USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1083 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 139 LYS NZ :NH3+ -156:sc= 0.00781 (180deg=0) USER MOD Set 1.2: A 142 GLN : amide:sc= -0.156 K(o=-0.15,f=-0.76) USER MOD Set 2.1: A 34 SER OG : rot -72:sc= 0.038 USER MOD Set 2.2: A 35 HIS : no HD1:sc= -1.71 X(o=-1.7,f=-1.3) USER MOD Set 3.1: A 12 ASN : amide:sc= -0.314 K(o=-1.6,f=-2.6!) USER MOD Set 3.2: A 15 THR OG1 : rot 180:sc= -1.29 USER MOD Single : A 3 THR OG1 : rot 180:sc=-0.00173 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 8 ASN :FLIP amide:sc= -3.5 F(o=-6!,f=-3.5) USER MOD Single : A 10 GLN : amide:sc= -0.418 K(o=-0.42,f=-0.98) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= 0.26 X(o=0.26,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 TYR OH : rot 160:sc= -0.205 USER MOD Single : A 20 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 TYR OH : rot 165:sc= -0.886 USER MOD Single : A 26 ASN :FLIP amide:sc= 0 F(o=-1.5,f=0) USER MOD Single : A 27 GLN : amide:sc= -0.182 X(o=-0.18,f=-0.27) USER MOD Single : A 28 ASN : amide:sc= -0.0355 K(o=-0.035,f=-1.3) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -1.31 X(o=-1.3,f=-1.6) USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 THR OG1 : rot 150:sc= 0.994 USER MOD Single : A 46 SER OG : rot -55:sc= -1.36 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 HIS : no HE2:sc= -1.41 X(o=-1.4,f=-1.3) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 ASN : amide:sc= -0.88 K(o=-0.88,f=-2.2!) USER MOD Single : A 56 TYR OH : rot -72:sc= 1.25 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 81 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.0132) USER MOD Single : A 82 HIS : no HD1:sc= -0.56 K(o=-0.56,f=-6.6!) USER MOD Single : A 83 SER OG : rot 170:sc= 0.295 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 ASN : amide:sc= -0.544 K(o=-0.54,f=-3.4!) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot -59:sc= 0.29 USER MOD Single : A 92 HIS : no HD1:sc= -2 X(o=-2,f=-2.1) USER MOD Single : A 93 TYR OH : rot -51:sc= 0.538 USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 104 HIS : no HD1:sc= -1.01 K(o=-1,f=-1.9) USER MOD Single : A 106 TYR OH : rot -64:sc= -2.37 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 SER OG : rot -130:sc= -0.0259 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 ASN : amide:sc= -0.972 X(o=-0.97,f=-1) USER MOD Single : A 124 TYR OH : rot 180:sc=-0.00275 USER MOD Single : A 125 THR OG1 : rot 180:sc= 0.0845 USER MOD Single : A 126 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 ASN : amide:sc= -0.381 X(o=-0.38,f=-0.21) USER MOD Single : A 129 LYS NZ :NH3+ -143:sc= -1.63 (180deg=-3.65!) USER MOD Single : A 137 HIS : no HE2:sc= 0.672 K(o=0.67,f=-4.3!) USER MOD Single : A 138 THR OG1 : rot 180:sc= 0.0683 USER MOD Single : A 141 ASN : amide:sc= -1.19 K(o=-1.2,f=-2.1) USER MOD Single : A 146 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 SER OG : rot 180:sc= 0 USER MOD Single : A 150 HIS : no HD1:sc= -2.81 X(o=-2.8,f=-2.8!) USER MOD ----------------------------------------------------------------- ATOM 11 N VAL A 2 3.711 -7.851 -15.475 1.00 0.00 N ATOM 12 CA VAL A 2 3.363 -9.179 -14.964 1.00 0.00 C ATOM 13 C VAL A 2 1.946 -9.110 -14.343 1.00 0.00 C ATOM 14 O VAL A 2 1.440 -8.026 -14.065 1.00 0.00 O ATOM 15 CB VAL A 2 4.451 -9.626 -13.956 1.00 0.00 C ATOM 16 CG1 VAL A 2 4.247 -11.094 -13.649 1.00 0.00 C ATOM 17 CG2 VAL A 2 5.885 -9.611 -14.481 1.00 0.00 C ATOM 0 HA VAL A 2 3.335 -9.926 -15.757 1.00 0.00 H new ATOM 0 HB VAL A 2 4.345 -8.924 -13.129 1.00 0.00 H new ATOM 0 HG11 VAL A 2 5.005 -11.426 -12.940 1.00 0.00 H new ATOM 0 HG12 VAL A 2 3.257 -11.241 -13.217 1.00 0.00 H new ATOM 0 HG13 VAL A 2 4.332 -11.673 -14.569 1.00 0.00 H new ATOM 0 HG21 VAL A 2 6.564 -9.941 -13.695 1.00 0.00 H new ATOM 0 HG22 VAL A 2 5.966 -10.282 -15.336 1.00 0.00 H new ATOM 0 HG23 VAL A 2 6.150 -8.599 -14.787 1.00 0.00 H new ATOM 27 N THR A 3 1.368 -10.288 -14.106 1.00 0.00 N ATOM 28 CA THR A 3 0.030 -10.444 -13.503 1.00 0.00 C ATOM 29 C THR A 3 0.112 -11.002 -12.072 1.00 0.00 C ATOM 30 O THR A 3 0.058 -12.202 -11.846 1.00 0.00 O ATOM 31 CB THR A 3 -0.842 -11.241 -14.488 1.00 0.00 C ATOM 32 OG1 THR A 3 -1.547 -10.254 -15.247 1.00 0.00 O ATOM 33 CG2 THR A 3 -1.844 -12.274 -13.936 1.00 0.00 C ATOM 0 H THR A 3 1.816 -11.177 -14.328 1.00 0.00 H new ATOM 0 HA THR A 3 -0.458 -9.481 -13.356 1.00 0.00 H new ATOM 0 HB THR A 3 -0.157 -11.881 -15.045 1.00 0.00 H new ATOM 0 HG1 THR A 3 -2.126 -10.697 -15.902 1.00 0.00 H new ATOM 0 HG21 THR A 3 -2.375 -12.744 -14.764 1.00 0.00 H new ATOM 0 HG22 THR A 3 -1.307 -13.036 -13.371 1.00 0.00 H new ATOM 0 HG23 THR A 3 -2.559 -11.774 -13.283 1.00 0.00 H new ATOM 41 N TRP A 4 0.275 -10.110 -11.114 1.00 0.00 N ATOM 42 CA TRP A 4 0.337 -10.510 -9.703 1.00 0.00 C ATOM 43 C TRP A 4 -1.067 -10.732 -9.147 1.00 0.00 C ATOM 44 O TRP A 4 -1.874 -9.817 -9.053 1.00 0.00 O ATOM 45 CB TRP A 4 1.079 -9.456 -8.873 1.00 0.00 C ATOM 46 CG TRP A 4 2.580 -9.403 -9.176 1.00 0.00 C ATOM 47 CD1 TRP A 4 3.148 -9.053 -10.326 1.00 0.00 C ATOM 48 CD2 TRP A 4 3.611 -9.696 -8.288 1.00 0.00 C ATOM 49 NE1 TRP A 4 4.479 -9.106 -10.228 1.00 0.00 N ATOM 50 CE2 TRP A 4 4.808 -9.490 -8.993 1.00 0.00 C ATOM 51 CE3 TRP A 4 3.628 -10.174 -6.955 1.00 0.00 C ATOM 52 CZ2 TRP A 4 6.056 -9.759 -8.394 1.00 0.00 C ATOM 53 CZ3 TRP A 4 4.875 -10.454 -6.366 1.00 0.00 C ATOM 54 CH2 TRP A 4 6.072 -10.248 -7.070 1.00 0.00 C ATOM 0 H TRP A 4 0.367 -9.107 -11.275 1.00 0.00 H new ATOM 0 HA TRP A 4 0.888 -11.448 -9.639 1.00 0.00 H new ATOM 0 HB2 TRP A 4 0.641 -8.477 -9.064 1.00 0.00 H new ATOM 0 HB3 TRP A 4 0.935 -9.668 -7.814 1.00 0.00 H new ATOM 0 HD1 TRP A 4 2.608 -8.766 -11.216 1.00 0.00 H new ATOM 0 HE1 TRP A 4 5.137 -8.888 -10.976 1.00 0.00 H new ATOM 0 HE3 TRP A 4 2.710 -10.320 -6.406 1.00 0.00 H new ATOM 0 HZ2 TRP A 4 6.976 -9.595 -8.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 4 4.912 -10.834 -5.356 1.00 0.00 H new ATOM 0 HH2 TRP A 4 7.016 -10.466 -6.593 1.00 0.00 H new ATOM 65 N THR A 5 -1.362 -11.978 -8.830 1.00 0.00 N ATOM 66 CA THR A 5 -2.695 -12.406 -8.367 1.00 0.00 C ATOM 67 C THR A 5 -2.597 -12.832 -6.896 1.00 0.00 C ATOM 68 O THR A 5 -1.594 -13.394 -6.450 1.00 0.00 O ATOM 69 CB THR A 5 -3.211 -13.536 -9.254 1.00 0.00 C ATOM 70 OG1 THR A 5 -2.972 -13.173 -10.623 1.00 0.00 O ATOM 71 CG2 THR A 5 -4.726 -13.741 -9.110 1.00 0.00 C ATOM 0 H THR A 5 -0.685 -12.739 -8.883 1.00 0.00 H new ATOM 0 HA THR A 5 -3.407 -11.584 -8.439 1.00 0.00 H new ATOM 0 HB THR A 5 -2.698 -14.451 -8.958 1.00 0.00 H new ATOM 0 HG1 THR A 5 -3.295 -13.887 -11.212 1.00 0.00 H new ATOM 0 HG21 THR A 5 -5.046 -14.555 -9.760 1.00 0.00 H new ATOM 0 HG22 THR A 5 -4.963 -13.988 -8.075 1.00 0.00 H new ATOM 0 HG23 THR A 5 -5.246 -12.825 -9.392 1.00 0.00 H new ATOM 79 N CYS A 6 -3.606 -12.423 -6.154 1.00 0.00 N ATOM 80 CA CYS A 6 -3.735 -12.705 -4.714 1.00 0.00 C ATOM 81 C CYS A 6 -5.071 -13.381 -4.430 1.00 0.00 C ATOM 82 O CYS A 6 -6.038 -13.241 -5.170 1.00 0.00 O ATOM 83 CB CYS A 6 -3.622 -11.415 -3.907 1.00 0.00 C ATOM 84 SG CYS A 6 -2.093 -11.410 -2.909 1.00 0.00 S ATOM 0 H CYS A 6 -4.380 -11.875 -6.529 1.00 0.00 H new ATOM 0 HA CYS A 6 -2.928 -13.375 -4.418 1.00 0.00 H new ATOM 0 HB2 CYS A 6 -3.626 -10.558 -4.580 1.00 0.00 H new ATOM 0 HB3 CYS A 6 -4.489 -11.311 -3.254 1.00 0.00 H new ATOM 89 N LEU A 7 -5.082 -14.128 -3.337 1.00 0.00 N ATOM 90 CA LEU A 7 -6.265 -14.894 -2.916 1.00 0.00 C ATOM 91 C LEU A 7 -6.748 -14.419 -1.533 1.00 0.00 C ATOM 92 O LEU A 7 -6.319 -14.899 -0.486 1.00 0.00 O ATOM 93 CB LEU A 7 -5.931 -16.391 -2.925 1.00 0.00 C ATOM 94 CG LEU A 7 -5.897 -16.973 -4.338 1.00 0.00 C ATOM 95 CD1 LEU A 7 -4.971 -18.181 -4.385 1.00 0.00 C ATOM 96 CD2 LEU A 7 -7.288 -17.387 -4.779 1.00 0.00 C ATOM 0 H LEU A 7 -4.281 -14.226 -2.714 1.00 0.00 H new ATOM 0 HA LEU A 7 -7.083 -14.724 -3.616 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -4.964 -16.547 -2.447 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -6.670 -16.929 -2.331 1.00 0.00 H new ATOM 0 HG LEU A 7 -5.525 -16.204 -5.015 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -4.954 -18.588 -5.396 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -3.964 -17.879 -4.099 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -5.331 -18.943 -3.694 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -7.243 -17.799 -5.787 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.677 -18.142 -4.096 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -7.946 -16.518 -4.771 1.00 0.00 H new ATOM 108 N ASN A 8 -7.525 -13.349 -1.576 1.00 0.00 N ATOM 109 CA ASN A 8 -8.067 -12.708 -0.368 1.00 0.00 C ATOM 110 C ASN A 8 -9.394 -13.378 -0.004 1.00 0.00 C ATOM 111 O ASN A 8 -10.152 -13.811 -0.876 1.00 0.00 O ATOM 112 CB ASN A 8 -8.316 -11.210 -0.592 1.00 0.00 C ATOM 113 CG ASN A 8 -7.093 -10.484 -1.173 1.00 0.00 C ATOM 114 OD1 ASN A 8 -6.526 -9.574 -0.425 1.00 0.00 O flip ATOM 115 ND2 ASN A 8 -6.645 -10.724 -2.285 1.00 0.00 N flip ATOM 0 H ASN A 8 -7.803 -12.893 -2.445 1.00 0.00 H new ATOM 0 HA ASN A 8 -7.339 -12.821 0.435 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -9.162 -11.084 -1.267 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -8.592 -10.747 0.355 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -7.086 -11.434 -2.870 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -5.830 -10.215 -2.627 1.00 0.00 H new ATOM 122 N ASP A 9 -9.675 -13.388 1.285 1.00 0.00 N ATOM 123 CA ASP A 9 -10.926 -13.973 1.773 1.00 0.00 C ATOM 124 C ASP A 9 -12.030 -12.890 1.792 1.00 0.00 C ATOM 125 O ASP A 9 -11.745 -11.713 1.974 1.00 0.00 O ATOM 126 CB ASP A 9 -10.640 -14.578 3.145 1.00 0.00 C ATOM 127 CG ASP A 9 -11.366 -15.907 3.436 1.00 0.00 C ATOM 128 OD1 ASP A 9 -12.181 -16.324 2.582 1.00 0.00 O ATOM 129 OD2 ASP A 9 -11.221 -16.362 4.582 1.00 0.00 O ATOM 0 H ASP A 9 -9.069 -13.005 2.011 1.00 0.00 H new ATOM 0 HA ASP A 9 -11.295 -14.765 1.122 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -9.566 -14.740 3.237 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -10.919 -13.854 3.910 1.00 0.00 H new ATOM 134 N GLN A 10 -13.260 -13.295 1.521 1.00 0.00 N ATOM 135 CA GLN A 10 -14.436 -12.410 1.460 1.00 0.00 C ATOM 136 C GLN A 10 -15.679 -13.060 2.064 1.00 0.00 C ATOM 137 O GLN A 10 -16.103 -14.120 1.607 1.00 0.00 O ATOM 138 CB GLN A 10 -14.730 -11.991 0.022 1.00 0.00 C ATOM 139 CG GLN A 10 -13.850 -10.804 -0.365 1.00 0.00 C ATOM 140 CD GLN A 10 -14.101 -10.331 -1.794 1.00 0.00 C ATOM 141 OE1 GLN A 10 -15.160 -10.490 -2.388 1.00 0.00 O ATOM 142 NE2 GLN A 10 -13.101 -9.702 -2.367 1.00 0.00 N ATOM 0 H GLN A 10 -13.485 -14.271 1.331 1.00 0.00 H new ATOM 0 HA GLN A 10 -14.192 -11.528 2.052 1.00 0.00 H new ATOM 0 HB2 GLN A 10 -14.547 -12.826 -0.654 1.00 0.00 H new ATOM 0 HB3 GLN A 10 -15.782 -11.723 -0.080 1.00 0.00 H new ATOM 0 HG2 GLN A 10 -14.034 -9.980 0.324 1.00 0.00 H new ATOM 0 HG3 GLN A 10 -12.802 -11.083 -0.257 1.00 0.00 H new ATOM 0 HE21 GLN A 10 -12.223 -9.575 -1.864 1.00 0.00 H new ATOM 0 HE22 GLN A 10 -13.202 -9.341 -3.315 1.00 0.00 H new ATOM 151 N LYS A 11 -16.110 -12.502 3.188 1.00 0.00 N ATOM 152 CA LYS A 11 -17.293 -12.992 3.916 1.00 0.00 C ATOM 153 C LYS A 11 -18.542 -12.474 3.215 1.00 0.00 C ATOM 154 O LYS A 11 -19.128 -11.444 3.571 1.00 0.00 O ATOM 155 CB LYS A 11 -17.249 -12.571 5.389 1.00 0.00 C ATOM 156 CG LYS A 11 -18.460 -13.111 6.166 1.00 0.00 C ATOM 157 CD LYS A 11 -18.756 -12.151 7.314 1.00 0.00 C ATOM 158 CE LYS A 11 -18.689 -12.885 8.646 1.00 0.00 C ATOM 159 NZ LYS A 11 -17.911 -12.071 9.586 1.00 0.00 N ATOM 0 H LYS A 11 -15.658 -11.700 3.626 1.00 0.00 H new ATOM 0 HA LYS A 11 -17.307 -14.082 3.908 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -16.330 -12.937 5.846 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -17.227 -11.483 5.457 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -19.326 -13.197 5.509 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -18.251 -14.110 6.550 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -18.038 -11.331 7.306 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -19.744 -11.710 7.183 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -19.693 -13.057 9.035 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -18.225 -13.863 8.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -17.855 -12.558 10.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -16.952 -11.929 9.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -18.374 -11.148 9.712 1.00 0.00 H new ATOM 173 N ASN A 12 -18.893 -13.192 2.167 1.00 0.00 N ATOM 174 CA ASN A 12 -20.077 -12.871 1.353 1.00 0.00 C ATOM 175 C ASN A 12 -21.307 -12.857 2.261 1.00 0.00 C ATOM 176 O ASN A 12 -21.475 -13.817 3.006 1.00 0.00 O ATOM 177 CB ASN A 12 -20.262 -13.928 0.263 1.00 0.00 C ATOM 178 CG ASN A 12 -20.802 -13.249 -0.995 1.00 0.00 C ATOM 179 OD1 ASN A 12 -20.438 -12.138 -1.355 1.00 0.00 O ATOM 180 ND2 ASN A 12 -21.728 -13.894 -1.667 1.00 0.00 N ATOM 0 H ASN A 12 -18.378 -14.012 1.847 1.00 0.00 H new ATOM 0 HA ASN A 12 -19.946 -11.896 0.883 1.00 0.00 H new ATOM 0 HB2 ASN A 12 -19.313 -14.419 0.049 1.00 0.00 H new ATOM 0 HB3 ASN A 12 -20.952 -14.701 0.600 1.00 0.00 H new ATOM 0 HD21 ASN A 12 -22.148 -13.469 -2.494 1.00 0.00 H new ATOM 0 HD22 ASN A 12 -22.028 -14.820 -1.362 1.00 0.00 H new ATOM 187 N PRO A 13 -22.106 -11.789 2.255 1.00 0.00 N ATOM 188 CA PRO A 13 -23.312 -11.682 3.108 1.00 0.00 C ATOM 189 C PRO A 13 -24.454 -12.575 2.616 1.00 0.00 C ATOM 190 O PRO A 13 -25.196 -13.127 3.428 1.00 0.00 O ATOM 191 CB PRO A 13 -23.671 -10.197 3.079 1.00 0.00 C ATOM 192 CG PRO A 13 -23.108 -9.673 1.761 1.00 0.00 C ATOM 193 CD PRO A 13 -21.904 -10.576 1.443 1.00 0.00 C ATOM 0 HA PRO A 13 -23.127 -12.032 4.123 1.00 0.00 H new ATOM 0 HB2 PRO A 13 -24.750 -10.052 3.131 1.00 0.00 H new ATOM 0 HB3 PRO A 13 -23.237 -9.671 3.929 1.00 0.00 H new ATOM 0 HG2 PRO A 13 -23.855 -9.720 0.968 1.00 0.00 H new ATOM 0 HG3 PRO A 13 -22.804 -8.630 1.851 1.00 0.00 H new ATOM 0 HD2 PRO A 13 -21.861 -10.816 0.381 1.00 0.00 H new ATOM 0 HD3 PRO A 13 -20.965 -10.084 1.697 1.00 0.00 H new ATOM 201 N LYS A 14 -24.470 -12.842 1.309 1.00 0.00 N ATOM 202 CA LYS A 14 -25.472 -13.731 0.685 1.00 0.00 C ATOM 203 C LYS A 14 -25.360 -15.154 1.230 1.00 0.00 C ATOM 204 O LYS A 14 -26.329 -15.748 1.687 1.00 0.00 O ATOM 205 CB LYS A 14 -25.330 -13.687 -0.839 1.00 0.00 C ATOM 206 CG LYS A 14 -26.235 -14.712 -1.551 1.00 0.00 C ATOM 207 CD LYS A 14 -26.909 -14.101 -2.775 1.00 0.00 C ATOM 208 CE LYS A 14 -26.954 -15.117 -3.911 1.00 0.00 C ATOM 209 NZ LYS A 14 -28.346 -15.476 -4.234 1.00 0.00 N ATOM 0 H LYS A 14 -23.796 -12.454 0.649 1.00 0.00 H new ATOM 0 HA LYS A 14 -26.470 -13.375 0.941 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -25.573 -12.685 -1.194 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -24.291 -13.877 -1.109 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -25.642 -15.576 -1.853 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -26.994 -15.073 -0.858 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -27.920 -13.782 -2.522 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -26.365 -13.212 -3.093 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -26.465 -14.705 -4.794 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -26.399 -16.011 -3.628 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -28.355 -16.169 -5.