USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 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 49 THR OG1 : rot -58:sc= 1.01 USER MOD Set 1.2: A 61 ASN : amide:sc= -1.33 K(o=-0.31,f=-3.4!) USER MOD Single : A 16 SER OG : rot 56:sc= 1.16 USER MOD Single : A 18 MET CE :methyl -133:sc= -0.529 (180deg=-2.95!) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 THR OG1 : rot 180:sc= -0.12 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= -0.088 X(o=-0.088,f=-0.088) USER MOD Single : A 30 HIS : no HD1:sc= -3.69! K(o=-3.7!,f=-1.7) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0.00851 USER MOD Single : A 38 THR OG1 : rot 78:sc= 0.734 USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 GLN : amide:sc= -0.747 X(o=-0.75,f=-0.49) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HE2:sc= -1.67 K(o=-1.7,f=-7.4!) USER MOD Single : A 48 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= 0.0355 X(o=0.035,f=0) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 57 TYR OH : rot -146:sc= 1.28 USER MOD Single : A 58 THR OG1 : rot 81:sc= 1.15 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 62 THR OG1 : rot 54:sc= 0.187 USER MOD Single : A 63 THR OG1 : rot 180:sc= -0.131 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.796 X(o=-0.8,f=-0.65) USER MOD Single : A 74 SER OG : rot 136:sc= -0.234! USER MOD Single : A 87 TYR OH : rot 180:sc=-0.00463 USER MOD Single : A 89 ASN : amide:sc= -5.04! C(o=-5!,f=-8.8!) 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 94 ASN : amide:sc= -1.93 K(o=-1.9,f=-0.75) USER MOD Single : A 95 THR OG1 : rot 79:sc= -3.81! USER MOD Single : A 96 THR OG1 : rot -64:sc= 0.65 USER MOD Single : A 98 ASN : amide:sc= -2.01 X(o=-2,f=-2.3!) USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -1.24 USER MOD Single : A 111 SER OG : rot 42:sc= 0.0397 USER MOD Single : A 114 ASN : amide:sc= -15.1! C(o=-15!,f=-20!) USER MOD Single : A 115 TYR OH : rot -54:sc= -0.258 USER MOD Single : A 116 SER OG : rot -167:sc= 0.0032 USER MOD Single : A 117 HIS : no HD1:sc= -2.08! C(o=-2.1!,f=-2.1!) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.113 X(o=-0.11,f=-2.1e-05) 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= -0.115 X(o=-0.12,f=-0.28) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 29.073 -19.831 34.222 1.00 0.00 N ATOM 2 CA GLY A 15 29.509 -19.300 32.942 1.00 0.00 C ATOM 3 C GLY A 15 29.823 -20.429 31.959 1.00 0.00 C ATOM 4 O GLY A 15 30.554 -21.361 32.291 1.00 0.00 O ATOM 0 HA2 GLY A 15 28.732 -18.657 32.527 1.00 0.00 H new ATOM 0 HA3 GLY A 15 30.394 -18.680 33.084 1.00 0.00 H new ATOM 8 N SER A 16 29.256 -20.308 30.767 1.00 0.00 N ATOM 9 CA SER A 16 29.467 -21.306 29.733 1.00 0.00 C ATOM 10 C SER A 16 28.662 -20.944 28.484 1.00 0.00 C ATOM 11 O SER A 16 27.810 -20.056 28.526 1.00 0.00 O ATOM 12 CB SER A 16 29.080 -22.701 30.227 1.00 0.00 C ATOM 13 OG SER A 16 30.208 -23.433 30.699 1.00 0.00 O ATOM 0 H SER A 16 28.651 -19.534 30.495 1.00 0.00 H new ATOM 0 HA SER A 16 30.528 -21.320 29.483 1.00 0.00 H new ATOM 0 HB2 SER A 16 28.346 -22.611 31.027 1.00 0.00 H new ATOM 0 HB3 SER A 16 28.603 -23.253 29.417 1.00 0.00 H new ATOM 0 HG SER A 16 30.663 -22.918 31.398 1.00 0.00 H new ATOM 18 N GLY A 17 28.960 -21.648 27.401 1.00 0.00 N ATOM 19 CA GLY A 17 28.273 -21.411 26.142 1.00 0.00 C ATOM 20 C GLY A 17 27.590 -22.685 25.643 1.00 0.00 C ATOM 21 O GLY A 17 28.014 -23.274 24.650 1.00 0.00 O ATOM 0 H GLY A 17 29.667 -22.382 27.369 1.00 0.00 H new ATOM 0 HA2 GLY A 17 27.531 -20.623 26.271 1.00 0.00 H new ATOM 0 HA3 GLY A 17 28.985 -21.059 25.395 1.00 0.00 H new ATOM 25 N MET A 18 26.541 -23.073 26.354 1.00 0.00 N ATOM 26 CA MET A 18 25.793 -24.267 25.995 1.00 0.00 C ATOM 27 C MET A 18 24.287 -24.006 26.047 1.00 0.00 C ATOM 28 O MET A 18 23.854 -22.924 26.441 1.00 0.00 O ATOM 29 CB MET A 18 26.150 -25.401 26.958 1.00 0.00 C ATOM 30 CG MET A 18 25.703 -25.071 28.384 1.00 0.00 C ATOM 31 SD MET A 18 25.943 -26.488 29.443 1.00 0.00 S ATOM 32 CE MET A 18 24.831 -27.648 28.665 1.00 0.00 C ATOM 0 H MET A 18 26.191 -22.582 27.177 1.00 0.00 H new ATOM 0 HA MET A 18 26.058 -24.548 24.976 1.00 0.00 H new ATOM 0 HB2 MET A 18 25.675 -26.325 26.629 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.226 -25.572 26.941 1.00 0.00 H new ATOM 0 HG2 MET A 18 26.271 -24.222 28.765 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.653 -24.779 28.386 1.00 0.00 H new ATOM 0 HE1 MET A 18 24.219 -28.132 29.426 1.00 0.00 H new ATOM 0 HE2 MET A 18 24.186 -27.119 27.963 1.00 0.00 H new ATOM 0 HE3 MET A 18 25.408 -28.402 28.130 1.00 0.00 H new ATOM 40 N LYS A 19 23.530 -25.017 25.645 1.00 0.00 N ATOM 41 CA LYS A 19 22.080 -24.911 25.641 1.00 0.00 C ATOM 42 C LYS A 19 21.656 -23.822 24.654 1.00 0.00 C ATOM 43 O LYS A 19 21.998 -22.653 24.830 1.00 0.00 O ATOM 44 CB LYS A 19 21.556 -24.694 27.062 1.00 0.00 C ATOM 45 CG LYS A 19 21.313 -26.029 27.768 1.00 0.00 C ATOM 46 CD LYS A 19 20.052 -25.972 28.632 1.00 0.00 C ATOM 47 CE LYS A 19 19.565 -27.379 28.985 1.00 0.00 C ATOM 48 NZ LYS A 19 18.684 -27.339 30.174 1.00 0.00 N ATOM 0 H LYS A 19 23.893 -25.913 25.320 1.00 0.00 H new ATOM 0 HA LYS A 19 21.629 -25.843 25.299 1.00 0.00 H new ATOM 0 HB2 LYS A 19 22.273 -24.103 27.631 1.00 0.00 H new ATOM 0 HB3 LYS A 19 20.628 -24.123 27.028 1.00 0.00 H new ATOM 0 HG2 LYS A 19 21.215 -26.823 27.028 1.00 0.00 H new ATOM 0 HG3 LYS A 19 22.173 -26.277 28.390 1.00 0.00 H new ATOM 0 HD2 LYS A 19 20.258 -25.415 29.546 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.267 -25.434 28.101 1.00 0.00 H new ATOM 0 HE2 LYS A 19 19.026 -27.806 28.140 1.00 0.00 H new ATOM 0 HE3 LYS A 19 20.419 -28.028 29.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 18.362 -28.302 30.400 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 19.210 -26.951 30.983 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 17.860 -26.736 29.975 1.00 0.00 H new ATOM 58 N GLU A 20 20.917 -24.243 23.639 1.00 0.00 N ATOM 59 CA GLU A 20 20.441 -23.317 22.625 1.00 0.00 C ATOM 60 C GLU A 20 19.378 -23.987 21.752 1.00 0.00 C ATOM 61 O GLU A 20 19.570 -25.108 21.283 1.00 0.00 O ATOM 62 CB GLU A 20 21.601 -22.795 21.773 1.00 0.00 C ATOM 63 CG GLU A 20 21.630 -21.265 21.768 1.00 0.00 C ATOM 64 CD GLU A 20 22.634 -20.740 20.739 1.00 0.00 C ATOM 65 OE1 GLU A 20 23.717 -21.356 20.637 1.00 0.00 O ATOM 66 OE2 GLU A 20 22.295 -19.735 20.077 1.00 0.00 O ATOM 0 H GLU A 20 20.636 -25.213 23.496 1.00 0.00 H new ATOM 0 HA GLU A 20 19.986 -22.462 23.125 1.00 0.00 H new ATOM 0 HB2 GLU A 20 22.544 -23.179 22.161 1.00 0.00 H new ATOM 0 HB3 GLU A 20 21.502 -23.164 20.752 1.00 0.00 H new ATOM 0 HG2 GLU A 20 20.636 -20.879 21.541 1.00 0.00 H new ATOM 0 HG3 GLU A 20 21.895 -20.899 22.760 1.00 0.00 H new ATOM 71 N THR A 21 18.279 -23.272 21.560 1.00 0.00 N ATOM 72 CA THR A 21 17.186 -23.783 20.751 1.00 0.00 C ATOM 73 C THR A 21 16.605 -22.671 19.876 1.00 0.00 C ATOM 74 O THR A 21 16.827 -21.490 20.138 1.00 0.00 O ATOM 75 CB THR A 21 16.157 -24.414 21.692 1.00 0.00 C ATOM 76 OG1 THR A 21 15.211 -25.020 20.816 1.00 0.00 O ATOM 77 CG2 THR A 21 15.341 -23.368 22.455 1.00 0.00 C ATOM 0 H THR A 21 18.122 -22.343 21.951 1.00 0.00 H new ATOM 0 HA THR A 21 17.532 -24.551 20.060 1.00 0.00 H new ATOM 0 HB THR A 21 16.667 -25.065 22.402 1.00 0.00 H new ATOM 0 HG1 THR A 21 14.508 -25.455 21.343 1.00 0.00 H new ATOM 0 HG21 THR A 21 14.626 -23.869 23.108 1.00 0.00 H new ATOM 0 HG22 THR A 21 16.010 -22.751 23.055 1.00 0.00 H new ATOM 0 HG23 THR A 21 14.804 -22.737 21.746 1.00 0.00 H new ATOM 85 N ALA A 22 15.872 -23.087 18.854 1.00 0.00 N ATOM 86 CA ALA A 22 15.258 -22.142 17.938 1.00 0.00 C ATOM 87 C ALA A 22 13.765 -22.028 18.253 1.00 0.00 C ATOM 88 O ALA A 22 12.980 -22.898 17.879 1.00 0.00 O ATOM 89 CB ALA A 22 15.517 -22.585 16.497 1.00 0.00 C ATOM 0 H ALA A 22 15.689 -24.067 18.640 1.00 0.00 H new ATOM 0 HA ALA A 22 15.697 -21.152 18.059 1.00 0.00 H new ATOM 0 HB1 ALA A 22 15.056 -21.876 15.810 1.00 0.00 H new ATOM 0 HB2 ALA A 22 16.591 -22.621 16.315 1.00 0.00 H new ATOM 0 HB3 ALA A 22 15.089 -23.575 16.338 1.00 0.00 H new ATOM 95 N ALA A 23 13.418 -20.949 18.939 1.00 0.00 N ATOM 96 CA ALA A 23 12.033 -20.710 19.309 1.00 0.00 C ATOM 97 C ALA A 23 11.125 -21.068 18.129 1.00 0.00 C ATOM 98 O ALA A 23 11.490 -20.853 16.974 1.00 0.00 O ATOM 99 CB ALA A 23 11.866 -19.256 19.753 1.00 0.00 C ATOM 0 H ALA A 23 14.072 -20.230 19.248 1.00 0.00 H new ATOM 0 HA ALA A 23 11.746 -21.342 20.150 1.00 0.00 H new ATOM 0 HB1 ALA A 23 10.827 -19.077 20.030 1.00 0.00 H new ATOM 0 HB2 ALA A 23 12.509 -19.061 20.611 1.00 0.00 H new ATOM 0 HB3 ALA A 23 12.142 -18.592 18.934 1.00 0.00 H new ATOM 105 N ALA A 24 9.962 -21.606 18.461 1.00 0.00 N ATOM 106 CA ALA A 24 9.000 -21.995 17.444 1.00 0.00 C ATOM 107 C ALA A 24 8.134 -20.787 17.079 1.00 0.00 C ATOM 108 O ALA A 24 6.999 -20.671 17.539 1.00 0.00 O ATOM 109 CB ALA A 24 8.170 -23.175 17.951 1.00 0.00 C ATOM 0 H ALA A 24 9.663 -21.782 19.420 1.00 0.00 H new ATOM 0 HA ALA A 24 9.510 -22.321 16.538 1.00 0.00 H new ATOM 0 HB1 ALA A 24 7.448 -23.467 17.188 1.00 0.00 H new ATOM 0 HB2 ALA A 24 8.828 -24.016 18.168 1.00 0.00 H new ATOM 0 HB3 ALA A 24 7.641 -22.884 18.859 1.00 0.00 H new ATOM 115 N LYS A 25 8.702 -19.919 16.254 1.00 0.00 N ATOM 116 CA LYS A 25 7.997 -18.725 15.823 1.00 0.00 C ATOM 117 C LYS A 25 8.528 -18.291 14.455 1.00 0.00 C ATOM 118 O LYS A 25 9.644 -18.645 14.078 1.00 0.00 O ATOM 119 CB LYS A 25 8.086 -17.634 16.891 1.00 0.00 C ATOM 120 CG LYS A 25 6.720 -17.379 17.530 1.00 0.00 C ATOM 121 CD LYS A 25 6.580 -15.918 17.962 1.00 0.00 C ATOM 122 CE LYS A 25 5.257 -15.686 18.694 1.00 0.00 C ATOM 123 NZ LYS A 25 5.000 -14.237 18.854 1.00 0.00 N ATOM 0 H LYS A 25 9.643 -20.020 15.873 1.00 0.00 H new ATOM 0 HA LYS A 25 6.934 -18.934 15.702 1.00 0.00 H new ATOM 0 HB2 LYS A 25 8.801 -17.929 17.659 1.00 0.00 H new ATOM 0 HB3 LYS A 25 8.460 -16.713 16.444 1.00 0.00 H new ATOM 0 HG2 LYS A 25 5.931 -17.629 16.821 1.00 0.00 H new ATOM 0 HG3 LYS A 25 6.591 -18.031 18.394 1.00 0.00 H new ATOM 0 HD2 LYS A 25 7.412 -15.646 18.612 1.00 0.00 H new ATOM 0 HD3 LYS A 25 6.634 -15.270 17.087 1.00 0.00 H new ATOM 0 HE2 LYS A 25 4.441 -16.147 18.137 1.00 0.00 H new ATOM 0 HE3 LYS A 25 5.287 -16.166 19.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 4.098 -14.097 19.353 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 5.770 -13.807 19.404 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 4.951 -13.788 17.917 1.00 0.00 H new ATOM 133 N PHE A 26 7.703 -17.530 13.750 1.00 0.00 N ATOM 134 CA PHE A 26 8.076 -17.044 12.432 1.00 0.00 C ATOM 135 C PHE A 26 8.381 -15.545 12.466 1.00 0.00 C ATOM 136 O PHE A 26 7.992 -14.851 13.404 1.00 0.00 O ATOM 137 CB PHE A 26 6.880 -17.288 11.510 1.00 0.00 C ATOM 138 CG PHE A 26 5.538 -16.853 12.103 1.00 0.00 C ATOM 139 CD1 PHE A 26 5.297 -15.536 12.343 1.00 0.00 C ATOM 140 CD2 PHE A 26 4.588 -17.783 12.391 1.00 0.00 C ATOM 141 CE1 PHE A 26 4.051 -15.132 12.893 1.00 0.00 C ATOM 142 CE2 PHE A 26 3.343 -17.378 12.941 1.00 0.00 C ATOM 143 CZ PHE A 26 3.101 -16.061 13.180 1.00 0.00 C ATOM 0 H PHE A 26 6.778 -17.238 14.066 1.00 0.00 H new ATOM 0 HA PHE A 26 8.970 -17.562 12.084 1.00 0.00 H new ATOM 0 HB2 PHE A 26 7.042 -16.755 10.573 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.832 -18.350 11.268 1.00 0.00 H new ATOM 0 HD1 PHE A 26 6.052 -14.798 12.116 1.00 0.00 H new ATOM 0 HD2 PHE A 26 4.780 -18.829 12.201 1.00 0.00 H new ATOM 0 HE1 PHE A 26 3.858 -14.086 13.083 1.00 0.00 H new ATOM 0 HE2 PHE A 26 2.588 -18.116 13.170 1.00 0.00 H new ATOM 0 HZ PHE A 26 2.154 -15.753 13.598 1.00 0.00 H new ATOM 152 N GLU A 27 9.074 -15.091 11.433 1.00 0.00 N ATOM 153 CA GLU A 27 9.435 -13.687 11.333 1.00 0.00 C ATOM 154 C GLU A 27 8.178 -12.822 11.220 1.00 0.00 C ATOM 155 O GLU A 27 7.177 -13.248 10.645 1.00 0.00 O ATOM 156 CB GLU A 27 10.375 -13.445 10.149 1.00 0.00 C ATOM 157 CG GLU A 27 9.666 -13.721 8.822 1.00 0.00 C ATOM 158 CD GLU A 27 10.658 -13.701 7.657 1.00 0.00 C ATOM 159 OE1 GLU A 27 11.817 -14.106 7.891 1.00 0.00 O ATOM 160 OE2 GLU A 27 10.234 -13.282 6.557 1.00 0.00 O ATOM 0 H GLU A 27 9.395 -15.670 10.657 1.00 0.00 H new ATOM 0 HA GLU A 27 9.967 -13.404 12.241 1.00 0.00 H new ATOM 0 HB2 GLU A 27 10.732 -12.415 10.168 1.00 0.00 H new ATOM 0 HB3 GLU A 27 11.251 -14.087 10.238 1.00 0.00 H new ATOM 0 HG2 GLU A 27 9.170 -14.690 8.865 1.00 0.00 H new ATOM 0 HG3 GLU A 27 8.891 -12.973 8.657 1.00 0.00 H new ATOM 165 N ARG A 28 8.270 -11.624 11.778 1.00 0.00 N ATOM 166 CA ARG A 28 7.153 -10.696 11.746 1.00 0.00 C ATOM 167 C ARG A 28 7.656 -9.267 11.529 1.00 0.00 C ATOM 168 O ARG A 28 8.819 -8.968 11.793 1.00 0.00 O ATOM 169 CB ARG A 28 6.352 -10.755 13.049 1.00 0.00 C ATOM 170 CG ARG A 28 4.901 -10.330 12.820 1.00 0.00 C ATOM 171 CD ARG A 28 3.931 -11.318 13.474 1.00 0.00 C ATOM 172 NE ARG A 28 2.840 -11.655 12.533 1.00 0.00 N ATOM 173 CZ ARG A 28 1.849 -10.818 12.200 1.00 0.00 C ATOM 174 NH1 ARG A 28 1.804 -9.589 12.728 1.00 0.00 N ATOM 175 NH2 ARG A 28 0.902 -11.211 11.337 1.00 0.00 N ATOM 0 H ARG A 28 9.101 -11.275 12.255 1.00 0.00 H new ATOM 0 HA ARG A 28 6.504 -10.986 10.919 1.00 0.00 H new ATOM 0 HB2 ARG A 28 6.379 -11.768 13.451 1.00 0.00 H new ATOM 0 HB3 ARG A 28 6.812 -10.104 13.793 1.00 0.00 H new ATOM 0 HG2 ARG A 28 4.741 -9.333 13.230 1.00 0.00 H new ATOM 0 HG3 ARG A 28 4.700 -10.271 11.750 1.00 0.00 H new ATOM 0 HD2 ARG A 28 4.463 -12.223 13.766 1.00 0.00 H new ATOM 0 HD3 ARG A 28 3.516 -10.885 14.384 1.00 0.00 H new ATOM 0 HE ARG A 28 2.843 -12.584 12.111 1.00 0.00 H new ATOM 0 HH11 ARG A 28 2.525 -9.289 13.384 1.00 0.00 H new ATOM 0 HH12 ARG A 28 1.049 -8.952 12.474 1.00 0.00 H new ATOM 0 HH21 ARG A 28 0.936 -12.147 10.934 