USER MOD reduce.3.24.130724 H: found=0, std=0, add=993, rem=0, adj=48 USER MOD reduce.3.24.130724 removed 991 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 13 HIS :FLIP no HD1:sc= -0.488 F(o=-8.4,f=-5.6) USER MOD Set 1.2: A 86 ASN : amide:sc= -5.1! C(o=-5.6!,f=-6.3!) USER MOD Set 2.1: A 64 CYS SG : rot 180:sc= -1.82 USER MOD Set 2.2: A 85 CYS SG : rot -94:sc= -11! USER MOD Set 3.1: A 62 SER OG : rot 171:sc= 0.712 USER MOD Set 3.2: A 88 SER OG : rot 94:sc= 0.436 USER MOD Set 4.1: A 50 GLN : amide:sc= -0.809 K(o=-1.4,f=-2.9) USER MOD Set 4.2: A 54 ASN :FLIP amide:sc= -0.626 F(o=-4.7,f=-1.4) USER MOD Set 5.1: A 37 TYR OH : rot 180:sc= 0.749 USER MOD Set 5.2: A 41 LYS NZ :NH3+ 161:sc= 0.849 (180deg=0) USER MOD Set 6.1: A 19 THR OG1 : rot 84:sc= 0.0727 USER MOD Set 6.2: A 122 SER OG : rot -22:sc= 0.422 USER MOD Set 7.1: A 15 ASN : amide:sc= 0 X(o=-0.39,f=-0.39) USER MOD Set 7.2: A 17 ASN :FLIP amide:sc= -0.388 F(o=-1.1,f=-0.39) USER MOD Single : A 1 GLY N :NH3+ 135:sc= 0.0116 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 1:sc= 0.63 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 32:sc= -0.0124 USER MOD Single : A 11 SER OG : rot -39:sc= 0.272 USER MOD Single : A 12 GLN : amide:sc= -0.254 X(o=-0.25,f=-0.42) USER MOD Single : A 21 THR OG1 : rot 29:sc= 0.637 USER MOD Single : A 22 ASN : amide:sc= -0.197 X(o=-0.2,f=-0.6) USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 GLN : amide:sc= -0.0085 X(o=-0.0085,f=-0.3) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot -103:sc= 0.951 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -160:sc=-0.00899 (180deg=-0.239) USER MOD Single : A 38 GLN : amide:sc= 0.104 X(o=0.1,f=-0.063) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 105:sc= 1.32 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.0856 K(o=-0.086,f=-0.85) USER MOD Single : A 49 ASN : amide:sc= 0.209 X(o=0.21,f=0) USER MOD Single : A 55 SER OG : rot -88:sc= 1.17 USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=-0.0016) USER MOD Single : A 71 SER OG : rot 72:sc= 1.06 USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 ASN : amide:sc= -1.24 K(o=-1.2,f=-4.2!) USER MOD Single : A 76 ASN : amide:sc= -0.0934 X(o=-0.093,f=0) USER MOD Single : A 77 ASN :FLIP amide:sc= -0.378 F(o=-1.2,f=-0.38) USER MOD Single : A 78 HIS :FLIP no HD1:sc= -4.44 F(o=-6.8,f=-4.4) USER MOD Single : A 79 THR OG1 : rot -21:sc= -1.81 USER MOD Single : A 83 SER OG : rot -129:sc= -3.8! USER MOD Single : A 100 TYR OH : rot 180:sc= 0 USER MOD Single : A 106 MET CE :methyl -134:sc= -3.16 (180deg=-5.01) USER MOD Single : A 107 THR OG1 : rot -102:sc= -0.801 USER MOD Single : A 108 HIS : no HD1:sc= 0 X(o=0,f=-0.0058) USER MOD Single : A 109 ASN : amide:sc= -1.12 K(o=-1.1,f=-6.2!) USER MOD Single : A 111 THR OG1 : rot -89:sc= 1.25 USER MOD Single : A 112 GLN : amide:sc= -0.252 K(o=-0.25,f=-2.2!) USER MOD Single : A 115 ASN : amide:sc= -0.128 X(o=-0.13,f=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.478 USER MOD Single : A 121 LYS NZ :NH3+ -123:sc= 0 (180deg=-0.0428) USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 138:sc= 0.283 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.346 31.292 -2.661 1.00 0.00 N ATOM 2 CA GLY A 1 -15.842 30.998 -4.031 1.00 0.00 C ATOM 3 C GLY A 1 -16.023 29.543 -4.416 1.00 0.00 C ATOM 4 O GLY A 1 -15.914 28.653 -3.573 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.652 31.877 -2.154 1.00 0.00 H new ATOM 0 H2 GLY A 1 -17.249 31.804 -2.726 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.490 30.400 -2.145 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -16.365 31.629 -4.750 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.785 31.257 -4.089 1.00 0.00 H new ATOM 10 N SER A 2 -16.301 29.302 -5.693 1.00 0.00 N ATOM 11 CA SER A 2 -16.499 27.944 -6.189 1.00 0.00 C ATOM 12 C SER A 2 -15.310 27.493 -7.031 1.00 0.00 C ATOM 13 O SER A 2 -15.465 26.724 -7.979 1.00 0.00 O ATOM 14 CB SER A 2 -17.784 27.861 -7.013 1.00 0.00 C ATOM 15 OG SER A 2 -18.328 26.553 -6.981 1.00 0.00 O ATOM 0 H SER A 2 -16.394 30.028 -6.403 1.00 0.00 H new ATOM 0 HA SER A 2 -16.585 27.279 -5.329 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.514 28.571 -6.626 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.577 28.147 -8.044 1.00 0.00 H new ATOM 0 HG SER A 2 -19.150 26.527 -7.514 1.00 0.00 H new ATOM 21 N SER A 3 -14.124 27.979 -6.680 1.00 0.00 N ATOM 22 CA SER A 3 -12.909 27.625 -7.404 1.00 0.00 C ATOM 23 C SER A 3 -12.459 26.210 -7.055 1.00 0.00 C