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -28.801 -15.889 -3.395 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -28.866 -14.624 -4.525 1.00 0.00 H new ATOM 223 N THR A 15 -24.127 -15.650 1.229 1.00 0.00 N ATOM 224 CA THR A 15 -23.842 -17.003 1.705 1.00 0.00 C ATOM 225 C THR A 15 -23.373 -17.012 3.168 1.00 0.00 C ATOM 226 O THR A 15 -23.099 -18.074 3.709 1.00 0.00 O ATOM 227 CB THR A 15 -22.794 -17.626 0.775 1.00 0.00 C ATOM 228 OG1 THR A 15 -21.646 -16.763 0.764 1.00 0.00 O ATOM 229 CG2 THR A 15 -23.344 -17.831 -0.642 1.00 0.00 C ATOM 0 H THR A 15 -23.308 -15.137 0.904 1.00 0.00 H new ATOM 0 HA THR A 15 -24.757 -17.595 1.682 1.00 0.00 H new ATOM 0 HB THR A 15 -22.519 -18.615 1.143 1.00 0.00 H new ATOM 0 HG1 THR A 15 -20.959 -17.141 0.176 1.00 0.00 H new ATOM 0 HG21 THR A 15 -22.572 -18.274 -1.271 1.00 0.00 H new ATOM 0 HG22 THR A 15 -24.207 -18.495 -0.605 1.00 0.00 H new ATOM 0 HG23 THR A 15 -23.644 -16.869 -1.059 1.00 0.00 H new ATOM 237 N ASN A 16 -23.241 -15.812 3.755 1.00 0.00 N ATOM 238 CA ASN A 16 -22.686 -15.575 5.114 1.00 0.00 C ATOM 239 C ASN A 16 -21.401 -16.366 5.392 1.00 0.00 C ATOM 240 O ASN A 16 -21.082 -16.735 6.515 1.00 0.00 O ATOM 241 CB ASN A 16 -23.788 -15.847 6.135 1.00 0.00 C ATOM 242 CG ASN A 16 -24.039 -14.601 6.985 1.00 0.00 C ATOM 243 OD1 ASN A 16 -23.628 -14.482 8.123 1.00 0.00 O ATOM 244 ND2 ASN A 16 -24.733 -13.641 6.407 1.00 0.00 N ATOM 0 H ASN A 16 -23.523 -14.949 3.291 1.00 0.00 H new ATOM 0 HA ASN A 16 -22.372 -14.534 5.192 1.00 0.00 H new ATOM 0 HB2 ASN A 16 -24.705 -16.137 5.622 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -23.503 -16.682 6.775 1.00 0.00 H new ATOM 0 HD21 ASN A 16 -24.934 -12.780 6.915 1.00 0.00 H new ATOM 0 HD22 ASN A 16 -25.069 -13.759 5.451 1.00 0.00 H new ATOM 251 N LYS A 17 -20.695 -16.657 4.300 1.00 0.00 N ATOM 252 CA LYS A 17 -19.507 -17.507 4.331 1.00 0.00 C ATOM 253 C LYS A 17 -18.332 -16.785 3.693 1.00 0.00 C ATOM 254 O LYS A 17 -18.496 -15.854 2.907 1.00 0.00 O ATOM 255 CB LYS A 17 -19.769 -18.836 3.600 1.00 0.00 C ATOM 256 CG LYS A 17 -19.503 -20.013 4.543 1.00 0.00 C ATOM 257 CD LYS A 17 -18.759 -21.138 3.811 1.00 0.00 C ATOM 258 CE LYS A 17 -17.302 -21.213 4.270 1.00 0.00 C ATOM 259 NZ LYS A 17 -16.483 -21.842 3.223 1.00 0.00 N ATOM 0 H LYS A 17 -20.931 -16.310 3.370 1.00 0.00 H new ATOM 0 HA LYS A 17 -19.268 -17.727 5.372 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -20.799 -18.869 3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -19.127 -18.910 2.722 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -18.914 -19.676 5.396 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -20.447 -20.391 4.936 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -19.254 -22.091 4.000 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -18.798 -20.966 2.735 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -16.927 -20.213 4.486 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -17.231 -21.787 5.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -15.493 -21.891 3.539 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -16.835 -22.803 3.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -16.540 -21.278 2.351 1.00 0.00 H new ATOM 273 N TYR A 18 -17.147 -17.299 4.007 1.00 0.00 N ATOM 274 CA TYR A 18 -15.873 -16.749 3.548 1.00 0.00 C ATOM 275 C TYR A 18 -15.347 -17.505 2.332 1.00 0.00 C ATOM 276 O TYR A 18 -15.311 -18.731 2.313 1.00 0.00 O ATOM 277 CB TYR A 18 -14.867 -16.812 4.691 1.00 0.00 C ATOM 278 CG TYR A 18 -14.511 -15.421 5.237 1.00 0.00 C ATOM 279 CD1 TYR A 18 -13.920 -14.487 4.375 1.00 0.00 C ATOM 280 CD2 TYR A 18 -14.665 -15.149 6.615 1.00 0.00 C ATOM 281 CE1 TYR A 18 -13.467 -13.252 4.866 1.00 0.00 C ATOM 282 CE2 TYR A 18 -14.211 -13.903 7.115 1.00 0.00 C ATOM 283 CZ TYR A 18 -13.627 -12.974 6.237 1.00 0.00 C ATOM 284 OH TYR A 18 -13.291 -11.721 6.642 1.00 0.00 O ATOM 0 H TYR A 18 -17.042 -18.124 4.598 1.00 0.00 H new ATOM 0 HA TYR A 18 -16.024 -15.713 3.245 1.00 0.00 H new ATOM 0 HB2 TYR A 18 -15.275 -17.422 5.497 1.00 0.00 H new ATOM 0 HB3 TYR A 18 -13.959 -17.307 4.345 1.00 0.00 H new ATOM 0 HD1 TYR A 18 -13.812 -14.719 3.326 1.00 0.00 H new ATOM 0 HD2 TYR A 18 -15.119 -15.875 7.273 1.00 0.00 H new ATOM 0 HE1 TYR A 18 -13.006 -12.531 4.207 1.00 0.00 H new ATOM 0 HE2 TYR A 18 -14.313 -13.669 8.164 1.00 0.00 H new ATOM 0 HH TYR A 18 -13.728 -11.525 7.497 1.00 0.00 H new ATOM 294 N GLU A 19 -15.068 -16.732 1.288 1.00 0.00 N ATOM 295 CA GLU A 19 -14.584 -17.304 0.016 1.00 0.00 C ATOM 296 C GLU A 19 -13.236 -16.690 -0.339 1.00 0.00 C ATOM 297 O GLU A 19 -12.987 -15.517 -0.042 1.00 0.00 O ATOM 298 CB GLU A 19 -15.567 -17.041 -1.132 1.00 0.00 C ATOM 299 CG GLU A 19 -17.035 -17.117 -0.697 1.00 0.00 C ATOM 300 CD GLU A 19 -18.023 -17.207 -1.850 1.00 0.00 C ATOM 301 OE1 GLU A 19 -17.810 -16.526 -2.882 1.00 0.00 O ATOM 302 OE2 GLU A 19 -19.028 -17.933 -1.649 1.00 0.00 O ATOM 0 H GLU A 19 -15.164 -15.717 1.287 1.00 0.00 H new ATOM 0 HA GLU A 19 -14.490 -18.382 0.150 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -15.370 -16.055 -1.552 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -15.392 -17.767 -1.926 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -17.167 -17.986 -0.052 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -17.271 -16.237 -0.099 1.00 0.00 H new ATOM 309 N THR A 20 -12.445 -17.442 -1.070 1.00 0.00 N ATOM 310 CA THR A 20 -11.086 -17.015 -1.426 1.00 0.00 C ATOM 311 C THR A 20 -11.079 -16.569 -2.895 1.00 0.00 C ATOM 312 O THR A 20 -10.897 -17.366 -3.814 1.00 0.00 O ATOM 313 CB THR A 20 -10.100 -18.149 -1.142 1.00 0.00 C ATOM 314 OG1 THR A 20 -10.416 -18.695 0.150 1.00 0.00 O ATOM 315 CG2 THR A 20 -8.655 -17.644 -1.088 1.00 0.00 C ATOM 0 H THR A 20 -12.708 -18.357 -1.437 1.00 0.00 H new ATOM 0 HA THR A 20 -10.770 -16.166 -0.821 1.00 0.00 H new ATOM 0 HB THR A 20 -10.184 -18.887 -1.940 1.00 0.00 H new ATOM 0 HG1 THR A 20 -9.798 -19.427 0.356 1.00 0.00 H new ATOM 0 HG21 THR A 20 -7.985 -18.479 -0.884 1.00 0.00 H new ATOM 0 HG22 THR A 20 -8.391 -17.192 -2.044 1.00 0.00 H new ATOM 0 HG23 THR A 20 -8.559 -16.900 -0.297 1.00 0.00 H new ATOM 323 N LYS A 21 -11.455 -15.303 -3.061 1.00 0.00 N ATOM 324 CA LYS A 21 -11.489 -14.647 -4.380 1.00 0.00 C ATOM 325 C LYS A 21 -10.067 -14.558 -4.977 1.00 0.00 C ATOM 326 O LYS A 21 -9.085 -14.899 -4.320 1.00 0.00 O ATOM 327 CB LYS A 21 -12.123 -13.258 -4.248 1.00 0.00 C ATOM 328 CG LYS A 21 -13.618 -13.333 -3.920 1.00 0.00 C ATOM 329 CD LYS A 21 -14.466 -13.657 -5.158 1.00 0.00 C ATOM 330 CE LYS A 21 -15.956 -13.628 -4.789 1.00 0.00 C ATOM 331 NZ LYS A 21 -16.712 -13.001 -5.885 1.00 0.00 N ATOM 0 H LYS A 21 -11.745 -14.699 -2.292 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.097 -15.242 -5.062 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -11.609 -12.699 -3.466 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -11.984 -12.707 -5.178 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -13.784 -14.095 -3.158 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -13.944 -12.383 -3.497 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -14.263 -12.934 -5.948 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -14.197 -14.639 -5.548 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -16.319 -14.640 -4.613 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -16.103 -13.071 -3.864 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -17.723 -12.978 -5.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -16.369 -12.030 -6.032 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -16.579 -13.551 -6.758 1.00 0.00 H new ATOM 345 N ARG A 22 -9.990 -14.128 -6.228 1.00 0.00 N ATOM 346 CA ARG A 22 -8.717 -14.054 -6.961 1.00 0.00 C ATOM 347 C ARG A 22 -8.489 -12.639 -7.510 1.00 0.00 C ATOM 348 O ARG A 22 -8.985 -12.258 -8.568 1.00 0.00 O ATOM 349 CB ARG A 22 -8.729 -15.052 -8.131 1.00 0.00 C ATOM 350 CG ARG A 22 -8.833 -16.491 -7.626 1.00 0.00 C ATOM 351 CD ARG A 22 -9.592 -17.392 -8.598 1.00 0.00 C ATOM 352 NE ARG A 22 -10.913 -17.719 -8.036 1.00 0.00 N ATOM 353 CZ ARG A 22 -11.929 -18.224 -8.744 1.00 0.00 C ATOM 354 NH1 ARG A 22 -11.827 -18.418 -10.046 1.00 0.00 N ATOM 355 NH2 ARG A 22 -13.075 -18.541 -8.141 1.00 0.00 N ATOM 0 H ARG A 22 -10.798 -13.820 -6.768 1.00 0.00 H new ATOM 0 HA ARG A 22 -7.910 -14.302 -6.271 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -9.569 -14.833 -8.791 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -7.820 -14.935 -8.722 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -7.832 -16.892 -7.469 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -9.335 -16.499 -6.659 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -9.708 -16.891 -9.559 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -9.026 -18.306 -8.781 1.00 0.00 H new ATOM 0 HE ARG A 22 -11.063 -17.549 -7.041 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -10.961 -18.182 -10.531 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -12.614 -18.804 -10.567 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -13.179 -18.399 -7.136 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -13.848 -18.926 -8.684 1.00 0.00 H new ATOM 369 N LEU A 23 -7.841 -11.831 -6.682 1.00 0.00 N ATOM 370 CA LEU A 23 -7.520 -10.444 -7.044 1.00 0.00 C ATOM 371 C LEU A 23 -6.265 -10.405 -7.928 1.00 0.00 C ATOM 372 O LEU A 23 -5.151 -10.573 -7.457 1.00 0.00 O ATOM 373 CB LEU A 23 -7.343 -9.603 -5.780 1.00 0.00 C ATOM 374 CG LEU A 23 -8.410 -8.495 -5.706 1.00 0.00 C ATOM 375 CD1 LEU A 23 -9.814 -9.078 -5.503 1.00 0.00 C ATOM 376 CD2 LEU A 23 -8.077 -7.553 -4.549 1.00 0.00 C ATOM 0 H LEU A 23 -7.524 -12.106 -5.752 1.00 0.00 H new ATOM 0 HA LEU A 23 -8.344 -10.019 -7.618 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -7.414 -10.242 -4.900 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -6.348 -9.157 -5.771 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.405 -7.952 -6.651 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.541 -8.267 -5.455 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -10.059 -9.736 -6.337 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.841 -9.645 -4.573 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -8.829 -6.766 -4.492 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.067 -8.114 -3.614 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.097 -7.106 -4.714 1.00 0.00 H new ATOM 388 N LEU A 24 -6.517 -10.275 -9.222 1.00 0.00 N ATOM 389 CA LEU A 24 -5.453 -10.131 -10.224 1.00 0.00 C ATOM 390 C LEU A 24 -5.089 -8.660 -10.384 1.00 0.00 C ATOM 391 O LEU A 24 -5.925 -7.799 -10.646 1.00 0.00 O ATOM 392 CB LEU A 24 -5.854 -10.897 -11.504 1.00 0.00 C ATOM 393 CG LEU A 24 -5.386 -10.390 -12.880 1.00 0.00 C ATOM 394 CD1 LEU A 24 -6.245 -9.236 -13.401 1.00 0.00 C ATOM 395 CD2 LEU A 24 -3.907 -10.012 -12.909 1.00 0.00 C ATOM 0 H LEU A 24 -7.459 -10.265 -9.613 1.00 0.00 H new ATOM 0 HA LEU A 24 -4.519 -10.596 -9.909 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -5.495 -11.920 -11.396 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.943 -10.942 -11.528 1.00 0.00 H new ATOM 0 HG LEU A 24 -5.516 -11.237 -13.553 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -5.873 -8.916 -14.374 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -7.279 -9.567 -13.499 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -6.196 -8.402 -12.701 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -3.640 -9.663 -13.906 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -3.720 -9.219 -12.185 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -3.304 -10.884 -12.657 1.00 0.00 H new ATOM 407 N TYR A 25 -3.788 -8.426 -10.257 1.00 0.00 N ATOM 408 CA TYR A 25 -3.157 -7.111 -10.418 1.00 0.00 C ATOM 409 C TYR A 25 -2.172 -7.122 -11.570 1.00 0.00 C ATOM 410 O TYR A 25 -1.616 -8.149 -11.961 1.00 0.00 O ATOM 411 CB TYR A 25 -2.410 -6.757 -9.120 1.00 0.00 C ATOM 412 CG TYR A 25 -3.383 -6.268 -8.053 1.00 0.00 C ATOM 413 CD1 TYR A 25 -4.192 -7.183 -7.347 1.00 0.00 C ATOM 414 CD2 TYR A 25 -3.431 -4.890 -7.831 1.00 0.00 C ATOM 415 CE1 TYR A 25 -5.104 -6.682 -6.395 1.00 0.00 C ATOM 416 CE2 TYR A 25 -4.296 -4.406 -6.840 1.00 0.00 C ATOM 417 CZ TYR A 25 -5.133 -5.286 -6.141 1.00 0.00 C ATOM 418 OH TYR A 25 -5.965 -4.785 -5.184 1.00 0.00 O ATOM 0 H TYR A 25 -3.120 -9.163 -10.033 1.00 0.00 H new ATOM 0 HA TYR A 25 -3.930 -6.373 -10.630 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -1.872 -7.631 -8.755 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -1.666 -5.986 -9.322 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -4.115 -8.244 -7.532 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -2.817 -4.214 -8.408 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -5.769 -7.350 -5.868 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -4.318 -3.350 -6.614 1.00 0.00 H new ATOM 0 HH TYR A 25 -5.699 -3.867 -4.967 1.00 0.00 H new ATOM 428 N ASN A 26 -1.866 -5.924 -12.027 1.00 0.00 N ATOM 429 CA ASN A 26 -0.890 -5.750 -13.100 1.00 0.00 C ATOM 430 C ASN A 26 0.324 -5.077 -12.480 1.00 0.00 C ATOM 431 O ASN A 26 0.259 -3.929 -12.036 1.00 0.00 O ATOM 432 CB ASN A 26 -1.494 -4.882 -14.204 1.00 0.00 C ATOM 433 CG ASN A 26 -1.182 -5.470 -15.575 1.00 0.00 C ATOM 434 OD1 ASN A 26 -0.331 -4.823 -16.321 1.00 0.00 O flip ATOM 435 ND2 ASN A 26 -1.702 -6.503 -15.981 1.00 0.00 N flip ATOM 0 H ASN A 26 -2.273 -5.056 -11.678 1.00 0.00 H new ATOM 0 HA ASN A 26 -0.607 -6.702 -13.549 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -2.573 -4.811 -14.069 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -1.097 -3.869 -14.137 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -2.367 -7.005 -15.392 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -1.470 -6.861 -16.907 1.00 0.00 H new ATOM 442 N GLN A 27 1.444 -5.793 -12.543 1.00 0.00 N ATOM 443 CA GLN A 27 2.757 -5.294 -12.097 1.00 0.00 C ATOM 444 C GLN A 27 3.053 -3.910 -12.690 1.00 0.00 C ATOM 445 O GLN A 27 3.645 -3.100 -11.991 1.00 0.00 O ATOM 446 CB GLN A 27 3.864 -6.241 -12.530 1.00 0.00 C ATOM 447 CG GLN A 27 5.140 -5.990 -11.743 1.00 0.00 C ATOM 448 CD GLN A 27 6.317 -5.412 -12.518 1.00 0.00 C ATOM 449 OE1 GLN A 27 6.615 -5.818 -13.623 1.00 0.00 O ATOM 450 NE2 GLN A 27 7.065 -4.531 -11.888 1.00 0.00 N ATOM 0 H GLN A 27 1.474 -6.745 -12.907 1.00 0.00 H new ATOM 0 HA GLN A 27 2.723 -5.227 -11.010 1.00 0.00 H new ATOM 0 HB2 GLN A 27 3.541 -7.272 -12.386 1.00 0.00 H new ATOM 0 HB3 GLN A 27 4.059 -6.114 -13.595 1.00 0.00 H new ATOM 0 HG2 GLN A 27 4.906 -5.312 -10.923 1.00 0.00 H new ATOM 0 HG3 GLN A 27 5.456 -6.933 -11.297 1.00 0.00 H new ATOM 0 HE21 GLN A 27 6.796 -4.204 -10.960 1.00 0.00 H new ATOM 0 HE22 GLN A 27 7.914 -4.176 -12.328 1.00 0.00 H new ATOM 459 N ASN A 28 2.469 -3.636 -13.847 1.00 0.00 N ATOM 460 CA ASN A 28 2.545 -2.334 -14.536 1.00 0.00 C ATOM 461 C ASN A 28 1.884 -1.239 -13.711 1.00 0.00 C ATOM 462 O ASN A 28 2.604 -0.488 -13.092 1.00 0.00 O ATOM 463 CB ASN A 28 1.898 -2.381 -15.912 1.00 0.00 C ATOM 464 CG ASN A 28 2.397 -1.222 -16.779 1.00 0.00 C ATOM 465 OD1 ASN A 28 3.260 -0.435 -16.415 1.00 0.00 O ATOM 466 ND2 ASN A 28 1.840 -1.144 -17.960 1.00 0.00 N ATOM 0 H ASN A 28 1.912 -4.323 -14.355 1.00 0.00 H new ATOM 0 HA ASN A 28 3.604 -2.108 -14.658 1.00 0.00 H new ATOM 0 HB2 ASN A 28 2.128 -3.330 -16.396 1.00 0.00 H new ATOM 0 HB3 ASN A 28 0.814 -2.328 -15.813 1.00 0.00 H new ATOM 0 HD21 ASN A 28 2.123 -0.410 -18.610 1.00 0.00 H new ATOM 0 HD22 ASN A 28 1.123 -1.817 -18.231 1.00 0.00 H new ATOM 473 N LYS A 29 0.569 -1.340 -13.516 1.00 0.00 N ATOM 474 CA LYS A 29 -0.183 -0.407 -12.671 1.00 0.00 C ATOM 475 C LYS A 29 0.375 -0.299 -11.251 1.00 0.00 C ATOM 476 O LYS A 29 0.341 0.780 -10.698 1.00 0.00 O ATOM 477 CB LYS A 29 -1.662 -0.786 -12.641 1.00 0.00 C ATOM 478 CG LYS A 29 -2.439 0.026 -13.679 1.00 0.00 C ATOM 479 CD LYS A 29 -1.869 -0.041 -15.084 1.00 0.00 C ATOM 480 CE LYS A 29 -2.889 0.399 -16.131 1.00 0.00 C ATOM 481 NZ LYS A 29 -2.197 0.398 -17.426 1.00 0.00 N ATOM 0 H LYS A 29 -0.006 -2.069 -13.938 1.00 0.00 H new ATOM 0 HA LYS A 29 -0.073 0.579 -13.122 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -1.776 -1.851 -12.843 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -2.071 -0.605 -11.647 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -3.470 -0.328 -13.701 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -2.466 1.068 -13.361 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -0.985 0.594 -15.148 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -1.546 -1.060 -15.297 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -3.742 -0.279 -16.148 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -3.276 1.392 -15.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -2.858 0.693 -18.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -1.395 1.060 -17.