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.147 -10.574 11.083 1.00 0.00 H new ATOM 186 N GLN A 29 6.754 -8.424 11.048 1.00 0.00 N ATOM 187 CA GLN A 29 7.091 -7.034 10.792 1.00 0.00 C ATOM 188 C GLN A 29 6.914 -6.201 12.064 1.00 0.00 C ATOM 189 O GLN A 29 7.783 -5.406 12.416 1.00 0.00 O ATOM 190 CB GLN A 29 6.251 -6.468 9.645 1.00 0.00 C ATOM 191 CG GLN A 29 7.135 -5.761 8.615 1.00 0.00 C ATOM 192 CD GLN A 29 7.967 -4.658 9.272 1.00 0.00 C ATOM 193 OE1 GLN A 29 9.180 -4.742 9.382 1.00 0.00 O ATOM 194 NE2 GLN A 29 7.251 -3.623 9.701 1.00 0.00 N ATOM 0 H GLN A 29 5.790 -8.677 10.829 1.00 0.00 H new ATOM 0 HA GLN A 29 8.138 -6.984 10.491 1.00 0.00 H new ATOM 0 HB2 GLN A 29 5.698 -7.274 9.163 1.00 0.00 H new ATOM 0 HB3 GLN A 29 5.515 -5.768 10.040 1.00 0.00 H new ATOM 0 HG2 GLN A 29 7.796 -6.486 8.139 1.00 0.00 H new ATOM 0 HG3 GLN A 29 6.513 -5.333 7.829 1.00 0.00 H new ATOM 0 HE21 GLN A 29 6.239 -3.617 9.577 1.00 0.00 H new ATOM 0 HE22 GLN A 29 7.714 -2.835 10.154 1.00 0.00 H new ATOM 201 N HIS A 30 5.781 -6.413 12.718 1.00 0.00 N ATOM 202 CA HIS A 30 5.478 -5.691 13.943 1.00 0.00 C ATOM 203 C HIS A 30 5.471 -4.187 13.664 1.00 0.00 C ATOM 204 O HIS A 30 6.075 -3.729 12.695 1.00 0.00 O ATOM 205 CB HIS A 30 6.450 -6.083 15.057 1.00 0.00 C ATOM 206 CG HIS A 30 7.573 -5.097 15.269 1.00 0.00 C ATOM 207 ND1 HIS A 30 8.906 -5.430 15.099 1.00 0.00 N ATOM 208 CD2 HIS A 30 7.549 -3.783 15.635 1.00 0.00 C ATOM 209 CE1 HIS A 30 9.641 -4.358 15.356 1.00 0.00 C ATOM 210 NE2 HIS A 30 8.799 -3.339 15.689 1.00 0.00 N ATOM 0 H HIS A 30 5.062 -7.074 12.423 1.00 0.00 H new ATOM 0 HA HIS A 30 4.483 -5.964 14.295 1.00 0.00 H new ATOM 0 HB2 HIS A 30 5.894 -6.190 15.989 1.00 0.00 H new ATOM 0 HB3 HIS A 30 6.876 -7.059 14.826 1.00 0.00 H new ATOM 0 HD2 HIS A 30 6.663 -3.202 15.845 1.00 0.00 H new ATOM 0 HE1 HIS A 30 10.719 -4.301 15.310 1.00 0.00 H new ATOM 0 HE2 HIS A 30 9.083 -2.392 15.939 1.00 0.00 H new ATOM 217 N MET A 31 4.782 -3.460 14.531 1.00 0.00 N ATOM 218 CA MET A 31 4.687 -2.018 14.390 1.00 0.00 C ATOM 219 C MET A 31 5.044 -1.315 15.702 1.00 0.00 C ATOM 220 O MET A 31 4.684 -1.786 16.780 1.00 0.00 O ATOM 221 CB MET A 31 3.265 -1.636 13.976 1.00 0.00 C ATOM 222 CG MET A 31 2.972 -2.085 12.543 1.00 0.00 C ATOM 223 SD MET A 31 1.221 -1.970 12.213 1.00 0.00 S ATOM 224 CE MET A 31 1.210 -2.349 10.469 1.00 0.00 C ATOM 0 H MET A 31 4.284 -3.844 15.334 1.00 0.00 H new ATOM 0 HA MET A 31 5.394 -1.700 13.624 1.00 0.00 H new ATOM 0 HB2 MET A 31 2.548 -2.094 14.658 1.00 0.00 H new ATOM 0 HB3 MET A 31 3.137 -0.557 14.056 1.00 0.00 H new ATOM 0 HG2 MET A 31 3.525 -1.464 11.838 1.00 0.00 H new ATOM 0 HG3 MET A 31 3.311 -3.111 12.398 1.00 0.00 H new ATOM 0 HE1 MET A 31 0.186 -2.321 10.097 1.00 0.00 H new ATOM 0 HE2 MET A 31 1.811 -1.614 9.933 1.00 0.00 H new ATOM 0 HE3 MET A 31 1.626 -3.344 10.310 1.00 0.00 H new ATOM 232 N ASP A 32 5.745 -0.199 15.567 1.00 0.00 N ATOM 233 CA ASP A 32 6.153 0.574 16.728 1.00 0.00 C ATOM 234 C ASP A 32 5.899 2.059 16.462 1.00 0.00 C ATOM 235 O ASP A 32 6.520 2.920 17.084 1.00 0.00 O ATOM 236 CB ASP A 32 7.646 0.394 17.013 1.00 0.00 C ATOM 237 CG ASP A 32 7.970 -0.389 18.287 1.00 0.00 C ATOM 238 OD1 ASP A 32 7.249 -0.173 19.285 1.00 0.00 O ATOM 239 OD2 ASP A 32 8.933 -1.184 18.234 1.00 0.00 O ATOM 0 H ASP A 32 6.041 0.189 14.671 1.00 0.00 H new ATOM 0 HA ASP A 32 5.577 0.224 17.585 1.00 0.00 H new ATOM 0 HB2 ASP A 32 8.104 -0.115 16.165 1.00 0.00 H new ATOM 0 HB3 ASP A 32 8.109 1.378 17.082 1.00 0.00 H new ATOM 243 N SER A 33 4.985 2.314 15.538 1.00 0.00 N ATOM 244 CA SER A 33 4.640 3.680 15.182 1.00 0.00 C ATOM 245 C SER A 33 3.290 4.057 15.796 1.00 0.00 C ATOM 246 O SER A 33 2.472 3.186 16.086 1.00 0.00 O ATOM 247 CB SER A 33 4.601 3.861 13.663 1.00 0.00 C ATOM 248 OG SER A 33 4.206 2.667 12.993 1.00 0.00 O ATOM 0 H SER A 33 4.472 1.597 15.024 1.00 0.00 H new ATOM 0 HA SER A 33 5.410 4.341 15.580 1.00 0.00 H new ATOM 0 HB2 SER A 33 3.908 4.664 13.411 1.00 0.00 H new ATOM 0 HB3 SER A 33 5.586 4.167 13.309 1.00 0.00 H new ATOM 0 HG SER A 33 4.192 2.824 12.026 1.00 0.00 H new ATOM 253 N PRO A 34 3.095 5.390 15.980 1.00 0.00 N ATOM 254 CA PRO A 34 1.858 5.892 16.555 1.00 0.00 C ATOM 255 C PRO A 34 0.716 5.831 15.538 1.00 0.00 C ATOM 256 O PRO A 34 0.808 5.117 14.540 1.00 0.00 O ATOM 257 CB PRO A 34 2.180 7.310 17.001 1.00 0.00 C ATOM 258 CG PRO A 34 3.436 7.710 16.246 1.00 0.00 C ATOM 259 CD PRO A 34 4.041 6.450 15.648 1.00 0.00 C ATOM 0 HA PRO A 34 1.511 5.292 17.396 1.00 0.00 H new ATOM 0 HB2 PRO A 34 1.356 7.987 16.775 1.00 0.00 H new ATOM 0 HB3 PRO A 34 2.341 7.353 18.078 1.00 0.00 H new ATOM 0 HG2 PRO A 34 3.198 8.428 15.462 1.00 0.00 H new ATOM 0 HG3 PRO A 34 4.147 8.194 16.916 1.00 0.00 H new ATOM 0 HD2 PRO A 34 4.167 6.545 14.569 1.00 0.00 H new ATOM 0 HD3 PRO A 34 5.026 6.247 16.067 1.00 0.00 H new ATOM 264 N ASP A 35 -0.332 6.587 15.827 1.00 0.00 N ATOM 265 CA ASP A 35 -1.490 6.626 14.950 1.00 0.00 C ATOM 266 C ASP A 35 -1.767 8.075 14.542 1.00 0.00 C ATOM 267 O ASP A 35 -1.928 8.945 15.397 1.00 0.00 O ATOM 268 CB ASP A 35 -2.736 6.089 15.658 1.00 0.00 C ATOM 269 CG ASP A 35 -2.465 5.032 16.731 1.00 0.00 C ATOM 270 OD1 ASP A 35 -1.671 4.113 16.433 1.00 0.00 O ATOM 271 OD2 ASP A 35 -3.057 5.167 17.824 1.00 0.00 O ATOM 0 H ASP A 35 -0.404 7.177 16.656 1.00 0.00 H new ATOM 0 HA ASP A 35 -1.274 6.007 14.079 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.263 6.925 16.118 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -3.405 5.663 14.910 1.00 0.00 H new ATOM 275 N LEU A 36 -1.812 8.289 13.235 1.00 0.00 N ATOM 276 CA LEU A 36 -2.065 9.617 12.703 1.00 0.00 C ATOM 277 C LEU A 36 -2.842 9.497 11.391 1.00 0.00 C ATOM 278 O LEU A 36 -4.064 9.640 11.373 1.00 0.00 O ATOM 279 CB LEU A 36 -0.758 10.401 12.574 1.00 0.00 C ATOM 280 CG LEU A 36 0.009 10.647 13.876 1.00 0.00 C ATOM 281 CD1 LEU A 36 1.411 11.190 13.592 1.00 0.00 C ATOM 282 CD2 LEU A 36 -0.782 11.561 14.813 1.00 0.00 C ATOM 0 H LEU A 36 -1.678 7.565 12.529 1.00 0.00 H new ATOM 0 HA LEU A 36 -2.687 10.190 13.391 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -0.103 9.867 11.886 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -0.980 11.366 12.119 1.00 0.00 H new ATOM 0 HG LEU A 36 0.132 9.692 14.387 1.00 0.00 H new ATOM 0 HD11 LEU A 36 1.934 11.356 14.534 1.00 0.00 H new ATOM 0 HD12 LEU A 36 1.965 10.469 12.991 1.00 0.00 H new ATOM 0 HD13 LEU A 36 1.333 12.132 13.049 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -0.215 11.720 15.730 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -0.957 12.519 14.324 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -1.738 11.096 15.053 1.00 0.00 H new ATOM 293 N GLY A 37 -2.102 9.234 10.324 1.00 0.00 N ATOM 294 CA GLY A 37 -2.706 9.093 9.010 1.00 0.00 C ATOM 295 C GLY A 37 -3.799 10.142 8.794 1.00 0.00 C ATOM 296 O GLY A 37 -4.972 9.800 8.648 1.00 0.00 O ATOM 0 H GLY A 37 -1.089 9.115 10.343 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -1.941 9.196 8.241 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -3.130 8.094 8.906 1.00 0.00 H new ATOM 300 N THR A 38 -3.376 11.397 8.780 1.00 0.00 N ATOM 301 CA THR A 38 -4.304 12.498 8.583 1.00 0.00 C ATOM 302 C THR A 38 -3.726 13.513 7.595 1.00 0.00 C ATOM 303 O THR A 38 -4.015 14.705 7.684 1.00 0.00 O ATOM 304 CB THR A 38 -4.622 13.098 9.954 1.00 0.00 C ATOM 305 OG1 THR A 38 -5.358 12.074 10.618 1.00 0.00 O ATOM 306 CG2 THR A 38 -5.604 14.267 9.867 1.00 0.00 C ATOM 0 H THR A 38 -2.403 11.676 8.902 1.00 0.00 H new ATOM 0 HA THR A 38 -5.237 12.154 8.138 1.00 0.00 H new ATOM 0 HB THR A 38 -3.699 13.434 10.427 1.00 0.00 H new ATOM 0 HG1 THR A 38 -4.741 11.386 10.943 1.00 0.00 H new ATOM 0 HG21 THR A 38 -5.796 14.656 10.867 1.00 0.00 H new ATOM 0 HG22 THR A 38 -5.177 15.055 9.246 1.00 0.00 H new ATOM 0 HG23 THR A 38 -6.540 13.924 9.426 1.00 0.00 H new ATOM 314 N THR A 39 -2.919 13.003 6.676 1.00 0.00 N ATOM 315 CA THR A 39 -2.297 13.850 5.673 1.00 0.00 C ATOM 316 C THR A 39 -1.695 12.997 4.554 1.00 0.00 C ATOM 317 O THR A 39 -0.476 12.876 4.448 1.00 0.00 O ATOM 318 CB THR A 39 -1.271 14.742 6.376 1.00 0.00 C ATOM 319 OG1 THR A 39 -0.829 15.633 5.356 1.00 0.00 O ATOM 320 CG2 THR A 39 -0.007 13.977 6.776 1.00 0.00 C ATOM 0 H THR A 39 -2.682 12.014 6.605 1.00 0.00 H new ATOM 0 HA THR A 39 -3.031 14.494 5.189 1.00 0.00 H new ATOM 0 HB THR A 39 -1.723 15.186 7.263 1.00 0.00 H new ATOM 0 HG1 THR A 39 -0.162 16.249 5.726 1.00 0.00 H new ATOM 0 HG21 THR A 39 0.688 14.656 7.271 1.00 0.00 H new ATOM 0 HG22 THR A 39 -0.271 13.168 7.457 1.00 0.00 H new ATOM 0 HG23 THR A 39 0.464 13.561 5.885 1.00 0.00 H new ATOM 328 N LEU A 40 -2.578 12.427 3.747 1.00 0.00 N ATOM 329 CA LEU A 40 -2.149 11.590 2.639 1.00 0.00 C ATOM 330 C LEU A 40 -1.145 12.361 1.782 1.00 0.00 C ATOM 331 O LEU A 40 -0.917 13.549 2.003 1.00 0.00 O ATOM 332 CB LEU A 40 -3.360 11.076 1.857 1.00 0.00 C ATOM 333 CG LEU A 40 -4.097 12.111 1.006 1.00 0.00 C ATOM 334 CD1 LEU A 40 -4.430 11.547 -0.378 1.00 0.00 C ATOM 335 CD2 LEU A 40 -5.342 12.629 1.728 1.00 0.00 C ATOM 0 H LEU A 40 -3.589 12.528 3.838 1.00 0.00 H new ATOM 0 HA LEU A 40 -1.636 10.702 3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.030 10.267 1.205 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -4.069 10.646 2.565 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.434 12.963 0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.954 12.303 -0.963 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.508 11.268 -0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.065 10.668 -0.269 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.847 13.363 1.101 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -6.018 11.798 1.930 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.049 13.095 2.669 1.00 0.00 H new ATOM 346 N LEU A 41 -0.570 11.653 0.820 1.00 0.00 N ATOM 347 CA LEU A 41 0.406 12.256 -0.072 1.00 0.00 C ATOM 348 C LEU A 41 -0.145 12.254 -1.499 1.00 0.00 C ATOM 349 O LEU A 41 0.550 12.641 -2.437 1.00 0.00 O ATOM 350 CB LEU A 41 1.761 11.559 0.066 1.00 0.00 C ATOM 351 CG LEU A 41 1.778 10.061 -0.246 1.00 0.00 C ATOM 352 CD1 LEU A 41 2.436 9.789 -1.599 1.00 0.00 C ATOM 353 CD2 LEU A 41 2.446 9.274 0.885 1.00 0.00 C ATOM 0 H LEU A 41 -0.762 10.668 0.639 1.00 0.00 H new ATOM 0 HA LEU A 41 0.581 13.297 0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 41 2.472 12.056 -0.594 1.00 0.00 H new ATOM 0 HB3 LEU A 41 2.119 11.702 1.086 1.00 0.00 H new ATOM 0 HG LEU A 41 0.747 9.715 -0.315 1.00 0.00 H new ATOM 0 HD11 LEU A 41 2.435 8.717 -1.795 1.00 0.00 H new ATOM 0 HD12 LEU A 41 1.880 10.302 -2.384 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.463 10.154 -1.584 1.00 0.00 H new ATOM 0 HD21 LEU A 41 2.445 8.212 0.639 1.00 0.00 H new ATOM 0 HD22 LEU A 41 3.473 9.617 1.010 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.896 9.432 1.813 1.00 0.00 H new ATOM 364 N GLU A 42 -1.389 11.815 -1.618 1.00 0.00 N ATOM 365 CA GLU A 42 -2.042 11.757 -2.915 1.00 0.00 C ATOM 366 C GLU A 42 -2.999 12.940 -3.081 1.00 0.00 C ATOM 367 O GLU A 42 -3.830 12.948 -3.987 1.00 0.00 O ATOM 368 CB GLU A 42 -2.775 10.428 -3.102 1.00 0.00 C ATOM 369 CG GLU A 42 -2.318 9.724 -4.381 1.00 0.00 C ATOM 370 CD GLU A 42 -2.678 10.549 -5.619 1.00 0.00 C ATOM 371 OE1 GLU A 42 -3.808 10.359 -6.119 1.00 0.00 O ATOM 372 OE2 GLU A 42 -1.816 11.350 -6.039 1.00 0.00 O ATOM 0 H GLU A 42 -1.963 11.496 -0.837 1.00 0.00 H new ATOM 0 HA GLU A 42 -1.276 11.823 -3.688 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -2.591 9.783 -2.242 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -3.850 10.604 -3.144 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -1.240 9.564 -4.347 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.785 8.741 -4.446 1.00 0.00 H new ATOM 377 N GLN A 43 -2.850 13.910 -2.191 1.00 0.00 N ATOM 378 CA GLN A 43 -3.691 15.094 -2.226 1.00 0.00 C ATOM 379 C GLN A 43 -5.124 14.716 -2.604 1.00 0.00 C ATOM 380 O GLN A 43 -5.570 14.990 -3.717 1.00 0.00 O ATOM 381 CB GLN A 43 -3.127 16.137 -3.193 1.00 0.00 C ATOM 382 CG GLN A 43 -1.852 16.771 -2.632 1.00 0.00 C ATOM 383 CD GLN A 43 -2.124 17.456 -1.291 1.00 0.00 C ATOM 384 OE1 GLN A 43 -2.592 18.581 -1.223 1.00 0.00 O ATOM 385 NE2 GLN A 43 -1.804 16.718 -0.232 1.00 0.00 N ATOM 0 H GLN A 43 -2.159 13.900 -1.441 1.00 0.00 H new ATOM 0 HA GLN A 43 -3.703 15.537 -1.230 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -2.913 15.669 -4.154 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -3.873 16.911 -3.375 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -1.087 16.005 -2.505 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -1.460 17.498 -3.343 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -1.416 15.783 -0.360 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -1.947 17.087 0.708 1.00 0.00 H new ATOM 392 N TYR A 44 -5.807 14.092 -1.654 1.00 0.00 N ATOM 393 CA TYR A 44 -7.181 13.673 -1.873 1.00 0.00 C ATOM 394 C TYR A 44 -7.256 12.562 -2.921 1.00 0.00 C ATOM 395 O TYR A 44 -7.346 12.836 -4.118 1.00 0.00 O ATOM 396 CB TYR A 44 -7.919 14.905 -2.401 1.00 0.00 C ATOM 397 CG TYR A 44 -7.455 16.223 -1.777 1.00 0.00 C ATOM 398 CD1 TYR A 44 -7.339 16.334 -0.406 1.00 0.00 C ATOM 399 CD2 TYR A 44 -7.155 17.302 -2.584 1.00 0.00 C ATOM 400 CE1 TYR A 44 -6.903 17.573 0.182 1.00 0.00 C ATOM 401 CE2 TYR A 44 -6.719 18.542 -1.996 1.00 0.00 C ATOM 402 CZ TYR A 44 -6.615 18.617 -0.642 1.00 0.00 C ATOM 403 OH TYR A 44 -6.203 19.788 -0.086 1.00 0.00 O ATOM 0 H TYR A 44 -5.434 13.867 -0.732 1.00 0.00 H new ATOM 0 HA TYR A 44 -7.615 13.288 -0.950 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -7.787 14.960 -3.482 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -8.986 14.783 -2.216 