ATOM 24 O SER A 3 -12.185 25.904 -5.895 1.00 0.00 O ATOM 25 CB SER A 3 -11.791 28.621 -7.085 1.00 0.00 C ATOM 26 OG SER A 3 -11.216 28.353 -5.818 1.00 0.00 O ATOM 0 H SER A 3 -13.979 28.619 -5.899 1.00 0.00 H new ATOM 0 HA SER A 3 -13.128 27.664 -8.471 1.00 0.00 H new ATOM 0 HB2 SER A 3 -11.022 28.568 -7.855 1.00 0.00 H new ATOM 0 HB3 SER A 3 -12.188 29.636 -7.100 1.00 0.00 H new ATOM 0 HG SER A 3 -11.657 27.576 -5.416 1.00 0.00 H new ATOM 32 N GLY A 4 -12.386 25.352 -8.066 1.00 0.00 N ATOM 33 CA GLY A 4 -11.969 23.979 -7.846 1.00 0.00 C ATOM 34 C GLY A 4 -10.602 23.685 -8.431 1.00 0.00 C ATOM 35 O GLY A 4 -9.696 23.247 -7.720 1.00 0.00 O ATOM 0 H GLY A 4 -12.608 25.582 -9.035 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -11.954 23.775 -6.775 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.702 23.305 -8.289 1.00 0.00 H new ATOM 39 N SER A 5 -10.450 23.927 -9.729 1.00 0.00 N ATOM 40 CA SER A 5 -9.184 23.684 -10.409 1.00 0.00 C ATOM 41 C SER A 5 -8.238 24.869 -10.239 1.00 0.00 C ATOM 42 O SER A 5 -8.231 25.792 -11.053 1.00 0.00 O ATOM 43 CB SER A 5 -9.422 23.418 -11.896 1.00 0.00 C ATOM 44 OG SER A 5 -8.200 23.188 -12.576 1.00 0.00 O ATOM 0 H SER A 5 -11.189 24.291 -10.331 1.00 0.00 H new ATOM 0 HA SER A 5 -8.722 22.805 -9.959 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.075 22.554 -12.014 1.00 0.00 H new ATOM 0 HB3 SER A 5 -9.936 24.269 -12.343 1.00 0.00 H new ATOM 0 HG SER A 5 -8.380 23.019 -13.524 1.00 0.00 H new ATOM 50 N SER A 6 -7.443 24.836 -9.174 1.00 0.00 N ATOM 51 CA SER A 6 -6.493 25.908 -8.897 1.00 0.00 C ATOM 52 C SER A 6 -5.218 25.355 -8.267 1.00 0.00 C ATOM 53 O SER A 6 -5.212 24.957 -7.102 1.00 0.00 O ATOM 54 CB SER A 6 -7.124 26.951 -7.971 1.00 0.00 C ATOM 55 OG SER A 6 -7.566 28.080 -8.704 1.00 0.00 O ATOM 0 H SER A 6 -7.438 24.080 -8.490 1.00 0.00 H new ATOM 0 HA SER A 6 -6.233 26.383 -9.843 1.00 0.00 H new ATOM 0 HB2 SER A 6 -7.965 26.508 -7.437 1.00 0.00 H new ATOM 0 HB3 SER A 6 -6.398 27.262 -7.220 1.00 0.00 H new ATOM 0 HG SER A 6 -7.967 28.731 -8.091 1.00 0.00 H new ATOM 61 N GLY A 7 -4.142 25.334 -9.046 1.00 0.00 N ATOM 62 CA GLY A 7 -2.876 24.828 -8.548 1.00 0.00 C ATOM 63 C GLY A 7 -2.523 23.473 -9.128 1.00 0.00 C ATOM 64 O GLY A 7 -2.555 22.463 -8.426 1.00 0.00 O ATOM 0 H GLY A 7 -4.124 25.658 -10.013 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -2.085 25.539 -8.787 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -2.920 24.754 -7.461 1.00 0.00 H new ATOM 68 N SER A 8 -2.186 23.452 -10.414 1.00 0.00 N ATOM 69 CA SER A 8 -1.826 22.210 -11.088 1.00 0.00 C ATOM 70 C SER A 8 -0.370 21.846 -10.816 1.00 0.00 C ATOM 71 O SER A 8 -0.012 20.669 -10.767 1.00 0.00 O ATOM 72 CB SER A 8 -2.060 22.336 -12.594 1.00 0.00 C ATOM 73 OG SER A 8 -3.396 22.713 -12.873 1.00 0.00 O ATOM 0 H SER A 8 -2.155 24.280 -11.009 1.00 0.00 H new ATOM 0 HA SER A 8 -2.460 21.415 -10.695 1.00 0.00 H new ATOM 0 HB2 SER A 8 -1.376 23.075 -13.011 1.00 0.00 H new ATOM 0 HB3 SER A 8 -1.838 21.386 -13.080 1.00 0.00 H new ATOM 0 HG SER A 8 -3.519 22.788 -13.842 1.00 0.00 H new ATOM 79 N SER A 9 0.466 22.864 -10.639 1.00 0.00 N ATOM 80 CA SER A 9 1.884 22.652 -10.372 1.00 0.00 C ATOM 81 C SER A 9 2.132 22.448 -8.880 1.00 0.00 C ATOM 82 O SER A 9 2.906 23.178 -8.262 1.00 0.00 O ATOM 83 CB SER A 9 2.703 23.839 -10.882 1.00 0.00 C ATOM 84 OG SER A 9 3.956 23.414 -11.390 1.00 0.00 O ATOM 0 H SER A 9 0.186 23.844 -10.676 1.00 0.00 H new ATOM 0 HA SER A 9 2.198 21.751 -10.899 1.00 0.00 H new ATOM 0 HB2 SER A 9 2.148 24.359 -11.663 1.00 0.00 H new ATOM 0 HB3 SER A 9 2.858 24.552 -10.072 1.00 0.00 H new ATOM 0 HG SER A 9 4.459 24.191 -11.711 1.00 0.00 H new ATOM 90 N SER A 10 1.469 21.448 -8.308 1.00 0.00 N ATOM 91 CA SER A 10 1.617 21.148 -6.889 1.00 0.00 C ATOM 92 C SER A 10 1.164 19.723 -6.584 1.00 0.00 C ATOM 93 O SER A 10 0.229 19.213 -7.201 1.00 0.00 O ATOM 94 CB SER A 10 0.813 22.141 -6.049 1.00 0.00 C ATOM 95 OG SER A 10 -0.444 22.416 -6.646 1.00 0.00 O ATOM 0 H SER A 10 0.825 20.833 -8.805 1.00 0.00 H new ATOM 0 HA SER A 10 2.673 21.238 -6.633 1.00 0.00 H new ATOM 0 HB2 SER A 10 0.663 21.737 -5.048 1.00 0.00 H new ATOM 0 HB3 SER A 10 1.376 23.067 -5.938 1.00 0.00 H new ATOM 0 HG SER A 10 -0.761 21.620 -7.122 1.00 0.00 H new ATOM 101 N SER A 11 1.832 19.087 -5.627 1.00 0.00 N ATOM 102 CA SER A 11 1.498 17.722 -5.240 1.00 0.00 C ATOM 103 C SER A 11 1.663 16.765 -6.417 1.00 0.00 C ATOM 104 O SER A 11 1.704 17.188 -7.572 1.00 0.00 O ATOM 105 CB SER A 11 0.064 17.657 -4.711 