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -1.847 -0.560 -17.632 1.00 0.00 H new ATOM 495 N ALA A 30 1.116 -1.294 -10.818 1.00 0.00 N ATOM 496 CA ALA A 30 1.846 -1.282 -9.537 1.00 0.00 C ATOM 497 C ALA A 30 3.190 -0.519 -9.631 1.00 0.00 C ATOM 498 O ALA A 30 3.306 0.572 -9.080 1.00 0.00 O ATOM 499 CB ALA A 30 2.028 -2.728 -9.099 1.00 0.00 C ATOM 0 H ALA A 30 1.241 -2.158 -11.345 1.00 0.00 H new ATOM 0 HA ALA A 30 1.271 -0.738 -8.788 1.00 0.00 H new ATOM 0 HB1 ALA A 30 2.566 -2.756 -8.152 1.00 0.00 H new ATOM 0 HB2 ALA A 30 1.052 -3.196 -8.976 1.00 0.00 H new ATOM 0 HB3 ALA A 30 2.597 -3.269 -9.856 1.00 0.00 H new ATOM 505 N GLU A 31 4.143 -1.062 -10.377 1.00 0.00 N ATOM 506 CA GLU A 31 5.442 -0.423 -10.660 1.00 0.00 C ATOM 507 C GLU A 31 5.271 0.986 -11.228 1.00 0.00 C ATOM 508 O GLU A 31 6.130 1.819 -11.036 1.00 0.00 O ATOM 509 CB GLU A 31 6.321 -1.271 -11.600 1.00 0.00 C ATOM 510 CG GLU A 31 5.808 -1.396 -13.046 1.00 0.00 C ATOM 511 CD GLU A 31 6.520 -0.493 -14.055 1.00 0.00 C ATOM 512 OE1 GLU A 31 6.323 0.738 -14.009 1.00 0.00 O ATOM 513 OE2 GLU A 31 7.284 -1.086 -14.848 1.00 0.00 O ATOM 0 H GLU A 31 4.042 -1.977 -10.816 1.00 0.00 H new ATOM 0 HA GLU A 31 5.955 -0.348 -9.701 1.00 0.00 H new ATOM 0 HB2 GLU A 31 7.321 -0.839 -11.623 1.00 0.00 H new ATOM 0 HB3 GLU A 31 6.416 -2.271 -11.178 1.00 0.00 H new ATOM 0 HG2 GLU A 31 5.915 -2.432 -13.367 1.00 0.00 H new ATOM 0 HG3 GLU A 31 4.743 -1.166 -13.061 1.00 0.00 H new ATOM 520 N SER A 32 4.144 1.269 -11.863 1.00 0.00 N ATOM 521 CA SER A 32 3.797 2.582 -12.417 1.00 0.00 C ATOM 522 C SER A 32 3.131 3.473 -11.358 1.00 0.00 C ATOM 523 O SER A 32 3.578 4.600 -11.162 1.00 0.00 O ATOM 524 CB SER A 32 2.869 2.442 -13.624 1.00 0.00 C ATOM 525 OG SER A 32 2.409 3.720 -14.066 1.00 0.00 O ATOM 0 H SER A 32 3.416 0.571 -12.016 1.00 0.00 H new ATOM 0 HA SER A 32 4.727 3.052 -12.738 1.00 0.00 H new ATOM 0 HB2 SER A 32 3.395 1.940 -14.436 1.00 0.00 H new ATOM 0 HB3 SER A 32 2.017 1.815 -13.361 1.00 0.00 H new ATOM 0 HG SER A 32 1.818 3.605 -14.840 1.00 0.00 H new ATOM 531 N ASN A 33 2.203 2.919 -10.585 1.00 0.00 N ATOM 532 CA ASN A 33 1.551 3.650 -9.472 1.00 0.00 C ATOM 533 C ASN A 33 2.578 4.170 -8.459 1.00 0.00 C ATOM 534 O ASN A 33 2.562 5.332 -8.100 1.00 0.00 O ATOM 535 CB ASN A 33 0.574 2.784 -8.672 1.00 0.00 C ATOM 536 CG ASN A 33 -0.849 2.789 -9.247 1.00 0.00 C ATOM 537 OD1 ASN A 33 -1.136 3.123 -10.384 1.00 0.00 O ATOM 538 ND2 ASN A 33 -1.777 2.376 -8.409 1.00 0.00 N ATOM 0 H ASN A 33 1.875 1.960 -10.700 1.00 0.00 H new ATOM 0 HA ASN A 33 1.017 4.465 -9.962 1.00 0.00 H new ATOM 0 HB2 ASN A 33 0.945 1.759 -8.646 1.00 0.00 H new ATOM 0 HB3 ASN A 33 0.544 3.139 -7.642 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -2.751 2.332 -8.708 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -1.522 2.100 -7.461 1.00 0.00 H new ATOM 545 N SER A 34 3.492 3.282 -8.097 1.00 0.00 N ATOM 546 CA SER A 34 4.607 3.626 -7.200 1.00 0.00 C ATOM 547 C SER A 34 5.510 4.685 -7.830 1.00 0.00 C ATOM 548 O SER A 34 5.685 5.712 -7.178 1.00 0.00 O ATOM 549 CB SER A 34 5.420 2.401 -6.800 1.00 0.00 C ATOM 550 OG SER A 34 6.052 1.789 -7.918 1.00 0.00 O ATOM 0 H SER A 34 3.491 2.311 -8.408 1.00 0.00 H new ATOM 0 HA SER A 34 4.168 4.038 -6.292 1.00 0.00 H new ATOM 0 HB2 SER A 34 6.176 2.691 -6.071 1.00 0.00 H new ATOM 0 HB3 SER A 34 4.767 1.677 -6.312 1.00 0.00 H new ATOM 0 HG SER A 34 5.378 1.338 -8.468 1.00 0.00 H new ATOM 556 N HIS A 35 5.696 4.606 -9.141 1.00 0.00 N ATOM 557 CA HIS A 35 6.481 5.590 -9.912 1.00 0.00 C ATOM 558 C HIS A 35 5.697 6.881 -10.228 1.00 0.00 C ATOM 559 O HIS A 35 6.208 7.797 -10.861 1.00 0.00 O ATOM 560 CB HIS A 35 6.979 4.935 -11.208 1.00 0.00 C ATOM 561 CG HIS A 35 8.031 3.818 -11.024 1.00 0.00 C ATOM 562 ND1 HIS A 35 8.643 3.201 -12.027 1.00 0.00 N ATOM 563 CD2 HIS A 35 8.366 3.180 -9.897 1.00 0.00 C ATOM 564 CE1 HIS A 35 9.321 2.167 -11.535 1.00 0.00 C ATOM 565 NE2 HIS A 35 9.143 2.149 -10.222 1.00 0.00 N ATOM 0 H HIS A 35 5.308 3.856 -9.713 1.00 0.00 H new ATOM 0 HA HIS A 35 7.324 5.893 -9.291 1.00 0.00 H new ATOM 0 HB2 HIS A 35 6.122 4.520 -11.738 1.00 0.00 H new ATOM 0 HB3 HIS A 35 7.404 5.709 -11.847 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.060 3.453 -8.898 1.00 0.00 H new ATOM 0 HE1 HIS A 35 9.912 1.466 -12.105 1.00 0.00 H new ATOM 0 HE2 HIS A 35 9.533 1.465 -9.574 1.00 0.00 H new ATOM 574 N HIS A 36 4.473 6.947 -9.714 1.00 0.00 N ATOM 575 CA HIS A 36 3.575 8.112 -9.835 1.00 0.00 C ATOM 576 C HIS A 36 3.439 8.822 -8.487 1.00 0.00 C ATOM 577 O HIS A 36 3.468 10.051 -8.411 1.00 0.00 O ATOM 578 CB HIS A 36 2.214 7.635 -10.347 1.00 0.00 C ATOM 579 CG HIS A 36 1.824 8.347 -11.653 1.00 0.00 C ATOM 580 ND1 HIS A 36 0.915 9.312 -11.748 1.00 0.00 N ATOM 581 CD2 HIS A 36 2.308 8.109 -12.866 1.00 0.00 C ATOM 582 CE1 HIS A 36 0.833 9.678 -13.022 1.00 0.00 C ATOM 583 NE2 HIS A 36 1.694 8.939 -13.710 1.00 0.00 N ATOM 0 H HIS A 36 4.059 6.178 -9.187 1.00 0.00 H new ATOM 0 HA HIS A 36 3.991 8.829 -10.543 1.00 0.00 H new ATOM 0 HB2 HIS A 36 2.243 6.558 -10.513 1.00 0.00 H new ATOM 0 HB3 HIS A 36 1.453 7.820 -9.589 1.00 0.00 H new ATOM 0 HD2 HIS A 36 3.060 7.378 -13.122 1.00 0.00 H new ATOM 0 HE1 HIS A 36 0.183 10.440 -13.425 1.00 0.00 H new ATOM 0 HE2 HIS A 36 1.858 8.996 -14.715 1.00 0.00 H new ATOM 592 N ALA A 37 3.357 8.032 -7.415 1.00 0.00 N ATOM 593 CA ALA A 37 3.325 8.528 -6.033 1.00 0.00 C ATOM 594 C ALA A 37 4.681 9.083 -5.578 1.00 0.00 C ATOM 595 O ALA A 37 5.720 8.573 -6.023 1.00 0.00 O ATOM 596 CB ALA A 37 2.840 7.401 -5.118 1.00 0.00 C ATOM 0 H ALA A 37 3.310 7.015 -7.481 1.00 0.00 H new ATOM 0 HA ALA A 37 2.631 9.367 -5.978 1.00 0.00 H new ATOM 0 HB1 ALA A 37 2.811 7.756 -4.088 1.00 0.00 H new ATOM 0 HB2 ALA A 37 1.841 7.090 -5.423 1.00 0.00 H new ATOM 0 HB3 ALA A 37 3.522 6.554 -5.191 1.00 0.00 H new ATOM 602 N PRO A 38 4.695 10.141 -4.756 1.00 0.00 N ATOM 603 CA PRO A 38 5.938 10.750 -4.258 1.00 0.00 C ATOM 604 C PRO A 38 6.601 9.827 -3.247 1.00 0.00 C ATOM 605 O PRO A 38 5.949 9.104 -2.514 1.00 0.00 O ATOM 606 CB PRO A 38 5.515 12.079 -3.632 1.00 0.00 C ATOM 607 CG PRO A 38 4.054 11.902 -3.231 1.00 0.00 C ATOM 608 CD PRO A 38 3.521 10.852 -4.210 1.00 0.00 C ATOM 0 HA PRO A 38 6.673 10.912 -5.046 1.00 0.00 H new ATOM 0 HB2 PRO A 38 6.132 12.317 -2.766 1.00 0.00 H new ATOM 0 HB3 PRO A 38 5.630 12.899 -4.341 1.00 0.00 H new ATOM 0 HG2 PRO A 38 3.962 11.566 -2.198 1.00 0.00 H new ATOM 0 HG3 PRO A 38 3.502 12.839 -3.312 1.00 0.00 H new ATOM 0 HD2 PRO A 38 2.850 10.158 -3.704 1.00 0.00 H new ATOM 0 HD3 PRO A 38 2.949 11.324 -5.009 1.00 0.00 H new ATOM 616 N LEU A 39 7.921 9.857 -3.211 1.00 0.00 N ATOM 617 CA LEU A 39 8.682 9.012 -2.273 1.00 0.00 C ATOM 618 C LEU A 39 8.875 9.696 -0.918 1.00 0.00 C ATOM 619 O LEU A 39 9.848 10.419 -0.671 1.00 0.00 O ATOM 620 CB LEU A 39 10.016 8.758 -2.935 1.00 0.00 C ATOM 621 CG LEU A 39 9.936 7.633 -3.955 1.00 0.00 C ATOM 622 CD1 LEU A 39 11.129 7.784 -4.909 1.00 0.00 C ATOM 623 CD2 LEU A 39 9.875 6.269 -3.271 1.00 0.00 C ATOM 0 H LEU A 39 8.496 10.449 -3.811 1.00 0.00 H new ATOM 0 HA LEU A 39 8.146 8.085 -2.068 1.00 0.00 H new ATOM 0 HB2 LEU A 39 10.358 9.670 -3.425 1.00 0.00 H new ATOM 0 HB3 LEU A 39 10.757 8.508 -2.176 1.00 0.00 H new ATOM 0 HG LEU A 39 9.015 7.697 -4.535 1.00 0.00 H new ATOM 0 HD11 LEU A 39 11.101 6.990 -5.655 1.00 0.00 H new ATOM 0 HD12 LEU A 39 11.076 8.752 -5.407 1.00 0.00 H new ATOM 0 HD13 LEU A 39 12.058 7.717 -4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 39 9.818 5.485 -4.026 1.00 0.00 H new ATOM 0 HD22 LEU A 39 10.770 6.125 -2.665 1.00 0.00 H new ATOM 0 HD23 LEU A 39 8.993 6.221 -2.632 1.00 0.00 H new ATOM 635 N SER A 40 7.873 9.481 -0.075 1.00 0.00 N ATOM 636 CA SER A 40 7.815 10.122 1.249 1.00 0.00 C ATOM 637 C SER A 40 6.834 9.407 2.158 1.00 0.00 C ATOM 638 O SER A 40 5.648 9.333 1.850 1.00 0.00 O ATOM 639 CB SER A 40 7.453 11.613 1.128 1.00 0.00 C ATOM 640 OG SER A 40 6.496 11.850 0.082 1.00 0.00 O ATOM 0 H SER A 40 7.084 8.867 -0.278 1.00 0.00 H new ATOM 0 HA SER A 40 8.807 10.049 1.695 1.00 0.00 H new ATOM 0 HB2 SER A 40 7.049 11.966 2.077 1.00 0.00 H new ATOM 0 HB3 SER A 40 8.356 12.191 0.931 1.00 0.00 H new ATOM 0 HG SER A 40 6.290 12.807 0.038 1.00 0.00 H new ATOM 646 N ASP A 41 7.368 8.889 3.253 1.00 0.00 N ATOM 647 CA ASP A 41 6.552 8.191 4.269 1.00 0.00 C ATOM 648 C ASP A 41 5.636 9.201 4.961 1.00 0.00 C ATOM 649 O ASP A 41 6.125 10.093 5.650 1.00 0.00 O ATOM 650 CB ASP A 41 7.443 7.496 5.305 1.00 0.00 C ATOM 651 CG ASP A 41 6.684 7.178 6.603 1.00 0.00 C ATOM 652 OD1 ASP A 41 5.637 6.498 6.519 1.00 0.00 O ATOM 653 OD2 ASP A 41 7.116 7.693 7.652 1.00 0.00 O ATOM 0 H ASP A 41 8.363 8.932 3.473 1.00 0.00 H new ATOM 0 HA ASP A 41 5.952 7.428 3.773 1.00 0.00 H new ATOM 0 HB2 ASP A 41 7.838 6.573 4.881 1.00 0.00 H new ATOM 0 HB3 ASP A 41 8.298 8.133 5.533 1.00 0.00 H new ATOM 658 N GLY A 42 4.335 8.941 4.843 1.00 0.00 N ATOM 659 CA GLY A 42 3.277 9.752 5.471 1.00 0.00 C ATOM 660 C GLY A 42 3.531 11.253 5.263 1.00 0.00 C ATOM 661 O GLY A 42 4.032 11.948 6.144 1.00 0.00 O ATOM 0 H GLY A 42 3.975 8.154 4.304 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.309 9.482 5.048 1.00 0.00 H new ATOM 0 HA3 GLY A 42 3.232 9.532 6.538 1.00 0.00 H new ATOM 665 N LYS A 43 3.341 11.660 4.014 1.00 0.00 N ATOM 666 CA LYS A 43 3.540 13.069 3.624 1.00 0.00 C ATOM 667 C LYS A 43 2.608 13.485 2.469 1.00 0.00 C ATOM 668 O LYS A 43 2.886 14.359 1.654 1.00 0.00 O ATOM 669 CB LYS A 43 5.004 13.303 3.256 1.00 0.00 C ATOM 670 CG LYS A 43 5.381 14.766 3.513 1.00 0.00 C ATOM 671 CD LYS A 43 6.101 15.379 2.310 1.00 0.00 C ATOM 672 CE LYS A 43 6.148 16.898 2.472 1.00 0.00 C ATOM 673 NZ LYS A 43 7.005 17.479 1.424 1.00 0.00 N ATOM 0 H LYS A 43 3.051 11.047 3.252 1.00 0.00 H new ATOM 0 HA LYS A 43 3.282 13.695 4.478 1.00 0.00 H new ATOM 0 HB2 LYS A 43 5.645 12.645 3.843 1.00 0.00 H new ATOM 0 HB3 LYS A 43 5.168 13.055 2.207 1.00 0.00 H new ATOM 0 HG2 LYS A 43 4.482 15.342 3.732 1.00 0.00 H new ATOM 0 HG3 LYS A 43 6.022 14.829 4.393 1.00 0.00 H new ATOM 0 HD2 LYS A 43 7.112 14.978 2.233 1.00 0.00 H new ATOM 0 HD3 LYS A 43 5.583 15.116 1.388 1.00 0.00 H new ATOM 0 HE2 LYS A 43 5.142 17.313 2.405 1.00 0.00 H new ATOM 0 HE3 LYS A 43 6.535 17.157 3.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 7.037 18.513 1.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 7.967 17.092 1.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 6.618 17.243 0.488 1.00 0.00 H new ATOM 687 N THR A 44 1.460 12.821 2.448 1.00 0.00 N ATOM 688 CA THR A 44 0.484 13.051 1.380 1.00 0.00 C ATOM 689 C THR A 44 -0.907 13.009 2.007 1.00 0.00 C ATOM 690 O THR A 44 -1.067 12.732 3.196 1.00 0.00 O ATOM 691 CB THR A 44 0.658 11.982 0.299 1.00 0.00 C ATOM 692 OG1 THR A 44 2.031 11.546 0.285 1.00 0.00 O ATOM 693 CG2 THR A 44 0.368 12.494 -1.106 1.00 0.00 C ATOM 0 H THR A 44 1.180 12.129 3.143 1.00 0.00 H new ATOM 0 HA THR A 44 0.628 14.021 0.904 1.00 0.00 H new ATOM 0 HB THR A 44 -0.047 11.187 0.544 1.00 0.00 H new ATOM 0 HG1 THR A 44 2.074 10.609 0.002 1.00 0.00 H new ATOM 0 HG21 THR A 44 0.510 11.686 -1.824 1.00 0.00 H new ATOM 0 HG22 THR A 44 -0.661 12.849 -1.159 1.00 0.00 H new ATOM 0 HG23 THR A 44 1.047 13.313 -1.342 1.00 0.00 H new ATOM 701 N GLY A 45 -1.899 13.215 1.151 1.00 0.00 N ATOM 702 CA GLY A 45 -3.293 13.300 1.579 1.00 0.00 C ATOM 703 C GLY A 45 -3.758 12.047 2.325 1.00 0.00 C ATOM 704 O GLY A 45 -3.886 12.044 3.554 1.00 0.00 O ATOM 0 H GLY A 45 -1.764 13.328 0.146 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -3.419 14.170 2.224 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -3.928 13.456 0.707 1.00 0.00 H new ATOM 708 N SER A 46 -3.863 10.957 1.579 1.00 0.00 N ATOM 709 CA SER A 46 -4.215 9.645 2.159 1.00 0.00 C ATOM 710 C SER A 46 -3.159 9.113 3.136 1.00 0.00 C ATOM 711 O SER A 46 -3.349 8.026 3.684 1.00 0.00 O ATOM 712 CB SER A 46 -4.364 8.597 1.077 1.00 0.00 C ATOM 713 OG SER A 46 -3.080 8.243 0.555 1.00 0.00 O ATOM 0 H SER A 46 -3.712 10.943 0.570 1.00 0.00 H new ATOM 0 HA SER A 46 -5.151 9.816 2.691 1.00 0.00 H new ATOM 0 HB2 SER A 46 -4.857 7.713 1.482 1.00 0.00 H new ATOM 0 HB3 SER A 46 -4.998 8.977 0.276 1.00 0.00 H new ATOM 0 HG SER A 46 -2.617 9.051 0.250 1.00 0.00 H new ATOM 719 N SER A 47 -2.010 9.799 3.176 1.00 0.00 N ATOM 720 CA SER A 47 -0.819 9.496 4.001 1.00 0.00 C ATOM 721 C SER A 47 0.103 8.472 3.291 1.00 0.00 C ATOM 722 O SER A 47 1.063 7.938 3.838 1.00 0.00 O ATOM 723 CB SER A 47 -1.257 9.016 5.388 1.00 0.00 C ATOM 724 OG SER A 47 -0.251 9.095 6.380 1.00 0.00 O ATOM 0 H SER A 47 -1.872 10.631 2.602 1.00 0.00 H new ATOM 0 HA SER A 47 -0.233 10.406 4.131 1.00 0.00 H new ATOM 0 HB2 SER A 47 -2.114 9.608 5.710 1.00 0.00 H new ATOM 0 HB3 SER A 47 -1.594 7.982 5.311 1.00 0.00 H new ATOM 0 HG SER A 47 -0.608 8.773 7.234 1.00 0.00 H new ATOM 730 N TYR A 48 -0.140 8.367 1.986 1.00 0.00 N ATOM 731 CA TYR A 48 0.559 7.434 1.092 1.00 0.00 C ATOM 732 C TYR A 48 1.484 8.133 0.088 1.00 0.00 C ATOM 733 O TYR A 48 1.081 9.148 -0.487 1.00 0.00 O ATOM 734 CB TYR A 48 -0.458 6.552 0.353 1.00 0.00 C ATOM 735 CG TYR A 48 -0.988 5.468 1.286 1.00 0.00 C ATOM 736 CD1 TYR A 48 -0.186 4.346 1.591 1.00 0.00 C ATOM 737 CD2 TYR A 48 -2.310 5.581 1.754 1.00 0.00 C ATOM 738 CE1 TYR A 48 -0.743 3.302 2.351 1.00 0.00 C ATOM 739 CE2 TYR A 48 -2.866 4.547 2.523 1.00 0.00 C ATOM 740 CZ TYR A 48 -2.071 3.419 2.813 1.00 0.00 C ATOM 741 OH TYR A 48 -2.611 2.407 3.536 1.00 0.00 O ATOM 0 H TYR A 48 -0.839 8.936 1.508 1.00 0.00 H new ATOM 0 HA TYR A 48 1.199 6.816 1.723 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -1.283 7.163 -0.013 1.00 0.00 H new ATOM 0 HB3 TYR A 48 0.011 6.095 -0.519 1.00 0.00 H new ATOM 0 HD1 TYR A 48 0.836 4.291 1.247 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -2.894 6.459 1.523 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -0.161 2.421 2.578 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -3.881 4.614 2.885 1.00 0.00 H new ATOM 0 HH TYR A 48 -3.531 2.636 3.783 1.00 0.00 H new ATOM 751 N PRO A 49 2.597 7.487 -0.271 1.00 0.00 N ATOM 752 CA PRO A 49 2.998 6.160 0.199 1.00 0.00 C ATOM 753 C PRO A 49 3.600 6.213 1.592 1.00 0.00 C ATOM 754 O PRO A 49 4.217 7.195 2.007 1.00 0.00 O ATOM 755 CB PRO A 49 3.958 5.602 -0.852 1.00 0.00 C ATOM 756 CG PRO A 49 4.506 6.844 -1.538 1.00 0.00 C ATOM 757 CD PRO A 49 3.491 7.976 -1.323 1.00 0.00 C ATOM 0 HA PRO A 49 2.138 5.499 0.303 1.00 0.00 H new ATOM 0 HB2 PRO A 49 4.754 5.013 -0.395 1.00 0.00 H new ATOM 0 HB3 PRO A 49 3.444 4.949 -1.557 1.00 0.00 H new ATOM 0 HG2 PRO A 49 5.476 7.115 -1.122 1.00 0.00 H new ATOM 0 HG3 PRO A 49 4.655 6.660 -2.602 1.00 0.00 H new ATOM 0 HD2 PRO A 49 3.987 8.899 -1.022 1.00 0.00 H new ATOM 0 HD3 PRO A 49 2.941 8.193 -2.239 1.00 0.00 H new ATOM 765 N HIS A 50 3.067 5.321 2.404 1.00 0.00 N ATOM 766 CA HIS A 50 3.554 5.223 3.784 1.00 0.00 C ATOM 767 C HIS A 50 4.715 4.224 3.838 1.00 0.00 C ATOM 768 O HIS A 50 4.914 3.410 2.937 1.00 0.00 O ATOM 769 CB HIS A 50 2.389 4.874 4.727 1.00 0.00 C ATOM 770 CG HIS A 50 1.928 3.409 4.767 1.00 0.00 C ATOM 771 ND1 HIS A 50 1.239 2.861 5.766 1.00 0.00 N ATOM 772 CD2 HIS A 50 2.205 2.425 3.917 1.00 0.00 C ATOM 773 CE1 HIS A 50 1.098 1.566 5.536 1.00 0.00 C ATOM 774 NE2 HIS A 50 1.700 1.303 4.387 1.00 0.00 N ATOM 0 H HIS A 50 2.322 4.670 2.154 1.00 0.00 H new ATOM 0 HA HIS A 50 3.945 6.180 4.129 1.00 0.00 H new ATOM 0 HB2 HIS A 50 2.675 5.165 5.738 1.00 0.00 H new ATOM 0 HB3 HIS A 50 1.534 5.489 4.448 1.00 0.00 H new ATOM 0 HD1 HIS A 50 0.878 3.360 6.579 1.00 0.00 H new ATOM 0 HD2 HIS A 50 2.754 2.529 2.993 1.00 0.00 H new ATOM 0 HE1 HIS A 50 0.587 0.855 6.168 1.00 0.00 H new ATOM 783 N TRP A 51 5.465 4.332 4.921 1.00 0.00 N ATOM 784 CA TRP A 51 6.542 3.380 5.216 1.00 0.00 C ATOM 785 C TRP A 51 5.919 2.053 5.627 1.00 0.00 C ATOM 786 O TRP A 51 5.031 1.952 6.482 1.00 0.00 O ATOM 787 CB TRP A 51 7.451 3.925 6.316 1.00 0.00 C ATOM 788 CG TRP A 51 8.376 2.891 6.953 1.00 0.00 C ATOM 789 CD1 TRP A 51 9.364 2.215 6.368 1.00 0.00 C ATOM 790 CD2 TRP A 51 8.337 2.508 8.277 1.00 0.00 C ATOM 791 NE1 TRP A 51 9.963 1.428 7.250 1.00 0.00 N ATOM 792 CE2 TRP A 51 9.383 1.578 8.441 1.00 0.00 C ATOM 793 CE3 TRP A 51 7.578 2.939 9.384 1.00 0.00 C ATOM 794 CZ2 TRP A 51 9.691 1.064 9.708 1.00 0.00 C ATOM 795 CZ3 TRP A 51 7.899 2.438 10.669 1.00 0.00 C ATOM 796 CH2 TRP A 51 8.950 1.506 10.824 1.00 0.00 C ATOM 0 H TRP A 51 5.354 5.069 5.617 1.00 0.00 H new ATOM 0 HA TRP A 51 7.158 3.229 4.329 1.00 0.00 H new ATOM 0 HB2 TRP A 51 8.059 4.729 5.900 