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -7.576 15.491 0.226 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -7.247 17.216 -3.657 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -6.807 17.672 1.253 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -6.480 19.393 -2.616 1.00 0.00 H new ATOM 0 HH TYR A 44 -6.032 20.444 -0.794 1.00 0.00 H new ATOM 412 N CYS A 45 -7.215 11.330 -2.435 1.00 0.00 N ATOM 413 CA CYS A 45 -7.276 10.175 -3.315 1.00 0.00 C ATOM 414 C CYS A 45 -8.733 9.968 -3.734 1.00 0.00 C ATOM 415 O CYS A 45 -9.443 9.155 -3.144 1.00 0.00 O ATOM 416 CB CYS A 45 -6.690 8.927 -2.652 1.00 0.00 C ATOM 417 SG CYS A 45 -5.118 8.339 -3.379 1.00 0.00 S ATOM 0 H CYS A 45 -7.140 11.106 -1.443 1.00 0.00 H new ATOM 0 HA CYS A 45 -6.666 10.356 -4.200 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -6.529 9.136 -1.594 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -7.424 8.123 -2.710 1.00 0.00 H new ATOM 421 N HIS A 46 -9.135 10.717 -4.751 1.00 0.00 N ATOM 422 CA HIS A 46 -10.494 10.625 -5.257 1.00 0.00 C ATOM 423 C HIS A 46 -10.679 11.610 -6.413 1.00 0.00 C ATOM 424 O HIS A 46 -10.174 12.731 -6.365 1.00 0.00 O ATOM 425 CB HIS A 46 -11.508 10.837 -4.130 1.00 0.00 C ATOM 426 CG HIS A 46 -12.674 9.877 -4.166 1.00 0.00 C ATOM 427 ND1 HIS A 46 -13.099 9.172 -3.054 1.00 0.00 N ATOM 428 CD2 HIS A 46 -13.500 9.515 -5.190 1.00 0.00 C ATOM 429 CE1 HIS A 46 -14.134 8.422 -3.404 1.00 0.00 C ATOM 430 NE2 HIS A 46 -14.379 8.636 -4.728 1.00 0.00 N ATOM 0 H HIS A 46 -8.543 11.390 -5.238 1.00 0.00 H new ATOM 0 HA HIS A 46 -10.674 9.623 -5.647 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -10.998 10.737 -3.172 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -11.888 11.857 -4.184 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -12.686 9.221 -2.123 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -13.447 9.882 -6.204 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -14.686 7.758 -2.755 1.00 0.00 H new ATOM 437 N ARG A 47 -11.404 11.156 -7.424 1.00 0.00 N ATOM 438 CA ARG A 47 -11.662 11.983 -8.591 1.00 0.00 C ATOM 439 C ARG A 47 -13.168 12.165 -8.790 1.00 0.00 C ATOM 440 O ARG A 47 -13.644 13.287 -8.955 1.00 0.00 O ATOM 441 CB ARG A 47 -11.059 11.360 -9.852 1.00 0.00 C ATOM 442 CG ARG A 47 -11.604 9.948 -10.079 1.00 0.00 C ATOM 443 CD ARG A 47 -10.788 9.212 -11.144 1.00 0.00 C ATOM 444 NE ARG A 47 -11.046 9.801 -12.477 1.00 0.00 N ATOM 445 CZ ARG A 47 -10.203 9.709 -13.515 1.00 0.00 C ATOM 446 NH1 ARG A 47 -9.044 9.051 -13.380 1.00 0.00 N ATOM 447 NH2 ARG A 47 -10.519 10.275 -14.688 1.00 0.00 N ATOM 0 H ARG A 47 -11.821 10.226 -7.460 1.00 0.00 H new ATOM 0 HA ARG A 47 -11.195 12.953 -8.420 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.287 11.985 -10.716 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.973 11.325 -9.761 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.577 9.389 -9.144 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -12.648 10.002 -10.388 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.726 9.276 -10.909 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -11.050 8.154 -11.148 1.00 0.00 H new ATOM 0 HE ARG A 47 -11.920 10.309 -12.614 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -8.803 8.620 -12.487 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -8.402 8.981 -14.170 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -11.401 10.776 -14.791 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -9.877 10.205 -15.478 1.00 0.00 H new ATOM 458 N THR A 48 -13.875 11.045 -8.768 1.00 0.00 N ATOM 459 CA THR A 48 -15.317 11.067 -8.944 1.00 0.00 C ATOM 460 C THR A 48 -15.889 9.652 -8.837 1.00 0.00 C ATOM 461 O THR A 48 -16.933 9.446 -8.217 1.00 0.00 O ATOM 462 CB THR A 48 -15.620 11.746 -10.282 1.00 0.00 C ATOM 463 OG1 THR A 48 -17.019 11.547 -10.463 1.00 0.00 O ATOM 464 CG2 THR A 48 -14.983 11.015 -11.465 1.00 0.00 C ATOM 0 H THR A 48 -13.476 10.116 -8.631 1.00 0.00 H new ATOM 0 HA THR A 48 -15.803 11.641 -8.155 1.00 0.00 H new ATOM 0 HB THR A 48 -15.263 12.776 -10.256 1.00 0.00 H new ATOM 0 HG1 THR A 48 -17.301 11.958 -11.307 1.00 0.00 H new ATOM 0 HG21 THR A 48 -15.228 11.537 -12.390 1.00 0.00 H new ATOM 0 HG22 THR A 48 -13.901 10.991 -11.338 1.00 0.00 H new ATOM 0 HG23 THR A 48 -15.366 9.995 -11.511 1.00 0.00 H new ATOM 472 N THR A 49 -15.181 8.714 -9.450 1.00 0.00 N ATOM 473 CA THR A 49 -15.607 7.325 -9.431 1.00 0.00 C ATOM 474 C THR A 49 -17.099 7.219 -9.748 1.00 0.00 C ATOM 475 O THR A 49 -17.863 6.649 -8.973 1.00 0.00 O ATOM 476 CB THR A 49 -15.231 6.735 -8.071 1.00 0.00 C ATOM 477 OG1 THR A 49 -15.796 5.426 -8.092 1.00 0.00 O ATOM 478 CG2 THR A 49 -15.948 7.432 -6.912 1.00 0.00 C ATOM 0 H THR A 49 -14.316 8.889 -9.962 1.00 0.00 H new ATOM 0 HA THR A 49 -15.102 6.746 -10.204 1.00 0.00 H new ATOM 0 HB THR A 49 -14.153 6.810 -7.928 1.00 0.00 H new ATOM 0 HG1 THR A 49 -16.762 5.489 -8.246 1.00 0.00 H new ATOM 0 HG21 THR A 49 -15.646 6.975 -5.970 1.00 0.00 H new ATOM 0 HG22 THR A 49 -15.684 8.489 -6.904 1.00 0.00 H new ATOM 0 HG23 THR A 49 -17.026 7.329 -7.036 1.00 0.00 H new ATOM 486 N ILE A 50 -17.469 7.778 -10.891 1.00 0.00 N ATOM 487 CA ILE A 50 -18.857 7.752 -11.322 1.00 0.00 C ATOM 488 C ILE A 50 -19.753 8.190 -10.162 1.00 0.00 C ATOM 489 O ILE A 50 -20.391 7.358 -9.518 1.00 0.00 O ATOM 490 CB ILE A 50 -19.216 6.380 -11.894 1.00 0.00 C ATOM 491 CG1 ILE A 50 -18.447 6.107 -13.188 1.00 0.00 C ATOM 492 CG2 ILE A 50 -20.728 6.244 -12.086 1.00 0.00 C ATOM 493 CD1 ILE A 50 -17.647 4.806 -13.086 1.00 0.00 C ATOM 0 H ILE A 50 -16.832 8.252 -11.532 1.00 0.00 H new ATOM 0 HA ILE A 50 -19.018 8.460 -12.135 1.00 0.00 H new ATOM 0 HB ILE A 50 -18.914 5.620 -11.173 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -19.144 6.045 -14.024 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -17.773 6.938 -13.397 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -20.956 5.259 -12.494 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -21.229 6.364 -11.125 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -21.078 7.012 -12.776 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -17.110 4.635 -14.019 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -16.934 4.881 -12.265 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -18.327 3.974 -12.902 1.00 0.00 H new ATOM 504 N GLY A 51 -19.773 9.494 -9.930 1.00 0.00 N ATOM 505 CA GLY A 51 -20.582 10.052 -8.859 1.00 0.00 C ATOM 506 C GLY A 51 -19.932 9.804 -7.496 1.00 0.00 C ATOM 507 O GLY A 51 -18.950 10.457 -7.145 1.00 0.00 O ATOM 0 H GLY A 51 -19.242 10.181 -10.465 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -20.710 11.123 -9.015 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -21.576 9.606 -8.879 1.00 0.00 H new ATOM 511 N ASN A 52 -20.505 8.859 -6.766 1.00 0.00 N ATOM 512 CA ASN A 52 -19.995 8.517 -5.449 1.00 0.00 C ATOM 513 C ASN A 52 -20.812 7.359 -4.874 1.00 0.00 C ATOM 514 O ASN A 52 -20.263 6.467 -4.229 1.00 0.00 O ATOM 515 CB ASN A 52 -20.111 9.702 -4.488 1.00 0.00 C ATOM 516 CG ASN A 52 -18.813 9.904 -3.705 1.00 0.00 C ATOM 517 OD1 ASN A 52 -18.578 9.295 -2.674 1.00 0.00 O ATOM 518 ND2 ASN A 52 -17.985 10.790 -4.251 1.00 0.00 N ATOM 0 H ASN A 52 -21.318 8.319 -7.062 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.946 8.241 -5.556 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -20.346 10.607 -5.048 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -20.935 9.533 -3.795 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -17.091 10.995 -3.805 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -18.244 11.264 -5.116 1.00 0.00 H new ATOM 524 N PHE A 53 -22.111 7.411 -5.128 1.00 0.00 N ATOM 525 CA PHE A 53 -23.011 6.377 -4.645 1.00 0.00 C ATOM 526 C PHE A 53 -22.940 5.131 -5.530 1.00 0.00 C ATOM 527 O PHE A 53 -23.971 4.597 -5.938 1.00 0.00 O ATOM 528 CB PHE A 53 -24.427 6.952 -4.705 1.00 0.00 C ATOM 529 CG PHE A 53 -25.057 6.909 -6.098 1.00 0.00 C ATOM 530 CD1 PHE A 53 -24.698 7.826 -7.036 1.00 0.00 C ATOM 531 CD2 PHE A 53 -25.977 5.953 -6.399 1.00 0.00 C ATOM 532 CE1 PHE A 53 -25.283 7.786 -8.329 1.00 0.00 C ATOM 533 CE2 PHE A 53 -26.561 5.913 -7.692 1.00 0.00 C ATOM 534 CZ PHE A 53 -26.202 6.831 -8.630 1.00 0.00 C ATOM 0 H PHE A 53 -22.562 8.153 -5.662 1.00 0.00 H new ATOM 0 HA PHE A 53 -22.734 6.086 -3.632 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -25.062 6.399 -4.013 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -24.403 7.986 -4.360 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -23.968 8.585 -6.797 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -26.263 5.225 -5.654 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -24.998 8.515 -9.073 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -27.291 5.154 -7.931 1.00 0.00 H new ATOM 0 HZ PHE A 53 -26.647 6.801 -9.613 1.00 0.00 H new ATOM 543 N SER A 54 -21.715 4.704 -5.799 1.00 0.00 N ATOM 544 CA SER A 54 -21.497 3.530 -6.628 1.00 0.00 C ATOM 545 C SER A 54 -21.972 3.803 -8.057 1.00 0.00 C ATOM 546 O SER A 54 -22.368 4.922 -8.379 1.00 0.00 O ATOM 547 CB SER A 54 -22.217 2.308 -6.053 1.00 0.00 C ATOM 548 OG SER A 54 -21.723 1.955 -4.765 1.00 0.00 O ATOM 0 H SER A 54 -20.863 5.150 -5.458 1.00 0.00 H new ATOM 0 HA SER A 54 -20.429 3.315 -6.642 1.00 0.00 H new ATOM 0 HB2 SER A 54 -23.285 2.514 -5.988 1.00 0.00 H new ATOM 0 HB3 SER A 54 -22.096 1.464 -6.732 1.00 0.00 H new ATOM 0 HG SER A 54 -22.209 1.172 -4.432 1.00 0.00 H new ATOM 553 N GLY A 55 -21.918 2.761 -8.873 1.00 0.00 N ATOM 554 CA GLY A 55 -22.338 2.875 -10.260 1.00 0.00 C ATOM 555 C GLY A 55 -21.864 1.671 -11.076 1.00 0.00 C ATOM 556 O GLY A 55 -22.051 0.527 -10.667 1.00 0.00 O ATOM 0 H GLY A 55 -21.590 1.834 -8.601 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -23.424 2.948 -10.310 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -21.937 3.792 -10.691 1.00 0.00 H new ATOM 560 N PRO A 56 -21.244 1.979 -12.247 1.00 0.00 N ATOM 561 CA PRO A 56 -20.741 0.935 -13.125 1.00 0.00 C ATOM 562 C PRO A 56 -19.457 0.320 -12.566 1.00 0.00 C ATOM 563 O PRO A 56 -19.446 -0.842 -12.165 1.00 0.00 O ATOM 564 CB PRO A 56 -20.538 1.616 -14.469 1.00 0.00 C ATOM 565 CG PRO A 56 -20.491 3.108 -14.177 1.00 0.00 C ATOM 566 CD PRO A 56 -21.005 3.323 -12.763 1.00 0.00 C ATOM 0 HA PRO A 56 -21.430 0.096 -13.219 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -19.614 1.281 -14.941 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -21.351 1.378 -15.155 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -19.473 3.484 -14.274 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -21.103 3.657 -14.893 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -20.276 3.857 -12.154 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -21.919 3.917 -12.760 1.00 0.00 H new ATOM 571 N TYR A 57 -18.407 1.128 -12.557 1.00 0.00 N ATOM 572 CA TYR A 57 -17.120 0.678 -12.054 1.00 0.00 C ATOM 573 C TYR A 57 -16.655 -0.582 -12.788 1.00 0.00 C ATOM 574 O TYR A 57 -17.407 -1.164 -13.568 1.00 0.00 O ATOM 575 CB TYR A 57 -17.339 0.341 -10.578 1.00 0.00 C ATOM 576 CG TYR A 57 -16.081 -0.147 -9.858 1.00 0.00 C ATOM 577 CD1 TYR A 57 -15.022 0.715 -9.659 1.00 0.00 C ATOM 578 CD2 TYR A 57 -16.005 -1.449 -9.408 1.00 0.00 C ATOM 579 CE1 TYR A 57 -13.837 0.256 -8.980 1.00 0.00 C ATOM 580 CE2 TYR A 57 -14.820 -1.909 -8.729 1.00 0.00 C ATOM 581 CZ TYR A 57 -13.794 -1.034 -8.550 1.00 0.00 C ATOM 582 OH TYR A 57 -12.676 -1.468 -7.910 1.00 0.00 O ATOM 0 H TYR A 57 -18.421 2.092 -12.890 1.00 0.00 H new ATOM 0 HA TYR A 57 -16.361 1.446 -12.200 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -17.718 1.226 -10.066 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -18.110 -0.426 -10.502 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -15.081 1.734 -10.012 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -16.834 -2.124 -9.565 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -13.002 0.921 -8.816 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -14.748 -2.925 -8.370 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.519 -2.410 -8.129 1.00 0.00 H new ATOM 591 N THR A 58 -15.418 -0.965 -12.512 1.00 0.00 N ATOM 592 CA THR A 58 -14.843 -2.145 -13.137 1.00 0.00 C ATOM 593 C THR A 58 -13.319 -2.134 -12.997 1.00 0.00 C ATOM 594 O THR A 58 -12.683 -3.186 -13.018 1.00 0.00 O ATOM 595 CB THR A 58 -15.320 -2.191 -14.590 1.00 0.00 C ATOM 596 OG1 THR A 58 -16.406 -3.113 -14.570 1.00 0.00 O ATOM 597 CG2 THR A 58 -14.296 -2.841 -15.522 1.00 0.00 C ATOM 0 H THR A 58 -14.797 -0.480 -11.864 1.00 0.00 H new ATOM 0 HA THR A 58 -15.177 -3.057 -12.642 1.00 0.00 H new ATOM 0 HB THR A 58 -15.533 -1.179 -14.934 1.00 0.00 H new ATOM 0 HG1 THR A 58 -17.216 -2.658 -14.258 1.00 0.00 H new ATOM 0 HG21 THR A 58 -14.684 -2.848 -16.541 1.00 0.00 H new ATOM 0 HG22 THR A 58 -13.366 -2.274 -15.492 1.00 0.00 H new ATOM 0 HG23 THR A 58 -14.108 -3.865 -15.198 1.00 0.00 H new ATOM 605 N TYR A 59 -12.779 -0.932 -12.859 1.00 0.00 N ATOM 606 CA TYR A 59 -11.342 -0.770 -12.717 1.00 0.00 C ATOM 607 C TYR A 59 -10.969 -0.431 -11.273 1.00 0.00 C ATOM 608 O TYR A 59 -11.772 0.144 -10.539 1.00 0.00 O ATOM 609 CB TYR A 59 -10.958 0.404 -13.619 1.00 0.00 C ATOM 610 CG TYR A 59 -11.850 1.637 -13.449 1.00 0.00 C ATOM 611 CD1 TYR A 59 -13.000 1.765 -14.200 1.00 0.00 C ATOM 612 CD2 TYR A 59 -11.502 2.620 -12.544 1.00 0.00 C ATOM 613 CE1 TYR A 59 -13.838 2.925 -14.040 1.00 0.00 C ATOM 614 CE2 TYR A 59 -12.341 3.779 -12.383 1.00 0.00 C ATOM 615 CZ TYR A 59 -13.467 3.874 -13.139 1.00 0.00 C ATOM 616 OH TYR A 59 -14.259 4.970 -12.987 1.00 0.00 O ATOM 0 H TYR A 59 -13.310 -0.062 -12.843 1.00 0.00 H new ATOM 0 HA TYR A 59 -10.824 -1.690 -12.986 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -9.925 0.684 -13.413 