1.00 0.00 C ATOM 106 OG SER A 11 -0.030 16.795 -3.591 1.00 0.00 O ATOM 0 H SER A 11 2.608 19.495 -5.106 1.00 0.00 H new ATOM 0 HA SER A 11 2.184 17.417 -4.450 1.00 0.00 H new ATOM 0 HB2 SER A 11 -0.269 18.657 -4.433 1.00 0.00 H new ATOM 0 HB3 SER A 11 -0.602 17.307 -5.500 1.00 0.00 H new ATOM 0 HG SER A 11 0.543 16.013 -3.731 1.00 0.00 H new ATOM 111 N GLN A 12 1.758 15.474 -6.115 1.00 0.00 N ATOM 112 CA GLN A 12 1.919 14.458 -7.149 1.00 0.00 C ATOM 113 C GLN A 12 1.181 13.177 -6.775 1.00 0.00 C ATOM 114 O GLN A 12 0.946 12.906 -5.597 1.00 0.00 O ATOM 115 CB GLN A 12 3.403 14.159 -7.376 1.00 0.00 C ATOM 116 CG GLN A 12 4.204 14.033 -6.089 1.00 0.00 C ATOM 117 CD GLN A 12 5.694 14.198 -6.313 1.00 0.00 C ATOM 118 OE1 GLN A 12 6.309 13.434 -7.055 1.00 0.00 O ATOM 119 NE2 GLN A 12 6.282 15.199 -5.669 1.00 0.00 N ATOM 0 H GLN A 12 1.726 15.107 -5.164 1.00 0.00 H new ATOM 0 HA GLN A 12 1.489 14.846 -8.072 1.00 0.00 H new ATOM 0 HB2 GLN A 12 3.496 13.233 -7.944 1.00 0.00 H new ATOM 0 HB3 GLN A 12 3.835 14.952 -7.987 1.00 0.00 H new ATOM 0 HG2 GLN A 12 3.862 14.784 -5.377 1.00 0.00 H new ATOM 0 HG3 GLN A 12 4.013 13.058 -5.640 1.00 0.00 H new ATOM 0 HE21 GLN A 12 5.732 15.808 -5.063 1.00 0.00 H new ATOM 0 HE22 GLN A 12 7.283 15.359 -5.780 1.00 0.00 H new ATOM 128 N HIS A 13 0.816 12.394 -7.785 1.00 0.00 N ATOM 129 CA HIS A 13 0.104 11.140 -7.563 1.00 0.00 C ATOM 130 C HIS A 13 0.904 9.957 -8.100 1.00 0.00 C ATOM 131 O HIS A 13 1.586 10.067 -9.118 1.00 0.00 O ATOM 132 CB HIS A 13 -1.271 11.186 -8.232 1.00 0.00 C ATOM 133 CG HIS A 13 -2.092 12.373 -7.833 1.00 0.00 C ATOM 134 ND1 HIS A 13 -1.991 13.202 -6.767 1.00 0.00 N flip ATOM 135 CD2 HIS A 13 -3.167 12.826 -8.569 1.00 0.00 C flip ATOM 136 CE1 HIS A 13 -2.996 14.130 -6.877 1.00 0.00 C flip ATOM 137 NE2 HIS A 13 -3.691 13.883 -7.972 1.00 0.00 N flip ATOM 0 H HIS A 13 1.001 12.606 -8.765 1.00 0.00 H new ATOM 0 HA HIS A 13 -0.026 11.010 -6.489 1.00 0.00 H new ATOM 0 HB2 HIS A 13 -1.139 11.193 -9.314 1.00 0.00 H new ATOM 0 HB3 HIS A 13 -1.818 10.276 -7.983 1.00 0.00 H new ATOM 0 HD2 HIS A 13 -3.525 12.386 -9.488 1.00 0.00 H new ATOM 0 HE1 HIS A 13 -3.187 14.933 -6.180 1.00 0.00 H new ATOM 0 HE2 HIS A 13 -4.495 14.417 -8.301 1.00 0.00 H new ATOM 146 N PHE A 14 0.813 8.826 -7.407 1.00 0.00 N ATOM 147 CA PHE A 14 1.527 7.621 -7.814 1.00 0.00 C ATOM 148 C PHE A 14 0.587 6.420 -7.852 1.00 0.00 C ATOM 149 O PHE A 14 0.239 5.857 -6.814 1.00 0.00 O ATOM 150 CB PHE A 14 2.691 7.347 -6.861 1.00 0.00 C ATOM 151 CG PHE A 14 3.735 8.427 -6.866 1.00 0.00 C ATOM 152 CD1 PHE A 14 4.650 8.518 -7.903 1.00 0.00 C ATOM 153 CD2 PHE A 14 3.801 9.352 -5.837 1.00 0.00 C ATOM 154 CE1 PHE A 14 5.612 9.512 -7.912 1.00 0.00 C ATOM 155 CE2 PHE A 14 4.760 10.347 -5.840 1.00 0.00 C ATOM 156 CZ PHE A 14 5.666 10.428 -6.879 1.00 0.00 C ATOM 0 H PHE A 14 0.252 8.719 -6.562 1.00 0.00 H new ATOM 0 HA PHE A 14 1.921 7.781 -8.818 1.00 0.00 H new ATOM 0 HB2 PHE A 14 2.303 7.232 -5.849 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.158 6.400 -7.132 1.00 0.00 H new ATOM 0 HD1 PHE A 14 4.612 7.805 -8.713 1.00 0.00 H new ATOM 0 HD2 PHE A 14 3.094 9.295 -5.022 1.00 0.00 H new ATOM 0 HE1 PHE A 14 6.320 9.572 -8.725 1.00 0.00 H new ATOM 0 HE2 PHE A 14 4.801 11.061 -5.030 1.00 0.00 H new ATOM 0 HZ PHE A 14 6.415 11.206 -6.884 1.00 0.00 H new ATOM 166 N ASN A 15 0.176 6.034 -9.057 1.00 0.00 N ATOM 167 CA ASN A 15 -0.727 4.901 -9.235 1.00 0.00 C ATOM 168 C ASN A 15 -0.186 3.646 -8.555 1.00 0.00 C ATOM 169 O ASN A 15 0.826 3.087 -8.976 1.00 0.00 O ATOM 170 CB ASN A 15 -0.950 4.634 -10.726 1.00 0.00 C ATOM 171 CG ASN A 15 -2.415 4.699 -11.114 1.00 0.00 C ATOM 172 OD1 ASN A 15 -3.013 5.774 -11.143 1.00 0.00 O ATOM 173 ND2 ASN A 15 -2.999 3.545 -11.413 1.00 0.00 N ATOM 0 H ASN A 15 0.455 6.490 -9.926 1.00 0.00 H new ATOM 0 HA ASN A 15 -1.679 5.154 -8.768 1.00 0.00 H new ATOM 0 HB2 ASN A 15 -0.390 5.364 -11.310 1.00 0.00 H new ATOM 0 HB3 ASN A 15 -0.553 3.651 -10.979 1.00 0.00 H new ATOM 0 HD21 ASN A 15 -3.983 3.526 -11.680 1.00 0.00 H new ATOM 0 HD22 ASN A 15 -2.464 2.678 -11.375 1.00 0.00 H new ATOM 180 N LEU A 16 -0.872 3.207 -7.504 1.00 0.00 N ATOM 181 CA LEU A 16 -0.465 2.017 -6.767 1.00 0.00 C ATOM 182 C LEU A 16 -1.255 0.798 -7.235 1.00 0.00 C ATOM 183 O LEU A 16 -2.484 0.834 -7.305 1.00 0.00 O ATOM 184 CB LEU A 16 -0.672 2.228 -5.265 1.00 0.00 C ATOM 185 CG LEU A 16 -0.007 1.186 -4.364 1.00 0.00 C ATOM 186 CD1 LEU A 16 1.507 1.322 -4.417 1.00 0.00 C ATOM 187 CD2 LEU A 16 -0.509 1.323 -2.934 