEU A 79 0.016 -8.621 -14.281 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -1.160 -7.351 -14.696 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.296 -7.577 -15.694 1.00 0.00 H new ATOM 0 HD21 LEU A 79 2.206 -8.023 -13.264 1.00 0.00 H new ATOM 0 HD22 LEU A 79 2.627 -6.940 -14.612 1.00 0.00 H new ATOM 0 HD23 LEU A 79 2.612 -6.321 -12.943 1.00 0.00 H new ATOM 882 N VAL A 80 0.301 -2.742 -11.782 1.00 0.00 N ATOM 883 CA VAL A 80 0.914 -1.544 -11.231 1.00 0.00 C ATOM 884 C VAL A 80 2.180 -1.932 -10.464 1.00 0.00 C ATOM 885 O VAL A 80 2.274 -1.702 -9.260 1.00 0.00 O ATOM 886 CB VAL A 80 -0.099 -0.787 -10.371 1.00 0.00 C ATOM 887 CG1 VAL A 80 0.600 0.240 -9.479 1.00 0.00 C ATOM 888 CG2 VAL A 80 -1.168 -0.122 -11.240 1.00 0.00 C ATOM 0 H VAL A 80 -0.105 -3.371 -11.089 1.00 0.00 H new ATOM 0 HA VAL A 80 1.213 -0.865 -12.029 1.00 0.00 H new ATOM 0 HB VAL A 80 -0.596 -1.510 -9.724 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -0.142 0.765 -8.878 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.305 -0.269 -8.822 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.136 0.957 -10.101 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -1.876 0.409 -10.603 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -0.695 0.583 -11.924 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -1.697 -0.884 -11.813 1.00 0.00 H new ATOM 898 N GLU A 81 3.121 -2.514 -11.194 1.00 0.00 N ATOM 899 CA GLU A 81 4.377 -2.935 -10.597 1.00 0.00 C ATOM 900 C GLU A 81 5.478 -1.917 -10.903 1.00 0.00 C ATOM 901 O GLU A 81 5.516 -1.347 -11.992 1.00 0.00 O ATOM 902 CB GLU A 81 4.772 -4.332 -11.080 1.00 0.00 C ATOM 903 CG GLU A 81 3.997 -5.413 -10.324 1.00 0.00 C ATOM 904 CD GLU A 81 4.620 -6.793 -10.549 1.00 0.00 C ATOM 905 OE1 GLU A 81 5.867 -6.864 -10.517 1.00 0.00 O ATOM 906 OE2 GLU A 81 3.834 -7.744 -10.748 1.00 0.00 O ATOM 0 H GLU A 81 3.039 -2.704 -12.193 1.00 0.00 H new ATOM 0 HA GLU A 81 4.245 -2.984 -9.516 1.00 0.00 H new ATOM 0 HB2 GLU A 81 4.577 -4.420 -12.149 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.842 -4.481 -10.938 1.00 0.00 H new ATOM 0 HG2 GLU A 81 3.990 -5.183 -9.259 1.00 0.00 H new ATOM 0 HG3 GLU A 81 2.959 -5.420 -10.656 1.00 0.00 H new ATOM 911 N ARG A 82 6.345 -1.718 -9.921 1.00 0.00 N ATOM 912 CA ARG A 82 7.443 -0.780 -10.071 1.00 0.00 C ATOM 913 C ARG A 82 8.506 -1.029 -8.999 1.00 0.00 C ATOM 914 O ARG A 82 8.809 -0.143 -8.202 1.00 0.00 O ATOM 915 CB ARG A 82 6.951 0.665 -9.966 1.00 0.00 C ATOM 916 CG ARG A 82 5.877 0.801 -8.884 1.00 0.00 C ATOM 917 CD ARG A 82 4.476 0.641 -9.480 1.00 0.00 C ATOM 918 NE ARG A 82 3.682 1.865 -9.237 1.00 0.00 N ATOM 919 CZ ARG A 82 3.416 2.360 -8.021 1.00 0.00 C ATOM 920 NH1 ARG A 82 3.879 1.737 -6.929 1.00 0.00 N ATOM 921 NH2 ARG A 82 2.685 3.476 -7.896 1.00 0.00 N ATOM 0 H ARG A 82 6.309 -2.191 -9.018 1.00 0.00 H new ATOM 0 HA ARG A 82 7.877 -0.934 -11.059 1.00 0.00 H new ATOM 0 HB2 ARG A 82 7.789 1.323 -9.736 1.00 0.00 H new ATOM 0 HB3 ARG A 82 6.548 0.986 -10.926 1.00 0.00 H new ATOM 0 HG2 ARG A 82 6.036 0.048 -8.112 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.962 1.775 -8.402 1.00 0.00 H new ATOM 0 HD2 ARG A 82 4.547 0.450 -10.551 1.00 0.00 H new ATOM 0 HD3 ARG A 82 3.978 -0.220 -9.034 1.00 0.00 H new ATOM 0 HE ARG A 82 3.314 2.364 -10.047 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.434 0.886 -7.024 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.677 2.113 -6.003 1.00 0.00 H new ATOM 0 HH21 ARG A 82 2.331 3.949 -8.727 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.483 3.852 -6.970 1.00 0.00 H new ATOM 932 N PRO A 83 9.056 -2.272 -9.015 1.00 0.00 N ATOM 933 CA PRO A 83 10.079 -2.650 -8.053 1.00 0.00 C ATOM 934 C PRO A 83 11.424 -2.012 -8.405 1.00 0.00 C ATOM 935 O PRO A 83 11.894 -2.128 -9.535 1.00 0.00 O ATOM 936 CB PRO A 83 10.113 -4.169 -8.092 1.00 0.00 C ATOM 937 CG PRO A 83 9.446 -4.568 -9.399 1.00 0.00 C ATOM 938 CD PRO A 83 8.722 -3.348 -9.943 1.00 0.00 C ATOM 0 HA PRO A 83 9.861 -2.296 -7.045 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.138 -4.538 -8.048 1.00 0.00 H new ATOM 0 HB3 PRO A 83 9.585 -4.593 -7.238 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.189 -4.922 -10.114 1.00 0.00 H new ATOM 0 HG3 PRO A 83 8.745 -5.387 -9.236 1.00 0.00 H new ATOM 0 HD2 PRO A 83 9.049 -3.113 -10.956 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.645 -3.513 -9.986 1.00 0.00 H new ATOM 943 N CYS A 84 12.007 -1.352 -7.414 1.00 0.00 N ATOM 944 CA CYS A 84 13.289 -0.695 -7.604 1.00 0.00 C ATOM 945 C CYS A 84 13.218 0.134 -8.888 1.00 0.00 C ATOM 946 O CYS A 84 13.373 -0.399 -9.986 1.00 0.00 O ATOM 947 CB CYS A 84 14.440 -1.702 -7.639 1.00 0.00 C ATOM 948 SG CYS A 84 15.175 -2.084 -6.007 1.00 0.00 S ATOM 0 H CYS A 84 11.615 -1.258 -6.477 1.00 0.00 H new ATOM 0 HA CYS A 84 13.493 -0.038 -6.759 1.00 0.00 H new ATOM 0 HB2 CYS A 84 14.080 -2.629 -8.086 1.00 0.00 H new ATOM 0 HB3 CYS A 84 15.222 -1.316 -8.293 1.00 0.00 H new ATOM 952 N PRO A 85 12.976 1.460 -8.703 1.00 0.00 N ATOM 953 CA PRO A 85 12.882 2.369 -9.832 1.00 0.00 C ATOM 954 C PRO A 85 14.266 2.667 -10.413 1.00 0.00 C ATOM 955 O PRO A 85 14.828 3.734 -10.171 1.00 0.00 O ATOM 956 CB PRO A 85 12.188 3.605 -9.287 1.00 0.00 C ATOM 957 CG PRO A 85 12.337 3.534 -7.775 1.00 0.00 C ATOM 958 CD PRO A 85 12.786 2.126 -7.417 1.00 0.00 C ATOM 0 HA PRO A 85 12.318 1.948 -10.664 1.00 0.00 H new ATOM 0 HB2 PRO A 85 12.642 4.514 -9.682 1.00 0.00 H new ATOM 0 HB3 PRO A 85 11.137 3.622 -9.576 1.00 0.00 H new ATOM 0 HG2 PRO A 85 13.066 4.267 -7.428 1.00 0.00 H new ATOM 0 HG3 PRO A 85 11.391 3.769 -7.287 1.00 0.00 H new ATOM 0 HD2 PRO A 85 13.709 2.140 -6.838 1.00 0.00 H new ATOM 0 HD3 PRO A 85 12.038 1.613 -6.812 1.00 0.00 H new ATOM 963 N GLU A 86 14.776 1.705 -11.168 1.00 0.00 N ATOM 964 CA GLU A 86 16.084 1.851 -11.784 1.00 0.00 C ATOM 965 C GLU A 86 16.537 0.521 -12.389 1.00 0.00 C ATOM 966 O GLU A 86 15.718 -0.362 -12.641 1.00 0.00 O ATOM 967 CB GLU A 86 17.109 2.373 -10.776 1.00 0.00 C ATOM 968 CG GLU A 86 17.741 3.680 -11.263 1.00 0.00 C ATOM 969 CD GLU A 86 18.854 4.136 -10.318 1.00 0.00 C ATOM 970 OE1 GLU A 86 18.737 3.827 -9.113 1.00 0.00 O ATOM 971 OE2 GLU A 86 19.797 4.782 -10.823 1.00 0.00 O ATOM 0 H GLU A 86 14.307 0.821 -11.367 1.00 0.00 H new ATOM 0 HA GLU A 86 16.007 2.585 -12.586 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.626 2.535 -9.812 1.00 0.00 H new ATOM 0 HB3 GLU A 86 17.886 1.625 -10.621 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.145 3.541 -12.266 1.00 0.00 H new ATOM 0 HG3 GLU A 86 16.977 4.454 -11.331 1.00 0.00 H new ATOM 976 N TYR A 87 17.840 0.418 -12.603 1.00 0.00 N ATOM 977 CA TYR A 87 