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -10.999 0.079 -14.659 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -13.272 0.996 -14.908 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.601 2.520 -11.957 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -14.741 3.039 -14.622 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -12.082 4.555 -11.678 1.00 0.00 H new ATOM 0 HH TYR A 59 -13.871 5.562 -12.309 1.00 0.00 H new ATOM 625 N CYS A 60 -9.751 -0.802 -10.907 1.00 0.00 N ATOM 626 CA CYS A 60 -9.262 -0.545 -9.563 1.00 0.00 C ATOM 627 C CYS A 60 -9.681 0.872 -9.162 1.00 0.00 C ATOM 628 O CYS A 60 -9.781 1.756 -10.011 1.00 0.00 O ATOM 629 CB CYS A 60 -7.747 -0.740 -9.465 1.00 0.00 C ATOM 630 SG CYS A 60 -7.190 -2.479 -9.585 1.00 0.00 S ATOM 0 H CYS A 60 -9.088 -1.279 -11.518 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.701 -1.263 -8.870 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.268 -0.164 -10.257 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.402 -0.327 -8.517 1.00 0.00 H new ATOM 634 N ASN A 61 -9.915 1.042 -7.870 1.00 0.00 N ATOM 635 CA ASN A 61 -10.322 2.335 -7.346 1.00 0.00 C ATOM 636 C ASN A 61 -9.134 2.991 -6.641 1.00 0.00 C ATOM 637 O ASN A 61 -8.088 2.366 -6.466 1.00 0.00 O ATOM 638 CB ASN A 61 -11.453 2.185 -6.327 1.00 0.00 C ATOM 639 CG ASN A 61 -12.163 3.521 -6.097 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.734 4.354 -5.315 1.00 0.00 O ATOM 641 ND2 ASN A 61 -13.269 3.679 -6.818 1.00 0.00 N ATOM 0 H ASN A 61 -9.831 0.306 -7.169 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.668 2.944 -8.181 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.170 1.444 -6.680 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.051 1.815 -5.384 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -13.814 4.537 -6.735 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.573 2.942 -7.454 1.00 0.00 H new ATOM 647 N THR A 62 -9.334 4.242 -6.253 1.00 0.00 N ATOM 648 CA THR A 62 -8.291 4.989 -5.570 1.00 0.00 C ATOM 649 C THR A 62 -8.377 4.766 -4.059 1.00 0.00 C ATOM 650 O THR A 62 -9.449 4.889 -3.469 1.00 0.00 O ATOM 651 CB THR A 62 -8.421 6.459 -5.975 1.00 0.00 C ATOM 652 OG1 THR A 62 -7.450 7.127 -5.173 1.00 0.00 O ATOM 653 CG2 THR A 62 -9.752 7.072 -5.535 1.00 0.00 C ATOM 0 H THR A 62 -10.202 4.757 -6.398 1.00 0.00 H new ATOM 0 HA THR A 62 -7.300 4.642 -5.862 1.00 0.00 H new ATOM 0 HB THR A 62 -8.320 6.548 -7.057 1.00 0.00 H new ATOM 0 HG1 THR A 62 -6.574 6.706 -5.301 1.00 0.00 H new ATOM 0 HG21 THR A 62 -9.793 8.116 -5.847 1.00 0.00 H new ATOM 0 HG22 THR A 62 -10.575 6.524 -5.994 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.838 7.014 -4.450 1.00 0.00 H new ATOM 661 N THR A 63 -7.232 4.439 -3.475 1.00 0.00 N ATOM 662 CA THR A 63 -7.165 4.197 -2.044 1.00 0.00 C ATOM 663 C THR A 63 -5.716 3.968 -1.611 1.00 0.00 C ATOM 664 O THR A 63 -4.845 3.724 -2.444 1.00 0.00 O ATOM 665 CB THR A 63 -8.089 3.022 -1.720 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.103 2.974 -0.296 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.490 1.675 -2.131 1.00 0.00 C ATOM 0 H THR A 63 -6.345 4.336 -3.967 1.00 0.00 H new ATOM 0 HA THR A 63 -7.508 5.064 -1.479 1.00 0.00 H new ATOM 0 HB THR A 63 -9.045 3.163 -2.224 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.681 2.240 0.001 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.186 0.875 -1.879 1.00 0.00 H new ATOM 0 HG22 THR A 63 -7.307 1.671 -3.205 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.550 1.518 -1.602 1.00 0.00 H new ATOM 675 N LEU A 64 -5.502 4.055 -0.306 1.00 0.00 N ATOM 676 CA LEU A 64 -4.173 3.862 0.249 1.00 0.00 C ATOM 677 C LEU A 64 -4.232 2.790 1.339 1.00 0.00 C ATOM 678 O LEU A 64 -4.938 2.949 2.334 1.00 0.00 O ATOM 679 CB LEU A 64 -3.592 5.193 0.727 1.00 0.00 C ATOM 680 CG LEU A 64 -4.521 6.065 1.575 1.00 0.00 C ATOM 681 CD1 LEU A 64 -4.337 5.774 3.066 1.00 0.00 C ATOM 682 CD2 LEU A 64 -4.328 7.548 1.252 1.00 0.00 C ATOM 0 H LEU A 64 -6.227 4.257 0.383 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.489 3.501 -0.519 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.692 4.987 1.306 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -3.285 5.767 -0.147 1.00 0.00 H new ATOM 0 HG LEU A 64 -5.551 5.812 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -5.009 6.407 3.646 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -4.565 4.727 3.263 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -3.306 5.981 3.353 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -5.000 8.145 1.868 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -3.297 7.834 1.458 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -4.550 7.723 0.199 1.00 0.00 H new ATOM 693 N ASP A 65 -3.480 1.721 1.116 1.00 0.00 N ATOM 694 CA ASP A 65 -3.439 0.623 2.066 1.00 0.00 C ATOM 695 C ASP A 65 -2.315 0.871 3.075 1.00 0.00 C ATOM 696 O ASP A 65 -1.746 1.960 3.120 1.00 0.00 O ATOM 697 CB ASP A 65 -3.157 -0.705 1.362 1.00 0.00 C ATOM 698 CG ASP A 65 -1.688 -0.953 1.011 1.00 0.00 C ATOM 699 OD1 ASP A 65 -0.985 0.052 0.769 1.00 0.00 O ATOM 700 OD2 ASP A 65 -1.302 -2.142 0.993 1.00 0.00 O ATOM 0 H ASP A 65 -2.894 1.593 0.291 1.00 0.00 H new ATOM 0 HA ASP A 65 -4.408 0.569 2.562 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -3.505 -1.518 2.000 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -3.746 -0.745 0.445 1.00 0.00 H new ATOM 704 N GLN A 66 -2.029 -0.159 3.859 1.00 0.00 N ATOM 705 CA GLN A 66 -0.984 -0.067 4.864 1.00 0.00 C ATOM 706 C GLN A 66 0.188 0.763 4.336 1.00 0.00 C ATOM 707 O GLN A 66 0.868 1.442 5.104 1.00 0.00 O ATOM 708 CB GLN A 66 -0.520 -1.457 5.301 1.00 0.00 C ATOM 709 CG GLN A 66 0.511 -1.363 6.428 1.00 0.00 C ATOM 710 CD GLN A 66 0.925 -2.754 6.911 1.00 0.00 C ATOM 711 OE1 GLN A 66 0.108 -3.639 7.109 1.00 0.00 O ATOM 712 NE2 GLN A 66 2.235 -2.897 7.088 1.00 0.00 N ATOM 0 H GLN A 66 -2.503 -1.061 3.818 1.00 0.00 H new ATOM 0 HA GLN A 66 -1.393 0.435 5.741 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -1.377 -2.042 5.635 1.00 0.00 H new ATOM 0 HB3 GLN A 66 -0.087 -1.984 4.451 1.00 0.00 H new ATOM 0 HG2 GLN A 66 1.389 -0.820 6.078 1.00 0.00 H new ATOM 0 HG3 GLN A 66 0.095 -0.794 7.260 1.00 0.00 H new ATOM 0 HE21 GLN A 66 2.863 -2.115 6.903 1.00 0.00 H new ATOM 0 HE22 GLN A 66 2.612 -3.789 7.408 1.00 0.00 H new ATOM 719 N ILE A 67 0.389 0.680 3.029 1.00 0.00 N ATOM 720 CA ILE A 67 1.467 1.414 2.390 1.00 0.00 C ATOM 721 C ILE A 67 0.950 2.781 1.936 1.00 0.00 C ATOM 722 O ILE A 67 0.246 2.881 0.933 1.00 0.00 O ATOM 723 CB ILE A 67 2.085 0.586 1.261 1.00 0.00 C ATOM 724 CG1 ILE A 67 2.484 -0.805 1.758 1.00 0.00 C ATOM 725 CG2 ILE A 67 3.260 1.324 0.619 1.00 0.00 C ATOM 726 CD1 ILE A 67 1.388 -1.830 1.457 1.00 0.00 C ATOM 0 H ILE A 67 -0.177 0.115 2.395 1.00 0.00 H new ATOM 0 HA ILE A 67 2.274 1.597 3.099 1.00 0.00 H new ATOM 0 HB ILE A 67 1.331 0.448 0.486 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.415 -1.112 1.282 1.00 0.00 H new ATOM 0 HG13 ILE A 67 2.671 -0.772 2.831 1.00 0.00 H new ATOM 0 HG21 ILE A 67 3.680 0.713 -0.180 1.00 0.00 H new ATOM 0 HG22 ILE A 67 2.913 2.272 0.207 1.00 0.00 H new ATOM 0 HG23 ILE A 67 4.025 1.514 1.372 1.00 0.00 H new ATOM 0 HD11 ILE A 67 1.697 -2.810 1.820 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.465 -1.533 1.955 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.221 -1.878 0.381 1.00 0.00 H new ATOM 737 N GLY A 68 1.318 3.800 2.700 1.00 0.00 N ATOM 738 CA GLY A 68 0.899 5.157 2.388 1.00 0.00 C ATOM 739 C GLY A 68 0.754 5.353 0.878 1.00 0.00 C ATOM 740 O GLY A 68 -0.170 6.024 0.422 1.00 0.00 O ATOM 0 H GLY A 68 1.901 3.714 3.533 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -0.051 5.370 2.879 1.00 0.00 H new ATOM 0 HA3 GLY A 68 1.627 5.866 2.782 1.00 0.00 H new ATOM 744 N THR A 69 1.683 4.758 0.145 1.00 0.00 N ATOM 745 CA THR A 69 1.671 4.859 -1.305 1.00 0.00 C ATOM 746 C THR A 69 0.248 4.685 -1.840 1.00 0.00 C ATOM 747 O THR A 69 -0.209 3.562 -2.046 1.00 0.00 O ATOM 748 CB THR A 69 2.658 3.830 -1.859 1.00 0.00 C ATOM 749 OG1 THR A 69 3.921 4.485 -1.784 1.00 0.00 O ATOM 750 CG2 THR A 69 2.459 3.574 -3.355 1.00 0.00 C ATOM 0 H THR A 69 2.449 4.204 0.528 1.00 0.00 H new ATOM 0 HA THR A 69 1.990 5.848 -1.635 1.00 0.00 H new ATOM 0 HB THR A 69 2.550 2.893 -1.313 1.00 0.00 H new ATOM 0 HG1 THR A 69 4.620 3.887 -2.122 1.00 0.00 H new ATOM 0 HG21 THR A 69 3.185 2.836 -3.698 1.00 0.00 H new ATOM 0 HG22 THR A 69 1.450 3.199 -3.529 1.00 0.00 H new ATOM 0 HG23 THR A 69 2.600 4.504 -3.905 1.00 0.00 H new ATOM 758 N CYS A 70 -0.414 5.814 -2.049 1.00 0.00 N ATOM 759 CA CYS A 70 -1.775 5.801 -2.555 1.00 0.00 C ATOM 760 C CYS A 70 -1.719 5.662 -4.078 1.00 0.00 C ATOM 761 O CYS A 70 -0.729 6.037 -4.703 1.00 0.00 O ATOM 762 CB CYS A 70 -2.551 7.048 -2.124 1.00 0.00 C ATOM 763 SG CYS A 70 -4.371 6.900 -2.249 1.00 0.00 S ATOM 0 H CYS A 70 -0.032 6.744 -1.877 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.315 4.954 -2.133 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -2.290 7.283 -1.092 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -2.226 7.890 -2.735 1.00 0.00 H new ATOM 767 N TRP A 71 -2.796 5.123 -4.630 1.00 0.00 N ATOM 768 CA TRP A 71 -2.883 4.930 -6.069 1.00 0.00 C ATOM 769 C TRP A 71 -4.171 5.594 -6.558 1.00 0.00 C ATOM 770 O TRP A 71 -5.266 5.208 -6.150 1.00 0.00 O ATOM 771 CB TRP A 71 -2.801 3.445 -6.428 1.00 0.00 C ATOM 772 CG TRP A 71 -1.832 2.646 -5.555 1.00 0.00 C ATOM 773 CD1 TRP A 71 -1.839 2.513 -4.222 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.704 1.869 -6.011 1.00 0.00 C ATOM 775 NE1 TRP A 71 -0.804 1.711 -3.787 1.00 0.00 N ATOM 776 CE2 TRP A 71 -0.091 1.307 -4.910 1.00 0.00 C ATOM 777 CE3 TRP A 71 -0.217 1.650 -7.312 1.00 0.00 C ATOM 778 CZ2 TRP A 71 1.041 0.488 -4.997 1.00 0.00 C ATOM 779 CZ3 TRP A 71 0.915 0.829 -7.383 1.00 0.00 C ATOM 780 CH2 TRP A 71 1.543 0.256 -6.283 1.00 0.00 C ATOM 0 H TRP A 71 -3.616 4.814 -4.108 1.00 0.00 H new ATOM 0 HA TRP A 71 -2.038 5.398 -6.573 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.795 3.006 -6.344 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -2.497 3.350 -7.471 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -2.564 2.976 -3.569 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -0.600 1.461 -2.820 1.00 0.00 H new ATOM 0 HE3 TRP A 71 -0.680 2.081 -8.187 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 1.502 0.059 -4.120 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 1.329 0.627 -8.360 1.00 0.00 H new ATOM 0 HH2 TRP A 71 2.415 -0.366 -6.420 1.00 0.00 H new ATOM 790 N PRO A 72 -3.994 6.607 -7.447 1.00 0.00 N ATOM 791 CA PRO A 72 -5.130 7.328 -7.997 1.00 0.00 C ATOM 792 C PRO A 72 -5.857 6.485 -9.048 1.00 0.00 C ATOM 793 O PRO A 72 -5.768 6.765 -10.243 1.00 0.00 O ATOM 794 CB PRO A 72 -4.544 8.610 -8.565 1.00 0.00 C ATOM 795 CG PRO A 72 -3.055 8.351 -8.729 1.00 0.00 C ATOM 796 CD PRO A 72 -2.713 7.090 -7.953 1.00 0.00 C ATOM 0 HA PRO A 72 -5.890 7.551 -7.248 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -5.005 8.860 -9.521 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -4.723 9.451 -7.895 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -2.802 8.231 -9.782 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -2.477 9.197 -8.357 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -2.235 6.348 -8.593 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -2.020 7.302 -7.139 1.00 0.00 H new ATOM 801 N GLN A 73 -6.561 5.472 -8.564 1.00 0.00 N ATOM 802 CA GLN A 73 -7.303 4.588 -9.446 1.00 0.00 C ATOM 803 C GLN A 73 -6.356 3.907 -10.435 1.00 0.00 C ATOM 804 O GLN A 73 -5.356 4.494 -10.848 1.00 0.00 O ATOM 805 CB GLN A 73 -8.409 5.349 -10.182 1.00 0.00 C ATOM 806 CG GLN A 73 -9.043 4.479 -11.269 1.00 0.00 C ATOM 807 CD GLN A 73 -8.488 4.836 -12.649 1.00 0.00 C ATOM 808 OE1 GLN A 73 -8.392 5.992 -13.028 1.00 0.00 O ATOM 809 NE2 GLN A 73 -8.131 3.782 -13.377 1.00 0.00 N ATOM 0 H GLN A 73 -6.633 5.244 -7.572 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.779 3.818 -8.839 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -9.173 5.664 -9.472 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -7.997 6.254 -10.629 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -8.851 3.427 -11.057 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -10.125 4.613 -11.262 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -8.238 2.841 -12.999 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -7.750 3.915 -14.314 1.00 0.00 H new ATOM 816 N SER A 74 -6.702 2.677 -10.786 1.00 0.00 N ATOM 817 CA SER A 74 -5.895 1.909 -11.719 1.00 0.00 C ATOM 818 C SER A 74 -6.796 1.044 -12.602 1.00 0.00 C ATOM 819 O SER A 74 -8.002 0.959 -12.371 1.00 0.00 O ATOM 820 CB SER A 74 -4.880 1.036 -10.979 1.00 0.00 C ATOM 821 OG SER A 74 -4.383 1.673 -9.804 1.00 0.00 O ATOM 0 H SER A 74 -7.531 2.193 -10.441 1.00 0.00 H new ATOM 0 HA SER A 74 -5.343 2.607 -12.349 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.346 0.089 -10.708 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.049 0.803 -11.644 1.00 0.00 H new ATOM 0 HG SER A 74 -4.356 1.027 -9.068 1.00 0.00 H new ATOM 826 N ALA A 75 -6.177 0.422 -13.595 1.00 0.00 N ATOM 827 CA ALA A 75 -6.908 -0.434 -14.513 1.00 0.00 C ATOM 828 C ALA A 75 -6.883 -1.872 -13.992 1.00 0.00 C ATOM 829 O ALA A 75 -5.940 -2.273 -13.313 1.00 0.00 O ATOM 830 CB ALA A 75 -6.306 -0.310 -15.915 1.00 0.00 C ATOM 0 H ALA A 75 -5.177 0.494 -13.784 1.00 0.00 H new ATOM 0 HA ALA A 75 -7.951 -0.126 -14.578 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -6.854 -0.952 -16.604 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -6.375 0.725 -16.250 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -5.260 -0.614 -15.890 1.00 0.00 H new ATOM 836 