1.00 0.00 C ATOM 0 H LEU A 16 -1.713 3.658 -7.144 1.00 0.00 H new ATOM 0 HA LEU A 16 0.593 1.841 -6.959 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -0.291 3.213 -4.997 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.742 2.233 -5.059 1.00 0.00 H new ATOM 0 HG LEU A 16 -0.273 0.194 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 16 1.963 0.573 -3.770 1.00 0.00 H new ATOM 0 HD12 LEU A 16 1.850 1.174 -5.441 1.00 0.00 H new ATOM 0 HD13 LEU A 16 1.795 2.317 -4.078 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -0.026 0.574 -2.306 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -0.272 2.319 -2.559 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -1.589 1.174 -2.912 1.00 0.00 H new ATOM 199 N ASN A 17 -0.544 -0.278 -7.562 1.00 0.00 N ATOM 200 CA ASN A 17 -1.189 -1.501 -8.028 1.00 0.00 C ATOM 201 C ASN A 17 -0.445 -2.740 -7.541 1.00 0.00 C ATOM 202 O ASN A 17 0.783 -2.802 -7.588 1.00 0.00 O ATOM 203 CB ASN A 17 -1.263 -1.507 -9.557 1.00 0.00 C ATOM 204 CG ASN A 17 -2.458 -0.735 -10.080 1.00 0.00 C ATOM 205 OD1 ASN A 17 -2.363 0.589 -10.061 1.00 0.00 O flip ATOM 206 ND2 ASN A 17 -3.456 -1.322 -10.499 1.00 0.00 N flip ATOM 0 H ASN A 17 0.474 -0.328 -7.513 1.00 0.00 H new ATOM 0 HA ASN A 17 -2.198 -1.526 -7.616 1.00 0.00 H new ATOM 0 HB2 ASN A 17 -0.349 -1.076 -9.964 1.00 0.00 H new ATOM 0 HB3 ASN A 17 -1.315 -2.536 -9.912 1.00 0.00 H new ATOM 0 HD21 ASN A 17 -3.487 -2.342 -10.496 1.00 0.00 H new ATOM 0 HD22 ASN A 17 -4.252 -0.789 -10.850 1.00 0.00 H new ATOM 213 N PHE A 18 -1.204 -3.730 -7.076 1.00 0.00 N ATOM 214 CA PHE A 18 -0.628 -4.976 -6.584 1.00 0.00 C ATOM 215 C PHE A 18 -1.727 -5.956 -6.183 1.00 0.00 C ATOM 216 O PHE A 18 -2.509 -5.688 -5.271 1.00 0.00 O ATOM 217 CB PHE A 18 0.301 -4.708 -5.397 1.00 0.00 C ATOM 218 CG PHE A 18 -0.410 -4.202 -4.173 1.00 0.00 C ATOM 219 CD1 PHE A 18 -0.851 -2.891 -4.105 1.00 0.00 C ATOM 220 CD2 PHE A 18 -0.634 -5.040 -3.092 1.00 0.00 C ATOM 221 CE1 PHE A 18 -1.503 -2.423 -2.981 1.00 0.00 C ATOM 222 CE2 PHE A 18 -1.286 -4.577 -1.965 1.00 0.00 C ATOM 223 CZ PHE A 18 -1.722 -3.268 -1.909 1.00 0.00 C ATOM 0 H PHE A 18 -2.222 -3.691 -7.030 1.00 0.00 H new ATOM 0 HA PHE A 18 -0.044 -5.421 -7.389 1.00 0.00 H new ATOM 0 HB2 PHE A 18 0.828 -5.628 -5.145 1.00 0.00 H new ATOM 0 HB3 PHE A 18 1.055 -3.980 -5.695 1.00 0.00 H new ATOM 0 HD1 PHE A 18 -0.683 -2.227 -4.940 1.00 0.00 H new ATOM 0 HD2 PHE A 18 -0.296 -6.065 -3.131 1.00 0.00 H new ATOM 0 HE1 PHE A 18 -1.841 -1.398 -2.940 1.00 0.00 H new ATOM 0 HE2 PHE A 18 -1.454 -5.239 -1.128 1.00 0.00 H new ATOM 0 HZ PHE A 18 -2.233 -2.905 -1.030 1.00 0.00 H new ATOM 233 N THR A 19 -1.785 -7.089 -6.876 1.00 0.00 N ATOM 234 CA THR A 19 -2.792 -8.106 -6.596 1.00 0.00 C ATOM 235 C THR A 19 -2.442 -8.901 -5.344 1.00 0.00 C ATOM 236 O THR A 19 -1.283 -9.247 -5.118 1.00 0.00 O ATOM 237 CB THR A 19 -2.936 -9.052 -7.789 1.00 0.00 C ATOM 238 OG1 THR A 19 -3.233 -8.328 -8.969 1.00 0.00 O ATOM 239 CG2 THR A 19 -4.020 -10.091 -7.601 1.00 0.00 C ATOM 0 H THR A 19 -1.146 -7.326 -7.635 1.00 0.00 H new ATOM 0 HA THR A 19 -3.740 -7.597 -6.423 1.00 0.00 H new ATOM 0 HB THR A 19 -1.977 -9.563 -7.871 1.00 0.00 H new ATOM 0 HG1 THR A 19 -2.402 -7.991 -9.364 1.00 0.00 H new ATOM 0 HG21 THR A 19 -4.069 -10.729 -8.483 1.00 0.00 H new ATOM 0 HG22 THR A 19 -3.793 -10.699 -6.725 1.00 0.00 H new ATOM 0 HG23 THR A 19 -4.980 -9.594 -7.459 1.00 0.00 H new ATOM 247 N ILE A 20 -3.457 -9.191 -4.533 1.00 0.00 N ATOM 248 CA ILE A 20 -3.262 -9.951 -3.304 1.00 0.00 C ATOM 249 C ILE A 20 -3.769 -11.381 -3.460 1.00 0.00 C ATOM 250 O ILE A 20 -4.971 -11.634 -3.398 1.00 0.00 O ATOM 251 CB ILE A 20 -3.983 -9.292 -2.113 1.00 0.00 C ATOM 252 CG1 ILE A 20 -3.649 -7.800 -2.045 1.00 0.00 C ATOM 253 CG2 ILE A 20 -3.602 -9.986 -0.814 1.00 0.00 C ATOM 254 CD1 ILE A 20 -4.621 -7.001 -1.204 1.00 0.00 C ATOM 0 H ILE A 20 -4.422 -8.910 -4.706 1.00 0.00 H new ATOM 0 HA ILE A 20 -2.190 -9.964 -3.107 1.00 0.00 H new ATOM 0 HB ILE A 20 -5.058 -9.396 -2.257 1.00 0.00 H new ATOM 0 HG12 ILE A 20 -2.645 -7.679 -1.639 1.00 0.00 H new ATOM 0 HG13 ILE A 20 -3.635 -7.392 -3.056 1.00 0.00 H new ATOM 0 HG21 ILE A 20 -4.119 -9.509 0.019 1.00 0.00 H new ATOM 0 HG22 ILE A 20 -3.888 -11.037 -0.865 1.00 0.00 H new ATOM 0 HG23 ILE A 20 -2.525 -9.910 -0.663 1.00 0.00 H new ATOM 0 HD11 ILE A 20 -4.323 -5.953 -1.201 1.00 0.00 H new ATOM 0 HD12 ILE A 20 -5.624 -7.092 -1.622 1.00 0.00 H new ATOM 0 HD13 ILE A 20 -4.618 -7.382 -0.183 1.00 0.00 H new ATOM 266 N THR A 21 -2.843 -12.312 -3.665 1.00 0.00 N ATOM 267 CA THR A 21 -3.194 -13.717 -3.831 1.00 0.00 C ATOM 268 C THR A 21 -3.937 -14.245 -2.607 1.00 0.00 C ATOM 269 O THR A 21 -4.743 -15.170 -2.709 1.00 0.00 O ATOM 270 CB THR A 21 -1.937 -14.552 -4.078 1.00 0.00 C ATOM 271 OG1 THR A 21 -0.887 -14.141 -3.221 1.00 0.00 O ATOM 272 CG2 THR A 21 -1.430 -14.463 -5.502 1.00 0.00 C ATOM 0 H THR A 21 -1.843 -12.118 -3.720 1.00 0.00 H new ATOM 0 HA THR A 21 -3.854 -13.799 -4.695 1.00 0.00 H new ATOM 0 HB THR A 21 -2.230 -15.583 -3.878 1.00 0.00 H new ATOM 0 HG1 THR A 21 -1.264 -13.776 -2.393 1.00 0.00 H new ATOM 0 HG21 THR A 21 -0.537 -15.078 -5.609 1.00 0.00 H new ATOM 0 HG22 THR A 21 -2.201 -14.820 -6.186 1.00 0.00 H new ATOM 0 HG23 THR A 21 -1.187 -13.427 -5.738 1.00 0.00 H new ATOM 280 N ASN A 22 -3.658 -13.654 -1.449 1.00 0.00 N ATOM 281 CA ASN A 22 -4.297 -14.067 -0.206 1.00 0.00 C ATOM 282 C ASN A 22 -5.754 -13.613 -0.159 1.00 0.00 C ATOM 283 O ASN A 22 -6.619 -14.326 0.347 1.00 0.00 O ATOM 284 CB ASN A 22 -3.536 -13.502 0.995 1.00 0.00 C ATOM 285 CG ASN A 22 -3.706 -14.350 2.240 1.00 0.00 C ATOM 286 OD1 ASN A 22 -3.631 -15.578 2.184 1.00 0.00 O ATOM 287 ND2 ASN A 22 -3.936 -13.698 3.374 1.00 0.00 N ATOM 0 H ASN A 22 -2.993 -12.887 -1.347 1.00 0.00 H new ATOM 0 HA ASN A 22 -4.276 -15.156 -0.163 1.00 0.00 H new ATOM 0 HB2 ASN A 22 -2.476 -13.431 0.749 1.00 0.00 H new ATOM 0 HB3 ASN A 22 -3.884 -12.489 1.198 1.00 0.00 H new ATOM 0 HD21 ASN A 22 -4.058 -14.216 4.244 1.00 0.00 H new ATOM 0 HD22 ASN A 22 -3.990 -12.679 3.375 1.00 0.00 H new ATOM 294 N LEU A 23 -6.017 -12.422 -0.689 1.00 0.00 N ATOM 295 CA LEU A 23 -7.369 -11.875 -0.706 1.00 0.00 C ATOM 296 C LEU A 23 -8.125 -12.328 -1.955 1.00 0.00 C ATOM 297 O LEU A 23 -7.819 -11.892 -3.064 1.00 0.00 O ATOM 298 CB LEU A 23 -7.321 -10.347 -0.652 1.00 0.00 C ATOM 299 CG LEU A 23 -8.551 -9.681 -0.032 1.00 0.00 C ATOM 300 CD1 LEU A 23 -9.783 -9.936 -0.886 1.00 0.00 C ATOM 301 CD2 LEU A 23 -8.768 -10.182 1.387 1.00 0.00 C ATOM 0 H LEU A 23 -5.312 -11.818 -1.112 1.00 0.00 H new ATOM 0 HA LEU A 23 -7.897 -12.248 0.171 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -6.440 -10.046 -0.085 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -7.193 -9.967 -1.666 1.00 0.00 H new ATOM 0 HG LEU A 23 -8.379 -8.605 0.007 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -10.648 -9.455 -0.430 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -9.625 -9.527 -1.884 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -9.960 -11.009 -0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -9.647 -9.698 1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -8.919 -11.261 1.373 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -7.894 -9.946 1.994 1.00 0.00 H new ATOM 313 N PRO A 24 -9.128 -13.212 -1.794 1.00 0.00 N ATOM 314 CA PRO A 24 -9.921 -13.716 -2.921 1.00 0.00 C ATOM 315 C PRO A 24 -10.922 -12.685 -3.431 1.00 0.00 C ATOM 316 O PRO A 24 -11.079 -11.614 -2.846 1.00 0.00 O ATOM 317 CB PRO A 24 -10.648 -14.918 -2.324 1.00 0.00 C ATOM 318 CG PRO A 24 -10.791 -14.589 -0.879 1.00 0.00 C ATOM 319 CD PRO A 24 -9.569 -13.791 -0.509 1.00 0.00 C ATOM 0 HA PRO A 24 -9.301 -13.959 -3.784 1.00 0.00 H new ATOM 0 HB2 PRO A 24 -11.620 -15.068 -2.795 1.00 0.00 H new ATOM 0 HB3 PRO A 24 -10.079 -15.837 -2.467 1.00 0.00 H new ATOM 0 HG2 PRO A 24 -11.700 -14.016 -0.698 1.00 0.00 H new ATOM 0 HG3 PRO A 24 -10.861 -15.496 -0.278 1.00 0.00 H new ATOM 0 HD2 PRO A 24 -9.803 -13.016 0.221 1.00 0.00 H new ATOM 0 HD3 PRO A 24 -8.797 -14.422 -0.068 1.00 0.00 H new ATOM 327 N TYR A 25 -11.598 -13.016 -4.527 1.00 0.00 N ATOM 328 CA TYR A 25 -12.585 -12.120 -5.117 1.00 0.00 C ATOM 329 C TYR A 25 -13.943 -12.806 -5.235 1.00 0.00 C ATOM 330 O TYR A 25 -14.175 -13.591 -6.154 1.00 0.00 O ATOM 331 CB TYR A 25 -12.117 -11.650 -6.496 1.00 0.00 C ATOM 332 CG TYR A 25 -12.713 -10.327 -6.920 1.00 0.00 C ATOM 333 CD1 TYR A 25 -14.076 -10.202 -7.158 1.00 0.00 C ATOM 334 CD2 TYR A 25 -11.912 -9.204 -7.084 1.00 0.00 C ATOM 335 CE1 TYR A 25 -14.624 -8.994 -7.546 1.00 0.00 C ATOM 336 CE2 TYR A 25 -12.453 -7.993 -7.472 1.00 0.00 C ATOM 337 CZ TYR A 25 -13.809 -7.894 -7.702 1.00 0.00 C ATOM 338 OH TYR A 25 -14.351 -6.690 -8.088 1.00 0.00 O ATOM 0 H TYR A 25 -11.480 -13.899 -5.024 1.00 0.00 H new ATOM 0 HA TYR A 25 -12.691 -11.255 -4.462 1.00 0.00 H new ATOM 0 HB2 TYR A 25 -11.030 -11.565 -6.492 1.00 0.00 H new ATOM 0 HB3 TYR A 25 -12.374 -12.408 -7.235 1.00 0.00 H new ATOM 0 HD1 TYR A 25 -14.718 -11.062 -7.038 1.00 