18.412 -0.789 -13.174 1.00 0.00 C ATOM 978 C TYR A 87 17.895 -1.023 -14.594 1.00 0.00 C ATOM 979 O TYR A 87 17.831 -0.093 -15.397 1.00 0.00 O ATOM 980 CB TYR A 87 17.948 -1.940 -12.279 1.00 0.00 C ATOM 981 CG TYR A 87 18.849 -3.175 -12.334 1.00 0.00 C ATOM 982 CD1 TYR A 87 19.776 -3.308 -13.347 1.00 0.00 C ATOM 983 CD2 TYR A 87 18.736 -4.154 -11.369 1.00 0.00 C ATOM 984 CE1 TYR A 87 20.625 -4.470 -13.399 1.00 0.00 C ATOM 985 CE2 TYR A 87 19.585 -5.317 -11.420 1.00 0.00 C ATOM 986 CZ TYR A 87 20.487 -5.417 -12.432 1.00 0.00 C ATOM 987 OH TYR A 87 21.289 -6.515 -12.481 1.00 0.00 O ATOM 0 H TYR A 87 18.517 1.151 -12.391 1.00 0.00 H new ATOM 0 HA TYR A 87 19.498 -0.711 -13.226 1.00 0.00 H new ATOM 0 HB2 TYR A 87 17.896 -1.587 -11.249 1.00 0.00 H new ATOM 0 HB3 TYR A 87 16.937 -2.227 -12.569 1.00 0.00 H new ATOM 0 HD1 TYR A 87 19.865 -2.540 -14.101 1.00 0.00 H new ATOM 0 HD2 TYR A 87 18.011 -4.049 -10.575 1.00 0.00 H new ATOM 0 HE1 TYR A 87 21.354 -4.587 -14.187 1.00 0.00 H new ATOM 0 HE2 TYR A 87 19.507 -6.091 -10.671 1.00 0.00 H new ATOM 0 HH TYR A 87 21.081 -7.106 -11.727 1.00 0.00 H new ATOM 996 N PHE A 88 17.539 -2.271 -14.862 1.00 0.00 N ATOM 997 CA PHE A 88 17.029 -2.639 -16.173 1.00 0.00 C ATOM 998 C PHE A 88 15.632 -2.059 -16.400 1.00 0.00 C ATOM 999 O PHE A 88 15.401 -1.352 -17.379 1.00 0.00 O ATOM 1000 CB PHE A 88 16.947 -4.166 -16.208 1.00 0.00 C ATOM 1001 CG PHE A 88 15.731 -4.740 -15.477 1.00 0.00 C ATOM 1002 CD1 PHE A 88 15.814 -5.042 -14.153 1.00 0.00 C ATOM 1003 CD2 PHE A 88 14.569 -4.950 -16.150 1.00 0.00 C ATOM 1004 CE1 PHE A 88 14.687 -5.575 -13.474 1.00 0.00 C ATOM 1005 CE2 PHE A 88 13.441 -5.483 -15.471 1.00 0.00 C ATOM 1006 CZ PHE A 88 13.524 -5.784 -14.148 1.00 0.00 C ATOM 0 H PHE A 88 17.593 -3.040 -14.194 1.00 0.00 H new ATOM 0 HA PHE A 88 17.685 -2.249 -16.951 1.00 0.00 H new ATOM 0 HB2 PHE A 88 16.922 -4.495 -17.247 1.00 0.00 H new ATOM 0 HB3 PHE A 88 17.853 -4.579 -15.765 1.00 0.00 H new ATOM 0 HD1 PHE A 88 16.738 -4.876 -13.618 1.00 0.00 H new ATOM 0 HD2 PHE A 88 14.503 -4.712 -17.201 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.753 -5.814 -12.423 1.00 0.00 H new ATOM 0 HE2 PHE A 88 12.518 -5.649 -16.006 1.00 0.00 H new ATOM 0 HZ PHE A 88 12.666 -6.189 -13.632 1.00 0.00 H new ATOM 1015 N ASN A 89 14.735 -2.380 -15.478 1.00 0.00 N ATOM 1016 CA ASN A 89 13.367 -1.900 -15.566 1.00 0.00 C ATOM 1017 C ASN A 89 13.051 -1.535 -17.017 1.00 0.00 C ATOM 1018 O ASN A 89 12.596 -2.378 -17.789 1.00 0.00 O ATOM 1019 CB ASN A 89 13.167 -0.648 -14.708 1.00 0.00 C ATOM 1020 CG ASN A 89 12.536 -1.002 -13.360 1.00 0.00 C ATOM 1021 OD1 ASN A 89 11.337 -1.192 -13.237 1.00 0.00 O ATOM 1022 ND2 ASN A 89 13.409 -1.080 -12.359 1.00 0.00 N ATOM 0 H ASN A 89 14.930 -2.967 -14.667 1.00 0.00 H new ATOM 0 HA ASN A 89 12.708 -2.691 -15.209 1.00 0.00 H new ATOM 0 HB2 ASN A 89 14.126 -0.156 -14.547 1.00 0.00 H new ATOM 0 HB3 ASN A 89 12.530 0.061 -15.236 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.088 -1.311 -11.419 1.00 0.00 H new ATOM 0 HD22 ASN A 89 14.400 -0.909 -12.532 1.00 0.00 H new ATOM 1028 N GLY A 90 13.305 -0.276 -17.346 1.00 0.00 N ATOM 1029 CA GLY A 90 13.053 0.211 -18.691 1.00 0.00 C ATOM 1030 C GLY A 90 11.580 0.580 -18.875 1.00 0.00 C ATOM 1031 O GLY A 90 11.205 1.175 -19.884 1.00 0.00 O ATOM 0 H GLY A 90 13.683 0.421 -16.704 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.677 1.083 -18.889 1.00 0.00 H new ATOM 0 HA3 GLY A 90 13.333 -0.553 -19.416 1.00 0.00 H new ATOM 1035 N ILE A 91 10.783 0.212 -17.882 1.00 0.00 N ATOM 1036 CA ILE A 91 9.359 0.496 -17.920 1.00 0.00 C ATOM 1037 C ILE A 91 9.077 1.774 -17.127 1.00 0.00 C ATOM 1038 O ILE A 91 9.826 2.745 -17.221 1.00 0.00 O ATOM 1039 CB ILE A 91 8.557 -0.715 -17.441 1.00 0.00 C ATOM 1040 CG1 ILE A 91 7.099 -0.624 -17.897 1.00 0.00 C ATOM 1041 CG2 ILE A 91 8.672 -0.883 -15.924 1.00 0.00 C ATOM 1042 CD1 ILE A 91 6.872 -1.443 -19.170 1.00 0.00 C ATOM 0 H ILE A 91 11.097 -0.281 -17.046 1.00 0.00 H new ATOM 0 HA ILE A 91 9.034 0.678 -18.945 1.00 0.00 H new ATOM 0 HB ILE A 91 8.982 -1.608 -17.899 1.00 0.00 H new ATOM 0 HG12 ILE A 91 6.443 -0.986 -17.105 1.00 0.00 H new ATOM 0 HG13 ILE A 91 6.835 0.418 -18.078 1.00 0.00 H new ATOM 0 HG21 ILE A 91 8.093 -1.751 -15.609 1.00 0.00 H new ATOM 0 HG22 ILE A 91 9.718 -1.027 -15.652 1.00 0.00 H new ATOM 0 HG23 ILE A 91 8.288 0.009 -15.429 1.00 0.00 H new ATOM 0 HD11 ILE A 91 5.828 -1.362 -19.473 1.00 0.00 H new ATOM 0 HD12 ILE A 91 7.512 -1.063 -19.966 1.00 0.00 H new ATOM 0 HD13 ILE A 91 7.114 -2.488 -18.978 1.00 0.00 H new ATOM 1053 N LYS A 92 7.994 1.732 -16.364 1.00 0.00 N ATOM 1054 CA LYS A 92 7.605 2.874 -15.555 1.00 0.00 C ATOM 1055 C LYS A 92 8.351 2.828 -14.221 1.00 0.00 C ATOM 1056 O LYS A 92 7.731 2.785 -13.160 1.00 0.00 O ATOM 1057 CB LYS A 92 6.083 2.931 -15.406 1.00 0.00 C ATOM 1058 CG LYS A 92 5.638 4.273 -14.822 1.00 0.00 C ATOM 1059 CD LYS A 92 4.174 4.222 -14.380 1.00 0.00 C ATOM 1060 CE LYS A 92 3.714 5.579 -13.845 1.00 0.00 C ATOM 1061 NZ LYS A 92 2.342 5.484 -13.302 1.00 0.00 N ATOM 0 H LYS A 92 7.374 0.925 -16.289 1.00 0.00 H new ATOM 0 HA LYS A 92 7.890 3.804 -16.048 1.00 0.00 H new ATOM 0 HB2 LYS A 92 5.613 2.780 -16.378 1.00 0.00 H new ATOM 0 HB3 LYS A 92 5.747 2.120 -14.760 1.00 0.00 H new ATOM 0 HG2 LYS A 92 6.269 4.530 -13.972 1.00 0.00 H new ATOM 0 HG3 LYS A 92 5.770 5.059 -15.566 1.00 0.00 H new ATOM 0 HD2 LYS A 92 3.547 3.927 -15.221 1.00 0.00 H new ATOM 0 HD3 LYS A 92 4.050 3.462 -13.608 1.00 0.00 H new ATOM 0 HE2 LYS A 92 4.397 5.920 -13.067 1.00 0.00 H new ATOM 0 HE3 LYS A 92 3.745 6.321 -14.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 2.046 6.414 -12.943 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 1.691 5.180 -14.