N PRO A 76 -7.960 -2.627 -14.340 1.00 0.00 N ATOM 837 CA PRO A 76 -8.070 -4.013 -13.915 1.00 0.00 C ATOM 838 C PRO A 76 -7.134 -4.911 -14.724 1.00 0.00 C ATOM 839 O PRO A 76 -6.882 -4.652 -15.900 1.00 0.00 O ATOM 840 CB PRO A 76 -9.538 -4.365 -14.098 1.00 0.00 C ATOM 841 CG PRO A 76 -10.100 -3.321 -15.051 1.00 0.00 C ATOM 842 CD PRO A 76 -9.095 -2.185 -15.144 1.00 0.00 C ATOM 0 HA PRO A 76 -7.765 -4.161 -12.879 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -9.651 -5.369 -14.507 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.066 -4.348 -13.144 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.275 -3.757 -16.035 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.060 -2.952 -14.690 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -8.800 -2.001 -16.177 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -9.513 -1.254 -14.761 1.00 0.00 H new ATOM 847 N GLY A 77 -6.644 -5.949 -14.063 1.00 0.00 N ATOM 848 CA GLY A 77 -5.741 -6.888 -14.707 1.00 0.00 C ATOM 849 C GLY A 77 -4.768 -6.162 -15.639 1.00 0.00 C ATOM 850 O GLY A 77 -4.456 -6.655 -16.722 1.00 0.00 O ATOM 0 H GLY A 77 -6.855 -6.161 -13.088 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.183 -7.439 -13.950 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.316 -7.620 -15.274 1.00 0.00 H new ATOM 854 N ALA A 78 -4.316 -5.003 -15.184 1.00 0.00 N ATOM 855 CA ALA A 78 -3.386 -4.204 -15.963 1.00 0.00 C ATOM 856 C ALA A 78 -2.001 -4.266 -15.316 1.00 0.00 C ATOM 857 O ALA A 78 -1.062 -3.627 -15.788 1.00 0.00 O ATOM 858 CB ALA A 78 -3.913 -2.772 -16.076 1.00 0.00 C ATOM 0 H ALA A 78 -4.577 -4.598 -14.285 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.295 -4.599 -16.975 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.215 -2.173 -16.661 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.885 -2.780 -16.568 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.014 -2.342 -15.080 1.00 0.00 H new ATOM 864 N LEU A 79 -1.918 -5.040 -14.244 1.00 0.00 N ATOM 865 CA LEU A 79 -0.664 -5.194 -13.527 1.00 0.00 C ATOM 866 C LEU A 79 -0.134 -3.814 -13.133 1.00 0.00 C ATOM 867 O LEU A 79 0.481 -3.125 -13.946 1.00 0.00 O ATOM 868 CB LEU A 79 0.327 -6.020 -14.350 1.00 0.00 C ATOM 869 CG LEU A 79 0.678 -7.400 -13.789 1.00 0.00 C ATOM 870 CD1 LEU A 79 1.430 -7.276 -12.463 1.00 0.00 C ATOM 871 CD2 LEU A 79 -0.571 -8.274 -13.660 1.00 0.00 C ATOM 0 H LEU A 79 -2.699 -5.567 -13.855 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.820 -5.752 -12.604 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -0.083 -6.150 -15.352 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.248 -5.447 -14.455 1.00 0.00 H new ATOM 0 HG LEU A 79 1.346 -7.896 -14.494 1.00 0.00 H new ATOM 0 HD11 LEU A 79 1.668 -8.270 -12.085 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.353 -6.717 -12.619 1.00 0.00 H new ATOM 0 HD13 LEU A 79 0.806 -6.752 -11.739 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.293 -9.249 -13.259 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -1.283 -7.795 -12.988 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -1.028 -8.402 -14.641 1.00 0.00 H new ATOM 882 N VAL A 80 -0.392 -3.450 -11.886 1.00 0.00 N ATOM 883 CA VAL A 80 0.051 -2.164 -11.374 1.00 0.00 C ATOM 884 C VAL A 80 1.389 -2.341 -10.652 1.00 0.00 C ATOM 885 O VAL A 80 1.495 -2.066 -9.458 1.00 0.00 O ATOM 886 CB VAL A 80 -1.032 -1.555 -10.483 1.00 0.00 C ATOM 887 CG1 VAL A 80 -0.507 -0.321 -9.747 1.00 0.00 C ATOM 888 CG2 VAL A 80 -2.285 -1.216 -11.295 1.00 0.00 C ATOM 0 H VAL A 80 -0.903 -4.023 -11.214 1.00 0.00 H new ATOM 0 HA VAL A 80 0.213 -1.462 -12.192 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.308 -2.299 -9.736 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.297 0.093 -9.120 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.341 -0.603 -9.123 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.190 0.428 -10.473 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -3.039 -0.784 -10.637 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -2.030 -0.498 -12.075 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.679 -2.124 -11.752 1.00 0.00 H new ATOM 898 N GLU A 81 2.376 -2.798 -11.409 1.00 0.00 N ATOM 899 CA GLU A 81 3.703 -3.015 -10.856 1.00 0.00 C ATOM 900 C GLU A 81 4.458 -1.688 -10.755 1.00 0.00 C ATOM 901 O GLU A 81 4.310 -0.819 -11.612 1.00 0.00 O ATOM 902 CB GLU A 81 4.485 -4.030 -11.692 1.00 0.00 C ATOM 903 CG GLU A 81 5.425 -4.856 -10.812 1.00 0.00 C ATOM 904 CD GLU A 81 6.864 -4.345 -10.915 1.00 0.00 C ATOM 905 OE1 GLU A 81 7.488 -4.616 -11.964 1.00 0.00 O ATOM 906 OE2 GLU A 81 7.307 -3.696 -9.944 1.00 0.00 O ATOM 0 H GLU A 81 2.284 -3.024 -12.399 1.00 0.00 H new ATOM 0 HA GLU A 81 3.596 -3.427 -9.852 1.00 0.00 H new ATOM 0 HB2 GLU A 81 3.791 -4.692 -12.210 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.061 -3.510 -12.457 1.00 0.00 H new ATOM 0 HG2 GLU A 81 5.092 -4.810 -9.775 1.00 0.00 H new ATOM 0 HG3 GLU A 81 5.385 -5.903 -11.113 1.00 0.00 H new ATOM 911 N ARG A 82 5.252 -1.576 -9.701 1.00 0.00 N ATOM 912 CA ARG A 82 6.031 -0.369 -9.476 1.00 0.00 C ATOM 913 C ARG A 82 6.804 -0.473 -8.160 1.00 0.00 C ATOM 914 O ARG A 82 6.364 -1.148 -7.231 1.00 0.00 O ATOM 915 CB ARG A 82 5.132 0.868 -9.436 1.00 0.00 C ATOM 916 CG ARG A 82 4.266 0.875 -8.177 1.00 0.00 C ATOM 917 CD ARG A 82 3.533 2.210 -8.022 1.00 0.00 C ATOM 918 NE ARG A 82 2.811 2.538 -9.271 1.00 0.00 N ATOM 919 CZ ARG A 82 3.324 3.277 -10.265 1.00 0.00 C ATOM 920 NH1 ARG A 82 4.566 3.769 -10.160 1.00 0.00 N ATOM 921 NH2 ARG A 82 2.596 3.523 -11.362 1.00 0.00 N ATOM 0 H ARG A 82 5.373 -2.300 -8.993 1.00 0.00 H new ATOM 0 HA ARG A 82 6.731 -0.268 -10.305 1.00 0.00 H new ATOM 0 HB2 ARG A 82 5.745 1.769 -9.465 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.495 0.888 -10.320 1.00 0.00 H new ATOM 0 HG2 ARG A 82 3.542 0.062 -8.225 1.00 0.00 H new ATOM 0 HG3 ARG A 82 4.890 0.695 -7.301 1.00 0.00 H new ATOM 0 HD2 ARG A 82 2.831 2.154 -7.190 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.245 3.000 -7.786 1.00 0.00 H new ATOM 0 HE ARG A 82 1.863 2.179 -9.383 1.00 0.00 H new ATOM 0 HH11 ARG A 82 5.120 3.581 -9.324 1.00 0.00 H new ATOM 0 HH12 ARG A 82 4.957 4.331 -10.916 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.651 3.148 -11.441 1.00 0.00 H new ATOM 0 HH22 ARG A 82 2.987 4.085 -12.118 1.00 0.00 H new ATOM 932 N PRO A 83 7.971 0.223 -8.122 1.00 0.00 N ATOM 933 CA PRO A 83 8.809 0.216 -6.934 1.00 0.00 C ATOM 934 C PRO A 83 8.208 1.094 -5.834 1.00 0.00 C ATOM 935 O PRO A 83 7.016 1.396 -5.858 1.00 0.00 O ATOM 936 CB PRO A 83 10.168 0.703 -7.408 1.00 0.00 C ATOM 937 CG PRO A 83 9.921 1.404 -8.734 1.00 0.00 C ATOM 938 CD PRO A 83 8.524 1.033 -9.203 1.00 0.00 C ATOM 0 HA PRO A 83 8.891 -0.773 -6.483 1.00 0.00 H new ATOM 0 HB2 PRO A 83 10.613 1.384 -6.683 1.00 0.00 H new ATOM 0 HB3 PRO A 83 10.861 -0.130 -7.530 1.00 0.00 H new ATOM 0 HG2 PRO A 83 10.010 2.484 -8.617 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.665 1.100 -9.471 1.00 0.00 H new ATOM 0 HD2 PRO A 83 7.918 1.921 -9.382 1.00 0.00 H new ATOM 0 HD3 PRO A 83 8.556 0.475 -10.139 1.00 0.00 H new ATOM 943 N CYS A 84 9.062 1.480 -4.898 1.00 0.00 N ATOM 944 CA CYS A 84 8.631 2.318 -3.792 1.00 0.00 C ATOM 945 C CYS A 84 9.619 3.479 -3.655 1.00 0.00 C ATOM 946 O CYS A 84 10.299 3.602 -2.638 1.00 0.00 O ATOM 947 CB CYS A 84 8.505 1.520 -2.493 1.00 0.00 C ATOM 948 SG CYS A 84 9.361 -0.098 -2.500 1.00 0.00 S ATOM 0 H CYS A 84 10.050 1.228 -4.883 1.00 0.00 H new ATOM 0 HA CYS A 84 7.636 2.712 -3.998 1.00 0.00 H new ATOM 0 HB2 CYS A 84 8.901 2.121 -1.674 1.00 0.00 H new ATOM 0 HB3 CYS A 84 7.448 1.355 -2.286 1.00 0.00 H new ATOM 952 N PRO A 85 9.667 4.321 -4.721 1.00 0.00 N ATOM 953 CA PRO A 85 10.560 5.467 -4.730 1.00 0.00 C ATOM 954 C PRO A 85 10.028 6.583 -3.828 1.00 0.00 C ATOM 955 O PRO A 85 9.626 7.639 -4.313 1.00 0.00 O ATOM 956 CB PRO A 85 10.658 5.879 -6.189 1.00 0.00 C ATOM 957 CG PRO A 85 9.461 5.247 -6.882 1.00 0.00 C ATOM 958 CD PRO A 85 8.876 4.205 -5.943 1.00 0.00 C ATOM 0 HA PRO A 85 11.547 5.234 -4.329 1.00 0.00 H new ATOM 0 HB2 PRO A 85 10.640 6.964 -6.290 1.00 0.00 H new ATOM 0 HB3 PRO A 85 11.593 5.533 -6.631 1.00 0.00 H new ATOM 0 HG2 PRO A 85 8.716 6.005 -7.123 1.00 0.00 H new ATOM 0 HG3 PRO A 85 9.764 4.787 -7.822 1.00 0.00 H new ATOM 0 HD2 PRO A 85 7.820 4.394 -5.750 1.00 0.00 H new ATOM 0 HD3 PRO A 85 8.948 3.204 -6.368 1.00 0.00 H new ATOM 963 N GLU A 86 10.045 6.311 -2.531 1.00 0.00 N ATOM 964 CA GLU A 86 9.570 7.279 -1.557 1.00 0.00 C ATOM 965 C GLU A 86 9.419 6.620 -0.185 1.00 0.00 C ATOM 966 O GLU A 86 8.749 5.597 -0.054 1.00 0.00 O ATOM 967 CB GLU A 86 8.252 7.910 -2.011 1.00 0.00 C ATOM 968 CG GLU A 86 7.281 6.845 -2.525 1.00 0.00 C ATOM 969 CD GLU A 86 6.241 7.459 -3.465 1.00 0.00 C ATOM 970 OE1 GLU A 86 5.873 8.628 -3.217 1.00 0.00 O ATOM 971 OE2 GLU A 86 5.838 6.747 -4.409 1.00 0.00 O ATOM 0 H GLU A 86 10.380 5.434 -2.132 1.00 0.00 H new ATOM 0 HA GLU A 86 10.308 8.077 -1.475 1.00 0.00 H new ATOM 0 HB2 GLU A 86 7.798 8.450 -1.180 1.00 0.00 H new ATOM 0 HB3 GLU A 86 8.446 8.640 -2.797 1.00 0.00 H new ATOM 0 HG2 GLU A 86 7.834 6.066 -3.049 1.00 0.00 H new ATOM 0 HG3 GLU A 86 6.779 6.369 -1.683 1.00 0.00 H new ATOM 976 N TYR A 87 10.052 7.234 0.803 1.00 0.00 N ATOM 977 CA TYR A 87 9.996 6.721 2.161 1.00 0.00 C ATOM 978 C TYR A 87 8.784 5.807 2.352 1.00 0.00 C ATOM 979 O TYR A 87 7.690 6.277 2.662 1.00 0.00 O ATOM 980 CB TYR A 87 9.846 7.943 3.069 1.00 0.00 C ATOM 981 CG TYR A 87 11.164 8.658 3.373 1.00 0.00 C ATOM 982 CD1 TYR A 87 12.099 8.061 4.194 1.00 0.00 C ATOM 983 CD2 TYR A 87 11.418 9.900 2.826 1.00 0.00 C ATOM 984 CE1 TYR A 87 13.340 8.734 4.480 1.00 0.00 C ATOM 985 CE2 TYR A 87 12.658 10.572 3.111 1.00 0.00 C ATOM 986 CZ TYR A 87 13.558 9.956 3.925 1.00 0.00 C ATOM 987 OH TYR A 87 14.730 10.592 4.194 1.00 0.00 O ATOM 0 H TYR A 87 10.607 8.083 0.690 1.00 0.00 H new ATOM 0 HA TYR A 87 10.889 6.139 2.388 1.00 0.00 H new ATOM 0 HB2 TYR A 87 9.161 8.649 2.600 1.00 0.00 H new ATOM 0 HB3 TYR A 87 9.389 7.631 4.008 1.00 0.00 H new ATOM 0 HD1 TYR A 87 11.900 7.090 4.622 1.00 0.00 H new ATOM 0 HD2 TYR A 87 10.686 10.367 2.184 1.00 0.00 H new ATOM 0 HE1 TYR A 87 14.080 8.278 5.121 1.00 0.00 H new ATOM 0 HE2 TYR A 87 12.870 11.543 2.689 1.00 0.00 H new ATOM 0 HH TYR A 87 14.748 11.455 3.729 1.00 0.00 H new ATOM 996 N PHE A 88 9.019 4.517 2.161 1.00 0.00 N ATOM 997 CA PHE A 88 7.961 3.533 2.307 1.00 0.00 C ATOM 998 C PHE A 88 8.145 2.716 3.588 1.00 0.00 C ATOM 999 O PHE A 88 7.341 1.836 3.888 1.00 0.00 O ATOM 1000 CB PHE A 88 8.049 2.596 1.101 1.00 0.00 C ATOM 1001 CG PHE A 88 9.476 2.165 0.752 1.00 0.00 C ATOM 1002 CD1 PHE A 88 10.260 2.969 -0.013 1.00 0.00 C ATOM 1003 CD2 PHE A 88 9.957 0.978 1.208 1.00 0.00 C ATOM 1004 CE1 PHE A 88 11.583 2.569 -0.338 1.00 0.00 C ATOM 1005 CE2 PHE A 88 11.281 0.578 0.883 1.00 0.00 C ATOM 1006 CZ PHE A 88 12.066 1.382 0.118 1.00 0.00 C ATOM 0 H PHE A 88 9.928 4.131 1.906 1.00 0.00 H new ATOM 0 HA PHE A 88 6.994 4.033 2.362 1.00 0.00 H new ATOM 0 HB2 PHE A 88 7.450 1.707 1.300 1.00 0.00 H new ATOM 0 HB3 PHE A 88 7.608 3.091 0.236 1.00 0.00 H new ATOM 0 HD1 PHE A 88 9.877 3.912 -0.374 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.333 0.340 1.817 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.206 3.207 -0.947 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.664 -0.365 1.244 1.00 0.00 H new ATOM 0 HZ PHE A 88 13.073 1.078 -0.128 1.00 0.00 H new ATOM 1015 N ASN A 89 9.210 3.037 4.308 1.00 0.00 N ATOM 1016 CA ASN A 89 9.512 2.344 5.549 1.00 0.00 C ATOM 1017 C ASN A 89 10.878 2.799 6.064 1.00 0.00 C ATOM 1018 O ASN A 89 11.749 1.975 6.337 1.00 0.00 O ATOM 1019 CB ASN A 89 9.568 0.830 5.334 1.00 0.00 C ATOM 1020 CG ASN A 89 10.622 0.463 4.288 1.00 0.00 C ATOM 1021 OD1 ASN A 89 11.627 1.136 4.118 1.00 0.00 O ATOM 1022 ND2 ASN A 89 10.340 -0.637 3.597 1.00 0.00 N ATOM 0 H ASN A 89 9.875 3.768 4.055 1.00 0.00 H new ATOM 0 HA ASN A 89 8.725 2.578 6.266 1.00 0.00 H new ATOM 0 HB2 ASN A 89 9.798 0.334 6.277 1.00 0.00 H new ATOM 0 HB3 ASN A 89 8.591 0.468 5.013 1.00 0.00 H new ATOM 0 HD21 ASN A 89 10.982 -0.964 2.875 1.00 0.00 H new ATOM 0 HD22 ASN A 89 9.482 -1.154 3.789 1.00 0.00 H new ATOM 1028 N GLY A 90 11.023 4.111 6.182 1.00 0.00 N ATOM 1029 CA GLY A 90 12.268 4.686 6.659 1.00 0.00 C ATOM 1030 C GLY A 90 13.207 5.006 5.494 1.00 0.00 C ATOM 1031 O GLY A 90 13.720 6.119 5.392 1.00 0.00 O ATOM 0 H GLY A 90 10.298 4.792 5.955 1.00 0.00 H new ATOM 0 HA2 GLY A 90 12.060 5.595 7.223 1.00 0.00 H new ATOM 0 HA3 GLY A 90 12.755 3.991 7.343 1.00 0.00 H new ATOM 1035 N ILE A 91 13.405 4.009 4.645 1.00 0.00 N ATOM 1036 CA ILE A 91 14.273 4.169 3.490 1.00 0.00 C ATOM 1037 C ILE A 91 13.534 4.959 2.409 1.00 0.00 C ATOM 1038 O ILE A 91 12.406 4.625 2.052 1.00 0.00 O ATOM 1039 CB ILE A 91 14.788 2.809 3.015 1.00 0.00 C ATOM 1040 CG1 ILE A 91 16.282 2.873 2.687 1.00 0.00 C ATOM 1041 CG2 ILE A 91 13.964 2.292 1.835 1.00 0.00 C ATOM 1042 CD1 ILE A 91 17.129 2.641 3.940 1.00 0.00 C ATOM 0 H ILE A 91 12.979 3.086 4.733 1.00 0.00 H new ATOM 0 HA ILE A 91 15.160 4.744 3.756 1.00 0.00 H new ATOM 0 HB ILE A 91 14.667 2.094 3.829 1.00 0.00 H new ATOM 0 HG12 ILE A 91 16.525 2.122 1.935 1.00 0.00 H new ATOM 0 HG13 ILE A 91 16.522 3.845 2.256 1.00 0.00 H new ATOM 0 HG21 ILE A 91 14.351 1.324 1.517 1.00 0.00 H new ATOM 0 HG22 ILE A 91 12.922 2.184 2.138 1.00 0.00 H new ATOM 0 HG23 ILE A 91 14.030 2.999 1.008 1.00 0.00 H new ATOM 0 HD11 ILE A 91 18.186 2.692 3.679 1.00 0.00 H new ATOM 0 HD12 ILE A 91 16.901 3.408 4.680 1.00 0.00 H new ATOM 0 HD13 ILE A 91 16.904 1.658 4.354 1.00 0.00 H new ATOM 1053 N LYS A 92 14.202 5.992 1.916 1.00 0.00 N ATOM 1054 CA LYS A 92 13.624 6.833 0.881 1.00 0.00 C ATOM 1055 C LYS A 92 13.741 6.124 -0.470 1.00 0.00 C ATOM 1056 O LYS A 92 13.523 4.917 -0.563 1.00 0.00 O ATOM 1057 CB LYS A 92 14.260 8.224 0.903 1.00 0.00 C ATOM 1058 CG LYS A 92 15.745 8.154 0.544 1.00 0.00 C ATOM 1059 CD LYS A 92 16.595 8.895 1.579 1.00 0.00 C ATOM 1060 CE LYS A 92 17.479 7.922 2.362 1.00 0.00 C ATOM 1061 NZ LYS A 92 18.089 8.599 3.528 1.00 0.00 N ATOM 0 H LYS A 92 15.138 6.266 2.214 1.00 0.00 H new ATOM 0 HA LYS A 92 12.562 6.991 1.068 1.00 0.00 H new ATOM 0 HB2 LYS A 92 13.742 8.875 0.199 1.00 0.00 H new ATOM 0 HB3 LYS A 92 14.142 8.666 1.892 1.00 0.00 H new ATOM 0 HG2 LYS A 92 16.060 7.112 0.488 1.00 0.00 H new ATOM 0 HG3 LYS A 92 15.905 8.589 -0.442 1.00 0.00 H new ATOM 0 HD2 LYS A 92 17.218 9.636 1.079 1.00 0.00 H new ATOM 0 HD3 LYS A 92 15.946 9.436 2.267 1.00 0.00 H new ATOM 0 HE2 LYS A 92 16.885 7.072 2.697 1.00 0.00 H new ATOM 0 HE3 LYS A 92 18.261 7.529 1.