1.00 0.00 H new ATOM 0 HB3 TRP A 51 6.830 4.366 7.096 1.00 0.00 H new ATOM 0 HD1 TRP A 51 9.637 2.297 5.326 1.00 0.00 H new ATOM 0 HE1 TRP A 51 10.745 0.805 7.049 1.00 0.00 H new ATOM 0 HE3 TRP A 51 6.766 3.639 9.254 1.00 0.00 H new ATOM 0 HZ2 TRP A 51 10.484 0.340 9.828 1.00 0.00 H new ATOM 0 HZ3 TRP A 51 7.340 2.769 11.532 1.00 0.00 H new ATOM 0 HH2 TRP A 51 9.188 1.128 11.807 1.00 0.00 H new ATOM 807 N PHE A 52 6.468 1.052 4.982 1.00 0.00 N ATOM 808 CA PHE A 52 6.079 -0.333 5.195 1.00 0.00 C ATOM 809 C PHE A 52 7.183 -0.988 6.010 1.00 0.00 C ATOM 810 O PHE A 52 8.173 -1.482 5.475 1.00 0.00 O ATOM 811 CB PHE A 52 5.961 -1.011 3.839 1.00 0.00 C ATOM 812 CG PHE A 52 5.343 -2.401 3.934 1.00 0.00 C ATOM 813 CD1 PHE A 52 4.206 -2.620 4.736 1.00 0.00 C ATOM 814 CD2 PHE A 52 5.981 -3.454 3.256 1.00 0.00 C ATOM 815 CE1 PHE A 52 3.696 -3.925 4.889 1.00 0.00 C ATOM 816 CE2 PHE A 52 5.477 -4.762 3.400 1.00 0.00 C ATOM 817 CZ PHE A 52 4.364 -4.979 4.231 1.00 0.00 C ATOM 0 H PHE A 52 7.205 1.171 4.287 1.00 0.00 H new ATOM 0 HA PHE A 52 5.126 -0.412 5.718 1.00 0.00 H new ATOM 0 HB2 PHE A 52 5.355 -0.392 3.178 1.00 0.00 H new ATOM 0 HB3 PHE A 52 6.950 -1.087 3.387 1.00 0.00 H new ATOM 0 HD1 PHE A 52 3.726 -1.790 5.233 1.00 0.00 H new ATOM 0 HD2 PHE A 52 6.844 -3.264 2.635 1.00 0.00 H new ATOM 0 HE1 PHE A 52 2.820 -4.112 5.492 1.00 0.00 H new ATOM 0 HE2 PHE A 52 5.940 -5.587 2.879 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.008 -5.989 4.371 1.00 0.00 H new ATOM 827 N THR A 53 6.925 -0.993 7.314 1.00 0.00 N ATOM 828 CA THR A 53 7.750 -1.693 8.307 1.00 0.00 C ATOM 829 C THR A 53 8.268 -3.034 7.762 1.00 0.00 C ATOM 830 O THR A 53 9.457 -3.296 7.787 1.00 0.00 O ATOM 831 CB THR A 53 6.952 -1.954 9.597 1.00 0.00 C ATOM 832 OG1 THR A 53 5.758 -2.677 9.312 1.00 0.00 O ATOM 833 CG2 THR A 53 6.513 -0.680 10.321 1.00 0.00 C ATOM 0 H THR A 53 6.127 -0.506 7.722 1.00 0.00 H new ATOM 0 HA THR A 53 8.600 -1.047 8.527 1.00 0.00 H new ATOM 0 HB THR A 53 7.637 -2.513 10.235 1.00 0.00 H new ATOM 0 HG1 THR A 53 5.265 -2.835 10.144 1.00 0.00 H new ATOM 0 HG21 THR A 53 5.956 -0.946 11.220 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.392 -0.097 10.597 1.00 0.00 H new ATOM 0 HG23 THR A 53 5.877 -0.088 9.662 1.00 0.00 H new ATOM 841 N ASN A 54 7.374 -3.752 7.075 1.00 0.00 N ATOM 842 CA ASN A 54 7.671 -5.061 6.455 1.00 0.00 C ATOM 843 C ASN A 54 8.309 -6.029 7.466 1.00 0.00 C ATOM 844 O ASN A 54 9.291 -6.719 7.210 1.00 0.00 O ATOM 845 CB ASN A 54 8.567 -4.860 5.217 1.00 0.00 C ATOM 846 CG ASN A 54 8.749 -6.182 4.447 1.00 0.00 C ATOM 847 OD1 ASN A 54 9.847 -6.638 4.162 1.00 0.00 O ATOM 848 ND2 ASN A 54 7.668 -6.871 4.202 1.00 0.00 N ATOM 0 H ASN A 54 6.413 -3.444 6.928 1.00 0.00 H new ATOM 0 HA ASN A 54 6.734 -5.516 6.133 1.00 0.00 H new ATOM 0 HB2 ASN A 54 8.124 -4.111 4.561 1.00 0.00 H new ATOM 0 HB3 ASN A 54 9.540 -4.478 5.526 1.00 0.00 H new ATOM 0 HD21 ASN A 54 7.738 -7.793 3.771 1.00 0.00 H new ATOM 0 HD22 ASN A 54 6.754 -6.487 4.441 1.00 0.00 H new ATOM 855 N GLY A 55 7.786 -5.915 8.685 1.00 0.00 N ATOM 856 CA GLY A 55 8.346 -6.619 9.850 1.00 0.00 C ATOM 857 C GLY A 55 9.467 -5.833 10.531 1.00 0.00 C ATOM 858 O GLY A 55 9.688 -5.949 11.735 1.00 0.00 O ATOM 0 H GLY A 55 6.971 -5.340 8.898 1.00 0.00 H new ATOM 0 HA2 GLY A 55 7.551 -6.809 10.571 1.00 0.00 H new ATOM 0 HA3 GLY A 55 8.728 -7.589 9.534 1.00 0.00 H new ATOM 862 N TYR A 56 10.238 -5.114 9.730 1.00 0.00 N ATOM 863 CA TYR A 56 11.377 -4.317 10.203 1.00 0.00 C ATOM 864 C TYR A 56 10.902 -3.037 10.900 1.00 0.00 C ATOM 865 O TYR A 56 9.910 -2.419 10.529 1.00 0.00 O ATOM 866 CB TYR A 56 12.211 -3.919 8.990 1.00 0.00 C ATOM 867 CG TYR A 56 12.612 -5.076 8.059 1.00 0.00 C ATOM 868 CD1 TYR A 56 13.650 -5.939 8.460 1.00 0.00 C ATOM 869 CD2 TYR A 56 11.972 -5.214 6.809 1.00 0.00 C ATOM 870 CE1 TYR A 56 14.029 -7.004 7.620 1.00 0.00 C ATOM 871 CE2 TYR A 56 12.356 -6.255 5.952 1.00 0.00 C ATOM 872 CZ TYR A 56 13.371 -7.144 6.384 1.00 0.00 C ATOM 873 OH TYR A 56 13.613 -8.251 5.654 1.00 0.00 O ATOM 0 H TYR A 56 10.095 -5.062 8.721 1.00 0.00 H new ATOM 0 HA TYR A 56 11.954 -4.910 10.913 1.00 0.00 H new ATOM 0 HB2 TYR A 56 11.651 -3.185 8.410 1.00 0.00 H new ATOM 0 HB3 TYR A 56 13.118 -3.425 9.339 1.00 0.00 H new ATOM 0 HD1 TYR A 56 14.151 -5.785 9.404 1.00 0.00 H new ATOM 0 HD2 TYR A 56 11.194 -4.525 6.515 1.00 0.00 H new ATOM 0 HE1 TYR A 56 14.804 -7.695 7.917 1.00 0.00 H new ATOM 0 HE2 TYR A 56 11.889 -6.376 4.986 1.00 0.00 H new ATOM 0 HH TYR A 56 14.517 -8.205 5.280 1.00 0.00 H new ATOM 883 N ASP A 57 11.635 -2.679 11.946 1.00 0.00 N ATOM 884 CA ASP A 57 11.300 -1.474 12.741 1.00 0.00 C ATOM 885 C ASP A 57 11.813 -0.209 12.011 1.00 0.00 C ATOM 886 O ASP A 57 12.317 -0.288 10.893 1.00 0.00 O ATOM 887 CB ASP A 57 11.927 -1.555 14.136 1.00 0.00 C ATOM 888 CG ASP A 57 11.984 -2.957 14.737 1.00 0.00 C ATOM 889 OD1 ASP A 57 10.999 -3.346 15.401 1.00 0.00 O ATOM 890 OD2 ASP A 57 13.051 -3.573 14.552 1.00 0.00 O ATOM 0 H ASP A 57 12.457 -3.188 12.271 1.00 0.00 H new ATOM 0 HA ASP A 57 10.217 -1.419 12.850 1.00 0.00 H new ATOM 0 HB2 ASP A 57 12.940 -1.156 14.086 1.00 0.00 H new ATOM 0 HB3 ASP A 57 11.363 -0.910 14.810 1.00 0.00 H new ATOM 895 N GLY A 58 11.843 0.902 12.748 1.00 0.00 N ATOM 896 CA GLY A 58 12.405 2.186 12.273 1.00 0.00 C ATOM 897 C GLY A 58 13.942 2.228 12.378 1.00 0.00 C ATOM 898 O GLY A 58 14.502 3.222 12.826 1.00 0.00 O ATOM 0 H GLY A 58 11.478 0.946 13.699 1.00 0.00 H new ATOM 0 HA2 GLY A 58 12.110 2.348 11.236 1.00 0.00 H new ATOM 0 HA3 GLY A 58 11.981 3.003 12.856 1.00 0.00 H new ATOM 1029 N THR A 67 7.985 -11.561 10.983 1.00 0.00 N ATOM 1030 CA THR A 67 7.966 -12.348 9.733 1.00 0.00 C ATOM 1031 C THR A 67 8.051 -11.463 8.477 1.00 0.00 C ATOM 1032 O THR A 67 7.039 -10.948 7.978 1.00 0.00 O ATOM 1033 CB THR A 67 6.779 -13.332 9.736 1.00 0.00 C ATOM 1034 OG1 THR A 67 6.998 -14.244 8.656 1.00 0.00 O ATOM 1035 CG2 THR A 67 5.386 -12.697 9.653 1.00 0.00 C ATOM 0 HA THR A 67 8.871 -12.954 9.692 1.00 0.00 H new ATOM 0 HB THR A 67 6.762 -13.828 10.706 1.00 0.00 H new ATOM 0 HG1 THR A 67 6.264 -14.892 8.621 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.628 -13.480 9.662 1.00 0.00 H new ATOM 0 HG22 THR A 67 5.236 -12.036 10.507 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.302 -12.122 8.731 1.00 0.00 H new ATOM 1043 N PRO A 68 9.278 -11.137 8.041 1.00 0.00 N ATOM 1044 CA PRO A 68 9.468 -10.283 6.856 1.00 0.00 C ATOM 1045 C PRO A 68 9.141 -11.083 5.589 1.00 0.00 C ATOM 1046 O PRO A 68 9.557 -12.232 5.423 1.00 0.00 O ATOM 1047 CB PRO A 68 10.917 -9.834 6.920 1.00 0.00 C ATOM 1048 CG PRO A 68 11.638 -10.918 7.725 1.00 0.00 C ATOM 1049 CD PRO A 68 10.562 -11.535 8.635 1.00 0.00 C ATOM 0 HA PRO A 68 8.809 -9.415 6.834 1.00 0.00 H new ATOM 0 HB2 PRO A 68 11.343 -9.736 5.922 1.00 0.00 H new ATOM 0 HB3 PRO A 68 11.007 -8.860 7.402 1.00 0.00 H new ATOM 0 HG2 PRO A 68 12.075 -11.670 7.068 1.00 0.00 H new ATOM 0 HG3 PRO A 68 12.453 -10.495 8.312 1.00 0.00 H new ATOM 0 HD2 PRO A 68 10.657 -12.620 8.677 1.00 0.00 H new ATOM 0 HD3 PRO A 68 10.653 -11.168 9.657 1.00 0.00 H new ATOM 1057 N ILE A 69 8.301 -10.479 4.772 1.00 0.00 N ATOM 1058 CA ILE A 69 7.899 -11.090 3.486 1.00 0.00 C ATOM 1059 C ILE A 69 9.143 -11.220 2.592 1.00 0.00 C ATOM 1060 O ILE A 69 9.787 -10.238 2.242 1.00 0.00 O ATOM 1061 CB ILE A 69 6.769 -10.295 2.794 1.00 0.00 C ATOM 1062 CG1 ILE A 69 5.524 -10.369 3.684 1.00 0.00 C ATOM 1063 CG2 ILE A 69 6.492 -10.814 1.372 1.00 0.00 C ATOM 1064 CD1 ILE A 69 4.381 -9.476 3.213 1.00 0.00 C ATOM 0 H ILE A 69 7.877 -9.571 4.959 1.00 0.00 H new ATOM 0 HA ILE A 69 7.488 -12.082 3.674 1.00 0.00 H new ATOM 0 HB ILE A 69 7.071 -9.255 2.673 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.176 -11.401 3.721 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.798 -10.088 4.701 1.00 0.00 H new ATOM 0 HG21 ILE A 69 5.691 -10.228 0.921 1.00 0.00 H new ATOM 0 HG22 ILE A 69 7.395 -10.720 0.768 1.00 0.00 H new ATOM 0 HG23 ILE A 69 6.194 -11.861 1.419 1.00 0.00 H new ATOM 0 HD11 ILE A 69 3.534 -9.581 3.891 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.711 -8.437 3.203 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.079 -9.771 2.208 1.00 0.00 H new ATOM 1076 N LYS A 70 9.410 -12.459 2.217 1.00 0.00 N ATOM 1077 CA LYS A 70 10.533 -12.767 1.341 1.00 0.00 C ATOM 1078 C LYS A 70 10.103 -12.609 -0.123 1.00 0.00 C ATOM 1079 O LYS A 70 9.282 -13.362 -0.647 1.00 0.00 O ATOM 1080 CB LYS A 70 11.066 -14.164 1.635 1.00 0.00 C ATOM 1081 CG LYS A 70 12.385 -14.430 0.892 1.00 0.00 C ATOM 1082 CD LYS A 70 13.404 -15.134 1.779 1.00 0.00 C ATOM 1083 CE LYS A 70 12.952 -16.533 2.207 1.00 0.00 C ATOM 1084 NZ LYS A 70 13.151 -16.676 3.658 1.00 0.00 N ATOM 0 H LYS A 70 8.865 -13.271 2.505 1.00 0.00 H new ATOM 0 HA LYS A 70 11.348 -12.067 1.527 1.00 0.00 H new ATOM 0 HB2 LYS A 70 11.222 -14.277 2.708 1.00 0.00 H new ATOM 0 HB3 LYS A 70 10.325 -14.907 1.341 1.00 0.00 H new ATOM 0 HG2 LYS A 70 12.188 -15.040 0.010 1.00 0.00 H new ATOM 0 HG3 LYS A 70 12.801 -13.486 0.540 1.00 0.00 H new ATOM 0 HD2 LYS A 70 14.352 -15.211 1.246 1.00 0.00 H new ATOM 0 HD3 LYS A 70 13.586 -14.528 2.667 1.00 0.00 H new ATOM 0 HE2 LYS A 70 11.903 -16.684 1.954 1.00 0.00 H new ATOM 0 HE3 LYS A 70 13.521 -17.293 1.672 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 12.847 -17.624 3.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 14.158 -16.548 3.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 12.589 -15.957 4.158 1.00 0.00 H new ATOM 1098 N PHE A 71 10.643 -11.557 -0.709 1.00 0.00 N ATOM 1099 CA PHE A 71 10.388 -11.199 -2.124 1.00 0.00 C ATOM 1100 C PHE A 71 11.298 -11.978 -3.080 1.00 0.00 C ATOM 1101 O PHE A 71 10.915 -12.341 -4.187 1.00 0.00 O ATOM 1102 CB PHE A 71 10.574 -9.698 -2.316 1.00 0.00 C ATOM 1103 CG PHE A 71 9.526 -8.893 -1.552 1.00 0.00 C ATOM 1104 CD1 PHE A 71 8.283 -8.613 -2.163 1.00 0.00 C ATOM 1105 CD2 PHE A 71 9.803 -8.417 -0.254 1.00 0.00 C ATOM 1106 CE1 PHE A 71 7.313 -7.839 -1.488 1.00 0.00 C ATOM 1107 CE2 PHE A 71 8.838 -7.651 0.441 1.00 0.00 C ATOM 1108 CZ PHE A 71 7.613 -7.370 -0.184 1.00 0.00 C ATOM 0 H PHE A 71 11.275 -10.914 -0.231 1.00 0.00 H new ATOM 0 HA PHE A 71 9.360 -11.471 -2.362 1.00 0.00 H new ATOM 0 HB2 PHE A 71 11.570 -9.409 -1.980 1.00 0.00 H new ATOM 0 HB3 PHE A 71 10.514 -9.457 -3.377 1.00 0.00 H new ATOM 0 HD1 PHE A 71 8.073 -8.993 -3.152 1.00 0.00 H new ATOM 0 HD2 PHE A 71 10.753 -8.637 0.210 1.00 0.00 H new ATOM 0 HE1 PHE A 71 6.366 -7.610 -1.954 1.00 0.00 H new ATOM 0 HE2 PHE A 71 9.041 -7.288 1.438 1.00 0.00 H new ATOM 0 HZ PHE A 71 6.878 -6.780 0.343 1.00 0.00 H new ATOM 1118 N GLY A 72 12.526 -12.211 -2.596 1.00 0.00 N ATOM 1119 CA GLY A 72 13.589 -12.918 -3.333 1.00 0.00 C ATOM 1120 C GLY A 72 14.715 -11.968 -3.745 1.00 0.00 C ATOM 1121 O GLY A 72 15.469 -12.221 -4.680 1.00 0.00 O ATOM 0 H GLY A 72 12.816 -11.909 -1.666 1.00 0.00 H new ATOM 0 HA2 GLY A 72 13.995 -13.716 -2.711 1.00 0.00 H new ATOM 0 HA3 GLY A 72 13.166 -13.389 -4.221 1.00 0.00 H new ATOM 1125 N LYS A 73 14.826 -10.854 -3.017 1.00 0.00 N ATOM 1126 CA LYS A 73 15.878 -9.867 -3.239 1.00 0.00 C ATOM 1127 C LYS A 73 16.506 -9.504 -1.901 1.00 0.00 C ATOM 1128 O LYS A 73 15.798 -9.065 -0.988 1.00 0.00 O ATOM 1129 CB LYS A 73 15.339 -8.618 -3.966 1.00 0.00 C ATOM 1130 CG LYS A 73 14.740 -8.960 -5.330 1.00 0.00 C ATOM 1131 CD LYS A 73 15.117 -7.960 -6.426 1.00 0.00 C ATOM 1132 CE LYS A 73 16.453 -8.342 -7.092 1.00 0.00 C ATOM 1133 NZ LYS A 73 17.435 -7.256 -6.918 1.00 0.00 N ATOM 0 H LYS A 73 14.188 -10.614 -2.258 1.00 0.00 H new ATOM 0 HA LYS A 73 16.640 -10.298 -3.888 1.00 0.00 H new ATOM 0 HB2 LYS A 73 14.580 -8.138 -3.347 1.00 0.00 H new ATOM 0 HB3 LYS A 73 16.147 -7.898 -4.096 1.00 0.00 H new ATOM 0 HG2 LYS A 73 15.073 -9.955 -5.626 1.00 0.00 H new ATOM 0 HG3 LYS A 73 13.654 -9.000 -5.242 1.00 0.00 H new ATOM 0 HD2 LYS A 73 14.329 -7.926 -7.178 1.00 0.00 H new ATOM 0 HD3 LYS A 73 15.193 -6.960 -5.999 1.00 0.00 H new ATOM 0 HE2 LYS A 73 16.837 -9.263 -6.653 1.00 0.00 H new ATOM 0 HE3 LYS A 73 16.297 -8.535 -8.153 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 18.332 -7.524 -7.371 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 17.072 -6.386 -7.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 17.595 -7.091 -5.904 1.00 0.00 H new ATOM 1147 N SER A 74 17.822 -9.572 -1.870 1.00 0.00 N ATOM 1148 CA SER A 74 18.624 -9.204 -0.679 1.00 0.00 C ATOM 1149 C SER A 74 18.502 -7.712 -0.346 1.00 0.00 C ATOM 1150 O SER A 74 18.818 -7.282 0.755 1.00 0.00 O ATOM 1151 CB SER A 74 20.097 -9.567 -0.891 1.00 0.00 C ATOM 1152 OG SER A 74 20.530 -10.366 0.209 1.00 0.00 O ATOM 0 H SER A 74 18.384 -9.883 -2.663 1.00 0.00 H new ATOM 0 HA SER A 74 18.228 -9.771 0.163 1.00 0.00 H new ATOM 0 HB2 SER A 74 20.222 -10.112 -1.827 1.00 0.00 H new ATOM 0 HB3 SER A 74 20.703 -8.664 -0.965 1.00 0.00 H new ATOM 0 HG SER A 74 21.472 -10.608 0.087 1.00 0.00 H new ATOM 1158 N ASP A 75 17.929 -6.960 -1.285 1.00 0.00 N ATOM 1159 CA ASP A 75 17.648 -5.521 -1.182 1.00 0.00 C ATOM 1160 C ASP A 75 16.259 -5.274 -0.606 1.00 0.00 C ATOM 1161 O ASP A 75 16.104 -4.690 0.458 1.00 0.00 O ATOM 1162 CB ASP A 75 17.724 -4.829 -2.539 1.00 0.00 C ATOM 1163 CG ASP A 75 19.094 -4.837 -3.226 1.00 0.00 C ATOM 1164 OD1 ASP A 75 19.986 -5.597 -2.772 1.00 0.00 O ATOM 1165 OD2 ASP A 75 19.166 -4.183 -4.282 1.00 0.00 O ATOM 0 H ASP A 75 17.633 -7.351 -2.180 1.00 0.00 H new ATOM 0 HA ASP A 75 18.410 -5.108 -0.521 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.003 -5.302 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.410 -3.793 -2.414 1.00 0.00 H new ATOM 1170 N CYS A 76 15.227 -5.849 -1.211 1.00 0.00 N ATOM 1171 CA CYS A 76 13.861 -5.760 -0.638 1.00 0.00 C ATOM 1172 C CYS A 76 13.746 -6.451 0.743 1.00 0.00 C ATOM 1173 O CYS A 76 12.844 -6.169 1.514 1.00 0.00 O ATOM 1174 CB CYS A 76 12.857 -6.339 -1.627 1.00 0.00 C ATOM 1175 SG CYS A 76 12.572 -5.261 -3.079 1.00 0.00 S ATOM 0 H CYS A 76 15.291 -6.376 -2.082 1.00 0.00 H new ATOM 0 HA CYS A 76 13.638 -4.707 -0.468 1.00 0.00 H new ATOM 0 HB2 CYS A 76 13.212 -7.311 -1.968 1.00 0.00 H new ATOM 0 HB3 CYS A 76 11.909 -6.508 -1.116 1.00 0.00 H new ATOM 1180 N ASP A 77 14.716 -7.317 1.022 1.00 0.00 N ATOM 1181 CA ASP A 77 14.852 -8.018 2.300 1.00 0.00 C ATOM 1182 C ASP A 77 15.819 -7.274 3.244 1.00 0.00 C ATOM 1183 O ASP A 77 15.860 -7.579 4.430 1.00 0.00 O ATOM 1184 CB ASP A 77 15.371 -9.440 2.064 1.00 0.00 C ATOM 1185 CG ASP A 77 15.392 -10.296 3.344 1.00 0.00 C ATOM 1186 OD1 ASP A 77 14.323 -10.406 3.963 1.00 0.00 O ATOM 1187 OD2 ASP A 77 16.456 -10.908 3.584 1.00 0.00 O ATOM 0 H ASP A 77 15.447 -7.558 0.353 1.00 0.00 H new ATOM 0 HA ASP A 77 13.868 -8.055 2.768 1.00 0.00 H new ATOM 0 HB2 ASP A 77 14.746 -9.929 1.317 1.00 0.00 H new ATOM 0 HB3 ASP A 77 16.379 -9.389 1.652 1.00 0.00 H new ATOM 1192 N ARG A 78 16.644 -6.399 2.702 1.00 0.00 N ATOM 1193 CA ARG A 78 17.607 -5.609 3.474 1.00 0.00 C ATOM 1194 C ARG A 78 16.905 -4.875 4.640 1.00 0.00 C ATOM 1195 O ARG A 78 15.703 -4.604 4.552 1.00 0.00 O ATOM 1196 CB ARG A 78 18.288 -4.627 2.518 1.00 0.00 C ATOM 1197 CG ARG A 78 17.670 -3.219 2.401 1.00 0.00 C ATOM 1198 CD ARG A 78 18.113 -2.482 1.129 1.00 0.00 C ATOM 1199 NE ARG A 78 19.541 -2.735 0.846 1.00 0.00 N ATOM 1200 CZ ARG A 78 20.555 -2.369 1.627 1.00 0.00 C ATOM 1201 NH1 ARG A 78 20.358 -1.714 2.764 1.00 0.00 N ATOM 1202 NH2 ARG A 78 21.787 -2.732 1.314 1.00 0.00 N ATOM 0 H ARG A 78 16.671 -6.208 1.700 1.00 0.00 H new ATOM 0 HA ARG A 78 18.358 -6.260 3.922 1.00 0.00 H new ATOM 0 HB2 ARG A 78 19.326 -4.516 2.830 1.00 0.00 H new ATOM 0 HB3 ARG A 78 18.300 -5.075 1.524 1.00 0.00 H new ATOM 0 HG2 ARG A 78 16.583 -3.302 2.408 1.00 0.00 H new ATOM 0 HG3 ARG A 78 17.951 -2.630 3.274 1.00 0.00 H new ATOM 0 HD2 ARG A 78 17.507 -2.809 0.284 1.00 0.00 H new ATOM 0 HD3 ARG A 78 17.945 -1.411 1.246 1.00 0.00 H new ATOM 0 HE ARG A 78 19.768 -3.230 -0.017 1.00 0.00 H new ATOM 0 HH11 ARG A 78 19.411 -1.478 3.059 1.00 0.00 H new ATOM 0 HH12 ARG A 78 21.154 -1.446 3.343 1.00 0.00 H new ATOM 0 HH21 ARG A 78 21.957 -3.290 0.477 1.00 0.00 H new ATOM 0 HH22 ARG A 78 22.567 -2.454 1.909 1.00 0.00 H new ATOM 1216 N PRO A 79 17.696 -4.462 5.630 1.00 0.00 N ATOM 1217 CA