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 2.323 4.791 -12.526 1.00 0.00 H new ATOM 1071 N TYR A 93 9.673 2.838 -14.318 1.00 0.00 N ATOM 1072 CA TYR A 93 10.511 2.798 -13.132 1.00 0.00 C ATOM 1073 C TYR A 93 11.102 4.176 -12.831 1.00 0.00 C ATOM 1074 O TYR A 93 12.316 4.316 -12.682 1.00 0.00 O ATOM 1075 CB TYR A 93 11.648 1.826 -13.453 1.00 0.00 C ATOM 1076 CG TYR A 93 12.645 2.354 -14.487 1.00 0.00 C ATOM 1077 CD1 TYR A 93 12.357 2.259 -15.833 1.00 0.00 C ATOM 1078 CD2 TYR A 93 13.830 2.926 -14.073 1.00 0.00 C ATOM 1079 CE1 TYR A 93 13.295 2.756 -16.806 1.00 0.00 C ATOM 1080 CE2 TYR A 93 14.769 3.423 -15.046 1.00 0.00 C ATOM 1081 CZ TYR A 93 14.454 3.313 -16.365 1.00 0.00 C ATOM 1082 OH TYR A 93 15.339 3.783 -17.284 1.00 0.00 O ATOM 0 H TYR A 93 10.184 2.873 -15.200 1.00 0.00 H new ATOM 0 HA TYR A 93 9.931 2.490 -12.262 1.00 0.00 H new ATOM 0 HB2 TYR A 93 12.184 1.593 -12.533 1.00 0.00 H new ATOM 0 HB3 TYR A 93 11.221 0.892 -13.819 1.00 0.00 H new ATOM 0 HD1 TYR A 93 11.429 1.812 -16.157 1.00 0.00 H new ATOM 0 HD2 TYR A 93 14.054 3.001 -13.019 1.00 0.00 H new ATOM 0 HE1 TYR A 93 13.082 2.688 -17.863 1.00 0.00 H new ATOM 0 HE2 TYR A 93 15.701 3.872 -14.736 1.00 0.00 H new ATOM 0 HH TYR A 93 16.121 4.154 -16.825 1.00 0.00 H new ATOM 1091 N ASN A 94 10.218 5.159 -12.751 1.00 0.00 N ATOM 1092 CA ASN A 94 10.638 6.522 -12.470 1.00 0.00 C ATOM 1093 C ASN A 94 10.339 6.853 -11.006 1.00 0.00 C ATOM 1094 O ASN A 94 11.160 6.594 -10.128 1.00 0.00 O ATOM 1095 CB ASN A 94 9.880 7.522 -13.345 1.00 0.00 C ATOM 1096 CG ASN A 94 8.509 6.974 -13.743 1.00 0.00 C ATOM 1097 OD1 ASN A 94 7.483 7.330 -13.187 1.00 0.00 O ATOM 1098 ND2 ASN A 94 8.548 6.089 -14.735 1.00 0.00 N ATOM 0 H ASN A 94 9.213 5.039 -12.876 1.00 0.00 H new ATOM 0 HA ASN A 94 11.705 6.596 -12.678 1.00 0.00 H new ATOM 0 HB2 ASN A 94 9.757 8.462 -12.807 1.00 0.00 H new ATOM 0 HB3 ASN A 94 10.462 7.741 -14.240 1.00 0.00 H new ATOM 0 HD21 ASN A 94 7.685 5.664 -15.074 1.00 0.00 H new ATOM 0 HD22 ASN A 94 9.441 5.835 -15.157 1.00 0.00 H new ATOM 1104 N THR A 95 9.161 7.419 -10.789 1.00 0.00 N ATOM 1105 CA THR A 95 8.744 7.787 -9.447 1.00 0.00 C ATOM 1106 C THR A 95 7.388 7.158 -9.119 1.00 0.00 C ATOM 1107 O THR A 95 6.344 7.736 -9.417 1.00 0.00 O ATOM 1108 CB THR A 95 8.744 9.314 -9.354 1.00 0.00 C ATOM 1109 OG1 THR A 95 8.246 9.739 -10.620 1.00 0.00 O ATOM 1110 CG2 THR A 95 10.158 9.897 -9.296 1.00 0.00 C ATOM 0 H THR A 95 8.482 7.632 -11.520 1.00 0.00 H new ATOM 0 HA THR A 95 9.436 7.402 -8.698 1.00 0.00 H new ATOM 0 HB THR A 95 8.187 9.624 -8.470 1.00 0.00 H new ATOM 0 HG1 THR A 95 7.393 9.293 -10.802 1.00 0.00 H new ATOM 0 HG21 THR A 95 10.101 10.984 -9.231 1.00 0.00 H new ATOM 0 HG22 THR A 95 10.677 9.507 -8.420 1.00 0.00 H new ATOM 0 HG23 THR A 95 10.705 9.616 -10.196 1.00 0.00 H new ATOM 1118 N THR A 96 7.448 5.983 -8.511 1.00 0.00 N ATOM 1119 CA THR A 96 6.238 5.270 -8.140 1.00 0.00 C ATOM 1120 C THR A 96 6.524 4.292 -6.998 1.00 0.00 C ATOM 1121 O THR A 96 5.813 3.302 -6.832 1.00 0.00 O ATOM 1122 CB THR A 96 5.683 4.594 -9.395 1.00 0.00 C ATOM 1123 OG1 THR A 96 6.790 3.863 -9.913 1.00 0.00 O ATOM 1124 CG2 THR A 96 5.349 5.597 -10.500 1.00 0.00 C ATOM 0 H THR A 96 8.316 5.507 -8.266 1.00 0.00 H new ATOM 0 HA THR A 96 5.478 5.952 -7.759 1.00 0.00 H new ATOM 0 HB THR A 96 4.789 4.027 -9.137 1.00 0.00 H new ATOM 0 HG1 THR A 96 6.518 3.392 -10.728 1.00 0.00 H new ATOM 0 HG21 THR A 96 4.959 5.066 -11.368 1.00 0.00 H new ATOM 0 HG22 THR A 96 4.599 6.301 -10.138 1.00 0.00 H new ATOM 0 HG23 THR A 96 6.250 6.141 -10.782 1.00 0.00 H new ATOM 1132 N ARG A 97 7.567 4.602 -6.243 1.00 0.00 N ATOM 1133 CA ARG A 97 7.957 3.763 -5.123 1.00 0.00 C ATOM 1134 C ARG A 97 8.432 2.397 -5.623 1.00 0.00 C ATOM 1135 O ARG A 97 8.356 2.108 -6.817 1.00 0.00 O ATOM 1136 CB ARG A 97 6.792 3.566 -4.151 1.00 0.00 C ATOM 1137 CG ARG A 97 7.285 3.540 -2.703 1.00 0.00 C ATOM 1138 CD ARG A 97 6.474 4.501 -1.831 1.00 0.00 C ATOM 1139 NE ARG A 97 6.750 4.243 -0.400 1.00 0.00 N ATOM 1140 CZ ARG A 97 6.475 5.106 0.586 1.00 0.00 C ATOM 1141 NH1 ARG A 97 5.915 6.291 0.303 1.00 0.00 N ATOM 1142 NH2 ARG A 97 6.760 4.786 1.857 1.00 0.00 N ATOM 0 H ARG A 97 8.155 5.423 -6.385 1.00 0.00 H new ATOM 0 HA ARG A 97 8.771 4.265 -4.600 1.00 0.00 H new ATOM 0 HB2 ARG A 97 6.068 4.371 -4.278 1.00 0.00 H new ATOM 0 HB3 ARG A 97 6.276 2.634 -4.380 1.00 0.00 H new ATOM 0 HG2 ARG A 97 7.206 2.528 -2.306 1.00 0.00 H new ATOM 0 HG3 ARG A 97 8.339 3.814 -2.669 1.00 0.00 H new ATOM 0 HD2 ARG A 97 6.728 5.532 -2.079 1.00 0.00 H new ATOM 0 HD3 ARG A 97 5.410 4.378 -2.032 1.00 0.00 H new ATOM 0 HE ARG A 97 7.177 3.351 -0.149 1.00 0.00 H new ATOM 0 HH11 ARG A 97 5.698 6.535 -0.663 1.00 0.00 H new ATOM 0 HH12 ARG A 97 5.705 6.948 1.054 1.00 0.00 H new ATOM 0 HH21 ARG A 97 7.186 3.885 2.073 1.00 0.00 H new ATOM 0 HH22 ARG A 97 6.550 5.444 2.608 1.00 0.00 H new ATOM 1153 N ASN A 98 8.910 1.593 -4.685 1.00 0.00 N ATOM 1154 CA ASN A 98 9.396 0.264 -5.015 1.00 0.00 C ATOM 1155 C ASN A 98 8.459 -0.783 -4.411 1.00 0.00 C ATOM 1156 O ASN A 98 8.348 -0.891 -3.190 1.00 0.00 O ATOM 1157 CB ASN A 98 10.796 0.032 -4.445 1.00 0.00 C ATOM 1158 CG ASN A 98 11.075 0.979 -3.274 1.00 0.00 C ATOM 1159 OD1 ASN A 98 10.421 0.943 -2.246 1.00 0.00 O ATOM 1160 ND2 ASN A 98 12.079 1.823 -3.489 1.00 0.00 N ATOM 0 H ASN A 98 8.971 1.836 -3.696 1.00 0.00 H new ATOM 0 HA ASN A 98 9.431 0.178 -6.101 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.890 -1.002 -4.112 1.00 0.00 H new ATOM 0 HB3 ASN A 98 11.541 0.185 -5.226 1.00 0.00 H new ATOM 0 HD21 ASN A 98 12.344 2.495 -2.769 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.585 1.799 -4.374 1.00 0.00 H new ATOM 1166 N ALA A 99 7.808 -1.528 -5.292 1.00 0.00 N ATOM 1167 CA ALA A 99 6.885 -2.563 -4.859 1.00 0.00 C ATOM 1168 C ALA A 99 6.222 -3.195 -6.086 1.00 0.00 C ATOM 1169 O ALA A 99 6.690 -3.014 -7.209 1.00 0.00 O ATOM 1170 CB ALA A 99 5.864 -1.964 -3.890 1.00 0.00 C ATOM 0 H ALA A 99 7.901 -1.435 -6.303 1.00 0.00 H new ATOM 0 HA ALA A 99 7.416 -3.352 -4.327 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.172 -2.741 -3.565 1.00 0.00 H new ATOM 0 HB2 ALA A 99 6.382 -1.554 -3.023 1.00 0.00 H new ATOM 0 HB3 ALA A 99 5.310 -1.170 -4.390 1.00 0.00 H new ATOM 1176 N TYR A 100 5.145 -3.923 -5.829 1.00 0.00 N ATOM 1177 CA TYR A 100 4.415 -4.582 -6.897 1.00 0.00 C ATOM 1178 C TYR A 100 2.956 -4.817 -6.501 1.00 0.00 C ATOM 1179 O TYR A 100 2.680 -5.436 -5.474 1.00 0.00 O ATOM 1180 CB TYR A 100 5.099 -5.934 -7.105 1.00 0.00 C ATOM 1181 CG TYR A 100 4.185 -7.137 -6.861 1.00 0.00 C ATOM 1182 CD1 TYR A 100 3.219 -7.468 -7.791 1.00 0.00 C ATOM 1183 CD2 TYR A 100 4.326 -7.891 -5.714 1.00 0.00 C ATOM 1184 CE1 TYR A 100 2.359 -8.600 -7.562 1.00 0.00 C ATOM 1185 CE2 TYR A 100 3.466 -9.023 -5.486 1.00 0.00 C ATOM 1186 CZ TYR A 100 2.525 -9.322 -6.421 1.00 0.00 C ATOM 1187 OH TYR A 100 1.712 -10.391 -6.205 1.00 0.00 O ATOM 0 H TYR A 100 4.761 -4.071 -4.896 1.00 0.00 H new ATOM 0 HA TYR A 100 4.419 -3.969 -7.798 1.00 0.00 H new ATOM 0 HB2 TYR A 100 5.483 -5.983 -8.124 1.00 0.00 H new ATOM 0 HB3 TYR A 100 5.958 -6.002 -6.437 1.00 0.00 H new ATOM 0 HD1 TYR A 100 3.109 -6.878 -8.689 1.00 0.00 H new ATOM 0 HD2 TYR A 100 5.082 -7.632 -4.987 1.00 0.00 H new ATOM 0 HE1 TYR A 100 1.599 -8.870 -8.280 1.00 0.00 H new ATOM 0 HE2 TYR A 100 3.566 -9.621 -4.592 1.00 0.00 H new ATOM 0 HH TYR A 100 0.879 -10.276 -6.708 1.00 0.00 H new ATOM 1196 N ARG A 101 2.060 -4.309 -7.334 1.00 0.00 N ATOM 1197 CA ARG A 101 0.636 -4.455 -7.083 1.00 0.00 C ATOM 1198 C ARG A 101 -0.134 -4.500 -8.404 1.00 0.00 C ATOM 1199 O ARG A 101 -0.052 -3.572 -9.207 1.00 0.00 O ATOM 1200 CB ARG A 101 0.106 -3.301 -6.231 1.00 0.00 C ATOM 1201 CG ARG A 101 0.173 -3.643 -4.741 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.164 -4.196 -4.245 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.035 -3.088 -3.795 1.00 0.00 N ATOM 1204 CZ ARG A 101 -3.033 -3.229 -2.912 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -3.294 -4.430 -2.380 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.773 -2.167 -2.562 1.00 0.00 N ATOM 0 H ARG A 101 2.292 -3.795 -8.184 1.00 0.00 H new ATOM 0 HA ARG A 101 0.489 -5.389 -6.541 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.689 -2.401 -6.428 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.924 -3.081 -6.511 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.961 -4.376 -4.568 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.436 -2.752 -4.171 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.654 -4.754 -5.043 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -0.996 -4.894 -3.425 1.00 0.00 H new ATOM 0 HE ARG A 101 -1.865 -2.159 -4.181 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -2.733 -5.239 -2.647 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.054 -4.536 -1.708 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.576 -1.252 -2.968 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -4.533 -2.274 -1.890 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.864 -5.590 -8.590 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.648 -5.769 -9.800 1.00 0.00 C ATOM 1219 C GLU A 102 -3.138 -5.591 -9.498 1.00 0.00 C ATOM 1220 O GLU A 102 -3.554 -5.661 -8.342 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.376 -7.135 -10.432 1.00 0.00 C ATOM 1222 CG GLU A 102 -1.803 -8.267 -9.497 1.00 0.00 C ATOM 1223 CD GLU A 102 -0.619 -9.177 -9.163 1.00 0.00 C ATOM 1224 OE1 GLU A 102 0.181 -9.431 -10.089 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -0.540 -9.599 -7.989 1.00 0.00 O ATOM 0 H GLU A 102 -0.929 -6.358 -7.922 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.349 -5.007 -10.520 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.914 -7.216 -11.376 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.314 -7.229 -10.661 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -2.216 -7.849 -8.579 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -2.595 -8.851 -9.965 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.901 -5.365 -10.558 1.00 0.00 N ATOM 1231 CA CYS A 103 -5.335 -5.178 -10.421 1.00 0.00 C ATOM 1232 C CYS A 103 -6.040 -6.358 -11.091 1.00 0.00 C ATOM 1233 O CYS A 103 -5.965 -6.523 -12.308 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.788 -3.837 -11.004 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.560 -2.698 -9.797 1.00 0.00 S ATOM 0 H CYS A 103 -3.553 -5.307 -11.515 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.601 -5.150 -9.364 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.926 -3.341 -11.451 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.498 -4.028 -11.808 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.710 -7.151 -10.267 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.429 -8.312 -10.764 1.00 0.00 C ATOM 1241 C LEU A 104 -8.387 -7.877 -11.874 1.00 0.00 C ATOM 1242 O LEU A 104 -8.544 -6.684 -12.130 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.115 -9.050 -9.614 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.229 -9.998 -8.802 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -7.753 -10.146 -7.371 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -7.086 -11.350 -9.502 1.00 0.00 C ATOM 0 H LEU A 104 -6.770 -7.012 -9.258 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.736 -9.029 -11.204 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.539 -8.310 -8.935 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -8.948 -9.623 -10.022 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.232 -9.562 -8.737 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.106 -10.825 -6.815 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.761 -9.171 -6.884 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -8.766 -10.548 -7.394 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -6.452 -12.004 -8.904 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.069 -11.805 -9.618 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -6.635 -11.206 -10.484 1.00 0.00 H new ATOM 1257 N GLU A 105 -9.003 -8.867 -12.503 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.942 -8.601 -13.580 1.00 0.00 C ATOM 1259 C GLU A 105 -11.287 -8.144 -13.010 1.00 0.00 C ATOM 1260 O GLU A 105 -12.228 -7.888 -13.760 1.00 0.00 O ATOM 1261 CB GLU A 105 -10.114 -9.830 -14.473 1.00 0.00 C ATOM 1262 CG GLU A 105 -10.131 -9.435 -15.951 1.00 0.00 C ATOM 1263 CD GLU A 105 -10.201 -10.673 -16.849 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -11.305 -11.252 -16.932 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -9.147 -11.011 -17.431 1.00 0.00 O ATOM 0 H GLU A 105 -8.870 -9.855 -12.287 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.539 -7.798 -14.197 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.302 -10.533 -14.290 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -11.042 -10.342 -14.219 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.987 -8.789 -16.149 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.236 -8.860 -16.188 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.335 -8.056 -11.689 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.549 -7.635 -11.010 1.00 0.00 C ATOM 1272 C ASN A 106 -12.455 -6.142 -10.687 1.00 0.00 C ATOM 1273 O ASN A 106 -13.392 -5.563 -10.141 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.736 -8.393 -9.695 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.219 -8.618 -9.397 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -14.878 -7.817 -8.755 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.705 -9.750 -9.898 1.00 0.00 N ATOM 0 H ASN A 106 -10.553 -8.269 -11.070 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.393 -7.842 -11.668 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -12.223 -9.353 -9.749 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.279 -7.832 -8.880 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -15.685 -9.992 -9.754 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -14.097 -10.376 -10.426 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.317 -5.564 -11.040 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.090 -4.150 -10.794 1.00 0.00 C ATOM 1285 C GLY A 107 -10.675 -3.904 -9.342 1.00 0.00 C