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 18.686 7.924 4.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 18.672 9.396 3.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 17.339 8.953 4.155 1.00 0.00 H new ATOM 1071 N TYR A 93 14.085 6.905 -1.484 1.00 0.00 N ATOM 1072 CA TYR A 93 14.234 6.368 -2.826 1.00 0.00 C ATOM 1073 C TYR A 93 15.694 6.418 -3.277 1.00 0.00 C ATOM 1074 O TYR A 93 16.037 7.157 -4.200 1.00 0.00 O ATOM 1075 CB TYR A 93 13.399 7.271 -3.736 1.00 0.00 C ATOM 1076 CG TYR A 93 13.333 8.728 -3.276 1.00 0.00 C ATOM 1077 CD1 TYR A 93 14.498 9.426 -3.024 1.00 0.00 C ATOM 1078 CD2 TYR A 93 12.110 9.346 -3.113 1.00 0.00 C ATOM 1079 CE1 TYR A 93 14.435 10.798 -2.591 1.00 0.00 C ATOM 1080 CE2 TYR A 93 12.048 10.718 -2.680 1.00 0.00 C ATOM 1081 CZ TYR A 93 13.213 11.377 -2.441 1.00 0.00 C ATOM 1082 OH TYR A 93 13.155 12.672 -2.033 1.00 0.00 O ATOM 0 H TYR A 93 14.265 7.906 -1.403 1.00 0.00 H new ATOM 0 HA TYR A 93 13.912 5.327 -2.861 1.00 0.00 H new ATOM 0 HB2 TYR A 93 13.814 7.237 -4.743 1.00 0.00 H new ATOM 0 HB3 TYR A 93 12.386 6.873 -3.795 1.00 0.00 H new ATOM 0 HD1 TYR A 93 15.456 8.943 -3.152 1.00 0.00 H new ATOM 0 HD2 TYR A 93 11.199 8.801 -3.310 1.00 0.00 H new ATOM 0 HE1 TYR A 93 15.338 11.355 -2.390 1.00 0.00 H new ATOM 0 HE2 TYR A 93 11.097 11.213 -2.548 1.00 0.00 H new ATOM 0 HH TYR A 93 12.218 12.954 -1.970 1.00 0.00 H new ATOM 1091 N ASN A 94 16.516 5.624 -2.607 1.00 0.00 N ATOM 1092 CA ASN A 94 17.932 5.569 -2.928 1.00 0.00 C ATOM 1093 C ASN A 94 18.297 4.149 -3.362 1.00 0.00 C ATOM 1094 O ASN A 94 19.096 3.962 -4.278 1.00 0.00 O ATOM 1095 CB ASN A 94 18.787 5.927 -1.711 1.00 0.00 C ATOM 1096 CG ASN A 94 18.810 4.778 -0.700 1.00 0.00 C ATOM 1097 OD1 ASN A 94 19.785 4.059 -0.560 1.00 0.00 O ATOM 1098 ND2 ASN A 94 17.683 4.647 -0.006 1.00 0.00 N ATOM 0 H ASN A 94 16.228 5.013 -1.843 1.00 0.00 H new ATOM 0 HA ASN A 94 18.125 6.285 -3.727 1.00 0.00 H new ATOM 0 HB2 ASN A 94 19.804 6.155 -2.031 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.393 6.826 -1.237 1.00 0.00 H new ATOM 0 HD21 ASN A 94 17.598 3.910 0.694 1.00 0.00 H new ATOM 0 HD22 ASN A 94 16.904 5.284 -0.173 1.00 0.00 H new ATOM 1104 N THR A 95 17.694 3.183 -2.684 1.00 0.00 N ATOM 1105 CA THR A 95 17.946 1.785 -2.988 1.00 0.00 C ATOM 1106 C THR A 95 17.236 1.384 -4.281 1.00 0.00 C ATOM 1107 O THR A 95 16.471 2.168 -4.842 1.00 0.00 O ATOM 1108 CB THR A 95 17.519 0.954 -1.776 1.00 0.00 C ATOM 1109 OG1 THR A 95 17.371 -0.365 -2.295 1.00 0.00 O ATOM 1110 CG2 THR A 95 16.117 1.317 -1.281 1.00 0.00 C ATOM 0 H THR A 95 17.031 3.341 -1.925 1.00 0.00 H new ATOM 0 HA THR A 95 19.006 1.604 -3.168 1.00 0.00 H new ATOM 0 HB THR A 95 18.237 1.095 -0.968 1.00 0.00 H new ATOM 0 HG1 THR A 95 18.253 -0.781 -2.387 1.00 0.00 H new ATOM 0 HG21 THR A 95 15.864 0.698 -0.420 1.00 0.00 H new ATOM 0 HG22 THR A 95 16.094 2.368 -0.992 1.00 0.00 H new ATOM 0 HG23 THR A 95 15.394 1.144 -2.078 1.00 0.00 H new ATOM 1118 N THR A 96 17.512 0.163 -4.717 1.00 0.00 N ATOM 1119 CA THR A 96 16.909 -0.350 -5.935 1.00 0.00 C ATOM 1120 C THR A 96 15.806 -1.357 -5.600 1.00 0.00 C ATOM 1121 O THR A 96 15.796 -2.470 -6.124 1.00 0.00 O ATOM 1122 CB THR A 96 18.023 -0.937 -6.803 1.00 0.00 C ATOM 1123 OG1 THR A 96 17.353 -1.362 -7.988 1.00 0.00 O ATOM 1124 CG2 THR A 96 18.603 -2.228 -6.220 1.00 0.00 C ATOM 0 H THR A 96 18.145 -0.485 -4.248 1.00 0.00 H new ATOM 0 HA THR A 96 16.421 0.444 -6.500 1.00 0.00 H new ATOM 0 HB THR A 96 18.819 -0.201 -6.917 1.00 0.00 H new ATOM 0 HG1 THR A 96 16.716 -2.073 -7.767 1.00 0.00 H new ATOM 0 HG21 THR A 96 19.390 -2.602 -6.875 1.00 0.00 H new ATOM 0 HG22 THR A 96 19.019 -2.027 -5.233 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.814 -2.976 -6.136 1.00 0.00 H new ATOM 1132 N ARG A 97 14.904 -0.931 -4.727 1.00 0.00 N ATOM 1133 CA ARG A 97 13.800 -1.781 -4.315 1.00 0.00 C ATOM 1134 C ARG A 97 12.713 -1.796 -5.392 1.00 0.00 C ATOM 1135 O ARG A 97 12.727 -0.972 -6.305 1.00 0.00 O ATOM 1136 CB ARG A 97 13.196 -1.298 -2.996 1.00 0.00 C ATOM 1137 CG ARG A 97 14.255 -1.249 -1.893 1.00 0.00 C ATOM 1138 CD ARG A 97 14.484 -2.637 -1.291 1.00 0.00 C ATOM 1139 NE ARG A 97 15.311 -3.455 -2.206 1.00 0.00 N ATOM 1140 CZ ARG A 97 16.652 -3.453 -2.211 1.00 0.00 C ATOM 1141 NH1 ARG A 97 17.324 -2.677 -1.350 1.00 0.00 N ATOM 1142 NH2 ARG A 97 17.319 -4.228 -3.076 1.00 0.00 N ATOM 0 H ARG A 97 14.916 -0.008 -4.294 1.00 0.00 H new ATOM 0 HA ARG A 97 14.191 -2.789 -4.174 1.00 0.00 H new ATOM 0 HB2 ARG A 97 12.762 -0.308 -3.132 1.00 0.00 H new ATOM 0 HB3 ARG A 97 12.386 -1.963 -2.698 1.00 0.00 H new ATOM 0 HG2 ARG A 97 15.191 -0.866 -2.299 1.00 0.00 H new ATOM 0 HG3 ARG A 97 13.940 -0.557 -1.112 1.00 0.00 H new ATOM 0 HD2 ARG A 97 14.978 -2.546 -0.324 1.00 0.00 H new ATOM 0 HD3 ARG A 97 13.527 -3.128 -1.115 1.00 0.00 H new ATOM 0 HE ARG A 97 14.831 -4.058 -2.874 1.00 0.00 H new ATOM 0 HH11 ARG A 97 16.816 -2.088 -0.691 1.00 0.00 H new ATOM 0 HH12 ARG A 97 18.344 -2.676 -1.354 1.00 0.00 H new ATOM 0 HH21 ARG A 97 16.807 -4.819 -3.731 1.00 0.00 H new ATOM 0 HH22 ARG A 97 18.339 -4.227 -3.080 1.00 0.00 H new ATOM 1153 N ASN A 98 11.796 -2.742 -5.247 1.00 0.00 N ATOM 1154 CA ASN A 98 10.704 -2.875 -6.196 1.00 0.00 C ATOM 1155 C ASN A 98 9.433 -3.288 -5.449 1.00 0.00 C ATOM 1156 O ASN A 98 9.506 -3.879 -4.373 1.00 0.00 O ATOM 1157 CB ASN A 98 11.008 -3.951 -7.240 1.00 0.00 C ATOM 1158 CG ASN A 98 12.380 -3.723 -7.879 1.00 0.00 C ATOM 1159 OD1 ASN A 98 12.812 -2.603 -8.100 1.00 0.00 O ATOM 1160 ND2 ASN A 98 13.037 -4.843 -8.162 1.00 0.00 N ATOM 0 H ASN A 98 11.787 -3.423 -4.487 1.00 0.00 H new ATOM 0 HA ASN A 98 10.573 -1.915 -6.695 1.00 0.00 H new ATOM 0 HB2 ASN A 98 10.980 -4.935 -6.772 1.00 0.00 H new ATOM 0 HB3 ASN A 98 10.238 -3.943 -8.011 1.00 0.00 H new ATOM 0 HD21 ASN A 98 13.961 -4.798 -8.591 1.00 0.00 H new ATOM 0 HD22 ASN A 98 12.617 -5.748 -7.950 1.00 0.00 H new ATOM 1166 N ALA A 99 8.298 -2.960 -6.050 1.00 0.00 N ATOM 1167 CA ALA A 99 7.015 -3.288 -5.455 1.00 0.00 C ATOM 1168 C ALA A 99 6.096 -3.878 -6.528 1.00 0.00 C ATOM 1169 O ALA A 99 6.451 -3.907 -7.705 1.00 0.00 O ATOM 1170 CB ALA A 99 6.420 -2.040 -4.801 1.00 0.00 C ATOM 0 H ALA A 99 8.241 -2.470 -6.943 1.00 0.00 H new ATOM 0 HA ALA A 99 7.136 -4.039 -4.674 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.457 -2.287 -4.355 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.096 -1.677 -4.027 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.282 -1.265 -5.555 1.00 0.00 H new ATOM 1176 N TYR A 100 4.935 -4.333 -6.082 1.00 0.00 N ATOM 1177 CA TYR A 100 3.963 -4.919 -6.990 1.00 0.00 C ATOM 1178 C TYR A 100 2.541 -4.765 -6.445 1.00 0.00 C ATOM 1179 O TYR A 100 2.300 -4.983 -5.259 1.00 0.00 O ATOM 1180 CB TYR A 100 4.306 -6.408 -7.071 1.00 0.00 C ATOM 1181 CG TYR A 100 5.571 -6.710 -7.877 1.00 0.00 C ATOM 1182 CD1 TYR A 100 6.815 -6.500 -7.316 1.00 0.00 C ATOM 1183 CD2 TYR A 100 5.469 -7.195 -9.164 1.00 0.00 C ATOM 1184 CE1 TYR A 100 8.004 -6.785 -8.075 1.00 0.00 C ATOM 1185 CE2 TYR A 100 6.659 -7.481 -9.924 1.00 0.00 C ATOM 1186 CZ TYR A 100 7.868 -7.262 -9.341 1.00 0.00 C ATOM 1187 OH TYR A 100 8.992 -7.532 -10.057 1.00 0.00 O ATOM 0 H TYR A 100 4.645 -4.308 -5.104 1.00 0.00 H new ATOM 0 HA TYR A 100 4.001 -4.427 -7.962 1.00 0.00 H new ATOM 0 HB2 TYR A 100 4.429 -6.798 -6.061 1.00 0.00 H new ATOM 0 HB3 TYR A 100 3.466 -6.940 -7.518 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.896 -6.122 -6.308 1.00 0.00 H new ATOM 0 HD2 TYR A 100 4.496 -7.361 -9.603 1.00 0.00 H new ATOM 0 HE1 TYR A 100 8.983 -6.624 -7.648 1.00 0.00 H new ATOM 0 HE2 TYR A 100 6.593 -7.860 -10.933 1.00 0.00 H new ATOM 0 HH TYR A 100 8.743 -7.867 -10.943 1.00 0.00 H new ATOM 1196 N ARG A 101 1.637 -4.391 -7.338 1.00 0.00 N ATOM 1197 CA ARG A 101 0.246 -4.206 -6.962 1.00 0.00 C ATOM 1198 C ARG A 101 -0.677 -4.733 -8.062 1.00 0.00 C ATOM 1199 O ARG A 101 -1.714 -4.137 -8.346 1.00 0.00 O ATOM 1200 CB ARG A 101 -0.065 -2.729 -6.710 1.00 0.00 C ATOM 1201 CG ARG A 101 -0.375 -2.478 -5.233 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.828 -2.038 -5.045 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.455 -2.818 -3.954 1.00 0.00 N ATOM 1204 CZ ARG A 101 -2.131 -2.695 -2.660 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -1.185 -1.823 -2.286 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -2.752 -3.444 -1.739 1.00 0.00 N ATOM 0 H ARG A 101 1.841 -4.211 -8.321 1.00 0.00 H new ATOM 0 HA ARG A 101 0.075 -4.764 -6.042 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.784 -2.118 -7.016 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -0.915 -2.423 -7.321 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.189 -3.386 -4.659 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.294 -1.711 -4.842 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.867 -0.974 -4.812 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.383 -2.182 -5.972 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.179 -3.491 -4.203 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -0.711 -1.253 -2.987 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -0.938 -1.729 -1.301 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.472 -4.108 -2.023 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -2.505 -3.350 -0.754 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.266 -5.846 -8.652 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.042 -6.461 -9.715 1.00 0.00 C ATOM 1219 C GLU A 102 -2.539 -6.286 -9.449 1.00 0.00 C ATOM 1220 O GLU A 102 -3.028 -6.641 -8.378 1.00 0.00 O ATOM 1221 CB GLU A 102 -0.682 -7.939 -9.873 1.00 0.00 C ATOM 1222 CG GLU A 102 -0.529 -8.615 -8.508 1.00 0.00 C ATOM 1223 CD GLU A 102 0.855 -9.249 -8.363 1.00 0.00 C ATOM 1224 OE1 GLU A 102 1.233 -10.003 -9.284 1.00 0.00 O ATOM 1225 OE2 GLU A 102 1.504 -8.965 -7.332 1.00 0.00 O ATOM 0 H GLU A 102 0.595 -6.338 -8.414 1.00 0.00 H new ATOM 0 HA GLU A 102 -0.798 -5.960 -10.652 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.456 -8.446 -10.449 1.00 0.00 H new ATOM 0 HB3 GLU A 102 0.247 -8.033 -10.435 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -0.682 -7.882 -7.716 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.297 -9.379 -8.388 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.224 -5.738 -10.443 1.00 0.00 N ATOM 1231 CA CYS A 103 -4.654 -5.511 -10.328 1.00 0.00 C ATOM 1232 C CYS A 103 -5.380 -6.752 -10.849 1.00 0.00 C ATOM 1233 O CYS A 103 -4.884 -7.437 -11.743 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.086 -4.244 -11.070 1.00 0.00 C ATOM 1235 SG CYS A 103 -5.347 -2.781 -10.001 1.00 0.00 S ATOM 0 H CYS A 103 -2.815 -5.445 -11.330 1.00 0.00 H new ATOM 0 HA CYS A 103 -4.917 -5.349 -9.283 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.330 -4.001 -11.816 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.010 -4.452 -11.609 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.543 -7.006 -10.269 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.343 -8.153 -10.663 1.00 0.00 C ATOM 1241 C LEU A 104 -8.229 -7.769 -11.850 1.00 0.00 C ATOM 1242 O LEU A 104 -8.618 -6.610 -11.988 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.123 -8.701 -9.466 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.370 -9.689 -8.571 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -6.722 -8.971 -7.386 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -8.287 -10.827 -8.119 1.00 0.00 C ATOM 0 H LEU A 104 -6.951 -6.436 -9.528 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.700 -8.968 -10.995 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -8.447 -7.860 -8.853 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.023 -9.191 -9.837 1.00 0.00 H new ATOM 0 HG LEU A 104 -6.566 -10.136 -9.156 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -6.194 -9.696 -6.766 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -6.017 -8.225 -7.754 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.493 -8.480 -6.792 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -7.728 -11.515 -7.485 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -9.126 -10.417 -7.558 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.661 -11.362 -8.992 1.00 0.00 H new ATOM 1257 N GLU A 105 -8.522 -8.763 -12.675 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.356 -8.542 -13.845 1.00 0.00 C ATOM 1259 C GLU A 105 -10.828 -8.453 -13.439 1.00 0.00 C ATOM 1260 O GLU A 105 -11.702 -8.299 -14.290 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.140 -9.643 -14.886 1.00 0.00 C ATOM 1262 CG GLU A 105 -9.654 -10.990 -14.376 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.287 -12.119 -15.341 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -9.497 -11.918 -16.556 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -8.802 -13.158 -14.842 1.00 0.00 O