PRO A 79 17.161 -3.698 6.761 1.00 0.00 C ATOM 1218 C PRO A 79 16.859 -2.232 6.374 1.00 0.00 C ATOM 1219 O PRO A 79 17.777 -1.498 5.997 1.00 0.00 O ATOM 1220 CB PRO A 79 18.231 -3.885 7.828 1.00 0.00 C ATOM 1221 CG PRO A 79 19.553 -4.079 7.099 1.00 0.00 C ATOM 1222 CD PRO A 79 19.119 -4.810 5.834 1.00 0.00 C ATOM 0 HA PRO A 79 16.189 -4.037 7.119 1.00 0.00 H new ATOM 0 HB2 PRO A 79 18.276 -3.017 8.486 1.00 0.00 H new ATOM 0 HB3 PRO A 79 18.005 -4.748 8.454 1.00 0.00 H new ATOM 0 HG2 PRO A 79 20.037 -3.129 6.874 1.00 0.00 H new ATOM 0 HG3 PRO A 79 20.259 -4.666 7.686 1.00 0.00 H new ATOM 0 HD2 PRO A 79 19.722 -4.503 4.980 1.00 0.00 H new ATOM 0 HD3 PRO A 79 19.246 -5.887 5.943 1.00 0.00 H new ATOM 1230 N PRO A 80 15.576 -1.847 6.354 1.00 0.00 N ATOM 1231 CA PRO A 80 15.133 -0.495 5.998 1.00 0.00 C ATOM 1232 C PRO A 80 15.438 0.473 7.140 1.00 0.00 C ATOM 1233 O PRO A 80 15.099 0.249 8.301 1.00 0.00 O ATOM 1234 CB PRO A 80 13.630 -0.599 5.736 1.00 0.00 C ATOM 1235 CG PRO A 80 13.165 -1.828 6.486 1.00 0.00 C ATOM 1236 CD PRO A 80 14.420 -2.699 6.634 1.00 0.00 C ATOM 0 HA PRO A 80 15.650 -0.112 5.118 1.00 0.00 H new ATOM 0 HB2 PRO A 80 13.110 0.293 6.086 1.00 0.00 H new ATOM 0 HB3 PRO A 80 13.424 -0.691 4.669 1.00 0.00 H new ATOM 0 HG2 PRO A 80 12.751 -1.564 7.459 1.00 0.00 H new ATOM 0 HG3 PRO A 80 12.382 -2.353 5.938 1.00 0.00 H new ATOM 0 HD2 PRO A 80 14.483 -3.114 7.640 1.00 0.00 H new ATOM 0 HD3 PRO A 80 14.387 -3.541 5.943 1.00 0.00 H new ATOM 1244 N LYS A 81 16.025 1.584 6.730 1.00 0.00 N ATOM 1245 CA LYS A 81 16.436 2.632 7.676 1.00 0.00 C ATOM 1246 C LYS A 81 15.482 3.823 7.583 1.00 0.00 C ATOM 1247 O LYS A 81 15.628 4.725 6.755 1.00 0.00 O ATOM 1248 CB LYS A 81 17.906 2.972 7.401 1.00 0.00 C ATOM 1249 CG LYS A 81 18.624 3.335 8.701 1.00 0.00 C ATOM 1250 CD LYS A 81 20.038 2.740 8.683 1.00 0.00 C ATOM 1251 CE LYS A 81 20.936 3.333 9.772 1.00 0.00 C ATOM 1252 NZ LYS A 81 20.411 3.067 11.124 1.00 0.00 N ATOM 0 H LYS A 81 16.232 1.793 5.753 1.00 0.00 H new ATOM 0 HA LYS A 81 16.372 2.295 8.711 1.00 0.00 H new ATOM 0 HB2 LYS A 81 18.400 2.122 6.931 1.00 0.00 H new ATOM 0 HB3 LYS A 81 17.968 3.804 6.700 1.00 0.00 H new ATOM 0 HG2 LYS A 81 18.674 4.418 8.812 1.00 0.00 H new ATOM 0 HG3 LYS A 81 18.067 2.953 9.556 1.00 0.00 H new ATOM 0 HD2 LYS A 81 19.976 1.660 8.816 1.00 0.00 H new ATOM 0 HD3 LYS A 81 20.491 2.916 7.707 1.00 0.00 H new ATOM 0 HE2 LYS A 81 21.939 2.915 9.683 1.00 0.00 H new ATOM 0 HE3 LYS A 81 21.025 4.409 9.623 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 21.065 3.455 11.833 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 19.479 3.517 11.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 20.318 2.041 11.265 1.00 0.00 H new ATOM 1266 N HIS A 82 14.391 3.657 8.322 1.00 0.00 N ATOM 1267 CA HIS A 82 13.340 4.687 8.409 1.00 0.00 C ATOM 1268 C HIS A 82 13.759 5.782 9.407 1.00 0.00 C ATOM 1269 O HIS A 82 14.585 5.561 10.293 1.00 0.00 O ATOM 1270 CB HIS A 82 12.019 4.021 8.788 1.00 0.00 C ATOM 1271 CG HIS A 82 10.847 5.007 8.934 1.00 0.00 C ATOM 1272 ND1 HIS A 82 10.433 5.534 10.080 1.00 0.00 N ATOM 1273 CD2 HIS A 82 10.127 5.533 7.961 1.00 0.00 C ATOM 1274 CE1 HIS A 82 9.452 6.392 9.821 1.00 0.00 C ATOM 1275 NE2 HIS A 82 9.270 6.392 8.521 1.00 0.00 N ATOM 0 H HIS A 82 14.203 2.820 8.874 1.00 0.00 H new ATOM 0 HA HIS A 82 13.202 5.175 7.444 1.00 0.00 H new ATOM 0 HB2 HIS A 82 11.766 3.280 8.030 1.00 0.00 H new ATOM 0 HB3 HIS A 82 12.150 3.484 9.728 1.00 0.00 H new ATOM 0 HD2 HIS A 82 10.214 5.311 6.908 1.00 0.00 H new ATOM 0 HE1 HIS A 82 8.906 6.979 10.545 1.00 0.00 H new ATOM 0 HE2 HIS A 82 8.585 6.957 8.019 1.00 0.00 H new ATOM 1284 N SER A 83 13.229 6.977 9.173 1.00 0.00 N ATOM 1285 CA SER A 83 13.530 8.154 10.010 1.00 0.00 C ATOM 1286 C SER A 83 12.270 8.653 10.762 1.00 0.00 C ATOM 1287 O SER A 83 11.480 7.853 11.238 1.00 0.00 O ATOM 1288 CB SER A 83 14.201 9.254 9.157 1.00 0.00 C ATOM 1289 OG SER A 83 13.269 10.024 8.382 1.00 0.00 O ATOM 0 H SER A 83 12.583 7.167 8.407 1.00 0.00 H new ATOM 0 HA SER A 83 14.241 7.866 10.784 1.00 0.00 H new ATOM 0 HB2 SER A 83 14.757 9.924 9.813 1.00 0.00 H new ATOM 0 HB3 SER A 83 14.925 8.792 8.486 1.00 0.00 H new ATOM 0 HG SER A 83 13.727 10.798 7.994 1.00 0.00 H new ATOM 1295 N LYS A 84 12.155 9.958 10.965 1.00 0.00 N ATOM 1296 CA LYS A 84 10.951 10.572 11.551 1.00 0.00 C ATOM 1297 C LYS A 84 9.739 10.490 10.608 1.00 0.00 C ATOM 1298 O LYS A 84 8.721 9.914 10.961 1.00 0.00 O ATOM 1299 CB LYS A 84 11.280 12.031 11.902 1.00 0.00 C ATOM 1300 CG LYS A 84 10.815 12.318 13.326 1.00 0.00 C ATOM 1301 CD LYS A 84 11.993 12.551 14.293 1.00 0.00 C ATOM 1302 CE LYS A 84 12.564 13.961 14.145 1.00 0.00 C ATOM 1303 NZ LYS A 84 12.632 14.580 15.476 1.00 0.00 N ATOM 0 H LYS A 84 12.888 10.628 10.732 1.00 0.00 H new ATOM 0 HA LYS A 84 10.672 10.021 12.449 1.00 0.00 H new ATOM 0 HB2 LYS A 84 12.352 12.207 11.814 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.788 12.706 11.202 1.00 0.00 H new ATOM 0 HG2 LYS A 84 10.170 13.197 13.325 1.00 0.00 H new ATOM 0 HG3 LYS A 84 10.214 11.482 13.684 1.00 0.00 H new ATOM 0 HD2 LYS A 84 11.659 12.398 15.319 1.00 0.00 H new ATOM 0 HD3 LYS A 84 12.776 11.817 14.099 1.00 0.00 H new ATOM 0 HE2 LYS A 84 13.556 13.922 13.694 1.00 0.00 H new ATOM 0 HE3 LYS A 84 11.936 14.556 13.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 13.019 15.542 15.392 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 11.678 14.626 15.887 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 13.247 14.012 16.092 1.00 0.00 H new ATOM 1317 N ASP A 85 9.939 10.962 9.376 1.00 0.00 N ATOM 1318 CA ASP A 85 8.902 10.881 8.313 1.00 0.00 C ATOM 1319 C ASP A 85 9.350 10.029 7.117 1.00 0.00 C ATOM 1320 O ASP A 85 8.944 10.252 5.975 1.00 0.00 O ATOM 1321 CB ASP A 85 8.519 12.285 7.829 1.00 0.00 C ATOM 1322 CG ASP A 85 7.356 12.926 8.585 1.00 0.00 C ATOM 1323 OD1 ASP A 85 6.537 12.179 9.173 1.00 0.00 O ATOM 1324 OD2 ASP A 85 7.338 14.180 8.580 1.00 0.00 O ATOM 0 H ASP A 85 10.807 11.407 9.077 1.00 0.00 H new ATOM 0 HA ASP A 85 8.035 10.394 8.759 1.00 0.00 H new ATOM 0 HB2 ASP A 85 9.391 12.934 7.913 1.00 0.00 H new ATOM 0 HB3 ASP A 85 8.262 12.232 6.771 1.00 0.00 H new ATOM 1329 N GLY A 86 10.278 9.108 7.386 1.00 0.00 N ATOM 1330 CA GLY A 86 10.894 8.264 6.353 1.00 0.00 C ATOM 1331 C GLY A 86 11.424 9.072 5.164 1.00 0.00 C ATOM 1332 O GLY A 86 11.006 8.908 4.025 1.00 0.00 O ATOM 0 H GLY A 86 10.626 8.924 8.327 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.713 7.697 6.795 1.00 0.00 H new ATOM 0 HA3 GLY A 86 10.161 7.540 5.997 1.00 0.00 H new ATOM 1336 N ASN A 87 12.240 10.051 5.516 1.00 0.00 N ATOM 1337 CA ASN A 87 12.811 11.017 4.552 1.00 0.00 C ATOM 1338 C ASN A 87 14.091 11.638 5.110 1.00 0.00 C ATOM 1339 O ASN A 87 14.127 12.705 5.716 1.00 0.00 O ATOM 1340 CB ASN A 87 11.747 12.079 4.228 1.00 0.00 C ATOM 1341 CG ASN A 87 11.340 12.935 5.438 1.00 0.00 C ATOM 1342 OD1 ASN A 87 11.494 12.584 6.605 1.00 0.00 O ATOM 1343 ND2 ASN A 87 10.894 14.137 5.147 1.00 0.00 N ATOM 0 H ASN A 87 12.535 10.211 6.479 1.00 0.00 H new ATOM 0 HA ASN A 87 13.086 10.508 3.628 1.00 0.00 H new ATOM 0 HB2 ASN A 87 12.126 12.733 3.443 1.00 0.00 H new ATOM 0 HB3 ASN A 87 10.861 11.584 3.830 1.00 0.00 H new ATOM 0 HD21 ASN A 87 10.671 14.793 5.895 1.00 0.00 H new ATOM 0 HD22 ASN A 87 10.772 14.414 4.173 1.00 0.00 H new ATOM 1350 N GLY A 88 15.139 10.825 5.044 1.00 0.00 N ATOM 1351 CA GLY A 88 16.468 11.228 5.535 1.00 0.00 C ATOM 1352 C GLY A 88 17.313 11.748 4.375 1.00 0.00 C ATOM 1353 O GLY A 88 16.821 11.955 3.269 1.00 0.00 O ATOM 0 H GLY A 88 15.103 9.882 4.657 1.00 0.00 H new ATOM 0 HA2 GLY A 88 16.365 12.001 6.297 1.00 0.00 H new ATOM 0 HA3 GLY A 88 16.964 10.380 6.006 1.00 0.00 H new ATOM 1357 N LYS A 89 18.620 11.704 4.606 1.00 0.00 N ATOM 1358 CA LYS A 89 19.620 12.056 3.575 1.00 0.00 C ATOM 1359 C LYS A 89 19.504 11.106 2.367 1.00 0.00 C ATOM 1360 O LYS A 89 19.411 11.533 1.228 1.00 0.00 O ATOM 1361 CB LYS A 89 21.016 12.036 4.212 1.00 0.00 C ATOM 1362 CG LYS A 89 22.201 12.141 3.256 1.00 0.00 C ATOM 1363 CD LYS A 89 22.860 10.771 3.134 1.00 0.00 C ATOM 1364 CE LYS A 89 24.314 10.826 2.660 1.00 0.00 C ATOM 1365 NZ LYS A 89 25.157 10.517 3.817 1.00 0.00 N ATOM 0 H LYS A 89 19.025 11.428 5.500 1.00 0.00 H new ATOM 0 HA LYS A 89 19.437 13.061 3.195 1.00 0.00 H new ATOM 0 HB2 LYS A 89 21.078 12.859 4.924 1.00 0.00 H new ATOM 0 HB3 LYS A 89 21.118 11.113 4.782 1.00 0.00 H new ATOM 0 HG2 LYS A 89 21.867 12.487 2.278 1.00 0.00 H new ATOM 0 HG3 LYS A 89 22.919 12.873 3.625 1.00 0.00 H new ATOM 0 HD2 LYS A 89 22.822 10.272 4.102 1.00 0.00 H new ATOM 0 HD3 LYS A 89 22.283 10.161 2.438 1.00 0.00 H new ATOM 0 HE2 LYS A 89 24.485 10.109 1.857 1.00 0.00 H new ATOM 0 HE3 LYS A 89 24.552 11.813 2.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 26.158 10.544 3.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 24.989 11.219 4.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 24.924 9.568 4.173 1.00 0.00 H new ATOM 1379 N THR A 90 19.491 9.809 2.681 1.00 0.00 N ATOM 1380 CA THR A 90 19.378 8.733 1.671 1.00 0.00 C ATOM 1381 C THR A 90 18.515 7.577 2.172 1.00 0.00 C ATOM 1382 O THR A 90 18.868 6.397 2.089 1.00 0.00 O ATOM 1383 CB THR A 90 20.777 8.260 1.245 1.00 0.00 C ATOM 1384 OG1 THR A 90 20.632 7.352 0.154 1.00 0.00 O ATOM 1385 CG2 THR A 90 21.604 7.636 2.376 1.00 0.00 C ATOM 0 H THR A 90 19.558 9.466 3.639 1.00 0.00 H new ATOM 0 HA THR A 90 18.874 9.137 0.793 1.00 0.00 H new ATOM 0 HB THR A 90 21.344 9.142 0.945 1.00 0.00 H new ATOM 0 HG1 THR A 90 20.085 6.589 0.434 1.00 0.00 H new ATOM 0 HG21 THR A 90 22.576 7.330 1.990 1.00 0.00 H new ATOM 0 HG22 THR A 90 21.744 8.368 3.171 1.00 0.00 H new ATOM 0 HG23 THR A 90 21.081 6.766 2.772 1.00 0.00 H new ATOM 1393 N ASP A 91 17.433 7.921 2.875 1.00 0.00 N ATOM 1394 CA ASP A 91 16.489 6.922 3.416 1.00 0.00 C ATOM 1395 C ASP A 91 16.259 5.783 2.412 1.00 0.00 C ATOM 1396 O ASP A 91 16.244 6.020 1.205 1.00 0.00 O ATOM 1397 CB ASP A 91 15.169 7.593 3.750 1.00 0.00 C ATOM 1398 CG ASP A 91 14.876 7.581 5.247 1.00 0.00 C ATOM 1399 OD1 ASP A 91 15.765 8.050 5.994 1.00 0.00 O ATOM 1400 OD2 ASP A 91 13.701 7.357 5.595 1.00 0.00 O ATOM 0 H ASP A 91 17.182 8.887 3.087 1.00 0.00 H new ATOM 0 HA ASP A 91 16.920 6.495 4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 91 15.187 8.623 3.394 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.362 7.087 3.220 1.00 0.00 H new ATOM 1405 N HIS A 92 16.450 4.566 2.888 1.00 0.00 N ATOM 1406 CA HIS A 92 16.326 3.386 2.009 1.00 0.00 C ATOM 1407 C HIS A 92 15.366 2.350 2.616 1.00 0.00 C ATOM 1408 O HIS A 92 15.649 1.180 2.861 1.00 0.00 O ATOM 1409 CB HIS A 92 17.713 2.839 1.627 1.00 0.00 C ATOM 1410 CG HIS A 92 18.457 2.148 2.776 1.00 0.00 C ATOM 1411 ND1 HIS A 92 18.345 0.854 3.071 1.00 0.00 N ATOM 1412 CD2 HIS A 92 19.221 2.709 3.695 1.00 0.00 C ATOM 1413 CE1 HIS A 92 19.027 0.614 4.181 1.00 0.00 C ATOM 1414 NE2 HIS A 92 19.578 1.756 4.558 1.00 0.00 N ATOM 0 H HIS A 92 16.688 4.356 3.857 1.00 0.00 H new ATOM 0 HA HIS A 92 15.867 3.679 1.065 1.00 0.00 H new ATOM 0 HB2 HIS A 92 17.598 2.131 0.806 1.00 0.00 H new ATOM 0 HB3 HIS A 92 18.325 3.661 1.256 1.00 0.00 H new ATOM 0 HD2 HIS A 92 19.505 3.750 3.740 1.00 0.00 H new ATOM 0 HE1 HIS A 92 19.117 -0.337 4.685 1.00 0.00 H new ATOM 0 HE2 HIS A 92 20.177 1.886 5.373 1.00 0.00 H new ATOM 1423 N TYR A 93 14.178 2.865 2.894 1.00 0.00 N ATOM 1424 CA TYR A 93 13.120 2.057 3.505 1.00 0.00 C ATOM 1425 C TYR A 93 12.216 1.423 2.452 1.00 0.00 C ATOM 1426 O TYR A 93 12.214 1.823 1.284 1.00 0.00 O ATOM 1427 CB TYR A 93 12.360 2.914 4.523 1.00 0.00 C ATOM 1428 CG TYR A 93 11.683 4.117 3.870 1.00 0.00 C ATOM 1429 CD1 TYR A 93 12.440 5.281 3.647 1.00 0.00 C ATOM 1430 CD2 TYR A 93 10.333 4.013 3.510 1.00 0.00 C ATOM 1431 CE1 TYR A 93 11.818 6.372 3.021 1.00 0.00 C ATOM 1432 CE2 TYR A 93 9.713 5.134 2.926 1.00 0.00 C ATOM 1433 CZ TYR A 93 10.457 6.291 2.659 1.00 0.00 C ATOM 1434 OH TYR A 93 9.883 7.317 1.975 1.00 0.00 O ATOM 0 H TYR A 93 13.918 3.834 2.709 1.00 0.00 H new ATOM 0 HA TYR A 93 13.562 1.217 4.040 1.00 0.00 H new ATOM 0 HB2 TYR A 93 11.608 2.302 5.022 1.00 0.00 H new ATOM 0 HB3 TYR A 93 13.051 3.260 5.292 1.00 0.00 H new ATOM 0 HD1 TYR A 93 13.475 5.334 3.950 1.00 0.00 H new ATOM 0 HD2 TYR A 93 9.783 3.098 3.676 1.00 0.00 H new ATOM 0 HE1 TYR A 93 12.380 7.271 2.817 1.00 0.00 H new ATOM 0 HE2 TYR A 93 8.661 5.102 2.683 1.00 0.00 H new ATOM 0 HH TYR A 93 10.071 8.162 2.434 1.00 0.00 H new ATOM 1444 N LEU A 94 11.426 0.449 2.901 1.00 0.00 N ATOM 1445 CA LEU A 94 10.419 -0.193 2.058 1.00 0.00 C ATOM 1446 C LEU A 94 9.053 0.475 2.248 1.00 0.00 C ATOM 1447 O LEU A 94 8.604 0.637 3.373 1.00 0.00 O ATOM 1448 CB LEU A 94 10.295 -1.693 2.342 1.00 0.00 C ATOM 1449 CG LEU A 94 11.025 -2.562 1.308 1.00 0.00 C ATOM 1450 CD1 LEU A 94 10.639 -4.019 1.485 1.00 0.00 C ATOM 1451 CD2 LEU A 94 10.556 -2.243 -0.102 1.00 0.00 C ATOM 0 H LEU A 94 11.465 0.085 3.853 1.00 0.00 H new ATOM 0 HA LEU A 94 10.749 -0.072 1.026 1.00 0.00 H new ATOM 0 HB2 LEU A 94 10.696 -1.904 3.333 1.00 0.00 H new ATOM 0 HB3 LEU A 94 9.240 -1.968 2.360 1.00 0.00 H new ATOM 0 HG LEU A 94 12.089 -2.373 1.449 1.00 0.00 H new ATOM 0 HD11 LEU A 94 11.162 -4.626 0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 94 10.914 -4.349 2.487 1.00 0.00 H new ATOM 0 HD13 LEU A 94 9.563 -4.130 1.349 1.00 0.00 H new ATOM 0 HD21 LEU A 94 11.089 -2.873 -0.814 1.00 0.00 H new ATOM 0 HD22 LEU A 94 9.485 -2.432 -0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 94 10.756 -1.195 -0.324 1.00 0.00 H new ATOM 1463 N LEU A 95 8.581 1.082 1.176 1.00 0.00 N ATOM 1464 CA LEU A 95 7.279 1.786 1.169 1.00 0.00 C ATOM 1465 C LEU A 95 6.187 0.830 0.671 1.00 0.00 C ATOM 1466 O LEU A 95 6.458 -0.170 0.012 1.00 0.00 O ATOM 1467 CB LEU A 95 7.256 3.068 0.305 1.00 0.00 C ATOM 1468 CG LEU A 95 8.623 3.729 0.111 1.00 0.00 C ATOM 1469 CD1 LEU A 95 9.422 3.090 -1.009 1.00 0.00 C ATOM 1470 CD2 LEU A 95 8.467 5.201 -0.229 1.00 0.00 C ATOM 0 H LEU A 95 9.073 1.111 0.283 1.00 0.00 H new ATOM 0 HA LEU A 95 7.100 2.101 2.197 1.00 0.00 H new ATOM 0 HB2 LEU A 95 6.843 2.824 -0.674 1.00 0.00 H new ATOM 0 HB3 LEU A 95 6.580 3.789 0.765 1.00 0.00 H new ATOM 0 HG LEU A 95 9.153 3.598 1.055 1.00 0.00 H new ATOM 0 HD11 LEU A 95 10.383 3.596 -1.105 1.00 0.00 H new ATOM 0 HD12 LEU A 95 9.587 2.037 -0.783 1.00 0.00 H new ATOM 0 HD13 LEU A 95 8.871 3.178 -1.945 1.00 0.00 H new ATOM 0 HD21 LEU A 95 9.451 5.650 -0.362 1.00 0.00 H new ATOM 0 HD22 LEU A 95 7.894 5.303 -1.151 1.00 0.00 H new ATOM 0 HD23 LEU A 95 7.944 5.708 0.582 1.00 0.00 H new ATOM 1482 N GLU A 96 4.968 1.124 1.107 1.00 0.00 N ATOM 1483 CA GLU A 96 3.781 0.363 0.714 1.00 0.00 C ATOM 1484 C GLU A 96 2.684 1.293 0.199 1.00 0.00 C ATOM 1485 O GLU A 96 2.073 2.071 0.931 1.00 0.00 O ATOM 1486 CB GLU A 96 3.295 -0.500 1.876 1.00 0.00 C ATOM 1487 CG GLU A 96 1.906 -1.100 1.679 1.00 0.00 C ATOM 1488 CD GLU A 96 1.712 -2.450 2.356 1.00 0.00 C ATOM 1489 OE1 GLU A 96 1.440 -2.454 3.573 1.00 0.00 O ATOM 1490 OE2 GLU A 96 1.790 -3.468 1.634 1.00 0.00 O ATOM 0 H GLU A 96 4.771 1.896 1.743 1.00 0.00 H new ATOM 0 HA GLU A 96 4.048 -0.304 -0.106 1.00 0.00 H new ATOM 0 HB2 GLU A 96 4.008 -1.309 2.034 1.00 0.00 H new ATOM 0 HB3 GLU A 96 3.291 0.103 2.784 1.00 0.00 H new ATOM 0 HG2 GLU A 96 1.162 -0.402 2.064 1.00 0.00 H new ATOM 0 HG3 GLU A 96 1.717 -1.210 0.611 1.00 0.00 H new ATOM 1497 N PHE A 97 2.369 1.056 -1.058 1.00 0.00 N ATOM 1498 CA PHE A 97 1.308 1.819 -1.730 1.00 0.00 C ATOM 1499 C PHE A 97 0.076 0.939 -1.972 1.00 0.00 C ATOM 1500 O PHE A 97 0.245 -0.196 -2.438 1.00 0.00 O ATOM 1501 CB PHE A 97 1.890 2.378 -3.034 1.00 0.00 C ATOM 1502 CG PHE A 97 0.938 3.351 -3.718 1.00 0.00 C ATOM 1503 CD1 PHE A 97 0.891 4.685 -3.252 1.00 0.00 C ATOM 1504 CD2 PHE A 97 0.115 2.900 -4.780 1.00 0.00 C ATOM 1505 CE1 PHE A 97 -0.008 5.579 -3.859 1.00 0.00 C ATOM 1506 CE2 PHE A 97 -0.777 3.812 -5.377 1.00 0.00 C ATOM 1507 CZ PHE A 97 -0.825 5.136 -4.920 1.00 0.00 C ATOM 0 H PHE A 97 2.821 0.351 -1.640 1.00 0.00 H new ATOM 0 HA PHE A 97 0.970 2.646 -1.105 1.00 0.00 H new ATOM 0 HB2 PHE A 97 2.833 2.883 -2.822 1.00 0.00 H new ATOM 0 HB3 PHE A 97 2.115 1.555 -3.712 1.00 0.00 H new ATOM 0 HD1 PHE A 97 