ATOM 1286 O GLY A 107 -10.845 -2.804 -8.821 1.00 0.00 O ATOM 0 H GLY A 107 -10.543 -6.048 -11.494 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.314 -3.781 -11.465 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -11.997 -3.589 -11.016 1.00 0.00 H new ATOM 1290 N THR A 108 -10.140 -4.950 -8.729 1.00 0.00 N ATOM 1291 CA THR A 108 -9.700 -4.863 -7.347 1.00 0.00 C ATOM 1292 C THR A 108 -8.174 -4.941 -7.268 1.00 0.00 C ATOM 1293 O THR A 108 -7.509 -5.207 -8.268 1.00 0.00 O ATOM 1294 CB THR A 108 -10.407 -5.964 -6.555 1.00 0.00 C ATOM 1295 OG1 THR A 108 -10.119 -7.155 -7.284 1.00 0.00 O ATOM 1296 CG2 THR A 108 -11.931 -5.846 -6.620 1.00 0.00 C ATOM 0 H THR A 108 -10.001 -5.862 -9.164 1.00 0.00 H new ATOM 0 HA THR A 108 -9.968 -3.903 -6.906 1.00 0.00 H new ATOM 0 HB THR A 108 -10.085 -5.927 -5.514 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.538 -7.921 -6.839 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.383 -6.651 -6.041 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.239 -4.885 -6.207 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.258 -5.917 -7.658 1.00 0.00 H new ATOM 1304 N TRP A 109 -7.663 -4.705 -6.068 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.228 -4.746 -5.845 1.00 0.00 C ATOM 1306 C TRP A 109 -5.858 -6.163 -5.402 1.00 0.00 C ATOM 1307 O TRP A 109 -6.695 -7.064 -5.430 1.00 0.00 O ATOM 1308 CB TRP A 109 -5.799 -3.674 -4.840 1.00 0.00 C ATOM 1309 CG TRP A 109 -5.626 -2.282 -5.452 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.354 -1.181 -5.215 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -4.629 -1.884 -6.416 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -5.900 -0.107 -5.954 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -4.818 -0.548 -6.707 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -3.601 -2.628 -7.022 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.018 0.160 -7.612 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -2.810 -1.905 -7.924 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -2.987 -0.561 -8.227 1.00 0.00 C ATOM 0 H TRP A 109 -8.217 -4.485 -5.241 1.00 0.00 H new ATOM 0 HA TRP A 109 -5.688 -4.517 -6.764 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -6.541 -3.620 -4.043 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -4.858 -3.977 -4.380 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.190 -1.140 -4.532 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.287 0.837 -5.948 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -3.435 -3.674 -6.809 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.187 1.205 -7.824 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.006 -2.429 -8.419 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.332 -0.074 -8.934 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.604 -6.315 -5.001 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.114 -7.607 -4.552 1.00 0.00 C ATOM 1329 C ALA A 110 -4.156 -7.662 -3.024 1.00 0.00 C ATOM 1330 O ALA A 110 -4.720 -6.775 -2.383 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.706 -7.838 -5.106 1.00 0.00 C ATOM 0 H ALA A 110 -3.913 -5.565 -4.978 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.749 -8.410 -4.927 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.337 -8.807 -4.770 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.736 -7.819 -6.195 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.041 -7.052 -4.748 1.00 0.00 H new ATOM 1337 N SER A 111 -3.552 -8.709 -2.484 1.00 0.00 N ATOM 1338 CA SER A 111 -3.514 -8.890 -1.043 1.00 0.00 C ATOM 1339 C SER A 111 -2.922 -7.648 -0.375 1.00 0.00 C ATOM 1340 O SER A 111 -3.580 -7.003 0.440 1.00 0.00 O ATOM 1341 CB SER A 111 -2.705 -10.133 -0.665 1.00 0.00 C ATOM 1342 OG SER A 111 -3.311 -10.860 0.401 1.00 0.00 O ATOM 0 H SER A 111 -3.085 -9.441 -3.018 1.00 0.00 H new ATOM 0 HA SER A 111 -4.535 -9.033 -0.689 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.607 -10.781 -1.536 1.00 0.00 H new ATOM 0 HB3 SER A 111 -1.697 -9.835 -0.374 1.00 0.00 H new ATOM 0 HG SER A 111 -2.766 -11.647 0.612 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.685 -7.349 -0.745 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.996 -6.196 -0.192 1.00 0.00 C ATOM 1349 C ARG A 112 0.398 -6.064 -0.808 1.00 0.00 C ATOM 1350 O ARG A 112 1.169 -7.023 -0.819 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.866 -6.308 1.328 1.00 0.00 C ATOM 1352 CG ARG A 112 -1.406 -5.055 2.020 1.00 0.00 C ATOM 1353 CD ARG A 112 -1.092 -5.076 3.516 1.00 0.00 C ATOM 1354 NE ARG A 112 -2.029 -4.191 4.244 1.00 0.00 N ATOM 1355 CZ ARG A 112 -1.906 -3.867 5.538 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -0.884 -4.353 6.256 1.00 0.00 N ATOM 1357 NH2 ARG A 112 -2.804 -3.056 6.114 1.00 0.00 N ATOM 0 H ARG A 112 -1.142 -7.886 -1.421 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.587 -5.312 -0.430 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -1.410 -7.185 1.679 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.180 -6.454 1.597 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.967 -4.167 1.565 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -2.484 -4.990 1.872 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.170 -6.094 3.898 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -0.066 -4.750 3.685 1.00 0.00 H new ATOM 0 HE ARG A 112 -2.818 -3.803 3.728 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -0.200 -4.969 5.817 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -0.790 -4.106 7.241 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -3.581 -2.685 5.567 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.710 -2.809 7.099 1.00 0.00 H new ATOM 1368 N VAL A 113 0.681 -4.869 -1.306 1.00 0.00 N ATOM 1369 CA VAL A 113 1.968 -4.600 -1.922 1.00 0.00 C ATOM 1370 C VAL A 113 3.071 -5.272 -1.103 1.00 0.00 C ATOM 1371 O VAL A 113 2.877 -5.580 0.072 1.00 0.00 O ATOM 1372 CB VAL A 113 2.171 -3.091 -2.074 1.00 0.00 C ATOM 1373 CG1 VAL A 113 2.816 -2.496 -0.820 1.00 0.00 C ATOM 1374 CG2 VAL A 113 2.997 -2.771 -3.321 1.00 0.00 C ATOM 0 H VAL A 113 0.040 -4.076 -1.295 1.00 0.00 H new ATOM 0 HA VAL A 113 2.006 -5.022 -2.926 1.00 0.00 H new ATOM 0 HB VAL A 113 1.190 -2.632 -2.196 1.00 0.00 H new ATOM 0 HG11 VAL A 113 2.949 -1.423 -0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.173 -2.677 0.041 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.786 -2.964 -0.653 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.126 -1.692 -3.405 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.974 -3.248 -3.243 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.480 -3.144 -4.205 1.00 0.00 H new ATOM 1384 N ASN