ATOM 0 H GLU A 105 -8.197 -9.723 -12.557 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.068 -7.594 -14.300 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -9.654 -9.380 -15.810 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -8.079 -9.721 -15.123 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -9.231 -11.196 -13.393 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -10.736 -10.948 -14.255 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.057 -8.555 -12.138 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.409 -8.488 -11.609 1.00 0.00 C ATOM 1272 C ASN A 106 -12.695 -7.062 -11.133 1.00 0.00 C ATOM 1273 O ASN A 106 -13.769 -6.785 -10.603 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.580 -9.428 -10.414 1.00 0.00 C ATOM 1275 CG ASN A 106 -13.970 -10.067 -10.415 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -14.874 -9.649 -9.710 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -14.089 -11.102 -11.242 1.00 0.00 N ATOM 0 H ASN A 106 -10.329 -8.683 -11.435 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.097 -8.783 -12.402 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -11.818 -10.206 -10.447 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.431 -8.875 -9.487 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -14.978 -11.598 -11.314 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.292 -11.400 -11.804 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.716 -6.195 -11.342 1.00 0.00 N ATOM 1284 CA GLY A 107 -11.848 -4.804 -10.940 1.00 0.00 C ATOM 1285 C GLY A 107 -11.600 -4.641 -9.440 1.00 0.00 C ATOM 1286 O GLY A 107 -12.350 -3.946 -8.755 1.00 0.00 O ATOM 0 H GLY A 107 -10.827 -6.428 -11.785 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -11.140 -4.192 -11.498 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -12.846 -4.443 -11.189 1.00 0.00 H new ATOM 1290 N THR A 108 -10.545 -5.291 -8.972 1.00 0.00 N ATOM 1291 CA THR A 108 -10.189 -5.227 -7.566 1.00 0.00 C ATOM 1292 C THR A 108 -8.684 -4.996 -7.407 1.00 0.00 C ATOM 1293 O THR A 108 -7.907 -5.302 -8.309 1.00 0.00 O ATOM 1294 CB THR A 108 -10.682 -6.509 -6.893 1.00 0.00 C ATOM 1295 OG1 THR A 108 -10.360 -7.537 -7.827 1.00 0.00 O ATOM 1296 CG2 THR A 108 -12.206 -6.567 -6.786 1.00 0.00 C ATOM 0 H THR A 108 -9.925 -5.865 -9.543 1.00 0.00 H new ATOM 0 HA THR A 108 -10.670 -4.381 -7.075 1.00 0.00 H new ATOM 0 HB THR A 108 -10.246 -6.586 -5.897 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.644 -8.404 -7.470 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.502 -7.497 -6.301 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.562 -5.722 -6.197 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.643 -6.524 -7.784 1.00 0.00 H new ATOM 1304 N TRP A 109 -8.319 -4.460 -6.251 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.922 -4.185 -5.962 1.00 0.00 C ATOM 1306 C TRP A 109 -6.249 -5.506 -5.585 1.00 0.00 C ATOM 1307 O TRP A 109 -6.833 -6.575 -5.752 1.00 0.00 O ATOM 1308 CB TRP A 109 -6.787 -3.113 -4.878 1.00 0.00 C ATOM 1309 CG TRP A 109 -6.388 -1.736 -5.411 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -6.914 -0.545 -5.095 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.350 -1.454 -6.374 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.294 0.480 -5.780 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.313 -0.091 -6.582 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.471 -2.322 -7.046 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.415 0.527 -7.463 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.581 -1.690 -7.921 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.530 -0.319 -8.142 1.00 0.00 C ATOM 0 H TRP A 109 -8.967 -4.209 -5.504 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.419 -3.776 -6.839 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -7.735 -3.025 -4.348 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -6.044 -3.439 -4.150 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.722 -0.405 -4.392 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.515 1.473 -5.711 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -4.482 -3.392 -6.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -4.406 1.597 -7.610 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -2.884 -2.312 -8.463 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -2.811 0.092 -8.835 1.00 0.00 H new ATOM 1327 N ALA A 110 -5.028 -5.388 -5.082 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.269 -6.561 -4.680 1.00 0.00 C ATOM 1329 C ALA A 110 -4.393 -6.747 -3.166 1.00 0.00 C ATOM 1330 O ALA A 110 -5.233 -6.118 -2.526 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.815 -6.406 -5.130 1.00 0.00 C ATOM 0 H ALA A 110 -4.546 -4.500 -4.944 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.665 -7.458 -5.157 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.245 -7.285 -4.829 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.779 -6.304 -6.215 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.384 -5.518 -4.667 1.00 0.00 H new ATOM 1337 N SER A 111 -3.545 -7.617 -2.637 1.00 0.00 N ATOM 1338 CA SER A 111 -3.549 -7.896 -1.211 1.00 0.00 C ATOM 1339 C SER A 111 -2.651 -6.896 -0.480 1.00 0.00 C ATOM 1340 O SER A 111 -3.018 -6.385 0.577 1.00 0.00 O ATOM 1341 CB SER A 111 -3.089 -9.327 -0.928 1.00 0.00 C ATOM 1342 OG SER A 111 -2.130 -9.779 -1.882 1.00 0.00 O ATOM 0 H SER A 111 -2.850 -8.138 -3.171 1.00 0.00 H new ATOM 0 HA SER A 111 -4.571 -7.793 -0.845 1.00 0.00 H new ATOM 0 HB2 SER A 111 -2.658 -9.378 0.072 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.951 -9.993 -0.937 1.00 0.00 H new ATOM 0 HG SER A 111 -1.491 -9.060 -2.069 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.493 -6.645 -1.073 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.540 -5.715 -0.491 1.00 0.00 C ATOM 1349 C ARG A 112 0.568 -5.392 -1.495 1.00 0.00 C ATOM 1350 O ARG A 112 0.805 -6.156 -2.430 1.00 0.00 O ATOM 1351 CB ARG A 112 0.086 -6.291 0.781 1.00 0.00 C ATOM 1352 CG ARG A 112 -0.312 -5.469 2.009 1.00 0.00 C ATOM 1353 CD ARG A 112 0.502 -5.886 3.235 1.00 0.00 C ATOM 1354 NE ARG A 112 -0.033 -7.149 3.792 1.00 0.00 N ATOM 1355 CZ ARG A 112 -1.230 -7.263 4.383 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -2.023 -6.191 4.499 1.00 0.00 N ATOM 1357 NH2 ARG A 112 -1.632 -8.449 4.858 1.00 0.00 N ATOM 0 H ARG A 112 -1.193 -7.070 -1.951 1.00 0.00 H new ATOM 0 HA ARG A 112 -1.081 -4.804 -0.236 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.234 -7.325 0.912 1.00 0.00 H new ATOM 0 HB3 ARG A 112 1.172 -6.303 0.683 1.00 0.00 H new ATOM 0 HG2 ARG A 112 -0.156 -4.409 1.808 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.375 -5.602 2.211 1.00 0.00 H new ATOM 0 HD2 ARG A 112 1.549 -6.015 2.960 1.00 0.00 H new ATOM 0 HD3 ARG A 112 0.465 -5.101 3.991 1.00 0.00 H new ATOM 0 HE ARG A 112 0.546 -7.985 3.721 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -1.716 -5.288 4.138 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -2.934 -6.277 4.949 1.00 0.00 H new ATOM 0 HH21 ARG A 112 -1.027 -9.265 4.770 1.00 0.00 H new ATOM 0 HH22 ARG A 112 -2.543 -8.536 5.308 1.00 0.00 H new ATOM 1368 N VAL A 113 1.216 -4.260 -1.269 1.00 0.00 N ATOM 1369 CA VAL A 113 2.293 -3.827 -2.142 1.00 0.00 C ATOM 1370 C VAL A 113 3.593 -3.743 -1.340 1.00 0.00 C ATOM 1371 O VAL A 113 3.572 -3.786 -0.111 1.00 0.00 O ATOM 1372 CB VAL A 113 1.922 -2.504 -2.817 1.00 0.00 C ATOM 1373 CG1 VAL A 113 1.957 -1.349 -1.814 1.00 0.00 C ATOM 1374 CG2 VAL A 113 2.835 -2.222 -4.012 1.00 0.00 C ATOM 0 H VAL A 113 1.016 -3.629 -0.493 1.00 0.00 H new ATOM 0 HA VAL A 113 2.449 -4.552 -2.941 1.00 0.00 H new ATOM 0 HB VAL A 113 0.902 -2.593 -3.190 1.00 0.00 H new ATOM 0 HG11 VAL A 113 1.690 -0.421 -2.319 1.00 0.00 H new ATOM 0 HG12 VAL A 113 1.246 -1.543 -1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 113 2.960 -1.259 -1.397 1.00 0.00 H new ATOM 0 HG21 VAL A 113 2.549 -1.276 -4.473 1.00 0.00 H new ATOM 0 HG22 VAL A 113 3.869 -2.163 -3.674 1.00 0.00 H new ATOM 0 HG23 VAL A 113 2.737 -3.025 -4.742 1.00 0.00 H new ATOM 1384 N ASN A 114 4.694 -3.626 -2.067 1.00 0.00 N ATOM 1385 CA ASN A 114 6.001 -3.536 -1.438 1.00 0.00 C ATOM 1386 C ASN A 114 6.271 -4.817 -0.647 1.00 0.00 C ATOM 1387 O ASN A 114 5.817 -4.959 0.487 1.00 0.00 O ATOM 1388 CB ASN A 114 6.064 -2.358 -0.463 1.00 0.00 C ATOM 1389 CG ASN A 114 5.501 -1.087 -1.104 1.00 0.00 C ATOM 1390 OD1 ASN A 114 4.487 -0.549 -0.691 1.00 0.00 O ATOM 1391 ND2 ASN A 114 6.214 -0.638 -2.133 1.00 0.00 N ATOM 0 H ASN A 114 4.708 -3.591 -3.086 1.00 0.00 H new ATOM 0 HA ASN A 114 6.743 -3.395 -2.224 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.499 -2.596 0.438 1.00 0.00 H new ATOM 0 HB3 ASN A 114 7.096 -2.189 -0.157 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.921 0.205 -2.627 1.00 0.00 H new ATOM 0 HD22 ASN A 114 7.054 -1.136 -2.428 1.00 0.00 H new ATOM 1397 N TYR A 115 7.008 -5.719 -1.279 1.00 0.00 N ATOM 1398 CA TYR A 115 7.344 -6.985 -0.648 1.00 0.00 C ATOM 1399 C TYR A 115 8.255 -7.822 -1.549 1.00 0.00 C ATOM 1400 O TYR A 115 9.162 -8.496 -1.066 1.00 0.00 O ATOM 1401 CB TYR A 115 6.019 -7.724 -0.456 1.00 0.00 C ATOM 1402 CG TYR A 115 5.265 -8.001 -1.757 1.00 0.00 C ATOM 1403 CD1 TYR A 115 4.761 -6.952 -2.499 1.00 0.00 C ATOM 1404 CD2 TYR A 115 5.089 -9.300 -2.191 1.00 0.00 C ATOM 1405 CE1 TYR A 115 4.052 -7.212 -3.725 1.00 0.00 C ATOM 1406 CE2 TYR A 115 4.380 -9.560 -3.417 1.00 0.00 C ATOM 1407 CZ TYR A 115 3.896 -8.503 -4.123 1.00 0.00 C ATOM 1408 OH TYR A 115 3.226 -8.748 -5.281 1.00 0.00 O ATOM 0 H TYR A 115 7.382 -5.599 -2.220 1.00 0.00 H new ATOM 0 HA TYR A 115 7.870 -6.818 0.292 1.00 0.00 H new ATOM 0 HB2 TYR A 115 6.213 -8.671 0.048 1.00 0.00 H new ATOM 0 HB3 TYR A 115 5.380 -7.137 0.204 1.00 0.00 H new ATOM 0 HD1 TYR A 115 4.898 -5.936 -2.160 1.00 0.00 H new ATOM 0 HD2 TYR A 115 5.483 -10.121 -1.611 1.00 0.00 H new ATOM 0 HE1 TYR A 115 3.653 -6.400 -4.315 1.00 0.00 H new ATOM 0 HE2 TYR A 115 4.236 -10.571 -3.768 1.00 0.00 H new ATOM 0 HH TYR A 115 2.345 -8.320 -5.246 1.00 0.00 H new ATOM 1417 N SER A 116 7.980 -7.751 -2.844 1.00 0.00 N ATOM 1418 CA SER A 116 8.763 -8.494 -3.816 1.00 0.00 C ATOM 1419 C SER A 116 10.240 -8.107 -3.704 1.00 0.00 C ATOM 1420 O SER A 116 11.114 -8.839 -4.168 1.00 0.00 O ATOM 1421 CB SER A 116 8.256 -8.243 -5.238 1.00 0.00 C ATOM 1422 OG SER A 116 8.110 -9.456 -5.973 1.00 0.00 O ATOM 0 H SER A 116 7.226 -7.191 -3.242 1.00 0.00 H new ATOM 0 HA SER A 116 8.655 -9.557 -3.602 1.00 0.00 H new ATOM 0 HB2 SER A 116 7.297 -7.727 -5.195 1.00 0.00 H new ATOM 0 HB3 SER A 116 8.950 -7.584 -5.760 1.00 0.00 H new ATOM 0 HG SER A 116 7.993 -9.250 -6.924 1.00 0.00 H new ATOM 1427 N HIS A 117 10.473 -6.960 -3.085 1.00 0.00 N ATOM 1428 CA HIS A 117 11.829 -6.468 -2.905 1.00 0.00 C ATOM 1429 C HIS A 117 11.788 -5.041 -2.354 1.00 0.00 C ATOM 1430 O HIS A 117 12.566 -4.186 -2.776 1.00 0.00 O ATOM 1431 CB HIS A 117 12.624 -6.578 -4.208 1.00 0.00 C ATOM 1432 CG HIS A 117 13.559 -7.762 -4.258 1.00 0.00 C ATOM 1433 ND1 HIS A 117 14.380 -8.113 -3.202 1.00 0.00 N ATOM 1434 CD2 HIS A 117 13.794 -8.671 -5.248 1.00 0.00 C ATOM 1435 CE1 HIS A 117 15.074 -9.187 -3.552 1.00 0.00 C ATOM 1436 NE2 HIS A 117 14.710 -9.530 -4.820 1.00 0.00 N ATOM 0 H HIS A 117 9.746 -6.356 -2.701 1.00 0.00 H new ATOM 0 HA HIS A 117 12.351 -7.087 -2.175 1.00 0.00 H new ATOM 0 HB2 HIS A 117 11.926 -6.643 -5.043 1.00 0.00 H new ATOM 0 HB3 HIS A 117 13.203 -5.665 -4.347 1.00 0.00 H new ATOM 0 HD2 HIS A 117 13.315 -8.688 -6.216 1.00 0.00 H new ATOM 0 HE1 HIS A 117 15.801 -9.700 -2.940 1.00 0.00 H new ATOM 0 HE2 HIS A 117 15.081 -10.317 -5.352 1.00 0.00 H new ATOM 1443 N CYS A 118 10.874 -4.828 -1.419 1.00 0.00 N ATOM 1444 CA CYS A 118 10.721 -3.519 -0.806 1.00 0.00 C ATOM 1445 C CYS A 118 10.786 -3.691 0.713 1.00 0.00 C ATOM 1446 O CYS A 118 11.638 -3.099 1.374 1.00 0.00 O ATOM 1447 CB CYS A 118 9.427 -2.834 -1.249 1.00 0.00 C ATOM 1448 SG CYS A 118 9.317 -1.057 -0.823 1.00 0.00 S ATOM 0 H CYS A 118 10.232 -5.540 -1.071 1.00 0.00 H new ATOM 0 HA CYS A 118 11.529 -2.865 -1.132 1.00 0.00 H new ATOM 0 HB2 CYS A 118 9.326 -2.942 -2.329 1.00 0.00 H new ATOM 0 HB3 CYS A 118 8.583 -3.355 -0.797 1.00 0.00 H new ATOM 1452 N GLU A 119 9.873 -4.504 1.225 1.00 0.00 N ATOM 1453 CA GLU A 119 9.814 -4.760 2.653 1.00 0.00 C ATOM 1454 C GLU A 119 11.175 -5.239 3.162 1.00 0.00 C ATOM 1455 O GLU A 119 11.722 -4.675 4.110 1.00 0.00 O ATOM 1456 CB GLU A 119 8.718 -5.775 2.984 1.00 0.00 C ATOM 1457 CG GLU A 119 7.810 -5.256 4.101 1.00 0.00 C ATOM 1458 CD GLU A 119 7.106 -3.964 3.680 1.00 0.00 C ATOM 1459 OE1 GLU A 119 6.303 -4.040 2.725 1.00 0.00 O ATOM 1460 OE2 GLU A 119 7.387 -2.929 4.321 1.00 0.00 O ATOM 0 H GLU A 119 9.168 -4.994 0.675 1.00 0.00 H new ATOM 0 HA GLU A 119 9.565 -3.827 3.159 1.00 0.00 H new ATOM 0 HB2 GLU A 119 8.124 -5.978 2.093 1.00 0.00 H new ATOM 0 HB3 GLU A 119 9.171 -6.719 3.288 1.00 0.00 H new ATOM 0 HG2 GLU A 119 7.068 -6.013 4.352 1.00 0.00 H new ATOM 0 HG3 GLU A 119 8.400 -5.077 5.000 1.00 0.00 H new ATOM 1465 N PRO A 120 11.699 -6.301 2.494 1.00 0.00 N ATOM 1466 CA PRO A 120 12.985 -6.862 2.868 1.00 0.00 C ATOM 1467 C PRO A 120 14.132 -5.961 2.404 1.00 0.00 C ATOM 1468 O PRO A 120 14.917 -6.345 1.539 1.00 0.00 O ATOM 1469 CB PRO A 120 13.016 -8.240 2.226 1.00 0.00 C ATOM 1470 CG PRO A 120 11.954 -8.217 1.140 1.00 0.00 C ATOM 1471 CD PRO A 120 11.081 -6.994 1.366 1.00 0.00 C ATOM 0 HA PRO A 120 13.112 -6.938 3.948 1.00 0.00 H new ATOM 0 HB2 PRO A 120 13.999 -8.453 1.807 1.00 0.00 H new ATOM 0 HB3 PRO A 120 12.807 -9.018 2.960 1.00 0.00 H new ATOM 0 HG2 PRO A 120 12.417 -8.178 0.154 1.00 0.00 H new ATOM 0 HG3 PRO A 120 11.353 -9.126 1.174 1.00 0.00 H new ATOM 0 HD2 PRO A 120 