1.532 5.010 -2.446 1.00 0.00 H new ATOM 0 HD2 PHE A 97 0.171 1.878 -5.124 1.00 0.00 H new ATOM 0 HE1 PHE A 97 -0.073 6.601 -3.515 1.00 0.00 H new ATOM 0 HE2 PHE A 97 -1.421 3.493 -6.183 1.00 0.00 H new ATOM 0 HZ PHE A 97 -1.503 5.833 -5.391 1.00 0.00 H new ATOM 1517 N PRO A 98 -1.137 1.452 -1.723 1.00 0.00 N ATOM 1518 CA PRO A 98 -2.398 0.717 -1.936 1.00 0.00 C ATOM 1519 C PRO A 98 -2.709 0.633 -3.422 1.00 0.00 C ATOM 1520 O PRO A 98 -3.190 1.586 -4.029 1.00 0.00 O ATOM 1521 CB PRO A 98 -3.445 1.474 -1.117 1.00 0.00 C ATOM 1522 CG PRO A 98 -2.930 2.899 -1.030 1.00 0.00 C ATOM 1523 CD PRO A 98 -1.417 2.798 -1.169 1.00 0.00 C ATOM 0 HA PRO A 98 -2.360 -0.321 -1.607 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -4.423 1.438 -1.598 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -3.561 1.036 -0.126 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -3.355 3.518 -1.820 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -3.206 3.358 -0.081 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -1.035 3.577 -1.829 1.00 0.00 H new ATOM 0 HD3 PRO A 98 -0.929 2.930 -0.204 1.00 0.00 H new ATOM 1531 N THR A 99 -2.079 -0.358 -4.053 1.00 0.00 N ATOM 1532 CA THR A 99 -2.272 -0.592 -5.492 1.00 0.00 C ATOM 1533 C THR A 99 -3.663 -1.179 -5.759 1.00 0.00 C ATOM 1534 O THR A 99 -4.209 -1.932 -4.956 1.00 0.00 O ATOM 1535 CB THR A 99 -1.157 -1.468 -6.084 1.00 0.00 C ATOM 1536 OG1 THR A 99 -1.229 -1.350 -7.515 1.00 0.00 O ATOM 1537 CG2 THR A 99 -1.183 -2.939 -5.667 1.00 0.00 C ATOM 0 H THR A 99 -1.436 -1.008 -3.600 1.00 0.00 H new ATOM 0 HA THR A 99 -2.211 0.370 -6.000 1.00 0.00 H new ATOM 0 HB THR A 99 -0.213 -1.099 -5.682 1.00 0.00 H new ATOM 0 HG1 THR A 99 -0.527 -1.898 -7.924 1.00 0.00 H new ATOM 0 HG21 THR A 99 -0.355 -3.466 -6.140 1.00 0.00 H new ATOM 0 HG22 THR A 99 -1.088 -3.012 -4.584 1.00 0.00 H new ATOM 0 HG23 THR A 99 -2.125 -3.389 -5.979 1.00 0.00 H new ATOM 1545 N PHE A 100 -4.245 -0.737 -6.860 1.00 0.00 N ATOM 1546 CA PHE A 100 -5.606 -1.128 -7.276 1.00 0.00 C ATOM 1547 C PHE A 100 -5.582 -1.953 -8.572 1.00 0.00 C ATOM 1548 O PHE A 100 -4.735 -1.693 -9.422 1.00 0.00 O ATOM 1549 CB PHE A 100 -6.491 0.109 -7.427 1.00 0.00 C ATOM 1550 CG PHE A 100 -6.826 0.730 -6.070 1.00 0.00 C ATOM 1551 CD1 PHE A 100 -5.817 1.420 -5.369 1.00 0.00 C ATOM 1552 CD2 PHE A 100 -8.124 0.616 -5.517 1.00 0.00 C ATOM 1553 CE1 PHE A 100 -6.082 1.964 -4.101 1.00 0.00 C ATOM 1554 CE2 PHE A 100 -8.411 1.219 -4.273 1.00 0.00 C ATOM 1555 CZ PHE A 100 -7.384 1.896 -3.568 1.00 0.00 C ATOM 0 H PHE A 100 -3.793 -0.090 -7.506 1.00 0.00 H new ATOM 0 HA PHE A 100 -6.029 -1.762 -6.497 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -5.984 0.846 -8.050 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -7.413 -0.163 -7.941 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -4.837 1.531 -5.808 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -8.892 0.070 -6.045 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -5.290 2.433 -3.537 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -9.408 1.165 -3.861 1.00 0.00 H new ATOM 0 HZ PHE A 100 -7.601 2.362 -2.618 1.00 0.00 H new ATOM 1565 N PRO A 101 -6.513 -2.915 -8.729 1.00 0.00 N ATOM 1566 CA PRO A 101 -6.585 -3.759 -9.932 1.00 0.00 C ATOM 1567 C PRO A 101 -7.167 -3.006 -11.131 1.00 0.00 C ATOM 1568 O PRO A 101 -6.561 -3.045 -12.193 1.00 0.00 O ATOM 1569 CB PRO A 101 -7.448 -4.960 -9.541 1.00 0.00 C ATOM 1570 CG PRO A 101 -8.325 -4.456 -8.401 1.00 0.00 C ATOM 1571 CD PRO A 101 -7.557 -3.300 -7.754 1.00 0.00 C ATOM 0 HA PRO A 101 -5.591 -4.070 -10.254 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -8.051 -5.304 -10.381 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -6.833 -5.802 -9.224 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -9.293 -4.121 -8.773 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -8.518 -5.249 -7.678 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -8.220 -2.462 -7.539 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -7.114 -3.607 -6.807 1.00 0.00 H new ATOM 1579 N ASP A 102 -8.214 -2.212 -10.882 1.00 0.00 N ATOM 1580 CA ASP A 102 -8.861 -1.340 -11.889 1.00 0.00 C ATOM 1581 C ASP A 102 -7.816 -0.544 -12.668 1.00 0.00 C ATOM 1582 O ASP A 102 -8.017 -0.207 -13.837 1.00 0.00 O ATOM 1583 CB ASP A 102 -9.825 -0.371 -11.190 1.00 0.00 C ATOM 1584 CG ASP A 102 -10.896 0.193 -12.139 1.00 0.00 C ATOM 1585 OD1 ASP A 102 -11.529 -0.638 -12.834 1.00 0.00 O ATOM 1586 OD2 ASP A 102 -11.115 1.421 -12.056 1.00 0.00 O ATOM 0 H ASP A 102 -8.649 -2.151 -9.961 1.00 0.00 H new ATOM 0 HA ASP A 102 -9.412 -1.970 -12.588 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -10.314 -0.886 -10.363 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -9.256 0.454 -10.761 1.00 0.00 H new ATOM 1591 N GLY A 103 -6.732 -0.244 -11.967 1.00 0.00 N ATOM 1592 CA GLY A 103 -5.572 0.462 -12.522 1.00 0.00 C ATOM 1593 C GLY A 103 -5.686 1.973 -12.329 1.00 0.00 C ATOM 1594 O GLY A 103 -4.875 2.738 -12.841 1.00 0.00 O ATOM 0 H GLY A 103 -6.626 -0.485 -10.982 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -4.662 0.101 -12.042 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -5.483 0.236 -13.585 1.00 0.00 H new ATOM 1598 N HIS A 104 -6.689 2.344 -11.544 1.00 0.00 N ATOM 1599 CA HIS A 104 -6.911 3.743 -11.183 1.00 0.00 C ATOM 1600 C HIS A 104 -5.944 4.096 -10.051 1.00 0.00 C ATOM 1601 O HIS A 104 -5.796 3.361 -9.068 1.00 0.00 O ATOM 1602 CB HIS A 104 -8.381 4.015 -10.824 1.00 0.00 C ATOM 1603 CG HIS A 104 -8.875 3.470 -9.476 1.00 0.00 C ATOM 1604 ND1 HIS A 104 -9.709 2.447 -9.281 1.00 0.00 N ATOM 1605 CD2 HIS A 104 -8.577 3.972 -8.275 1.00 0.00 C ATOM 1606 CE1 HIS A 104 -9.886 2.290 -7.981 1.00 0.00 C ATOM 1607 NE2 HIS A 104 -9.177 3.228 -7.360 1.00 0.00 N ATOM 0 H HIS A 104 -7.365 1.695 -11.142 1.00 0.00 H new ATOM 0 HA HIS A 104 -6.708 4.389 -12.037 1.00 0.00 H new ATOM 0 HB2 HIS A 104 -8.539 5.093 -10.833 1.00 0.00 H new ATOM 0 HB3 HIS A 104 -9.007 3.594 -11.611 1.00 0.00 H new ATOM 0 HD2 HIS A 104 -7.955 4.834 -8.084 1.00 0.00 H new ATOM 0 HE1 HIS A 104 -10.497 1.535 -7.508 1.00 0.00 H new ATOM 0 HE2 HIS A 104 -9.107 3.353 -6.350 1.00 0.00 H new ATOM 1616 N ASP A 105 -5.147 5.112 -10.333 1.00 0.00 N ATOM 1617 CA ASP A 105 -4.240 5.687 -9.320 1.00 0.00 C ATOM 1618 C ASP A 105 -5.098 6.341 -8.246 1.00 0.00 C ATOM 1619 O ASP A 105 -5.457 7.521 -8.357 1.00 0.00 O ATOM 1620 CB ASP A 105 -3.288 6.702 -9.989 1.00 0.00 C ATOM 1621 CG ASP A 105 -2.635 7.665 -8.973 1.00 0.00 C ATOM 1622 OD1 ASP A 105 -2.133 7.145 -7.950 1.00 0.00 O ATOM 1623 OD2 ASP A 105 -2.783 8.890 -9.182 1.00 0.00 O ATOM 0 H ASP A 105 -5.100 5.563 -11.247 1.00 0.00 H new ATOM 0 HA ASP A 105 -3.620 4.916 -8.863 1.00 0.00 H new ATOM 0 HB2 ASP A 105 -2.508 6.163 -10.526 1.00 0.00 H new ATOM 0 HB3 ASP A 105 -3.842 7.281 -10.728 1.00 0.00 H new ATOM 1628 N TYR A 106 -5.484 5.537 -7.277 1.00 0.00 N ATOM 1629 CA TYR A 106 -6.228 6.008 -6.097 1.00 0.00 C ATOM 1630 C TYR A 106 -5.704 7.380 -5.682 1.00 0.00 C ATOM 1631 O TYR A 106 -4.495 7.594 -5.686 1.00 0.00 O ATOM 1632 CB TYR A 106 -5.945 5.027 -4.972 1.00 0.00 C ATOM 1633 CG TYR A 106 -6.195 5.506 -3.544 1.00 0.00 C ATOM 1634 CD1 TYR A 106 -7.462 5.985 -3.156 1.00 0.00 C ATOM 1635 CD2 TYR A 106 -5.075 5.521 -2.691 1.00 0.00 C ATOM 1636 CE1 TYR A 106 -7.606 6.520 -1.864 1.00 0.00 C ATOM 1637 CE2 TYR A 106 -5.219 6.028 -1.390 1.00 0.00 C ATOM 1638 CZ TYR A 106 -6.486 6.524 -1.021 1.00 0.00 C ATOM 1639 OH TYR A 106 -6.654 7.065 0.201 1.00 0.00 O ATOM 0 H TYR A 106 -5.297 4.534 -7.273 1.00 0.00 H new ATOM 0 HA TYR A 106 -7.294 6.077 -6.314 1.00 0.00 H new ATOM 0 HB2 TYR A 106 -6.552 4.137 -5.140 1.00 0.00 H new ATOM 0 HB3 TYR A 106 -4.902 4.720 -5.047 1.00 0.00 H new ATOM 0 HD1 TYR A 106 -8.301 5.942 -3.834 1.00 0.00 H new ATOM 0 HD2 TYR A 106 -4.120 5.148 -3.032 1.00 0.00 H new ATOM 0 HE1 TYR A 106 -8.553 6.917 -1.530 1.00 0.00 H new ATOM 0 HE2 TYR A 106 -4.390 6.038 -0.698 1.00 0.00 H new ATOM 0 HH TYR A 106 -6.859 8.019 0.111 1.00 0.00 H new ATOM 1649 N LYS A 107 -6.649 8.251 -5.377 1.00 0.00 N ATOM 1650 CA LYS A 107 -6.365 9.604 -4.879 1.00 0.00 C ATOM 1651 C LYS A 107 -5.692 9.527 -3.492 1.00 0.00 C ATOM 1652 O LYS A 107 -6.194 9.951 -2.458 1.00 0.00 O ATOM 1653 CB LYS A 107 -7.646 10.436 -4.905 1.00 0.00 C ATOM 1654 CG LYS A 107 -8.779 9.779 -4.096 1.00 0.00 C ATOM 1655 CD LYS A 107 -10.152 10.092 -4.683 1.00 0.00 C ATOM 1656 CE LYS A 107 -10.832 11.260 -3.973 1.00 0.00 C ATOM 1657 NZ LYS A 107 -11.310 12.193 -4.987 1.00 0.00 N ATOM 0 H LYS A 107 -7.645 8.048 -5.465 1.00 0.00 H new ATOM 0 HA LYS A 107 -5.653 10.113 -5.528 1.00 0.00 H new ATOM 0 HB2 LYS A 107 -7.442 11.428 -4.502 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -7.969 10.571 -5.937 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -8.631 8.699 -4.074 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -8.737 10.127 -3.064 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -10.047 10.325 -5.743 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -10.785 9.208 -4.612 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -11.662 10.903 -3.363 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -10.132 11.755 -3.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -11.778 12.999 -4.525 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -10.506 12.536 -5.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -11.988 11.710 -5.611 1.00 0.00 H new ATOM 1671 N PHE A 108 -4.447 9.095 -3.545 1.00 0.00 N ATOM 1672 CA PHE A 108 -3.569 8.972 -2.367 1.00 0.00 C ATOM 1673 C PHE A 108 -3.144 10.331 -1.800 1.00 0.00 C ATOM 1674 O PHE A 108 -2.482 10.440 -0.765 1.00 0.00 O ATOM 1675 CB PHE A 108 -2.370 8.069 -2.664 1.00 0.00 C ATOM 1676 CG PHE A 108 -1.431 8.685 -3.692 1.00 0.00 C ATOM 1677 CD1 PHE A 108 -0.480 9.622 -3.258 1.00 0.00 C ATOM 1678 CD2 PHE A 108 -1.612 8.391 -5.064 1.00 0.00 C ATOM 1679 CE1 PHE A 108 0.291 10.304 -4.211 1.00 0.00 C ATOM 1680 CE2 PHE A 108 -0.808 9.049 -6.023 1.00 0.00 C ATOM 1681 CZ PHE A 108 0.127 10.010 -5.584 1.00 0.00 C ATOM 0 H PHE A 108 -3.997 8.812 -4.416 1.00 0.00 H new ATOM 0 HA PHE A 108 -4.155 8.494 -1.582 1.00 0.00 H new ATOM 0 HB2 PHE A 108 -1.822 7.879 -1.741 1.00 0.00 H new ATOM 0 HB3 PHE A 108 -2.724 7.105 -3.029 1.00 0.00 H new ATOM 0 HD1 PHE A 108 -0.344 9.815 -2.204 1.00 0.00 H new ATOM 0 HD2 PHE A 108 -2.356 7.672 -5.375 1.00 0.00 H new ATOM 0 HE1 PHE A 108 1.006 11.050 -3.897 1.00 0.00 H new ATOM 0 HE2 PHE A 108 -0.908 8.820 -7.074 1.00 0.00 H new ATOM 0 HZ PHE A 108 0.730 10.532 -6.312 1.00 0.00 H new ATOM 1691 N ASP A 109 -3.422 11.340 -2.603 1.00 0.00 N ATOM 1692 CA ASP A 109 -3.199 12.741 -2.254 1.00 0.00 C ATOM 1693 C ASP A 109 -4.440 13.369 -1.585 1.00 0.00 C ATOM 1694 O ASP A 109 -4.336 14.452 -1.014 1.00 0.00 O ATOM 1695 CB ASP A 109 -2.783 13.487 -3.523 1.00 0.00 C ATOM 1696 CG ASP A 109 -2.870 15.011 -3.379 1.00 0.00 C ATOM 1697 OD1 ASP A 109 -3.995 15.504 -3.620 1.00 0.00 O ATOM 1698 OD2 ASP A 109 -1.850 15.611 -3.006 1.00 0.00 O ATOM 0 H ASP A 109 -3.817 11.213 -3.535 1.00 0.00 H new ATOM 0 HA ASP A 109 -2.402 12.816 -1.515 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -1.761 13.210 -3.782 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -3.419 13.169 -4.349 1.00 0.00 H new ATOM 1703 N SER A 110 -5.573 12.672 -1.635 1.00 0.00 N ATOM 1704 CA SER A 110 -6.827 13.201 -1.079 1.00 0.00 C ATOM 1705 C SER A 110 -6.947 12.828 0.401 1.00 0.00 C ATOM 1706 O SER A 110 -7.180 11.671 0.741 1.00 0.00 O ATOM 1707 CB SER A 110 -8.032 12.619 -1.825 1.00 0.00 C ATOM 1708 OG SER A 110 -8.885 13.674 -2.243 1.00 0.00 O ATOM 0 H SER A 110 -5.654 11.744 -2.051 1.00 0.00 H new ATOM 0 HA SER A 110 -6.814 14.285 -1.191 1.00 0.00 H new ATOM 0 HB2 SER A 110 -7.696 12.045 -2.689 1.00 0.00 H new ATOM 0 HB3 SER A 110 -8.577 11.932 -1.178 1.00 0.00 H new ATOM 0 HG SER A 110 -9.807 13.475 -1.976 1.00 0.00 H new ATOM 1714 N LYS A 111 -6.554 13.797 1.223 1.00 0.00 N ATOM 1715 CA LYS A 111 -6.604 13.627 2.691 1.00 0.00 C ATOM 1716 C LYS A 111 -8.012 13.354 3.186 1.00 0.00 C ATOM 1717 O LYS A 111 -8.329 12.237 3.594 1.00 0.00 O ATOM 1718 CB LYS A 111 -5.959 14.842 3.396 1.00 0.00 C ATOM 1719 CG LYS A 111 -5.526 14.473 4.812 1.00 0.00 C ATOM 1720 CD LYS A 111 -5.005 15.662 5.631 1.00 0.00 C ATOM 1721 CE LYS A 111 -3.721 16.271 5.082 1.00 0.00 C ATOM 1722 NZ LYS A 111 -3.208 17.249 6.048 1.00 0.00 N ATOM 0 H LYS A 111 -6.200 14.702 0.913 1.00 0.00 H new ATOM 0 HA LYS A 111 -6.020 12.744 2.949 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.097 15.186 2.824 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -6.669 15.668 3.431 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -6.371 14.026 5.335 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -4.747 13.713 4.757 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -5.775 16.432 5.666 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -4.832 15.337 6.657 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -2.980 15.492 4.905 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -3.912 16.753 4.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -2.331 17.671 5.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.916 17.996 6.195 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.013 16.774 6.952 1.00 0.00 H new ATOM 1736 N LYS A 112 -8.814 14.398 3.110 1.00 0.00 N ATOM 1737 CA LYS A 112 -10.221 14.313 3.477 1.00 0.00 C ATOM 1738 C LYS A 112 -11.106 14.890 2.360 1.00 0.00 C ATOM 1739 O LYS A 112 -10.877 16.016 1.927 1.00 0.00 O ATOM 1740 CB LYS A 112 -10.480 14.977 4.833 1.00 0.00 C ATOM 1741 CG LYS A 112 -11.658 14.286 5.521 1.00 0.00 C ATOM 1742 CD LYS A 112 -12.061 15.070 6.761 1.00 0.00 C ATOM 1743 CE LYS A 112 -12.540 14.124 7.856 1.00 0.00 C ATOM 1744 NZ LYS A 112 -14.000 14.204 8.026 1.00 0.00 N ATOM 0 H LYS A 112 -8.517 15.322 2.796 1.00 0.00 H new ATOM 0 HA LYS A 112 -10.489 13.263 3.590 1.00 0.00 H new ATOM 0 HB2 LYS A 112 -9.590 14.911 5.458 1.00 0.00 H new ATOM 0 HB3 LYS A 112 -10.695 16.037 4.696 1.00 0.00 H new ATOM 0 HG2 LYS A 112 -12.501 14.215 4.834 1.00 0.00 H new ATOM 0 HG3 LYS A 112 -11.384 13.268 5.796 1.00 0.00 H new ATOM 0 HD2 LYS A 112 -11.214 15.654 7.121 1.00 0.00 H new ATOM 0 HD3 LYS A 112 -12.852 15.777 6.511 1.00 0.00 H new ATOM 0 HE2 LYS A 112 -12.255 13.102 7.607 1.00 0.00 H new ATOM 0 HE3 LYS A 112 -12.047 14.372 8.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 -14.298 13.550 8.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 -14.267 15.175 8.286 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 -14.468 13.944 7.135 1.00 0.00 H new ATOM 1758 N PRO A 113 -12.050 14.061 1.868 1.00 0.00 N ATOM 1759 CA PRO A 113 -12.236 12.661 2.289 1.00 0.00 C ATOM 1760 C PRO A 113 -11.169 11.750 1.677 1.00 0.00 C ATOM 1761 O PRO A 113 -10.240 12.207 1.014 1.00 0.00 O ATOM 1762 CB PRO A 113 -13.664 12.320 1.884 1.00 0.00 C ATOM 1763 CG PRO A 113 -13.953 13.216 0.685 1.00 0.00 C ATOM 1764 CD PRO A 113 -13.059 14.446 0.860 1.00 0.00 C ATOM 0 HA PRO A 113 -12.107 12.513 3.361 1.00 0.00 H new ATOM 0 HB2 PRO A 113 -13.760 11.266 1.623 1.00 0.00 H new ATOM 0 HB3 PRO A 113 -14.363 12.511 2.698 1.00 0.00 H new ATOM 0 HG2 PRO A 113 -13.732 12.702 -0.250 1.00 0.00 H new ATOM 0 HG3 PRO A 113 -15.005 13.499 0.652 1.00 0.00 H new ATOM 0 HD2 PRO A 113 -12.586 14.725 -0.082 1.00 0.00 H new ATOM 0 HD3 PRO A 113 -13.638 15.307 1.193 1.00 0.00 H new ATOM 1772 N LYS A 114 -11.297 10.475 2.006 1.00 0.00 N ATOM 1773 CA LYS A 114 -10.337 9.446 1.590 1.00 0.00 C ATOM 1774 C LYS A 114 -11.012 8.087 1.686 1.00 0.00 C ATOM 1775 O LYS A 114 -11.476 7.670 2.755 1.00 0.00 O ATOM 1776 CB LYS A 114 -9.103 9.530 2.496 1.00 0.00 C ATOM 1777 CG LYS A 114 -8.105 8.416 2.250 1.00 0.00 C ATOM 1778 CD LYS A 114 -7.827 7.641 3.539 1.00 0.00 C ATOM 1779 CE LYS A 114 -6.956 6.416 3.246 1.00 0.00 C ATOM 1780 NZ LYS A 114 -6.795 5.650 4.489 1.00 0.00 N ATOM 0 H LYS A 114 -12.068 10.116 2.570 1.00 0.00 H new ATOM 0 HA LYS A 114 -10.015 9.597 0.560 1.00 0.00 H new ATOM 0 HB2 LYS A 114 -8.611 10.490 2.341 1.00 0.00 H new ATOM 0 HB3 LYS A 114 -9.422 9.500 3.538 1.00 0.00 H new ATOM 0 HG2 LYS A 114 -8.491 7.738 1.489 1.00 0.00 H new ATOM 0 HG3 LYS A 114 -7.175 8.833 1.864 1.00 0.00 H new ATOM 0 HD2 LYS A 114 -7.326 8.288 4.259 1.00 0.00 H new ATOM 0 HD3 LYS A 114 -8.767 7.327 3.992 1.00 0.00 H new ATOM 0 HE2 LYS A 114 -7.419 5.797 2.477 1.00 0.00 H new ATOM 0 HE3 LYS A 114 -5.983 6.726 2.863 1.00 0.00 H new ATOM 0 HZ1 LYS A 114 -6.205 4.813 4.307 1.00 0.00 H new ATOM 0 HZ2 LYS A 114 -6.338 6.247 5.