A 114 4.206 -5.480 -1.755 1.00 0.00 N ATOM 1385 CA ASN A 114 5.340 -6.110 -1.101 1.00 0.00 C ATOM 1386 C ASN A 114 6.574 -5.986 -1.998 1.00 0.00 C ATOM 1387 O ASN A 114 6.451 -5.896 -3.219 1.00 0.00 O ATOM 1388 CB ASN A 114 5.080 -7.598 -0.859 1.00 0.00 C ATOM 1389 CG ASN A 114 6.344 -8.302 -0.363 1.00 0.00 C ATOM 1390 OD1 ASN A 114 6.718 -9.366 -0.831 1.00 0.00 O ATOM 1391 ND2 ASN A 114 6.981 -7.652 0.607 1.00 0.00 N ATOM 0 H ASN A 114 4.364 -5.223 -2.729 1.00 0.00 H new ATOM 0 HA ASN A 114 5.497 -5.611 -0.145 1.00 0.00 H new ATOM 0 HB2 ASN A 114 4.282 -7.717 -0.126 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.737 -8.066 -1.782 1.00 0.00 H new ATOM 0 HD21 ASN A 114 7.836 -8.040 1.005 1.00 0.00 H new ATOM 0 HD22 ASN A 114 6.614 -6.765 0.953 1.00 0.00 H new ATOM 1397 N TYR A 115 7.733 -5.985 -1.357 1.00 0.00 N ATOM 1398 CA TYR A 115 8.988 -5.873 -2.082 1.00 0.00 C ATOM 1399 C TYR A 115 9.780 -7.181 -2.013 1.00 0.00 C ATOM 1400 O TYR A 115 10.674 -7.326 -1.180 1.00 0.00 O ATOM 1401 CB TYR A 115 9.784 -4.771 -1.380 1.00 0.00 C ATOM 1402 CG TYR A 115 8.914 -3.692 -0.733 1.00 0.00 C ATOM 1403 CD1 TYR A 115 7.767 -3.260 -1.365 1.00 0.00 C ATOM 1404 CD2 TYR A 115 9.278 -3.151 0.484 1.00 0.00 C ATOM 1405 CE1 TYR A 115 6.948 -2.243 -0.756 1.00 0.00 C ATOM 1406 CE2 TYR A 115 8.460 -2.135 1.093 1.00 0.00 C ATOM 1407 CZ TYR A 115 7.335 -1.731 0.443 1.00 0.00 C ATOM 1408 OH TYR A 115 6.562 -0.772 1.019 1.00 0.00 O ATOM 0 H TYR A 115 7.830 -6.060 -0.344 1.00 0.00 H new ATOM 0 HA TYR A 115 8.805 -5.651 -3.133 1.00 0.00 H new ATOM 0 HB2 TYR A 115 10.414 -5.223 -0.614 1.00 0.00 H new ATOM 0 HB3 TYR A 115 10.450 -4.301 -2.103 1.00 0.00 H new ATOM 0 HD1 TYR A 115 7.483 -3.684 -2.317 1.00 0.00 H new ATOM 0 HD2 TYR A 115 10.176 -3.490 0.979 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.048 -1.895 -1.240 1.00 0.00 H new ATOM 0 HE2 TYR A 115 8.733 -1.703 2.044 1.00 0.00 H new ATOM 0 HH TYR A 115 6.960 -0.500 1.872 1.00 0.00 H new ATOM 1417 N SER A 116 9.422 -8.099 -2.898 1.00 0.00 N ATOM 1418 CA SER A 116 10.088 -9.390 -2.948 1.00 0.00 C ATOM 1419 C SER A 116 10.746 -9.587 -4.316 1.00 0.00 C ATOM 1420 O SER A 116 11.343 -10.631 -4.576 1.00 0.00 O ATOM 1421 CB SER A 116 9.106 -10.528 -2.663 1.00 0.00 C ATOM 1422 OG SER A 116 8.929 -10.742 -1.264 1.00 0.00 O ATOM 0 H SER A 116 8.680 -7.975 -3.586 1.00 0.00 H new ATOM 0 HA SER A 116 10.857 -9.408 -2.176 1.00 0.00 H new ATOM 0 HB2 SER A 116 8.143 -10.299 -3.120 1.00 0.00 H new ATOM 0 HB3 SER A 116 9.469 -11.445 -3.127 1.00 0.00 H new ATOM 0 HG SER A 116 8.019 -10.486 -1.006 1.00 0.00 H new ATOM 1427 N HIS A 117 10.614 -8.568 -5.152 1.00 0.00 N ATOM 1428 CA HIS A 117 11.188 -8.617 -6.486 1.00 0.00 C ATOM 1429 C HIS A 117 11.642 -7.216 -6.900 1.00 0.00 C ATOM 1430 O HIS A 117 11.234 -6.712 -7.946 1.00 0.00 O ATOM 1431 CB HIS A 117 10.205 -9.240 -7.479 1.00 0.00 C ATOM 1432 CG HIS A 117 8.753 -8.999 -7.137 1.00 0.00 C ATOM 1433 ND1 HIS A 117 7.761 -9.932 -7.385 1.00 0.00 N ATOM 1434 CD2 HIS A 117 8.139 -7.925 -6.565 1.00 0.00 C ATOM 1435 CE1 HIS A 117 6.605 -9.430 -6.977 1.00 0.00 C ATOM 1436 NE2 HIS A 117 6.840 -8.186 -6.469 1.00 0.00 N ATOM 0 H HIS A 117 10.118 -7.704 -4.932 1.00 0.00 H new ATOM 0 HA HIS A 117 12.068 -9.261 -6.484 1.00 0.00 H new ATOM 0 HB2 HIS A 117 10.405 -8.840 -8.473 1.00 0.00 H new ATOM 0 HB3 HIS A 117 10.383 -10.314 -7.526 1.00 0.00 H new ATOM 0 HD2 HIS A 117 8.626 -7.016 -6.244 1.00 0.00 H new ATOM 0 HE1 HIS A 117 5.644 -9.920 -7.036 1.00 0.00 H new ATOM 0 HE2 HIS A 117 6.135 -7.560 -6.080 1.00 0.00 H new ATOM 1443 N CYS A 118 12.480 -6.627 -6.060 1.00 0.00 N ATOM 1444 CA CYS A 118 12.993 -5.294 -6.326 1.00 0.00 C ATOM 1445 C CYS A 118 13.675 -5.306 -7.695 1.00 0.00 C ATOM 1446 O CYS A 118 13.264 -4.588 -8.604 1.00 0.00 O ATOM 1447 CB CYS A 118 13.940 -4.822 -5.221 1.00 0.00 C ATOM 1448 SG CYS A 118 13.857 -3.031 -4.853 1.00 0.00 S ATOM 0 H CYS A 118 12.817 -7.049 -5.194 1.00 0.00 H new ATOM 0 HA CYS A 118 12.169 -4.580 -6.338 1.00 0.00 H new ATOM 0 HB2 CYS A 118 13.717 -5.377 -4.309 1.00 0.00 H new ATOM 0 HB3 CYS A 118 14.962 -5.073 -5.506 1.00 0.00 H new ATOM 1452 N GLU A 119 14.707 -6.131 -7.800 1.00 0.00 N ATOM 1453 CA GLU A 119 15.450 -6.246 -9.043 1.00 0.00 C ATOM 1454 C GLU A 119 15.329 -7.665 -9.604 1.00 0.00 C ATOM 1455 O GLU A 119 16.248 -8.471 -9.466 1.00 0.00 O ATOM 1456 CB GLU A 119 16.916 -5.860 -8.844 1.00 0.00 C ATOM 1457 CG GLU A 119 17.470 -6.458 -7.549 1.00 0.00 C ATOM 1458 CD GLU A 119 18.958 -6.788 -7.690 1.00 0.00 C ATOM 1459 OE1 GLU A 119 19.714 -5.857 -8.043 1.00 0.00 O ATOM 1460 OE2 GLU A 119 19.304 -7.962 -7.440 1.00 0.00 O ATOM 0 H GLU A 119 15.046 -6.726 -7.044 1.00 0.00 H new ATOM 0 HA GLU A 119 15.021 -5.552 -9.765 1.00 0.00 H new ATOM 0 HB2 GLU A 119 17.506 -6.209 -9.691 1.00 0.00 H new ATOM 0 HB3 GLU A 119 17.009 -4.774 -8.816 1.00 0.00 H new ATOM 0 HG2 GLU A 119 17.326 -5.755 -6.729 1.00 0.00 H new ATOM 0 HG3 GLU A 119 16.916 -7.362 -7.295 1.00 0.00 H new ATOM 1465 N PRO A 120 14.158 -7.934 -10.241 1.00 0.00 N ATOM 1466 CA PRO A 120 13.905 -9.240 -10.824 1.00 0.00 C ATOM 1467 C PRO A 120 14.692 -9.425 -12.122 1.00 0.00 C ATOM 1468 O PRO A 120 15.670 -8.717 -12.365 1.00 0.00 O ATOM 1469 CB PRO A 120 12.399 -9.295 -11.030 1.00 0.00 C ATOM 1470 CG PRO A 120 11.921 -7.853 -10.990 1.00 0.00 C ATOM 1471 CD PRO A 120 13.047 -7.003 -10.423 1.00 0.00 C ATOM 0 HA PRO A 120 14.237 -10.057 -10.183 1.00 0.00 H new ATOM 0 HB2 PRO A 120 12.152 -9.762 -11.983 1.00 0.00 H new ATOM 0 HB3 PRO A 120 11.919 -9.887 -10.251 1.00 0.00 H new ATOM 0 HG2 PRO A 120 11.652 -7.512 -11.990 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.028 -7.764 -10.372 1.00 0.00 H new ATOM 0 HD2 PRO A 120 13.315 -6.195 -11.104 1.00 0.00 H new ATOM 0 HD3 PRO A 120 12.758 -6.542 -9.479 1.00 0.00 H new ATOM 1476 N ILE A 121 14.239 -10.378 -12.923 1.00 0.00 N ATOM 1477 CA ILE A 121 14.890 -10.664 -14.190 1.00 0.00 C ATOM 1478 C ILE A 121 15.365 -9.354 -14.821 1.00 0.00 C ATOM 1479 O ILE A 121 14.805 -8.291 -14.552 1.00 0.00 O ATOM 1480 CB ILE A 121 13.966 -11.481 -15.094 1.00 0.00 C ATOM 1481 CG1 ILE A 121 13.320 -12.634 -14.320 1.00 0.00 C ATOM 1482 CG2 ILE A 121 14.709 -11.972 -16.337 1.00 0.00 C ATOM 1483 CD1 ILE A 121 11.917 -12.255 -13.843 1.00 0.00 C ATOM 0 H ILE A 121 13.428 -10.962 -12.719 1.00 0.00 H new ATOM 0 HA ILE A 121 15.774 -11.282 -14.033 1.00 0.00 H new ATOM 0 HB ILE A 121 13.161 -10.831 -15.436 1.00 0.00 H new ATOM 0 HG12 ILE A 121 13.266 -13.518 -14.955 1.00 0.00 H new ATOM 0 HG13 ILE A 121 13.941 -12.895 -13.463 1.00 0.00 H new ATOM 0 HG21 ILE A 121 14.029 -12.550 -16.963 1.00 0.00 H new ATOM 0 