0.00 H new ATOM 0 HD2 TYR A 25 -10.849 -9.278 -6.905 1.00 0.00 H new ATOM 0 HE1 TYR A 25 -15.686 -8.913 -7.726 1.00 0.00 H new ATOM 0 HE2 TYR A 25 -11.817 -7.129 -7.594 1.00 0.00 H new ATOM 0 HH TYR A 25 -13.641 -6.017 -8.151 1.00 0.00 H new ATOM 348 N SER A 26 -14.837 -12.501 -4.300 1.00 0.00 N ATOM 349 CA SER A 26 -16.172 -13.087 -4.300 1.00 0.00 C ATOM 350 C SER A 26 -17.195 -12.109 -4.868 1.00 0.00 C ATOM 351 O SER A 26 -16.853 -10.990 -5.250 1.00 0.00 O ATOM 352 CB SER A 26 -16.573 -13.498 -2.882 1.00 0.00 C ATOM 353 OG SER A 26 -16.897 -12.364 -2.095 1.00 0.00 O ATOM 0 H SER A 26 -14.661 -11.852 -3.533 1.00 0.00 H new ATOM 0 HA SER A 26 -16.152 -13.973 -4.934 1.00 0.00 H new ATOM 0 HB2 SER A 26 -17.428 -14.172 -2.924 1.00 0.00 H new ATOM 0 HB3 SER A 26 -15.756 -14.048 -2.415 1.00 0.00 H new ATOM 0 HG SER A 26 -17.152 -12.653 -1.194 1.00 0.00 H new ATOM 359 N GLN A 27 -18.452 -12.539 -4.921 1.00 0.00 N ATOM 360 CA GLN A 27 -19.525 -11.700 -5.443 1.00 0.00 C ATOM 361 C GLN A 27 -19.765 -10.495 -4.537 1.00 0.00 C ATOM 362 O GLN A 27 -20.168 -9.428 -5.002 1.00 0.00 O ATOM 363 CB GLN A 27 -20.814 -12.515 -5.583 1.00 0.00 C ATOM 364 CG GLN A 27 -21.493 -12.350 -6.933 1.00 0.00 C ATOM 365 CD GLN A 27 -22.464 -11.187 -6.958 1.00 0.00 C ATOM 366 OE1 GLN A 27 -22.223 -10.175 -7.617 1.00 0.00 O ATOM 367 NE2 GLN A 27 -23.572 -11.324 -6.238 1.00 0.00 N ATOM 0 H GLN A 27 -18.752 -13.463 -4.609 1.00 0.00 H new ATOM 0 HA GLN A 27 -19.224 -11.337 -6.426 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -20.586 -13.569 -5.426 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -21.509 -12.219 -4.797 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -20.734 -12.202 -7.702 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -22.025 -13.268 -7.183 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -23.732 -12.180 -5.706 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -24.263 -10.574 -6.217 1.00 0.00 H new ATOM 376 N ASP A 28 -19.515 -10.672 -3.244 1.00 0.00 N ATOM 377 CA ASP A 28 -19.703 -9.599 -2.274 1.00 0.00 C ATOM 378 C ASP A 28 -18.839 -8.391 -2.622 1.00 0.00 C ATOM 379 O ASP A 28 -19.299 -7.250 -2.569 1.00 0.00 O ATOM 380 CB ASP A 28 -19.366 -10.091 -0.866 1.00 0.00 C ATOM 381 CG ASP A 28 -20.172 -11.315 -0.473 1.00 0.00 C ATOM 382 OD1 ASP A 28 -21.416 -11.263 -0.573 1.00 0.00 O ATOM 383 OD2 ASP A 28 -19.559 -12.323 -0.065 1.00 0.00 O ATOM 0 H ASP A 28 -19.182 -11.549 -2.843 1.00 0.00 H new ATOM 0 HA ASP A 28 -20.749 -9.296 -2.306 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -18.303 -10.326 -0.811 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -19.553 -9.291 -0.150 1.00 0.00 H new ATOM 388 N ILE A 29 -17.586 -8.650 -2.979 1.00 0.00 N ATOM 389 CA ILE A 29 -16.657 -7.584 -3.338 1.00 0.00 C ATOM 390 C ILE A 29 -17.128 -6.829 -4.580 1.00 0.00 C ATOM 391 O ILE A 29 -16.678 -5.716 -4.847 1.00 0.00 O ATOM 392 CB ILE A 29 -15.240 -8.134 -3.591 1.00 0.00 C ATOM 393 CG1 ILE A 29 -14.794 -9.017 -2.423 1.00 0.00 C ATOM 394 CG2 ILE A 29 -14.257 -6.992 -3.806 1.00 0.00 C ATOM 395 CD1 ILE A 29 -14.838 -8.314 -1.083 1.00 0.00 C ATOM 0 H ILE A 29 -17.190 -9.589 -3.028 1.00 0.00 H new ATOM 0 HA ILE A 29 -16.628 -6.897 -2.492 1.00 0.00 H new ATOM 0 HB ILE A 29 -15.260 -8.744 -4.494 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -15.431 -9.900 -2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -13.778 -9.365 -2.608 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -13.261 -7.398 -3.983 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -14.567 -6.402 -4.669 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -14.238 -6.357 -2.920 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -14.509 -8.999 -0.302 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -14.179 -7.446 -1.106 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -15.858 -7.990 -0.876 1.00 0.00 H new ATOM 407 N ALA A 30 -18.036 -7.440 -5.336 1.00 0.00 N ATOM 408 CA ALA A 30 -18.562 -6.819 -6.546 1.00 0.00 C ATOM 409 C ALA A 30 -19.684 -5.835 -6.225 1.00 0.00 C ATOM 410 O ALA A 30 -20.008 -4.966 -7.034 1.00 0.00 O ATOM 411 CB ALA A 30 -19.056 -7.887 -7.512 1.00 0.00 C ATOM 0 H ALA A 30 -18.421 -8.362 -5.132 1.00 0.00 H new ATOM 0 HA ALA A 30 -17.753 -6.260 -7.016 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -19.446 -7.411 -8.412 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -18.230 -8.546 -7.779 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -19.846 -8.469 -7.038 1.00 0.00 H new ATOM 