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 114 -7.728 5.347 4.834 1.00 0.00 H new ATOM 1794 N GLU A 115 -11.144 7.475 0.523 1.00 0.00 N ATOM 1795 CA GLU A 115 -11.699 6.108 0.427 1.00 0.00 C ATOM 1796 C GLU A 115 -10.753 5.134 1.132 1.00 0.00 C ATOM 1797 O GLU A 115 -9.527 5.235 1.040 1.00 0.00 O ATOM 1798 CB GLU A 115 -11.875 5.726 -1.050 1.00 0.00 C ATOM 1799 CG GLU A 115 -12.490 4.326 -1.202 1.00 0.00 C ATOM 1800 CD GLU A 115 -12.569 3.866 -2.660 1.00 0.00 C ATOM 1801 OE1 GLU A 115 -12.918 4.709 -3.516 1.00 0.00 O ATOM 1802 OE2 GLU A 115 -12.326 2.656 -2.884 1.00 0.00 O ATOM 0 H GLU A 115 -10.880 7.888 -0.372 1.00 0.00 H new ATOM 0 HA GLU A 115 -12.675 6.064 0.911 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.513 6.460 -1.543 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -10.908 5.756 -1.552 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -11.897 3.610 -0.632 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -13.491 4.326 -0.771 1.00 0.00 H new ATOM 1809 N ASN A 116 -11.372 4.117 1.727 1.00 0.00 N ATOM 1810 CA ASN A 116 -10.669 3.007 2.390 1.00 0.00 C ATOM 1811 C ASN A 116 -9.615 2.394 1.448 1.00 0.00 C ATOM 1812 O ASN A 116 -9.859 2.313 0.235 1.00 0.00 O ATOM 1813 CB ASN A 116 -11.676 1.935 2.826 1.00 0.00 C ATOM 1814 CG ASN A 116 -11.225 1.315 4.140 1.00 0.00 C ATOM 1815 OD1 ASN A 116 -11.211 1.949 5.188 1.00 0.00 O ATOM 1816 ND2 ASN A 116 -10.739 0.088 4.102 1.00 0.00 N ATOM 0 H ASN A 116 -12.388 4.034 1.766 1.00 0.00 H new ATOM 0 HA ASN A 116 -10.159 3.395 3.272 1.00 0.00 H new ATOM 0 HB2 ASN A 116 -12.666 2.377 2.942 1.00 0.00 H new ATOM 0 HB3 ASN A 116 -11.758 1.165 2.058 1.00 0.00 H new ATOM 0 HD21 ASN A 116 -10.351 -0.333 4.946 1.00 0.00 H new ATOM 0 HD22 ASN A 116 -10.751 -0.439 3.229 1.00 0.00 H new ATOM 1823 N PRO A 117 -8.435 2.050 1.977 1.00 0.00 N ATOM 1824 CA PRO A 117 -7.364 1.450 1.181 1.00 0.00 C ATOM 1825 C PRO A 117 -7.711 0.013 0.784 1.00 0.00 C ATOM 1826 O PRO A 117 -8.597 -0.630 1.366 1.00 0.00 O ATOM 1827 CB PRO A 117 -6.113 1.552 2.055 1.00 0.00 C ATOM 1828 CG PRO A 117 -6.637 1.590 3.489 1.00 0.00 C ATOM 1829 CD PRO A 117 -8.013 2.254 3.383 1.00 0.00 C ATOM 0 HA PRO A 117 -7.208 1.962 0.232 1.00 0.00 H new ATOM 0 HB2 PRO A 117 -5.451 0.700 1.899 1.00 0.00 H new ATOM 0 HB3 PRO A 117 -5.539 2.448 1.820 1.00 0.00 H new ATOM 0 HG2 PRO A 117 -6.713 0.587 3.910 1.00 0.00 H new ATOM 0 HG3 PRO A 117 -5.972 2.159 4.139 1.00 0.00 H new ATOM 0 HD2 PRO A 117 -8.723 1.803 4.077 1.00 0.00 H new ATOM 0 HD3 PRO A 117 -7.958 3.315 3.628 1.00 0.00 H new ATOM 1837 N GLY A 118 -7.043 -0.419 -0.285 1.00 0.00 N ATOM 1838 CA GLY A 118 -7.179 -1.757 -0.863 1.00 0.00 C ATOM 1839 C GLY A 118 -6.411 -2.816 -0.046 1.00 0.00 C ATOM 1840 O GLY A 118 -5.542 -2.456 0.751 1.00 0.00 O ATOM 0 H GLY A 118 -6.375 0.166 -0.786 1.00 0.00 H new ATOM 0 HA2 GLY A 118 -8.234 -2.028 -0.908 1.00 0.00 H new ATOM 0 HA3 GLY A 118 -6.808 -1.749 -1.888 1.00 0.00 H new ATOM 1844 N PRO A 119 -6.763 -4.112 -0.206 1.00 0.00 N ATOM 1845 CA PRO A 119 -6.064 -5.198 0.484 1.00 0.00 C ATOM 1846 C PRO A 119 -4.687 -5.443 -0.127 1.00 0.00 C ATOM 1847 O PRO A 119 -3.702 -5.557 0.603 1.00 0.00 O ATOM 1848 CB PRO A 119 -6.990 -6.415 0.369 1.00 0.00 C ATOM 1849 CG PRO A 119 -7.876 -6.139 -0.843 1.00 0.00 C ATOM 1850 CD PRO A 119 -7.876 -4.622 -1.042 1.00 0.00 C ATOM 0 HA PRO A 119 -5.866 -4.963 1.530 1.00 0.00 H new ATOM 0 HB2 PRO A 119 -6.417 -7.333 0.236 1.00 0.00 H new ATOM 0 HB3 PRO A 119 -7.588 -6.540 1.272 1.00 0.00 H new ATOM 0 HG2 PRO A 119 -7.492 -6.647 -1.728 1.00 0.00 H new ATOM 0 HG3 PRO A 119 -8.888 -6.509 -0.677 1.00 0.00 H new ATOM 0 HD2 PRO A 119 -7.729 -4.364 -2.091 1.00 0.00 H new ATOM 0 HD3 PRO A 119 -8.827 -4.186 -0.737 1.00 0.00 H new ATOM 1858 N ALA A 120 -4.652 -5.503 -1.459 1.00 0.00 N ATOM 1859 CA ALA A 120 -3.392 -5.647 -2.199 1.00 0.00 C ATOM 1860 C ALA A 120 -2.669 -4.321 -2.389 1.00 0.00 C ATOM 1861 O ALA A 120 -3.251 -3.275 -2.643 1.00 0.00 O ATOM 1862 CB ALA A 120 -3.590 -6.358 -3.524 1.00 0.00 C ATOM 0 H ALA A 120 -5.482 -5.454 -2.050 1.00 0.00 H new ATOM 0 HA ALA A 120 -2.749 -6.273 -1.580 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -2.633 -6.443 -4.038 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -3.996 -7.354 -3.345 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -4.284 -5.789 -4.142 1.00 0.00 H new ATOM 1868 N ARG A 121 -1.411 -4.416 -2.023 1.00 0.00 N ATOM 1869 CA ARG A 121 -0.508 -3.268 -2.001 1.00 0.00 C ATOM 1870 C ARG A 121 0.830 -3.618 -2.639 1.00 0.00 C ATOM 1871 O ARG A 121 1.312 -4.748 -2.550 1.00 0.00 O ATOM 1872 CB ARG A 121 -0.295 -2.777 -0.576 1.00 0.00 C ATOM 1873 CG ARG A 121 -1.608 -2.436 0.146 1.00 0.00 C ATOM 1874 CD ARG A 121 -1.471 -1.168 0.977 1.00 0.00 C ATOM 1875 NE ARG A 121 -2.418 -1.196 2.107 1.00 0.00 N ATOM 1876 CZ ARG A 121 -2.304 -1.997 3.179 1.00 0.00 C ATOM 1877 NH1 ARG A 121 -1.323 -2.879 3.281 1.00 0.00 N ATOM 1878 NH2 ARG A 121 -3.207 -1.941 4.144 1.00 0.00 N ATOM 0 H ARG A 121 -0.976 -5.291 -1.730 1.00 0.00 H new ATOM 0 HA ARG A 121 -0.970 -2.468 -2.580 1.00 0.00 H new ATOM 0 HB2 ARG A 121 0.236 -3.542 -0.010 1.00 0.00 H new ATOM 0 HB3 ARG A 121 0.343 -1.893 -0.594 1.00 0.00 H new ATOM 0 HG2 ARG A 121 -2.405 -2.309 -0.586 1.00 0.00 H new ATOM 0 HG3 ARG A 121 -1.897 -3.266 0.791 1.00 0.00 H new ATOM 0 HD2 ARG A 121 -0.451 -1.077 1.350 1.00 0.00 H new ATOM 0 HD3 ARG A 121 -1.662 -0.294 0.354 1.00 0.00 H new ATOM 0 HE ARG A 121 -3.216 -0.562 2.072 1.00 0.00 H new ATOM 0 HH11 ARG A 121 -0.632 -2.962 2.535 1.00 0.00 H new ATOM 0 HH12 ARG A 121 -1.258 -3.476 4.105 1.00 0.00 H new ATOM 0 HH21 ARG A 121 -3.989 -1.290 4.074 1.00 0.00 H new ATOM 0 HH22 ARG A 121 -3.121 -2.549 4.959 1.00 0.00 H new ATOM 1892 N VAL A 122 1.402 -2.607 -3.276 1.00 0.00 N ATOM 1893 CA VAL A 122 2.705 -2.733 -3.941 1.00 0.00 C ATOM 1894 C VAL A 122 3.824 -2.342 -2.971 1.00 0.00 C ATOM 1895 O VAL A 122 3.694 -1.394 -2.197 1.00 0.00 O ATOM 1896 CB VAL A 122 2.735 -1.911 -5.251 1.00 0.00 C ATOM 1897 CG1 VAL A 122 2.673 -0.405 -5.046 1.00 0.00 C ATOM 1898 CG2 VAL A 122 3.968 -2.273 -6.083 1.00 0.00 C ATOM 0 H VAL A 122 0.985 -1.679 -3.350 1.00 0.00 H new ATOM 0 HA VAL A 122 2.869 -3.772 -4.226 1.00 0.00 H new ATOM 0 HB VAL A 122 1.825 -2.182 -5.786 1.00 0.00 H new ATOM 0 HG11 VAL A 122 2.699 0.095 -6.014 1.00 0.00 H new ATOM 0 HG12 VAL A 122 1.749 -0.146 -4.528 1.00 0.00 H new ATOM 0 HG13 VAL A 122 3.526 -0.084 -4.449 1.00 0.00 H new ATOM 0 HG21 VAL A 122 3.973 -1.685 -7.001 1.00 0.00 H new ATOM 0 HG22 VAL A 122 4.870 -2.058 -5.510 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.941 -3.334 -6.332 1.00 0.00 H new ATOM 1908 N ILE A 123 4.901 -3.110 -3.057 1.00 0.00 N ATOM 1909 CA ILE A 123 6.086 -2.902 -2.204 1.00 0.00 C ATOM 1910 C ILE A 123 7.291 -2.632 -3.091 1.00 0.00 C ATOM 1911 O ILE A 123 7.445 -3.227 -4.164 1.00 0.00 O ATOM 1912 CB ILE A 123 6.355 -4.104 -1.288 1.00 0.00 C ATOM 1913 CG1 ILE A 123 5.070 -4.651 -0.648 1.00 0.00 C ATOM 1914 CG2 ILE A 123 7.378 -3.760 -0.202 1.00 0.00 C ATOM 1915 CD1 ILE A 123 4.291 -3.600 0.150 1.00 0.00 C ATOM 0 H ILE A 123 4.989 -3.889 -3.709 1.00 0.00 H new ATOM 0 HA ILE A 123 5.898 -2.046 -1.556 1.00 0.00 H new ATOM 0 HB ILE A 123 6.768 -4.887 -1.924 1.00 0.00 H new ATOM 0 HG12 ILE A 123 4.426 -5.053 -1.430 1.00 0.00 H new ATOM 0 HG13 ILE A 123 5.326 -5.480 0.011 1.00 0.00 H new ATOM 0 HG21 ILE A 123 7.546 -4.633 0.429 1.00 0.00 H new ATOM 0 HG22 ILE A 123 8.318 -3.463 -0.668 1.00 0.00 H new ATOM 0 HG23 ILE A 123 7.000 -2.939 0.407 1.00 0.00 H new ATOM 0 HD11 ILE A 123 3.396 -4.055 0.574 1.00 0.00 H new ATOM 0 HD12 ILE A 123 4.918 -3.215 0.954 1.00 0.00 H new ATOM 0 HD13 ILE A 123 4.004 -2.781 -0.510 1.00 0.00 H new ATOM 1927 N TYR A 124 8.104 -1.697 -2.625 1.00 0.00 N ATOM 1928 CA TYR A 124 9.234 -1.160 -3.393 1.00 0.00 C ATOM 1929 C TYR A 124 10.122 -0.293 -2.510 1.00 0.00 C ATOM 1930 O TYR A 124 9.646 0.259 -1.516 1.00 0.00 O ATOM 1931 CB TYR A 124 8.741 -0.335 -4.594 1.00 0.00 C ATOM 1932 CG TYR A 124 7.778 0.787 -4.189 1.00 0.00 C ATOM 1933 CD1 TYR A 124 6.426 0.478 -3.882 1.00 0.00 C ATOM 1934 CD2 TYR A 124 8.267 2.103 -4.094 1.00 0.00 C ATOM 1935 CE1 TYR A 124 5.565 1.504 -3.448 1.00 0.00 C ATOM 1936 CE2 TYR A 124 7.405 3.137 -3.701 1.00 0.00 C ATOM 1937 CZ TYR A 124 6.059 2.823 -3.388 1.00 0.00 C ATOM 1938 OH TYR A 124 5.198 3.822 -3.096 1.00 0.00 O ATOM 0 H TYR A 124 8.004 -1.282 -1.699 1.00 0.00 H new ATOM 0 HA TYR A 124 9.814 -2.006 -3.761 1.00 0.00 H new ATOM 0 HB2 TYR A 124 9.599 0.097 -5.109 1.00 0.00 H new ATOM 0 HB3 TYR A 124 8.243 -0.996 -5.303 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.062 -0.534 -3.981 1.00 0.00 H new ATOM 0 HD2 TYR A 124 9.301 2.316 -4.323 1.00 0.00 H new ATOM 0 HE1 TYR A 124 4.546 1.285 -3.166 1.00 0.00 H new ATOM 0 HE2 TYR A 124 7.761 4.155 -3.638 1.00 0.00 H new ATOM 0 HH TYR A 124 5.678 4.676 -3.088 1.00 0.00 H new ATOM 1948 N THR A 125 11.422 -0.429 -2.744 1.00 0.00 N ATOM 1949 CA THR A 125 12.453 0.298 -1.980 1.00 0.00 C ATOM 1950 C THR A 125 12.423 1.784 -2.378 1.00 0.00 C ATOM 1951 O THR A 125 11.496 2.236 -3.035 1.00 0.00 O ATOM 1952 CB THR A 125 13.823 -0.338 -2.228 1.00 0.00 C ATOM 1953 OG1 THR A 125 14.171 -0.159 -3.608 1.00 0.00 O ATOM 1954 CG2 THR A 125 13.876 -1.828 -1.838 1.00 0.00 C ATOM 0 H THR A 125 11.800 -1.043 -3.465 1.00 0.00 H new ATOM 0 HA THR A 125 12.252 0.233 -0.911 1.00 0.00 H new ATOM 0 HB THR A 125 14.548 0.162 -1.586 1.00 0.00 H new ATOM 0 HG1 THR A 125 15.048 -0.561 -3.779 1.00 0.00 H new ATOM 0 HG21 THR A 125 14.873 -2.221 -2.037 1.00 0.00 H new ATOM 0 HG22 THR A 125 13.649 -1.935 -0.777 1.00 0.00 H new ATOM 0 HG23 THR A 125 13.143 -2.384 -2.423 1.00 0.00 H new ATOM 1962 N TYR A 126 13.501 2.503 -2.070 1.00 0.00 N ATOM 1963 CA TYR A 126 13.614 3.955 -2.320 1.00 0.00 C ATOM 1964 C TYR A 126 15.042 4.479 -2.081 1.00 0.00 C ATOM 1965 O TYR A 126 15.718 3.941 -1.210 1.00 0.00 O ATOM 1966 CB TYR A 126 12.572 4.672 -1.444 1.00 0.00 C ATOM 1967 CG TYR A 126 12.919 6.109 -1.047 1.00 0.00 C ATOM 1968 CD1 TYR A 126 12.712 7.202 -1.908 1.00 0.00 C ATOM 1969 CD2 TYR A 126 13.549 6.296 0.191 1.00 0.00 C ATOM 1970 CE1 TYR A 126 13.150 8.489 -1.572 1.00 0.00 C ATOM 1971 CE2 TYR A 126 13.977 7.589 0.543 1.00 0.00 C ATOM 1972 CZ TYR A 126 13.780 8.662 -0.329 1.00 0.00 C ATOM 1973 OH TYR A 126 14.161 9.895 0.063 1.00 0.00 O ATOM 0 H TYR A 126 14.331 2.100 -1.636 1.00 0.00 H new ATOM 0 HA TYR A 126 13.410 4.162 -3.370 1.00 0.00 H new ATOM 0 HB2 TYR A 126 11.621 4.681 -1.976 1.00 0.00 H new ATOM 0 HB3 TYR A 126 12.424 4.089 -0.535 1.00 0.00 H new ATOM 0 HD1 TYR A 126 12.204 7.045 -2.848 1.00 0.00 H new ATOM 0 HD2 TYR A 126 13.703 5.464 0.862 1.00 0.00 H new ATOM 0 HE1 TYR A 126 13.008 9.321 -2.246 1.00 0.00 H new ATOM 0 HE2 TYR A 126 14.461 7.753 1.494 1.00 0.00 H new ATOM 0 HH TYR A 126 14.581 9.842 0.947 1.00 0.00 H new ATOM 1983 N PRO A 127 15.490 5.441 -2.913 1.00 0.00 N ATOM 1984 CA PRO A 127 14.791 5.955 -4.120 1.00 0.00 C ATOM 1985 C PRO A 127 14.821 5.017 -5.307 1.00 0.00 C ATOM 1986 O PRO A 127 14.021 5.174 -6.229 1.00 0.00 O ATOM 1987 CB PRO A 127 15.402 7.322 -4.414 1.00 0.00 C ATOM 1988 CG PRO A 127 16.800 7.233 -3.827 1.00 0.00 C ATOM 1989 CD PRO A 127 16.735 6.212 -2.686 1.00 0.00 C ATOM 0 HA PRO A 127 13.722 6.039 -3.922 1.00 0.00 H new ATOM 0 HB2 PRO A 127 15.431 7.525 -5.485 1.00 0.00 H new ATOM 0 HB3 PRO A 127 14.826 8.124 -3.953 1.00 0.00 H new ATOM 0 HG2 PRO A 127 17.519 6.921 -4.585 1.00 0.00 H new ATOM 0 HG3 PRO A 127 17.127 8.205 -3.458 1.00 0.00 H new ATOM 0 HD2 PRO A 127 17.608 5.559 -2.694 1.00 0.00 H new ATOM 0 HD3 PRO A 127 16.717 6.709 -1.716 1.00 0.00 H new ATOM 1997 N ASN A 128 15.556 3.926 -5.110 1.00 0.00 N ATOM 1998 CA ASN A 128 15.658 2.830 -6.078 1.00 0.00 C ATOM 1999 C ASN A 128 14.298 2.436 -6.632 1.00 0.00 C ATOM 2000 O ASN A 128 14.146 2.347 -7.842 1.00 0.00 O ATOM 2001 CB ASN A 128 16.318 1.636 -5.401 1.00 0.00 C ATOM 2002 CG ASN A 128 17.581 1.238 -6.162 1.00 0.00 C ATOM 2003 OD1 ASN A 128 18.628 0.999 -5.574 1.00 0.00 O ATOM 2004 ND2 ASN A 128 17.502 1.173 -7.471 1.00 0.00 N ATOM 0 H ASN A 128 16.105 3.773 -4.264 1.00 0.00 H new ATOM 0 HA ASN A 128 16.262 3.166 -6.921 1.00 0.00 H new ATOM 0 HB2 ASN A 128 16.568 1.884 -4.369 1.00 0.00 H new ATOM 0 HB3 ASN A 128 15.624 0.796 -5.368 1.00 0.00 H new ATOM 0 HD21 ASN A 128 18.324 0.919 -8.020 1.00 0.00 H new ATOM 0 HD22 ASN A 128 16.619 1.376 -7.939 1.00 0.00 H new ATOM 2011 N LYS A 129 13.323 2.290 -5.719 1.00 0.00 N ATOM 2012 CA LYS A 129 11.942 1.901 -6.062 1.00 0.00 C ATOM 2013 C LYS A 129 11.916 0.554 -6.789 1.00 0.00 C ATOM 2014 O LYS A 129 11.094 0.313 -7.672 1.00 0.00 O ATOM 2015 CB LYS A 129 11.237 2.977 -6.891 1.00 0.00 C ATOM 2016 CG LYS A 129 10.776 4.141 -6.029 1.00 0.00 C ATOM 2017 CD LYS A 129 10.022 5.147 -6.892 1.00 0.00 C ATOM 2018 CE LYS A 129 8.601 5.337 -6.356 1.00 0.00 C ATOM 2019 NZ LYS A 129 8.189 6.743 -6.507 1.00 0.00 N ATOM 0 H LYS A 129 13.469 2.438 -4.720 1.00 0.00 H new ATOM 0 HA LYS A 129 11.394 1.797 -5.125 1.00 0.00 H new ATOM 0 HB2 LYS A 129 11.914 3.342 -7.664 1.00 0.00 H new ATOM 0 HB3 LYS A 129 10.378 2.539 -7.400 1.00 0.00 H new ATOM 0 HG2 LYS A 129 10.133 3.780 -5.226 1.00 0.00 H new ATOM 0 HG3 LYS A 129 11.634 4.621 -5.558 1.00 0.00 H new ATOM 0 HD2 LYS A 129 10.548 6.101 -6.896 1.00 0.00 H new ATOM 0 HD3 LYS A 129 9.986 4.798 -7.924 1.00 0.00 H new ATOM 0 HE2 LYS A 129 7.911 4.687 -6.894 1.00 0.00 H new ATOM 0 HE3 LYS A 129 8.558 5.048 -5.306 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 7.616 7.027 -5.687 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 9.033 7.348 -6.