HG22 ILE A 121 15.081 -11.116 -16.900 1.00 0.00 H new ATOM 0 HG23 ILE A 121 15.547 -12.600 -16.035 1.00 0.00 H new ATOM 0 HD11 ILE A 121 11.480 -13.091 -13.296 1.00 0.00 H new ATOM 0 HD12 ILE A 121 11.978 -11.385 -13.189 1.00 0.00 H new ATOM 0 HD13 ILE A 121 11.292 -12.018 -14.704 1.00 0.00 H new ATOM 1494 N LEU A 122 16.393 -9.471 -15.647 1.00 0.00 N ATOM 1495 CA LEU A 122 16.950 -8.309 -16.319 1.00 0.00 C ATOM 1496 C LEU A 122 16.187 -8.064 -17.623 1.00 0.00 C ATOM 1497 O LEU A 122 15.153 -8.682 -17.866 1.00 0.00 O ATOM 1498 CB LEU A 122 18.459 -8.474 -16.512 1.00 0.00 C ATOM 1499 CG LEU A 122 19.345 -7.834 -15.441 1.00 0.00 C ATOM 1500 CD1 LEU A 122 20.006 -8.900 -14.566 1.00 0.00 C ATOM 1501 CD2 LEU A 122 20.374 -6.892 -16.071 1.00 0.00 C ATOM 0 H LEU A 122 16.856 -10.353 -15.867 1.00 0.00 H new ATOM 0 HA LEU A 122 16.826 -7.418 -15.704 1.00 0.00 H new ATOM 0 HB2 LEU A 122 18.686 -9.539 -16.554 1.00 0.00 H new ATOM 0 HB3 LEU A 122 18.730 -8.052 -17.480 1.00 0.00 H new ATOM 0 HG LEU A 122 18.711 -7.231 -14.791 1.00 0.00 H new ATOM 0 HD11 LEU A 122 20.630 -8.418 -13.814 1.00 0.00 H new ATOM 0 HD12 LEU A 122 19.237 -9.494 -14.073 1.00 0.00 H new ATOM 0 HD13 LEU A 122 20.623 -9.549 -15.187 1.00 0.00 H new ATOM 0 HD21 LEU A 122 20.991 -6.451 -15.288 1.00 0.00 H new ATOM 0 HD22 LEU A 122 21.007 -7.452 -16.759 1.00 0.00 H new ATOM 0 HD23 LEU A 122 19.858 -6.101 -16.615 1.00 0.00 H new ATOM 1512 N ASP A 123 16.729 -7.161 -18.427 1.00 0.00 N ATOM 1513 CA ASP A 123 16.112 -6.826 -19.700 1.00 0.00 C ATOM 1514 C ASP A 123 17.061 -7.209 -20.837 1.00 0.00 C ATOM 1515 O ASP A 123 18.277 -7.242 -20.651 1.00 0.00 O ATOM 1516 CB ASP A 123 15.835 -5.326 -19.800 1.00 0.00 C ATOM 1517 CG ASP A 123 15.479 -4.825 -21.201 1.00 0.00 C ATOM 1518 OD1 ASP A 123 14.831 -5.603 -21.933 1.00 0.00 O ATOM 1519 OD2 ASP A 123 15.864 -3.676 -21.509 1.00 0.00 O ATOM 0 H ASP A 123 17.588 -6.651 -18.222 1.00 0.00 H new ATOM 0 HA ASP A 123 15.171 -7.371 -19.773 1.00 0.00 H new ATOM 0 HB2 ASP A 123 15.018 -5.077 -19.123 1.00 0.00 H new ATOM 0 HB3 ASP A 123 16.714 -4.785 -19.450 1.00 0.00 H new ATOM 1523 N ASP A 124 16.469 -7.489 -21.990 1.00 0.00 N ATOM 1524 CA ASP A 124 17.247 -7.868 -23.157 1.00 0.00 C ATOM 1525 C ASP A 124 18.184 -9.019 -22.789 1.00 0.00 C ATOM 1526 O ASP A 124 19.264 -8.796 -22.243 1.00 0.00 O ATOM 1527 CB ASP A 124 18.104 -6.700 -23.651 1.00 0.00 C ATOM 1528 CG ASP A 124 17.568 -5.985 -24.892 1.00 0.00 C ATOM 1529 OD1 ASP A 124 16.462 -6.364 -25.333 1.00 0.00 O ATOM 1530 OD2 ASP A 124 18.278 -5.075 -25.372 1.00 0.00 O ATOM 0 H ASP A 124 15.461 -7.461 -22.140 1.00 0.00 H new ATOM 0 HA ASP A 124 16.552 -8.164 -23.943 1.00 0.00 H new ATOM 0 HB2 ASP A 124 18.200 -5.973 -22.845 1.00 0.00 H new ATOM 0 HB3 ASP A 124 19.106 -7.070 -23.868 1.00 0.00 H new ATOM 1534 N LYS A 125 17.737 -10.227 -23.102 1.00 0.00 N ATOM 1535 CA LYS A 125 18.522 -11.414 -22.810 1.00 0.00 C ATOM 1536 C LYS A 125 19.645 -11.544 -23.841 1.00 0.00 C ATOM 1537 O LYS A 125 19.575 -10.952 -24.918 1.00 0.00 O ATOM 1538 CB LYS A 125 17.619 -12.647 -22.726 1.00 0.00 C ATOM 1539 CG LYS A 125 17.007 -12.972 -24.090 1.00 0.00 C ATOM 1540 CD LYS A 125 17.458 -14.349 -24.580 1.00 0.00 C ATOM 1541 CE LYS A 125 16.321 -15.367 -24.476 1.00 0.00 C ATOM 1542 NZ LYS A 125 16.593 -16.339 -23.393 1.00 0.00 N ATOM 0 H LYS A 125 16.841 -10.409 -23.555 1.00 0.00 H new ATOM 0 HA LYS A 125 18.995 -11.326 -21.832 1.00 0.00 H new ATOM 0 HB2 LYS A 125 18.195 -13.501 -22.369 1.00 0.00 H new ATOM 0 HB3 LYS A 125 16.825 -12.472 -22.000 1.00 0.00 H new ATOM 0 HG2 LYS A 125 15.920 -12.945 -24.020 1.00 0.00 H new ATOM 0 HG3 LYS A 125 17.299 -12.211 -24.814 1.00 0.00 H new ATOM 0 HD2 LYS A 125 17.795 -14.279 -25.614 1.00 0.00 H new ATOM 0 HD3 LYS A 125 18.310 -14.688 -23.990 1.00 0.00 H new ATOM 0 HE2 LYS A 125 15.380 -14.852 -24.282 1.00 0.00 H new ATOM 0 HE3 LYS A 125 16.207 -15.892 -25.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 15.812 -17.023 -23.336 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 17.480 -16.843 -23.594 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 16.679 -15.835 -22.487 1.00 0.00 H new ATOM 1552 N GLN A 126 20.653 -12.322 -23.476 1.00 0.00 N ATOM 1553 CA GLN A 126 21.789 -12.537 -24.357 1.00 0.00 C ATOM 1554 C GLN A 126 21.361 -13.334 -25.591 1.00 0.00 C ATOM 1555 O GLN A 126 20.215 -13.770 -25.685 1.00 0.00 O ATOM 1556 CB GLN A 126 22.930 -13.241 -23.618 1.00 0.00 C ATOM 1557 CG GLN A 126 23.710 -12.254 -22.748 1.00 0.00 C ATOM 1558 CD GLN A 126 25.191 -12.235 -23.134 1.00 0.00 C ATOM 1559 OE1 GLN A 126 25.688 -11.302 -23.741 1.00 0.00 O ATOM 1560 NE2 GLN A 126 25.864 -13.314 -22.747 1.00 0.00 N ATOM 0 H GLN A 126 20.707 -12.811 -22.583 1.00 0.00 H new ATOM 0 HA GLN A 126 22.158 -11.565 -24.686 1.00 0.00 H new ATOM 0 HB2 GLN A 126 22.527 -14.040 -22.996 1.00 0.00 H new ATOM 0 HB3 GLN A 126 23.602 -13.706 -24.339 1.00 0.00 H new ATOM 0 HG2 GLN A 126 23.289 -11.255 -22.858 1.00 0.00 H new ATOM 0 HG3 GLN A 126 23.607 -12.529 -21.698 1.00 0.00 H new ATOM 0 HE21 GLN A 126 25.385 -14.059 -22.241 1.00 0.00 H new ATOM 0 HE22 GLN A 126 26.859 -13.396 -22.956 1.00 0.00 H new ATOM 1567 N ARG A 127 22.304 -13.498 -26.506 1.00 0.00 N ATOM 1568 CA ARG A 127 22.040 -14.233 -27.731 1.00 0.00 C ATOM 1569 C ARG A 127 22.105 -15.740 -27.469 1.00 0.00 C ATOM 1570 O ARG A 127 23.087 -16.393 -27.822 1.00 0.00 O ATOM 1571 CB ARG A 127 23.048 -13.868 -28.822 1.00 0.00 C ATOM 1572 CG ARG A 127 22.590 -12.632 -29.599 1.00 0.00 C ATOM 1573 CD ARG A 127 23.697 -12.125 -30.525 1.00 0.00 C ATOM 1574 NE ARG A 127 23.209 -12.081 -31.922 1.00 0.00 N ATOM 1575 CZ ARG A 127 22.350 -11.163 -32.388 1.00 0.00 C ATOM 1576 NH1 ARG A 127 21.881 -10.209 -31.573 1.00 0.00 N ATOM 1577 NH2 ARG A 127 21.962 -11.200 -33.670 1.00 0.00 N ATOM 0 H ARG A 127 23.253 -13.134 -26.424 1.00 0.00 H new ATOM 0 HA ARG A 127 21.041 -13.962 -28.072 1.00 0.00 H new ATOM 0 HB2 ARG A 127 24.023 -13.679 -28.373 1.00 0.00 H new ATOM 0 HB3 ARG A 127 23.169 -14.708 -29.506 1.00 0.00 H new ATOM 0 HG2 ARG A 127 21.703 -12.874 -30.185 1.00 0.00 H new ATOM 0 HG3 ARG A 127 22.305 -11.844 -28.901 1.00 0.00 H new ATOM 0 HD2 ARG A 127 24.018 -11.131 -30.212 1.00 0.00 H new ATOM 0 HD3 ARG A 127 24.567 -12.777 -30.456 1.00 0.00 H new ATOM 0 HE ARG A 127 23.547 -12.793 -32.570 1.00 0.00 H new ATOM 0 HH11 ARG A 127 22.177 -10.181 -30.597 1.00 0.00 H new ATOM 0 HH12 ARG A 127 21.228 -9.511 -31.928 1.00 0.00 H new ATOM 0 HH21 ARG A 127 22.320 -11.926 -34.290 1.00 0.00 H new ATOM 0 HH22 ARG A 127 21.309 -10.502 -34.025 1.00 0.00 H new ATOM 1588 N LYS A 128 21.048 -16.247 -26.854 1.00 0.00 N