417 N GLN A 31 -20.278 -5.977 -5.043 1.00 0.00 N ATOM 418 CA GLN A 31 -21.364 -5.097 -4.625 1.00 0.00 C ATOM 419 C GLN A 31 -21.040 -4.422 -3.292 1.00 0.00 C ATOM 420 O GLN A 31 -21.011 -5.076 -2.249 1.00 0.00 O ATOM 421 CB GLN A 31 -22.667 -5.890 -4.500 1.00 0.00 C ATOM 422 CG GLN A 31 -23.403 -6.059 -5.819 1.00 0.00 C ATOM 423 CD GLN A 31 -24.135 -4.801 -6.244 1.00 0.00 C ATOM 424 OE1 GLN A 31 -24.837 -4.178 -5.447 1.00 0.00 O ATOM 425 NE2 GLN A 31 -23.973 -4.420 -7.506 1.00 0.00 N ATOM 0 H GLN A 31 -20.026 -6.691 -4.360 1.00 0.00 H new ATOM 0 HA GLN A 31 -21.483 -4.324 -5.384 1.00 0.00 H new ATOM 0 HB2 GLN A 31 -22.446 -6.875 -4.088 1.00 0.00 H new ATOM 0 HB3 GLN A 31 -23.322 -5.387 -3.789 1.00 0.00 H new ATOM 0 HG2 GLN A 31 -22.691 -6.340 -6.595 1.00 0.00 H new ATOM 0 HG3 GLN A 31 -24.117 -6.878 -5.730 1.00 0.00 H new ATOM 0 HE21 GLN A 31 -23.382 -4.967 -8.132 1.00 0.00 H new ATOM 0 HE22 GLN A 31 -24.440 -3.581 -7.849 1.00 0.00 H new ATOM 434 N PRO A 32 -20.794 -3.098 -3.304 1.00 0.00 N ATOM 435 CA PRO A 32 -20.474 -2.345 -2.086 1.00 0.00 C ATOM 436 C PRO A 32 -21.524 -2.532 -0.996 1.00 0.00 C ATOM 437 O PRO A 32 -21.236 -2.372 0.191 1.00 0.00 O ATOM 438 CB PRO A 32 -20.451 -0.888 -2.558 1.00 0.00 C ATOM 439 CG PRO A 32 -20.162 -0.965 -4.017 1.00 0.00 C ATOM 440 CD PRO A 32 -20.808 -2.233 -4.499 1.00 0.00 C ATOM 0 HA PRO A 32 -19.536 -2.677 -1.641 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -21.405 -0.396 -2.369 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -19.687 -0.314 -2.033 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -20.564 -0.098 -4.541 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -19.088 -0.979 -4.202 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -21.823 -2.057 -4.856 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -20.253 -2.679 -5.324 1.00 0.00 H new ATOM 448 N SER A 33 -22.744 -2.870 -1.404 1.00 0.00 N ATOM 449 CA SER A 33 -23.838 -3.078 -0.462 1.00 0.00 C ATOM 450 C SER A 33 -23.473 -4.132 0.580 1.00 0.00 C ATOM 451 O SER A 33 -23.934 -4.078 1.719 1.00 0.00 O ATOM 452 CB SER A 33 -25.105 -3.501 -1.207 1.00 0.00 C ATOM 453 OG SER A 33 -26.246 -3.396 -0.374 1.00 0.00 O ATOM 0 H SER A 33 -22.999 -3.006 -2.382 1.00 0.00 H new ATOM 0 HA SER A 33 -24.022 -2.135 0.053 1.00 0.00 H new ATOM 0 HB2 SER A 33 -25.237 -2.876 -2.090 1.00 0.00 H new ATOM 0 HB3 SER A 33 -24.999 -4.528 -1.556 1.00 0.00 H new ATOM 0 HG SER A 33 -27.043 -3.671 -0.874 1.00 0.00 H new ATOM 459 N THR A 34 -22.642 -5.089 0.181 1.00 0.00 N ATOM 460 CA THR A 34 -22.215 -6.155 1.079 1.00 0.00 C ATOM 461 C THR A 34 -21.153 -5.654 2.053 1.00 0.00 C ATOM 462 O THR A 34 -20.571 -4.586 1.857 1.00 0.00 O ATOM 463 CB THR A 34 -21.672 -7.340 0.279 1.00 0.00 C ATOM 464 OG1 THR A 34 -20.484 -6.981 -0.404 1.00 0.00 O ATOM 465 CG2 THR A 34 -22.652 -7.867 -0.748 1.00 0.00 C ATOM 0 H THR A 34 -22.251 -5.148 -0.759 1.00 0.00 H new ATOM 0 HA THR A 34 -23.083 -6.481 1.652 1.00 0.00 H new ATOM 0 HB THR A 34 -21.484 -8.123 1.013 1.00 0.00 H new ATOM 0 HG1 THR A 34 -20.684 -6.832 -1.352 1.00 0.00 H new ATOM 0 HG21 THR A 34 -22.205 -8.706 -1.280 1.00 0.00 H new ATOM 0 HG22 THR A 34 -23.561 -8.198 -0.247 1.00 0.00 H new ATOM 0 HG23 THR A 34 -22.896 -7.076 -1.457 1.00 0.00 H new ATOM 473 N THR A 35 -20.906 -6.431 3.103 1.00 0.00 N ATOM 474 CA THR A 35 -19.915 -6.066 4.108 1.00 0.00 C ATOM 475 C THR A 35 -18.510 -6.461 3.662 1.00 0.00 C ATOM 476 O THR A 35 -17.530 -5.802 4.007 1.00 0.00 O ATOM 477 CB THR A 35 -20.244 -6.733 5.444 1.00 0.00 C ATOM 478 OG1 THR A 35 -21.602 -6.525 5.788 1.00 0.00 O ATOM 479 CG2 THR A 35 -19.396 -6.227 6.591 1.00 0.00 C ATOM 0 H THR A 35 -21.379 -7.317 3.280 1.00 0.00 H new ATOM 0 HA THR A 35 -19.944 -4.983 4.232 1.00 0.00 H new ATOM 0 HB THR A 35 -20.032 -7.792 5.297 1.00 0.00 H new ATOM 0 HG1 THR A 35 -21.793 -6.961 6.645 1.00 0.00 H new ATOM 0 HG21 THR A 35 -19.681 -6.741 7.509 1.00 0.00 H new ATOM 0 HG22 THR A 35 -18.344 -6.420 6.379 1.00 0.00 H new ATOM 0 HG23 THR A 35 -19.551 -5.155 6.713 1.00 0.00 H new ATOM 487 N LYS A 36 -18.421 -7.542 2.894 1.00 0.00 N ATOM 488 CA LYS A 36 -17.136 -8.028 2.401 1.00 0.00 C ATOM 489 C LYS A 36 -16.391 -6.936 1.637 1.00 0.00 C ATOM 490 O LYS A 36 -15.161 -6.909 1.615 1.00 0.00 O ATOM 491 CB LYS A 36 -17.340 -9.247 1.499 1.00 0.00 C ATOM 492 CG LYS A 36 -16.092 -10.098 1.334 1.00 0.00 C ATOM 493 CD LYS A 36 -15.873 -11.007 2.533 1.00 0.00 C ATOM 494 CE LYS A 36 -14.429 -10.971 3.007 1.00 0.00 C ATOM 495 NZ LYS A 36 -13.477 -11.312 