11.051 -6.360 0.480 1.00 0.00 H new ATOM 0 HD3 PRO A 120 10.053 -7.277 1.590 1.00 0.00 H new ATOM 1476 N ILE A 121 14.192 -4.780 3.001 1.00 0.00 N ATOM 1477 CA ILE A 121 15.229 -3.821 2.660 1.00 0.00 C ATOM 1478 C ILE A 121 16.362 -3.914 3.685 1.00 0.00 C ATOM 1479 O ILE A 121 16.149 -3.675 4.872 1.00 0.00 O ATOM 1480 CB ILE A 121 14.637 -2.417 2.522 1.00 0.00 C ATOM 1481 CG1 ILE A 121 15.690 -1.424 2.025 1.00 0.00 C ATOM 1482 CG2 ILE A 121 13.996 -1.962 3.835 1.00 0.00 C ATOM 1483 CD1 ILE A 121 16.776 -1.202 3.079 1.00 0.00 C ATOM 0 H ILE A 121 13.539 -4.465 3.719 1.00 0.00 H new ATOM 0 HA ILE A 121 15.660 -4.056 1.687 1.00 0.00 H new ATOM 0 HB ILE A 121 13.847 -2.451 1.772 1.00 0.00 H new ATOM 0 HG12 ILE A 121 16.141 -1.797 1.106 1.00 0.00 H new ATOM 0 HG13 ILE A 121 15.213 -0.474 1.783 1.00 0.00 H new ATOM 0 HG21 ILE A 121 13.583 -0.961 3.710 1.00 0.00 H new ATOM 0 HG22 ILE A 121 13.198 -2.653 4.109 1.00 0.00 H new ATOM 0 HG23 ILE A 121 14.750 -1.948 4.622 1.00 0.00 H new ATOM 0 HD11 ILE A 121 17.511 -0.492 2.700 1.00 0.00 H new ATOM 0 HD12 ILE A 121 16.325 -0.806 3.989 1.00 0.00 H new ATOM 0 HD13 ILE A 121 17.267 -2.150 3.301 1.00 0.00 H new ATOM 1494 N LEU A 122 17.539 -4.262 3.188 1.00 0.00 N ATOM 1495 CA LEU A 122 18.705 -4.390 4.047 1.00 0.00 C ATOM 1496 C LEU A 122 18.707 -3.252 5.069 1.00 0.00 C ATOM 1497 O LEU A 122 19.020 -2.111 4.733 1.00 0.00 O ATOM 1498 CB LEU A 122 19.982 -4.465 3.208 1.00 0.00 C ATOM 1499 CG LEU A 122 20.253 -3.271 2.290 1.00 0.00 C ATOM 1500 CD1 LEU A 122 21.727 -2.863 2.342 1.00 0.00 C ATOM 1501 CD2 LEU A 122 19.789 -3.561 0.862 1.00 0.00 C ATOM 0 H LEU A 122 17.711 -4.459 2.202 1.00 0.00 H new ATOM 0 HA LEU A 122 18.664 -5.323 4.609 1.00 0.00 H new ATOM 0 HB2 LEU A 122 20.830 -4.579 3.883 1.00 0.00 H new ATOM 0 HB3 LEU A 122 19.939 -5.366 2.596 1.00 0.00 H new ATOM 0 HG LEU A 122 19.671 -2.423 2.652 1.00 0.00 H new ATOM 0 HD11 LEU A 122 21.893 -2.012 1.681 1.00 0.00 H new ATOM 0 HD12 LEU A 122 21.992 -2.586 3.362 1.00 0.00 H new ATOM 0 HD13 LEU A 122 22.348 -3.699 2.020 1.00 0.00 H new ATOM 0 HD21 LEU A 122 19.993 -2.696 0.230 1.00 0.00 H new ATOM 0 HD22 LEU A 122 20.324 -4.428 0.475 1.00 0.00 H new ATOM 0 HD23 LEU A 122 18.718 -3.766 0.862 1.00 0.00 H new ATOM 1512 N ASP A 123 18.354 -3.602 6.297 1.00 0.00 N ATOM 1513 CA ASP A 123 18.311 -2.624 7.371 1.00 0.00 C ATOM 1514 C ASP A 123 18.107 -3.346 8.705 1.00 0.00 C ATOM 1515 O ASP A 123 17.097 -3.142 9.377 1.00 0.00 O ATOM 1516 CB ASP A 123 17.150 -1.647 7.181 1.00 0.00 C ATOM 1517 CG ASP A 123 15.758 -2.283 7.201 1.00 0.00 C ATOM 1518 OD1 ASP A 123 15.704 -3.524 7.345 1.00 0.00 O ATOM 1519 OD2 ASP A 123 14.781 -1.514 7.074 1.00 0.00 O ATOM 0 H ASP A 123 18.095 -4.549 6.572 1.00 0.00 H new ATOM 0 HA ASP A 123 19.251 -2.073 7.362 1.00 0.00 H new ATOM 0 HB2 ASP A 123 17.199 -0.892 7.965 1.00 0.00 H new ATOM 0 HB3 ASP A 123 17.283 -1.129 6.231 1.00 0.00 H new ATOM 1523 N ASP A 124 19.082 -4.175 9.048 1.00 0.00 N ATOM 1524 CA ASP A 124 19.022 -4.928 10.289 1.00 0.00 C ATOM 1525 C ASP A 124 20.213 -5.885 10.358 1.00 0.00 C ATOM 1526 O ASP A 124 20.965 -6.015 9.394 1.00 0.00 O ATOM 1527 CB ASP A 124 17.740 -5.761 10.366 1.00 0.00 C ATOM 1528 CG ASP A 124 16.876 -5.506 11.602 1.00 0.00 C ATOM 1529 OD1 ASP A 124 17.470 -5.170 12.649 1.00 0.00 O ATOM 1530 OD2 ASP A 124 15.642 -5.652 11.472 1.00 0.00 O ATOM 0 H ASP A 124 19.918 -4.342 8.488 1.00 0.00 H new ATOM 0 HA ASP A 124 19.041 -4.218 11.116 1.00 0.00 H new ATOM 0 HB2 ASP A 124 17.142 -5.563 9.476 1.00 0.00 H new ATOM 0 HB3 ASP A 124 18.009 -6.817 10.341 1.00 0.00 H new ATOM 1534 N LYS A 125 20.347 -6.532 11.507 1.00 0.00 N ATOM 1535 CA LYS A 125 21.434 -7.473 11.714 1.00 0.00 C ATOM 1536 C LYS A 125 20.959 -8.599 12.636 1.00 0.00 C ATOM 1537 O LYS A 125 21.615 -8.910 13.629 1.00 0.00 O ATOM 1538 CB LYS A 125 22.681 -6.748 12.221 1.00 0.00 C ATOM 1539 CG LYS A 125 23.881 -7.695 12.280 1.00 0.00 C ATOM 1540 CD LYS A 125 25.125 -7.045 11.673 1.00 0.00 C ATOM 1541 CE LYS A 125 25.414 -7.607 10.281 1.00 0.00 C ATOM 1542 NZ LYS A 125 25.891 -6.536 9.378 1.00 0.00 N ATOM 0 H LYS A 125 19.720 -6.423 12.304 1.00 0.00 H new ATOM 0 HA LYS A 125 21.724 -7.934 10.770 1.00 0.00 H new ATOM 0 HB2 LYS A 125 22.909 -5.907 11.566 1.00 0.00 H new ATOM 0 HB3 LYS A 125 22.489 -6.337 13.212 1.00 0.00 H new ATOM 0 HG2 LYS A 125 24.080 -7.971 13.316 1.00 0.00 H new ATOM 0 HG3 LYS A 125 23.649 -8.615 11.744 1.00 0.00 H new ATOM 0 HD2 LYS A 125 24.982 -5.966 11.611 1.00 0.00 H new ATOM 0 HD3 LYS A 125 25.983 -7.216 12.323 1.00 0.00 H new ATOM 0 HE2 LYS A 125 26.165 -8.394 10.349 1.00 0.00 H new ATOM 0 HE3 LYS A 125 24.512 -8.061 9.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 26.083 -6.935 8.437 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 25.162 -5.798 9.299 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 26.764 -6.121 9.762 1.00 0.00 H new ATOM 1552 N GLN A 126 19.823 -9.177 12.275 1.00 0.00 N ATOM 1553 CA GLN A 126 19.253 -10.260 13.058 1.00 0.00 C ATOM 1554 C GLN A 126 19.464 -10.003 14.552 1.00 0.00 C ATOM 1555 O GLN A 126 20.041 -10.834 15.252 1.00 0.00 O ATOM 1556 CB GLN A 126 19.848 -11.608 12.644 1.00 0.00 C ATOM 1557 CG GLN A 126 20.278 -11.588 11.176 1.00 0.00 C ATOM 1558 CD GLN A 126 20.155 -12.980 10.550 1.00 0.00 C ATOM 1559 OE1 GLN A 126 21.129 -13.598 10.152 1.00 0.00 O ATOM 1560 NE2 GLN A 126 18.907 -13.435 10.487 1.00 0.00 N ATOM 0 H GLN A 126 19.282 -8.916 11.451 1.00 0.00 H new ATOM 0 HA GLN A 126 18.181 -10.298 12.864 1.00 0.00 H new ATOM 0 HB2 GLN A 126 20.706 -11.840 13.275 1.00 0.00 H new ATOM 0 HB3 GLN A 126 19.113 -12.398 12.801 1.00 0.00 H new ATOM 0 HG2 GLN A 126 19.661 -10.880 10.622 1.00 0.00 H new ATOM 0 HG3 GLN A 126 21.308 -11.241 11.100 1.00 0.00 H new ATOM 0 HE21 GLN A 126 18.138 -12.865 10.839 1.00 0.00 H new ATOM 0 HE22 GLN A 126 18.719 -14.354 10.087 1.00 0.00 H new ATOM 1567 N ARG A 127 18.986 -8.851 14.995 1.00 0.00 N ATOM 1568 CA ARG A 127 19.114 -8.474 16.392 1.00 0.00 C ATOM 1569 C ARG A 127 18.561 -7.065 16.616 1.00 0.00 C ATOM 1570 O ARG A 127 18.349 -6.319 15.661 1.00 0.00 O ATOM 1571 CB ARG A 127 20.576 -8.518 16.842 1.00 0.00 C ATOM 1572 CG ARG A 127 20.691 -9.014 18.285 1.00 0.00 C ATOM 1573 CD ARG A 127 21.663 -10.192 18.384 1.00 0.00 C ATOM 1574 NE ARG A 127 22.618 -9.968 19.492 1.00 0.00 N ATOM 1575 CZ ARG A 127 22.348 -10.228 20.779 1.00 0.00 C ATOM 1576 NH1 ARG A 127 21.152 -10.720 21.128 1.00 0.00 N ATOM 1577 NH2 ARG A 127 23.276 -9.993 21.718 1.00 0.00 N ATOM 0 H ARG A 127 18.509 -8.165 14.411 1.00 0.00 H new ATOM 0 HA ARG A 127 18.542 -9.190 16.982 1.00 0.00 H new ATOM 0 HB2 ARG A 127 21.144 -9.174 16.182 1.00 0.00 H new ATOM 0 HB3 ARG A 127 21.016 -7.524 16.759 1.00 0.00 H new ATOM 0 HG2 ARG A 127 21.032 -8.201 18.927 1.00 0.00 H new ATOM 0 HG3 ARG A 127 19.709 -9.317 18.649 1.00 0.00 H new ATOM 0 HD2 ARG A 127 21.111 -11.117 18.550 1.00 0.00 H new ATOM 0 HD3 ARG A 127 22.204 -10.308 17.445 1.00 0.00 H new ATOM 0 HE ARG A 127 23.538 -9.593 19.262 1.00 0.00 H new ATOM 0 HH11 ARG A 127 20.445 -10.897 20.414 1.00 0.00 H new ATOM 0 HH12 ARG A 127 20.948 -10.917 22.108 1.00 0.00 H new ATOM 0 HH21 ARG A 127 24.186 -9.617 21.453 1.00 0.00 H new ATOM 0 HH22 ARG A 127 23.072 -10.190 22.698 1.00 0.00 H new ATOM 1588 N LYS A 128 18.342 -6.745 17.882 1.00 0.00 N ATOM 1589 CA LYS A 128 17.817 -5.438 18.244 1.00 0.00 C ATOM 1590 C LYS A 128 18.978 -4.505 18.590 1.00 0.00 C ATOM 1591 O LYS A 128 19.142 -3.456 17.970 1.00 0.00 O ATOM 1592 CB LYS A 128 16.778 -5.568 19.360 1.00 0.00 C ATOM 1593 CG LYS A 128 16.252 -4.194 19.781 1.00 0.00 C ATOM 1594 CD LYS A 128 15.071 -3.768 18.906 1.00 0.00 C ATOM 1595 CE LYS A 128 15.405 -2.504 18.113 1.00 0.00 C ATOM 1596 NZ LYS A 128 15.015 -2.663 16.694 1.00 0.00 N ATOM 0 H LYS A 128 18.518 -7.367 18.671 1.00 0.00 H new ATOM 0 HA LYS A 128 17.290 -4.992 17.400 1.00 0.00 H new ATOM 0 HB2 LYS A 128 15.950 -6.190 19.020 1.00 0.00 H new ATOM 0 HB3 LYS A 128 17.223 -6.070 20.219 1.00 0.00 H new ATOM 0 HG2 LYS A 128 15.943 -4.223 20.826 1.00 0.00 H new ATOM 0 HG3 LYS A 128 17.050 -3.456 19.705 1.00 0.00 H new ATOM 0 HD2 LYS A 128 14.813 -4.575 18.220 1.00 0.00 H new ATOM 0 HD3 LYS A 128 14.196 -3.589 19.531 1.00 0.00 H new ATOM 0 HE2 LYS A 128 14.886 -1.649 18.545 1.00 0.00 H new ATOM 0 HE3 LYS A 128 16.473 -2.296 18.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 15.249 -1.795 16.170 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 15.530 -3.466 16.280 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 13.992 -2.839 16.633 1.00 0.00 H new ATOM 1606 N TYR A 129 19.753 -4.921 19.581 1.00 0.00 N ATOM 1607 CA TYR A 129 20.895 -4.135 20.018 1.00 0.00 C ATOM 1608 C TYR A 129 20.489 -2.686 20.295 1.00 0.00 C ATOM 1609 O TYR A 129 19.339 -2.307 20.082 1.00 0.00 O ATOM 1610 CB TYR A 129 21.893 -4.159 18.858 1.00 0.00 C ATOM 1611 CG TYR A 129 23.321 -4.515 19.273 1.00 0.00 C ATOM 1612 CD1 TYR A 129 23.553 -5.617 20.072 1.00 0.00 C ATOM 1613 CD2 TYR A 129 24.379 -3.735 18.850 1.00 0.00 C ATOM 1614 CE1 TYR A 129 24.898 -5.952 20.462 1.00 0.00 C ATOM 1615 CE2 TYR A 129 25.723 -4.070 19.241 1.00 0.00 C ATOM 1616 CZ TYR A 129 25.917 -5.163 20.028 1.00 0.00 C ATOM 1617 OH TYR A 129 27.187 -5.479 20.398 1.00 0.00 O ATOM 0 H TYR A 129 19.613 -5.792 20.094 1.00 0.00 H new ATOM 0 HA TYR A 129 21.313 -4.544 20.938 1.00 0.00 H new ATOM 0 HB2 TYR A 129 21.552 -4.879 18.114 1.00 0.00 H new ATOM 0 HB3 TYR A 129 21.899 -3.181 18.377 1.00 0.00 H new ATOM 0 HD1 TYR A 129 22.726 -6.227 20.404 1.00 0.00 H new ATOM 0 HD2 TYR A 129 24.198 -2.873 18.225 1.00 0.00 H new ATOM 0 HE1 TYR A 129 25.093 -6.812 21.086 1.00 0.00 H new ATOM 0 HE2 TYR A 129 26.559 -3.467 18.917 1.00 0.00 H new ATOM 0 HH TYR A 129 27.811 -4.829 20.014 1.00 0.00 H new ATOM 1626 N ASP A 130 21.457 -1.914 20.768 1.00 0.00 N ATOM 1627 CA ASP A 130 21.215 -0.514 21.077 1.00 0.00 C ATOM 1628 C ASP A 130 20.136 -0.414 22.156 1.00 0.00 C ATOM 1629 O ASP A 130 18.992 -0.808 21.935 1.00 0.00 O ATOM 1630 CB ASP A 130 20.721 0.245 19.843 1.00 0.00 C ATOM 1631 CG ASP A 130 21.264 -0.270 18.507 1.00 0.00 C ATOM 1632 OD1 ASP A 130 22.500 -0.206 18.335 1.00 0.00 O ATOM 1633 OD2 ASP A 130 20.429 -0.713 17.690 1.00 0.00 O ATOM 0 H ASP A 130 22.410 -2.231 20.945 1.00 0.00 H new ATOM 0 HA ASP A 130 22.153 -0.077 21.418 1.00 0.00 H new ATOM 0 HB2 ASP A 130 19.632 0.198 19.818 1.00 0.00 H new ATOM 0 HB3 ASP A 130 20.993 1.295 19.948 1.00 0.00 H new ATOM 1637 N LEU A 131 20.538 0.114 23.303 1.00 0.00 N ATOM 1638 CA LEU A 131 19.620 0.270 24.418 1.00 0.00 C ATOM 1639 C LEU A 131 20.316 1.041 25.542 1.00 0.00 C ATOM 1640 O LEU A 131 21.459 0.743 25.887 1.00 0.00 O ATOM 1641 CB LEU A 131 19.069 -1.089 24.854 1.00 0.00 C ATOM 1642 CG LEU A 131 17.761 -1.059 25.648 1.00 0.00 C ATOM 1643 CD1 LEU A 131 16.579 -0.704 24.745 1.00 0.00 C ATOM 1644 CD2 LEU A 131 17.541 -2.380 26.389 1.00 0.00 C ATOM 0 H LEU A 131 21.488 0.439 23.484 1.00 0.00 H new ATOM 0 HA LEU A 131 18.752 0.857 24.117 1.00 0.00 H new ATOM 0 HB2 LEU A 131 18.917 -1.700 23.964 1.00 0.00 H new ATOM 0 HB3 LEU A 131 19.826 -1.589 25.458 1.00 0.00 H new ATOM 0 HG LEU A 131 17.836 -0.275 26.401 1.00 0.00 H new ATOM 0 HD11 LEU A 131 15.662 -0.690 25.334 1.00 0.00 H new ATOM 0 HD12 LEU A 131 16.741 0.279 24.303 1.00 0.00 H new ATOM 0 HD13 LEU A 131 16.490 -1.448 23.953 1.00 0.00 H new ATOM 0 HD21 LEU A 131 16.605 -2.333 26.946 1.00 0.00 H new ATOM 0 HD22 LEU A 131 17.495 -3.197 25.669 1.00 0.00 H new ATOM 0 HD23 LEU A 131 18.366 -2.551 27.080 1.00 0.00 H new ATOM 1655 N HIS A 132 19.598 2.014 26.082 1.00 0.00 N ATOM 1656 CA HIS A 132 20.133 2.829 27.159 1.00 0.00 C ATOM 1657 C HIS A 132 21.479 3.419 26.737 1.00 0.00 C ATOM 1658 O HIS A 132 22.010 3.073 25.684 1.00 0.00 O ATOM 1659 CB HIS A 132 20.220 2.023 28.458 1.00 0.00 C ATOM 1660 CG HIS A 132 19.186 2.408 29.490 1.00 0.00 C ATOM 1661 ND1 HIS A 132 17.896 2.782 29.154 1.00 0.00 N ATOM 1662 CD2 HIS A 132 19.263 2.470 30.850 1.00 0.00 C ATOM 1663 CE1 HIS A 132 17.237 3.056 30.270 1.00 0.00 C ATOM 1664 NE2 HIS A 132 18.086 2.862 31.320 1.00 0.00 N ATOM 0 H HIS A 132 18.650 2.257 25.794 1.00 0.00 H new ATOM 0 HA HIS A 132 19.458 3.661 27.359 1.00 0.00 H new ATOM 0 HB2 HIS A 132 20.109 0.964 28.225 1.00 0.00 H new ATOM 0 HB3 HIS A 132 21.213 2.152 28.888 1.00 0.00 H new ATOM 0 HD2 HIS A 132 20.135 2.239 31.444 1.00 0.00 H new ATOM 0 HE1 HIS A 132 16.208 3.377 30.337 1.00 0.00 H new ATOM 0 HE2 HIS A 132 17.854 2.996 32.304 1.00 0.00 H new ATOM 1672 N TYR A 133 21.994 4.301 27.582 1.00 0.00 N ATOM 1673 CA TYR A 133 23.268 4.944 27.310 1.00 0.00 C ATOM 1674 C TYR A 133 24.434 4.066 27.772 1.00 0.00 C ATOM 1675 O TYR A 133 24.608 3.841 28.970 1.00 0.00 O ATOM 1676 CB TYR A 133 23.269 6.241 28.120 1.00 0.00 C ATOM 1677 CG TYR A 133 24.449 7.165 27.815 1.00 0.00 C ATOM 1678 CD1 TYR A 133 25.624 7.043 28.530 1.00 0.00 C ATOM 1679 CD2 TYR A 133 24.340 8.121 26.825 1.00 0.00 C ATOM 1680 CE1 TYR A 133 26.735 7.913 28.242 1.00 0.00 C ATOM 1681 CE2 TYR A 133 25.451 8.990 26.538 1.00 0.00 C ATOM 1682 CZ TYR A 133 26.593 8.844 27.260 1.00 0.00 C ATOM 1683 OH TYR A 133 27.643 9.665 26.989 1.00 0.00 O ATOM 0 H TYR A 133 21.551 4.585 28.456 1.00 0.00 H new ATOM 0 HA TYR A 133 23.388 5.120 26.241 1.00 0.00 H new ATOM 0 HB2 TYR A 133 22.341 6.779 27.927 1.00 0.00 H new ATOM 0 HB3 TYR A 133 23.279 5.994 29.182 1.00 0.00 H new ATOM 0 HD1 TYR A 133 25.710 6.296 29.305 1.00 0.00 H new ATOM 0 HD2 TYR A 133 23.421 8.217 26.266 1.00 0.00 H new ATOM 0 HE1 TYR A 133 27.660 7.828 28.793 1.00 0.00 H new ATOM 0 HE2 TYR A 133 25.379 9.742 25.766 1.00 0.00 H new ATOM 0 HH TYR A 133 27.400 10.279 26.264 1.00 0.00 H new TER 1692 TYR A 133