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 7.627 6.849 -7.375 1.00 0.00 H new ATOM 2033 N VAL A 130 12.867 -0.290 -6.404 1.00 0.00 N ATOM 2034 CA VAL A 130 13.044 -1.644 -6.964 1.00 0.00 C ATOM 2035 C VAL A 130 11.812 -2.446 -6.563 1.00 0.00 C ATOM 2036 O VAL A 130 11.714 -2.904 -5.418 1.00 0.00 O ATOM 2037 CB VAL A 130 14.339 -2.315 -6.467 1.00 0.00 C ATOM 2038 CG1 VAL A 130 14.491 -3.745 -6.991 1.00 0.00 C ATOM 2039 CG2 VAL A 130 15.568 -1.536 -6.937 1.00 0.00 C ATOM 0 H VAL A 130 13.552 -0.059 -5.684 1.00 0.00 H new ATOM 0 HA VAL A 130 13.143 -1.594 -8.048 1.00 0.00 H new ATOM 0 HB VAL A 130 14.269 -2.327 -5.379 1.00 0.00 H new ATOM 0 HG11 VAL A 130 15.419 -4.174 -6.613 1.00 0.00 H new ATOM 0 HG12 VAL A 130 13.648 -4.348 -6.653 1.00 0.00 H new ATOM 0 HG13 VAL A 130 14.515 -3.733 -8.081 1.00 0.00 H new ATOM 0 HG21 VAL A 130 16.471 -2.028 -6.575 1.00 0.00 H new ATOM 0 HG22 VAL A 130 15.584 -1.505 -8.026 1.00 0.00 H new ATOM 0 HG23 VAL A 130 15.526 -0.520 -6.545 1.00 0.00 H new ATOM 2049 N PHE A 131 10.846 -2.442 -7.481 1.00 0.00 N ATOM 2050 CA PHE A 131 9.579 -3.167 -7.360 1.00 0.00 C ATOM 2051 C PHE A 131 9.856 -4.547 -6.767 1.00 0.00 C ATOM 2052 O PHE A 131 10.556 -5.369 -7.359 1.00 0.00 O ATOM 2053 CB PHE A 131 8.952 -3.265 -8.754 1.00 0.00 C ATOM 2054 CG PHE A 131 7.765 -4.225 -8.811 1.00 0.00 C ATOM 2055 CD1 PHE A 131 6.466 -3.741 -8.523 1.00 0.00 C ATOM 2056 CD2 PHE A 131 8.010 -5.609 -8.997 1.00 0.00 C ATOM 2057 CE1 PHE A 131 5.406 -4.668 -8.389 1.00 0.00 C ATOM 2058 CE2 PHE A 131 6.957 -6.534 -8.834 1.00 0.00 C ATOM 2059 CZ PHE A 131 5.665 -6.045 -8.530 1.00 0.00 C ATOM 0 H PHE A 131 10.924 -1.920 -8.354 1.00 0.00 H new ATOM 0 HA PHE A 131 8.883 -2.650 -6.699 1.00 0.00 H new ATOM 0 HB2 PHE A 131 8.626 -2.274 -9.070 1.00 0.00 H new ATOM 0 HB3 PHE A 131 9.711 -3.592 -9.465 1.00 0.00 H new ATOM 0 HD1 PHE A 131 6.287 -2.682 -8.408 1.00 0.00 H new ATOM 0 HD2 PHE A 131 8.998 -5.954 -9.262 1.00 0.00 H new ATOM 0 HE1 PHE A 131 4.405 -4.322 -8.180 1.00 0.00 H new ATOM 0 HE2 PHE A 131 7.134 -7.594 -8.939 1.00 0.00 H new ATOM 0 HZ PHE A 131 4.855 -6.747 -8.402 1.00 0.00 H new ATOM 2069 N CYS A 132 9.370 -4.718 -5.548 1.00 0.00 N ATOM 2070 CA CYS A 132 9.568 -5.984 -4.822 1.00 0.00 C ATOM 2071 C CYS A 132 8.466 -6.958 -5.245 1.00 0.00 C ATOM 2072 O CYS A 132 8.737 -7.975 -5.885 1.00 0.00 O ATOM 2073 CB CYS A 132 9.545 -5.708 -3.318 1.00 0.00 C ATOM 2074 SG CYS A 132 10.731 -4.464 -2.693 1.00 0.00 S ATOM 0 H CYS A 132 8.840 -4.012 -5.037 1.00 0.00 H new ATOM 0 HA CYS A 132 10.533 -6.432 -5.060 1.00 0.00 H new ATOM 0 HB2 CYS A 132 8.540 -5.386 -3.046 1.00 0.00 H new ATOM 0 HB3 CYS A 132 9.731 -6.647 -2.797 1.00 0.00 H new ATOM 2079 N GLY A 133 7.227 -6.557 -4.974 1.00 0.00 N ATOM 2080 CA GLY A 133 6.042 -7.342 -5.307 1.00 0.00 C ATOM 2081 C GLY A 133 4.748 -6.671 -4.866 1.00 0.00 C ATOM 2082 O GLY A 133 4.720 -5.479 -4.551 1.00 0.00 O ATOM 0 H GLY A 133 7.016 -5.672 -4.514 1.00 0.00 H new ATOM 0 HA2 GLY A 133 6.012 -7.507 -6.384 1.00 0.00 H new ATOM 0 HA3 GLY A 133 6.117 -8.322 -4.836 1.00 0.00 H new ATOM 2086 N ILE A 134 3.705 -7.486 -4.862 1.00 0.00 N ATOM 2087 CA ILE A 134 2.375 -7.075 -4.393 1.00 0.00 C ATOM 2088 C ILE A 134 1.925 -8.030 -3.300 1.00 0.00 C ATOM 2089 O ILE A 134 1.928 -9.243 -3.460 1.00 0.00 O ATOM 2090 CB ILE A 134 1.370 -6.958 -5.554 1.00 0.00 C ATOM 2091 CG1 ILE A 134 1.649 -5.691 -6.357 1.00 0.00 C ATOM 2092 CG2 ILE A 134 -0.106 -6.908 -5.145 1.00 0.00 C ATOM 2093 CD1 ILE A 134 2.365 -6.017 -7.659 1.00 0.00 C ATOM 0 H ILE A 134 3.748 -8.453 -5.182 1.00 0.00 H new ATOM 0 HA ILE A 134 2.427 -6.073 -3.967 1.00 0.00 H new ATOM 0 HB ILE A 134 1.518 -7.872 -6.128 1.00 0.00 H new ATOM 0 HG12 ILE A 134 0.711 -5.179 -6.572 1.00 0.00 H new ATOM 0 HG13 ILE A 134 2.257 -5.007 -5.765 1.00 0.00 H new ATOM 0 HG21 ILE A 134 -0.728 -6.826 -6.036 1.00 0.00 H new ATOM 0 HG22 ILE A 134 -0.365 -7.819 -4.605 1.00 0.00 H new ATOM 0 HG23 ILE A 134 -0.276 -6.044 -4.503 1.00 0.00 H new ATOM 0 HD11 ILE A 134 2.552 -5.096 -8.212 1.00 0.00 H new ATOM 0 HD12 ILE A 134 3.313 -6.507 -7.440 1.00 0.00 H new ATOM 0 HD13 ILE A 134 1.744 -6.681 -8.260 1.00 0.00 H new ATOM 2105 N ILE A 135 1.668 -7.459 -2.150 1.00 0.00 N ATOM 2106 CA ILE A 135 1.179 -8.228 -0.998 1.00 0.00 C ATOM 2107 C ILE A 135 -0.240 -7.781 -0.627 1.00 0.00 C ATOM 2108 O ILE A 135 -0.590 -6.612 -0.791 1.00 0.00 O ATOM 2109 CB ILE A 135 2.106 -8.086 0.195 1.00 0.00 C ATOM 2110 CG1 ILE A 135 2.359 -6.608 0.487 1.00 0.00 C ATOM 2111 CG2 ILE A 135 3.421 -8.829 -0.066 1.00 0.00 C ATOM 2112 CD1 ILE A 135 2.810 -6.429 1.909 1.00 0.00 C ATOM 0 H ILE A 135 1.785 -6.462 -1.971 1.00 0.00 H new ATOM 0 HA ILE A 135 1.158 -9.281 -1.280 1.00 0.00 H new ATOM 0 HB ILE A 135 1.634 -8.531 1.071 1.00 0.00 H new ATOM 0 HG12 ILE A 135 3.117 -6.220 -0.194 1.00 0.00 H new ATOM 0 HG13 ILE A 135 1.449 -6.034 0.312 1.00 0.00 H new ATOM 0 HG21 ILE A 135 4.078 -8.720 0.797 1.00 0.00 H new ATOM 0 HG22 ILE A 135 3.215 -9.886 -0.234 1.00 0.00 H new ATOM 0 HG23 ILE A 135 3.907 -8.410 -0.947 1.00 0.00 H new ATOM 0 HD11 ILE A 135 2.987 -5.371 2.104 1.00 0.00 H new ATOM 0 HD12 ILE A 135 2.039 -6.799 2.585 1.00 0.00 H new ATOM 0 HD13 ILE A 135 3.732 -6.987 2.071 1.00 0.00 H new ATOM 2124 N ALA A 136 -1.030 -8.742 -0.183 1.00 0.00 N ATOM 2125 CA ALA A 136 -2.426 -8.504 0.189 1.00 0.00 C ATOM 2126 C ALA A 136 -2.799 -9.326 1.414 1.00 0.00 C ATOM 2127 O ALA A 136 -2.217 -10.375 1.682 1.00 0.00 O ATOM 2128 CB ALA A 136 -3.344 -8.931 -0.959 1.00 0.00 C ATOM 0 H ALA A 136 -0.729 -9.710 -0.068 1.00 0.00 H new ATOM 0 HA ALA A 136 -2.543 -7.442 0.404 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -4.383 -8.753 -0.680 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -3.104 -8.353 -1.851 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -3.200 -9.992 -1.165 1.00 0.00 H new ATOM 2134 N HIS A 137 -3.880 -8.883 2.057 1.00 0.00 N ATOM 2135 CA HIS A 137 -4.365 -9.572 3.246 1.00 0.00 C ATOM 2136 C HIS A 137 -5.260 -10.743 2.808 1.00 0.00 C ATOM 2137 O HIS A 137 -6.260 -10.562 2.120 1.00 0.00 O ATOM 2138 CB HIS A 137 -5.168 -8.617 4.111 1.00 0.00 C ATOM 2139 CG HIS A 137 -4.376 -7.373 4.516 1.00 0.00 C ATOM 2140 ND1 HIS A 137 -3.749 -7.183 5.676 1.00 0.00 N ATOM 2141 CD2 HIS A 137 -4.289 -6.245 3.821 1.00 0.00 C ATOM 2142 CE1 HIS A 137 -3.287 -5.936 5.701 1.00 0.00 C ATOM 2143 NE2 HIS A 137 -3.607 -5.368 4.545 1.00 0.00 N ATOM 0 H HIS A 137 -4.425 -8.067 1.779 1.00 0.00 H new ATOM 0 HA HIS A 137 -3.518 -9.942 3.824 1.00 0.00 H new ATOM 0 HB2 HIS A 137 -6.064 -8.311 3.571 1.00 0.00 H new ATOM 0 HB3 HIS A 137 -5.499 -9.139 5.009 1.00 0.00 H new ATOM 0 HD1 HIS A 137 -3.642 -7.875 6.418 1.00 0.00 H new ATOM 0 HD2 HIS A 137 -4.702 -6.072 2.838 1.00 0.00 H new ATOM 0 HE1 HIS A 137 -2.749 -5.471 6.514 1.00 0.00 H new ATOM 2152 N THR A 138 -4.955 -11.905 3.342 1.00 0.00 N ATOM 2153 CA THR A 138 -5.681 -13.151 3.022 1.00 0.00 C ATOM 2154 C THR A 138 -6.936 -13.328 3.892 1.00 0.00 C ATOM 2155 O THR A 138 -7.328 -14.430 4.255 1.00 0.00 O ATOM 2156 CB THR A 138 -4.712 -14.316 3.192 1.00 0.00 C ATOM 2157 OG1 THR A 138 -3.955 -14.092 4.391 1.00 0.00 O ATOM 2158 CG2 THR A 138 -3.809 -14.454 1.965 1.00 0.00 C ATOM 0 H THR A 138 -4.198 -12.031 4.014 1.00 0.00 H new ATOM 0 HA THR A 138 -6.038 -13.110 1.993 1.00 0.00 H new ATOM 0 HB THR A 138 -5.258 -15.255 3.281 1.00 0.00 H new ATOM 0 HG1 THR A 138 -3.325 -14.831 4.523 1.00 0.00 H new ATOM 0 HG21 THR A 138 -3.126 -15.291 2.108 1.00 0.00 H new ATOM 0 HG22 THR A 138 -4.421 -14.632 1.081 1.00 0.00 H new ATOM 0 HG23 THR A 138 -3.236 -13.537 1.830 1.00 0.00 H new ATOM 2166 N LYS A 139 -7.616 -12.198 4.097 1.00 0.00 N ATOM 2167 CA LYS A 139 -8.840 -12.109 4.919 1.00 0.00 C ATOM 2168 C LYS A 139 -9.422 -10.689 4.861 1.00 0.00 C ATOM 2169 O LYS A 139 -9.217 -9.867 5.746 1.00 0.00 O ATOM 2170 CB LYS A 139 -8.563 -12.529 6.371 1.00 0.00 C ATOM 2171 CG LYS A 139 -9.887 -12.731 7.102 1.00 0.00 C ATOM 2172 CD LYS A 139 -9.757 -12.350 8.572 1.00 0.00 C ATOM 2173 CE LYS A 139 -11.100 -11.772 9.025 1.00 0.00 C ATOM 2174 NZ LYS A 139 -11.212 -11.878 10.478 1.00 0.00 N ATOM 0 H LYS A 139 -7.334 -11.304 3.695 1.00 0.00 H new ATOM 0 HA LYS A 139 -9.577 -12.800 4.509 1.00 0.00 H new ATOM 0 HB2 LYS A 139 -7.980 -13.450 6.390 1.00 0.00 H new ATOM 0 HB3 LYS A 139 -7.970 -11.766 6.875 1.00 0.00 H new ATOM 0 HG2 LYS A 139 -10.663 -12.127 6.632 1.00 0.00 H new ATOM 0 HG3 LYS A 139 -10.199 -13.772 7.018 1.00 0.00 H new ATOM 0 HD2 LYS A 139 -9.495 -13.222 9.171 1.00 0.00 H new ATOM 0 HD3 LYS A 139 -8.961 -11.618 8.708 1.00 0.00 H new ATOM 0 HE2 LYS A 139 -11.181 -10.729 8.719 1.00 0.00 H new ATOM 0 HE3 LYS A 139 -11.919 -12.309 8.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 139 -12.216 -11.881 10.750 1.00 0.00 H new ATOM 0 HZ2 LYS A 139 -10.764 -12.761 10.797 1.00 0.00 H new ATOM 0 HZ3 LYS A 139 -10.735 -11.068 10.923 1.00 0.00 H new ATOM 2188 N GLU A 140 -10.114 -10.418 3.758 1.00 0.00 N ATOM 2189 CA GLU A 140 -10.771 -9.128 3.467 1.00 0.00 C ATOM 2190 C GLU A 140 -9.722 -8.035 3.230 1.00 0.00 C ATOM 2191 O GLU A 140 -9.233 -7.883 2.107 1.00 0.00 O ATOM 2192 CB GLU A 140 -11.752 -8.797 4.597 1.00 0.00 C ATOM 2193 CG GLU A 140 -13.221 -8.955 4.201 1.00 0.00 C ATOM 2194 CD GLU A 140 -13.913 -7.580 4.158 1.00 0.00 C ATOM 2195 OE1 GLU A 140 -13.575 -6.727 5.010 1.00 0.00 O ATOM 2196 OE2 GLU A 140 -14.798 -7.445 3.300 1.00 0.00 O ATOM 0 H GLU A 140 -10.242 -11.104 3.014 1.00 0.00 H new ATOM 0 HA GLU A 140 -11.349 -9.193 2.545 1.00 0.00 H new ATOM 0 HB2 GLU A 140 -11.543 -9.444 5.449 1.00 0.00 H new ATOM 0 HB3 GLU A 140 -11.582 -7.772 4.926 1.00 0.00 H new ATOM 0 HG2 GLU A 140 -13.292 -9.436 3.226 1.00 0.00 H new ATOM 0 HG3 GLU A 140 -13.729 -9.604 4.914 1.00 0.00 H new ATOM 2203 N ASN A 141 -9.240 -7.466 4.331 1.00 0.00 N ATOM 2204 CA ASN A 141 -8.228 -6.391 4.365 1.00 0.00 C ATOM 2205 C ASN A 141 -7.395 -6.411 5.666 1.00 0.00 C ATOM 2206 O ASN A 141 -6.841 -5.408 6.094 1.00 0.00 O ATOM 2207 CB ASN A 141 -8.931 -5.039 4.211 1.00 0.00 C ATOM 2208 CG ASN A 141 -9.491 -4.842 2.808 1.00 0.00 C ATOM 2209 OD1 ASN A 141 -10.509 -5.386 2.403 1.00 0.00 O ATOM 2210 ND2 ASN A 141 -8.836 -4.002 2.048 1.00 0.00 N ATOM 0 H ASN A 141 -9.548 -7.744 5.263 1.00 0.00 H new ATOM 0 HA ASN A 141 -7.534 -6.554 3.541 1.00 0.00 H new ATOM 0 HB2 ASN A 141 -9.740 -4.967 4.938 1.00 0.00 H new ATOM 0 HB3 ASN A 141 -8.228 -4.237 4.436 1.00 0.00 H new ATOM 0 HD21 ASN A 141 -9.173 -3.795 1.108 1.00 0.00 H new ATOM 0 HD22 ASN A 141 -7.988 -3.554 2.396 1.00 0.00 H new ATOM 2217 N GLN A 142 -7.365 -7.580 6.292 1.00 0.00 N ATOM 2218 CA GLN A 142 -6.728 -7.795 7.603 1.00 0.00 C ATOM 2219 C GLN A 142 -6.046 -9.164 7.661 1.00 0.00 C ATOM 2220 O GLN A 142 -6.439 -10.104 6.967 1.00 0.00 O ATOM 2221 CB GLN A 142 -7.713 -7.631 8.764 1.00 0.00 C ATOM 2222 CG GLN A 142 -9.164 -7.943 8.359 1.00 0.00 C ATOM 2223 CD GLN A 142 -10.052 -8.355 9.527 1.00 0.00 C ATOM 2224 OE1 GLN A 142 -9.655 -9.034 10.471 1.00 0.00 O ATOM 2225 NE2 GLN A 142 -11.310 -8.010 9.412 1.00 0.00 N ATOM 0 H GLN A 142 -7.787 -8.424 5.905 1.00 0.00 H new ATOM 0 HA GLN A 142 -5.968 -7.022 7.716 1.00 0.00 H new ATOM 0 HB2 GLN A 142 -7.418 -8.290 9.581 1.00 0.00 H new ATOM 0 HB3 GLN A 142 -7.657 -6.610 9.142 1.00 0.00 H new ATOM 0 HG2 GLN A 142 -9.595 -7.064 7.879 1.00 0.00 H new ATOM 0 HG3 GLN A 142 -9.161 -8.742 7.617 1.00 0.00 H new ATOM 0 HE21 GLN A 142 -11.614 -7.446 8.618 1.00 0.00 H new ATOM 0 HE22 GLN A 142 -11.986 -8.306 10.116 1.00 0.00 H new ATOM 2234 N GLY A 143 -4.942 -9.180 8.400 1.00 0.00 N ATOM 2235 CA GLY A 143 -4.095 -10.368 8.583 1.00 0.00 C ATOM 2236 C GLY A 143 -2.817 -10.242 7.759 1.00 0.00 C ATOM 2237 O GLY A 143 -2.722 -9.415 6.860 1.00 0.00 O ATOM 0 H GLY A 143 -4.600 -8.359 8.899 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -3.845 -10.486 9.637 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -4.642 -11.262 8.283 1.00 0.00 H new ATOM 2241 N GLU A 144 -1.818 -11.034 8.146 1.00 0.00 N ATOM 2242 CA GLU A 144 -0.500 -11.054 7.465 1.00 0.00 C ATOM 2243 C GLU A 144 -0.641 -11.020 5.940 1.00 0.00 C ATOM 2244 O GLU A 144 -1.424 -11.764 5.338 1.00 0.00 O ATOM 2245 CB GLU A 144 0.346 -12.272 7.823 1.00 0.00 C ATOM 2246 CG GLU A 144 1.317 -11.989 8.970 1.00 0.00 C ATOM 2247 CD GLU A 144 0.831 -12.502 10.324 1.00 0.00 C ATOM 2248 OE1 GLU A 144 0.231 -13.601 10.354 1.00 0.00 O ATOM 2249 OE2 GLU A 144 1.054 -11.764 11.314 1.00 0.00 O ATOM 0 H GLU A 144 -1.886 -11.679 8.933 1.00 0.00 H new ATOM 0 HA GLU A 144 0.002 -10.154 7.821 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -0.309 -13.098 8.100 1.00 0.00 H new ATOM 0 HB3 GLU A 144 0.908 -12.592 6.945 1.00 0.00 H new ATOM 0 HG2 GLU A 144 2.279 -12.447 8.742 1.00 0.00 H new ATOM 0 HG3 GLU A 144 1.484 -10.914 9.037 1.00 0.00 H new ATOM 2256 N LEU A 145 0.008 -10.007 5.380 1.00 0.00 N ATOM 2257 CA LEU A 145 -0.066 -9.758 3.939 1.00 0.00 C ATOM 2258 C LEU A 145 0.767 -10.814 3.218 1.00 0.00 C ATOM 2259 O LEU A 145 1.951 -10.994 3.526 1.00 0.00 O ATOM 2260 CB LEU A 145 0.463 -8.370 3.593 1.00 0.00 C ATOM 2261 CG LEU A 145 -0.098 -7.259 4.469 1.00 0.00 C ATOM 2262 CD1 LEU A 145 1.001 -6.685 5.360 1.00 0.00 C ATOM 2263 CD2 LEU A 145 -0.636 -6.156 3.554 1.00 0.00 C ATOM 0 H LEU A 145 0.589 -9.346 5.895 1.00 0.00 H new ATOM 0 HA LEU A 145 -1.108 -9.811 3.624 1.00 0.00 H new ATOM 0 HB2 LEU A 145 1.550 -8.374 3.680 1.00 0.00 H new ATOM 0 HB3 LEU A 145 0.228 -8.152 2.551 1.00 0.00 H new ATOM 0 HG LEU A 145 -0.891 -7.654 5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 145 0.588 -5.891 5.982 1.00 0.00 H new ATOM 0 HD12 LEU A 145 1.402 -7.473 5.997 1.00 0.00 H new ATOM 0 HD13 LEU A 145 1.799 -6.280 4.738 1.00 0.00 H new ATOM 0 HD21 LEU A 145 -1.044 -5.347 4.160 1.00 0.00 H new ATOM 0 HD22 LEU A 145 0.173 -5.771 2.933 1.00 0.00 H new ATOM 0 HD23 LEU A 145 -1.421 -6.563 2.916 1.00 0.00 H new ATOM 2275 N LYS A 146 0.103 -11.659 2.456 1.00 0.00 N ATOM 2276 CA LYS A 146 0.809 -12.698 1.692 1.00 0.00 C ATOM 2277 C LYS A 146 1.273 -12.143 0.347 1.00 0.00 C ATOM 2278 O LYS A 146 0.535 -11.414 -0.319 1.00 0.00 O ATOM 2279 CB LYS A 146 -0.096 -13.920 1.518 1.00 0.00 C ATOM 2280 CG LYS A 146 0.650 -15.123 0.929 1.00 0.00 C ATOM 2281 CD LYS A 146 -0.199 -16.383 1.085 1.00 0.00 C ATOM 2282 CE LYS A 146 0.663 -17.511 1.662 1.00 0.00 C ATOM 2283 NZ LYS A 146 -0.197 -18.434 2.411 1.00 0.00 N ATOM 0 H LYS A 146 -0.911 -11.658 2.342 1.00 0.00 H new ATOM 0 HA LYS A 146 1.697 -13.012 2.241 1.00 0.00 H new ATOM 0 HB2 LYS A 146 -0.518 -14.196 2.484 1.00 0.00 H new ATOM 0 HB3 LYS A 146 -0.931 -13.660 0.867 1.00 0.00 H new ATOM 0 HG2 LYS A 146 0.868 -14.948 -0.125 1.00 0.00 H new ATOM 0 HG3 LYS A 146 1.607 -15.253 1.435 1.00 0.00 H new ATOM 0 HD2 LYS A 146 -1.046 -16.185 1.742 1.00 0.00 H new ATOM 0 HD3 LYS A 146 -0.608 -16.681 0.120 1.00 0.00 H new ATOM 0 HE2 LYS A 146 1.175 -18.041 0.859 1.00 0.00 H new ATOM 0 HE3 LYS A 146 1.433 -17.100 2.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 146 0.381 -19.203 2.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 146 -0.666 -17.921 3.184 1.00 0.00 H new ATOM 0 HZ3 LYS A 146 -0.916 -18.833 1.774 1.00 0.00 H new ATOM 2297 N LEU A 147 2.537 -12.430 0.040 1.00 0.00 N ATOM 2298 CA LEU A 147 3.166 -12.066 -1.238 1.00 0.00 C ATOM 2299 C LEU A 147 2.403 -12.744 -2.368 1.00 0.00 C ATOM 2300 O LEU A 147 2.413 -13.971 -2.481 1.00 0.00 O ATOM 2301 CB LEU A 147 4.651 -12.452 -1.231 1.00 0.00 C ATOM 2302 CG LEU A 147 5.322 -12.297 -2.595 1.00 0.00 C ATOM 2303 CD1 LEU A 147 5.809 -10.868 -2.845 1.00 0.00 C ATOM 2304 CD2 LEU A 147 6.497 -13.270 -2.681 1.00 0.00 C ATOM 0 H LEU A 147 3.163 -12.926 0.674 1.00 0.00 H new ATOM 0 HA LEU A 147 3.122 -10.987 -1.388 1.00 0.00 H new ATOM 0 HB2 LEU A 147 5.176 -11.834 -0.503 1.00 0.00 H new ATOM 0 HB3 LEU A 147 4.749 -13.486 -0.901 1.00 0.00 H new ATOM 0 HG LEU A 147 4.582 -12.520 -3.363 1.00 0.00 H new ATOM 0 HD11 LEU A 147 6.278 -10.810 -3.827 1.00 0.00 H new ATOM 0 HD12 LEU A 147 4.962 -10.183 -2.807 1.00 0.00 H new ATOM 0 HD13 LEU A 147 6.534 -10.592 -2.080 1.00 0.00 H new ATOM 0 HD21 LEU A 147 6.984 -13.168 -3.651 1.00 0.00 H new ATOM 0 HD22 LEU A 147 7.213 -13.046 -1.890 1.00 0.00 H new ATOM 0 HD23 LEU A 147 6.133 -14.291 -2.563 1.00 0.00 H new ATOM 2316 N CYS A 148 1.625 -11.925 -3.080 1.00 0.00 N ATOM 2317 CA CYS A 148 0.884 -12.368 -4.265 1.00 0.00 C ATOM 2318 C CYS A 148 1.854 -13.063 -5.236 1.00 0.00 C ATOM 2319 O CYS A 148 3.079 -13.073 -5.061 1.00 0.00 O ATOM 2320 CB CYS A 148 0.198 -11.197 -4.989 1.00 0.00 C ATOM 2321 SG CYS A 148 -0.879 -10.137 -3.944 1.00 0.00 S ATOM 0 H CYS A 148 1.491 -10.940 -2.853 1.00 0.00 H new ATOM 0 HA CYS A 148 0.107 -13.057 -3.934 1.00 0.00 H new ATOM 0 HB2 CYS A 148 0.968 -10.570 -5.438 1.00 0.00 H new ATOM 0 HB3 CYS A 148 -0.401 -11.600 -5.806 1.00 0.00 H new ATOM 2326 N SER A 149 1.276 -13.678 -6.236 1.00 0.00 N ATOM 2327 CA SER A 149 2.064 -14.464 -7.198 1.00 0.00 C ATOM 2328 C SER A 149 1.515 -14.289 -8.598 1.00 0.00 C ATOM 2329 O SER A 149 0.357 -13.952 -8.818 1.00 0.00 O ATOM 2330 CB SER A 149 2.070 -15.942 -6.819 1.00 0.00 C ATOM 2331 OG SER A 149 0.740 -16.458 -6.878 1.00 0.00 O ATOM 0 H SER A 149 0.273 -13.661 -6.419 1.00 0.00 H new ATOM 0 HA SER A 149 3.090 -14.098 -7.172 1.00 0.00 H new ATOM 0 HB2 SER A 149 2.717 -16.499 -7.497 1.00 0.00 H new ATOM 0 HB3 SER A 149 2.476 -16.069 -5.815 1.00 0.00 H new ATOM 0 HG SER A 149 0.747 -17.408 -6.636 1.00 0.00 H new ATOM 2337 N HIS A 150 2.402 -14.490 -9.548 1.00 0.00 N ATOM 2338 CA HIS A 150 2.059 -14.356 -10.969 1.00 0.00 C ATOM 2339 C HIS A 150 2.264 -15.633 -11.802 1.00 0.00 C ATOM 2340 O HIS A 150 2.878 -15.560 -12.886 1.00 0.00 O ATOM 2341 CB HIS A 150 2.780 -13.134 -11.503 1.00 0.00 C ATOM 2342 CG HIS A 150 4.280 -13.131 -11.233 1.00 0.00 C ATOM 2343 ND1 HIS A 150 5.202 -13.655 -12.031 1.00 0.00 N ATOM 2344 CD2 HIS A 150 4.887 -12.499 -10.244 1.00 0.00 C ATOM 2345 CE1 HIS A 150 6.395 -13.352 -11.534 1.00 0.00 C ATOM 2346 NE2 HIS A 150 6.194 -12.635 -10.436 1.00 0.00 N ATOM 2347 OXT HIS A 150 1.884 -16.698 -11.267 1.00 0.00 O ATOM 0 H HIS A 150 3.373 -14.748 -9.373 1.00 0.00 H new ATOM 0 HA HIS A 150 0.983 -14.209 -11.064 1.00 0.00 H new ATOM 0 HB2 HIS A 150 2.615 -13.069 -12.578 1.00 0.00 H new ATOM 0 HB3 HIS A 150 2.339 -12.242 -11.058 1.00 0.00 H new ATOM 0 HD2 HIS A 150 4.410 -11.971 -9.432 1.00 0.00 H new ATOM 0 HE1 HIS A 150 7.352 -13.636 -11.947 1.00 0.00 H new ATOM 0 HE2 HIS A 150 6.925 -12.251 -9.837 1.00 0.00 H new