ATOM 1589 CA LYS A 128 20.974 -17.665 -26.541 1.00 0.00 C ATOM 1590 C LYS A 128 22.187 -18.062 -25.698 1.00 0.00 C ATOM 1591 O LYS A 128 23.151 -17.304 -25.596 1.00 0.00 O ATOM 1592 CB LYS A 128 20.818 -18.488 -27.821 1.00 0.00 C ATOM 1593 CG LYS A 128 19.832 -19.640 -27.616 1.00 0.00 C ATOM 1594 CD LYS A 128 20.484 -20.986 -27.938 1.00 0.00 C ATOM 1595 CE LYS A 128 20.136 -21.438 -29.357 1.00 0.00 C ATOM 1596 NZ LYS A 128 21.112 -22.442 -29.836 1.00 0.00 N ATOM 0 H LYS A 128 20.236 -15.703 -26.564 1.00 0.00 H new ATOM 0 HA LYS A 128 20.088 -17.877 -25.943 1.00 0.00 H new ATOM 0 HB2 LYS A 128 20.469 -17.846 -28.630 1.00 0.00 H new ATOM 0 HB3 LYS A 128 21.787 -18.884 -28.123 1.00 0.00 H new ATOM 0 HG2 LYS A 128 19.478 -19.641 -26.585 1.00 0.00 H new ATOM 0 HG3 LYS A 128 18.959 -19.494 -28.252 1.00 0.00 H new ATOM 0 HD2 LYS A 128 21.566 -20.904 -27.834 1.00 0.00 H new ATOM 0 HD3 LYS A 128 20.150 -21.736 -27.221 1.00 0.00 H new ATOM 0 HE2 LYS A 128 19.132 -21.862 -29.374 1.00 0.00 H new ATOM 0 HE3 LYS A 128 20.131 -20.579 -30.028 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 20.861 -22.738 -30.801 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 22.065 -22.026 -29.839 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 21.097 -23.269 -29.205 1.00 0.00 H new ATOM 1606 N TYR A 129 22.101 -19.249 -25.117 1.00 0.00 N ATOM 1607 CA TYR A 129 23.181 -19.755 -24.286 1.00 0.00 C ATOM 1608 C TYR A 129 23.675 -21.110 -24.796 1.00 0.00 C ATOM 1609 O TYR A 129 23.006 -21.757 -25.601 1.00 0.00 O ATOM 1610 CB TYR A 129 22.587 -19.937 -22.888 1.00 0.00 C ATOM 1611 CG TYR A 129 23.021 -18.867 -21.883 1.00 0.00 C ATOM 1612 CD1 TYR A 129 22.528 -17.582 -21.988 1.00 0.00 C ATOM 1613 CD2 TYR A 129 23.906 -19.186 -20.875 1.00 0.00 C ATOM 1614 CE1 TYR A 129 22.936 -16.575 -21.043 1.00 0.00 C ATOM 1615 CE2 TYR A 129 24.314 -18.179 -19.930 1.00 0.00 C ATOM 1616 CZ TYR A 129 23.809 -16.924 -20.061 1.00 0.00 C ATOM 1617 OH TYR A 129 24.196 -15.972 -19.169 1.00 0.00 O ATOM 0 H TYR A 129 21.301 -19.875 -25.205 1.00 0.00 H new ATOM 0 HA TYR A 129 24.027 -19.068 -24.295 1.00 0.00 H new ATOM 0 HB2 TYR A 129 21.500 -19.931 -22.963 1.00 0.00 H new ATOM 0 HB3 TYR A 129 22.875 -20.917 -22.507 1.00 0.00 H new ATOM 0 HD1 TYR A 129 21.836 -17.332 -22.779 1.00 0.00 H new ATOM 0 HD2 TYR A 129 24.293 -20.191 -20.794 1.00 0.00 H new ATOM 0 HE1 TYR A 129 22.557 -15.566 -21.113 1.00 0.00 H new ATOM 0 HE2 TYR A 129 25.006 -18.416 -19.135 1.00 0.00 H new ATOM 0 HH TYR A 129 24.821 -16.363 -18.523 1.00 0.00 H new ATOM 1626 N ASP A 130 24.844 -21.499 -24.308 1.00 0.00 N ATOM 1627 CA ASP A 130 25.437 -22.766 -24.705 1.00 0.00 C ATOM 1628 C ASP A 130 25.987 -23.475 -23.467 1.00 0.00 C ATOM 1629 O ASP A 130 26.387 -22.827 -22.500 1.00 0.00 O ATOM 1630 CB ASP A 130 26.595 -22.549 -25.681 1.00 0.00 C ATOM 1631 CG ASP A 130 27.142 -23.824 -26.327 1.00 0.00 C ATOM 1632 OD1 ASP A 130 26.526 -24.886 -26.098 1.00 0.00 O ATOM 1633 OD2 ASP A 130 28.165 -23.707 -27.036 1.00 0.00 O ATOM 0 H ASP A 130 25.397 -20.960 -23.642 1.00 0.00 H new ATOM 0 HA ASP A 130 24.665 -23.364 -25.189 1.00 0.00 H new ATOM 0 HB2 ASP A 130 26.264 -21.873 -26.469 1.00 0.00 H new ATOM 0 HB3 ASP A 130 27.407 -22.050 -25.153 1.00 0.00 H new ATOM 1637 N LEU A 131 25.992 -24.799 -23.536 1.00 0.00 N ATOM 1638 CA LEU A 131 26.488 -25.604 -22.433 1.00 0.00 C ATOM 1639 C LEU A 131 26.470 -27.080 -22.836 1.00 0.00 C ATOM 1640 O LEU A 131 25.423 -27.726 -22.795 1.00 0.00 O ATOM 1641 CB LEU A 131 25.701 -25.306 -21.156 1.00 0.00 C ATOM 1642 CG LEU A 131 26.081 -26.130 -19.925 1.00 0.00 C ATOM 1643 CD1 LEU A 131 27.453 -25.714 -19.390 1.00 0.00 C ATOM 1644 CD2 LEU A 131 24.997 -26.044 -18.849 1.00 0.00 C ATOM 0 H LEU A 131 25.660 -25.334 -24.339 1.00 0.00 H new ATOM 0 HA LEU A 131 27.523 -25.347 -22.209 1.00 0.00 H new ATOM 0 HB2 LEU A 131 25.826 -24.250 -20.914 1.00 0.00 H new ATOM 0 HB3 LEU A 131 24.642 -25.463 -21.361 1.00 0.00 H new ATOM 0 HG LEU A 131 26.154 -27.176 -20.224 1.00 0.00 H new ATOM 0 HD11 LEU A 131 27.700 -26.315 -18.515 1.00 0.00 H new ATOM 0 HD12 LEU A 131 28.207 -25.870 -20.162 1.00 0.00 H new ATOM 0 HD13 LEU A 131 27.431 -24.660 -19.112 1.00 0.00 H new ATOM 0 HD21 LEU A 131 25.294 -26.639 -17.985 1.00 0.00 H new ATOM 0 HD22 LEU A 131 24.867 -25.005 -18.546 1.00 0.00 H new ATOM 0 HD23 LEU A 131 24.057 -26.426 -19.248 1.00 0.00 H new ATOM 1655 N HIS A 132 27.640 -27.571 -23.216 1.00 0.00 N ATOM 1656 CA HIS A 132 27.772 -28.958 -23.627 1.00 0.00 C ATOM 1657 C HIS A 132 29.199 -29.439 -23.359 1.00 0.00 C ATOM 1658 O HIS A 132 30.076 -28.642 -23.031 1.00 0.00 O ATOM 1659 CB HIS A 132 27.349 -29.136 -25.086 1.00 0.00 C ATOM 1660 CG HIS A 132 26.359 -30.254 -25.308 1.00 0.00 C ATOM 1661 ND1 HIS A 132 25.837 -30.556 -26.553 1.00 0.00 N ATOM 1662 CD2 HIS A 132 25.802 -31.138 -24.431 1.00 0.00 C ATOM 1663 CE1 HIS A 132 25.003 -31.578 -26.421 1.00 0.00 C ATOM 1664 NE2 HIS A 132 24.983 -31.937 -25.104 1.00 0.00 N ATOM 0 H HIS A 132 28.506 -27.033 -23.248 1.00 0.00 H new ATOM 0 HA HIS A 132 27.099 -29.581 -23.037 1.00 0.00 H new ATOM 0 HB2 HIS A 132 26.913 -28.203 -25.443 1.00 0.00 H new ATOM 0 HB3 HIS A 132 28.236 -29.325 -25.690 1.00 0.00 H new ATOM 0 HD2 HIS A 132 25.995 -31.181 -23.369 1.00 0.00 H new ATOM 0 HE1 HIS A 132 24.439 -32.044 -27.215 1.00 0.00 H new ATOM 0 HE2 HIS A 132 24.430 -32.694 -24.703 1.00 0.00 H new ATOM 1672 N TYR A 133 29.389 -30.742 -23.511 1.00 0.00 N ATOM 1673 CA TYR A 133 30.695 -31.338 -23.290 1.00 0.00 C ATOM 1674 C TYR A 133 31.052 -32.310 -24.417 1.00 0.00 C ATOM 1675 O TYR A 133 32.183 -32.317 -24.900 1.00 0.00 O ATOM 1676 CB TYR A 133 30.586 -32.118 -21.977 1.00 0.00 C ATOM 1677 CG TYR A 133 31.921 -32.304 -21.252 1.00 0.00 C ATOM 1678 CD1 TYR A 133 32.670 -31.202 -20.892 1.00 0.00 C ATOM 1679 CD2 TYR A 133 32.375 -33.573 -20.957 1.00 0.00 C ATOM 1680 CE1 TYR A 133 33.926 -31.377 -20.210 1.00 0.00 C ATOM 1681 CE2 TYR A 133 33.631 -33.748 -20.274 1.00 0.00 C ATOM 1682 CZ TYR A 133 34.344 -32.641 -19.935 1.00 0.00 C ATOM 1683 OH TYR A 133 35.529 -32.807 -19.289 1.00 0.00 O ATOM 0 H TYR A 133 28.660 -31.401 -23.784 1.00 0.00 H new ATOM 0 HA TYR A 133 31.467 -30.569 -23.258 1.00 0.00 H new ATOM 0 HB2 TYR A 133 29.893 -31.599 -21.314 1.00 0.00 H new ATOM 0 HB3 TYR A 133 30.156 -33.098 -22.183 1.00 0.00 H new ATOM 0 HD1 TYR A 133 32.314 -30.209 -21.122 1.00 0.00 H new ATOM 0 HD2 TYR A 133 31.789 -34.435 -21.238 1.00 0.00 H new ATOM 0 HE1 TYR A 133 34.522 -30.523 -19.923 1.00 0.00 H new ATOM 0 HE2 TYR A 133 33.998 -34.736 -20.037 1.00 0.00 H new ATOM 0 HH TYR A 133 35.699 -33.763 -19.158 1.00 0.00 H new TER 1692 TYR A 133