1.914 1.00 0.00 N ATOM 0 H LYS A 36 -19.223 -8.099 2.599 1.00 0.00 H new ATOM 0 HA LYS A 36 -16.534 -8.316 3.263 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -18.138 -9.864 1.911 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -17.672 -8.910 0.517 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -16.179 -10.701 0.430 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -15.224 -9.451 1.203 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -16.531 -10.702 3.347 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -16.145 -12.029 2.270 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -14.198 -9.978 3.393 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -14.300 -11.671 3.832 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -12.568 -11.607 2.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -13.868 -12.089 1.343 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -13.329 -10.479 1.310 1.00 0.00 H new ATOM 509 N TYR A 37 -17.145 -6.039 1.011 1.00 0.00 N ATOM 510 CA TYR A 37 -16.556 -4.946 0.247 1.00 0.00 C ATOM 511 C TYR A 37 -16.003 -3.868 1.174 1.00 0.00 C ATOM 512 O TYR A 37 -14.868 -3.420 1.014 1.00 0.00 O ATOM 513 CB TYR A 37 -17.595 -4.341 -0.700 1.00 0.00 C ATOM 514 CG TYR A 37 -17.082 -3.158 -1.492 1.00 0.00 C ATOM 515 CD1 TYR A 37 -17.197 -1.864 -0.999 1.00 0.00 C ATOM 516 CD2 TYR A 37 -16.484 -3.336 -2.733 1.00 0.00 C ATOM 517 CE1 TYR A 37 -16.731 -0.782 -1.721 1.00 0.00 C ATOM 518 CE2 TYR A 37 -16.015 -2.260 -3.461 1.00 0.00 C ATOM 519 CZ TYR A 37 -16.140 -0.985 -2.950 1.00 0.00 C ATOM 520 OH TYR A 37 -15.674 0.090 -3.672 1.00 0.00 O ATOM 0 H TYR A 37 -18.165 -6.047 1.018 1.00 0.00 H new ATOM 0 HA TYR A 37 -15.731 -5.349 -0.340 1.00 0.00 H new ATOM 0 HB2 TYR A 37 -17.934 -5.111 -1.393 1.00 0.00 H new ATOM 0 HB3 TYR A 37 -18.464 -4.029 -0.120 1.00 0.00 H new ATOM 0 HD1 TYR A 37 -17.658 -1.701 -0.036 1.00 0.00 H new ATOM 0 HD2 TYR A 37 -16.384 -4.333 -3.136 1.00 0.00 H new ATOM 0 HE1 TYR A 37 -16.829 0.218 -1.325 1.00 0.00 H new ATOM 0 HE2 TYR A 37 -15.553 -2.416 -4.425 1.00 0.00 H new ATOM 0 HH TYR A 37 -15.285 -0.226 -4.514 1.00 0.00 H new ATOM 530 N GLN A 38 -16.812 -3.456 2.144 1.00 0.00 N ATOM 531 CA GLN A 38 -16.404 -2.428 3.096 1.00 0.00 C ATOM 532 C GLN A 38 -15.307 -2.946 4.022 1.00 0.00 C ATOM 533 O GLN A 38 -14.351 -2.232 4.327 1.00 0.00 O ATOM 534 CB GLN A 38 -17.604 -1.961 3.921 1.00 0.00 C ATOM 535 CG GLN A 38 -18.383 -0.828 3.272 1.00 0.00 C ATOM 536 CD GLN A 38 -19.867 -0.893 3.573 1.00 0.00 C ATOM 537 OE1 GLN A 38 -20.287 -0.736 4.719 1.00 0.00 O ATOM 538 NE2 GLN A 38 -20.671 -1.125 2.542 1.00 0.00 N ATOM 0 H GLN A 38 -17.754 -3.818 2.292 1.00 0.00 H new ATOM 0 HA GLN A 38 -16.009 -1.584 2.531 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -18.274 -2.805 4.083 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -17.256 -1.637 4.902 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -17.987 0.126 3.620 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -18.233 -0.861 2.193 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -20.280 -1.249 1.608 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -21.680 -1.179 2.684 1.00 0.00 H new ATOM 547 N GLN A 39 -15.451 -4.190 4.466 1.00 0.00 N ATOM 548 CA GLN A 39 -14.471 -4.800 5.358 1.00 0.00 C ATOM 549 C GLN A 39 -13.092 -4.846 4.706 1.00 0.00 C ATOM 550 O GLN A 39 -12.134 -4.265 5.214 1.00 0.00 O ATOM 551 CB GLN A 39 -14.915 -6.212 5.749 1.00 0.00 C ATOM 552 CG GLN A 39 -15.418 -6.317 7.180 1.00 0.00 C ATOM 553 CD GLN A 39 -15.302 -7.723 7.737 1.00 0.00 C ATOM 554 OE1 GLN A 39 -14.420 -8.012 8.546 1.00 0.00 O ATOM 555 NE2 GLN A 39 -16.195 -8.605 7.306 1.00 0.00 N ATOM 0 H GLN A 39 -16.236 -4.795 4.223 1.00 0.00 H new ATOM 0 HA GLN A 39 -14.404 -4.187 6.257 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -15.704 -6.537 5.071 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -14.078 -6.897 5.616 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -14.852 -5.632 7.811 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -16.460 -5.999 7.219 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -16.909 -8.322 6.635 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -16.167 -9.566 7.646 1.00 0.00 H new ATOM 564 N THR A 40 -13.001 -5.542 3.577 1.00 0.00 N ATOM 565 CA THR A 40 -11.739 -5.666 2.856 1.00 0.00 C ATOM 566 C THR A 40 -11.225 -4.298 2.419 1.00 0.00 C ATOM 567 O THR A 40 -10.046 -3.984 2.586 1.00 0.00 O ATOM 568 CB THR A 40 -11.911 -6.572 1.637 1.00 0.00 C ATOM 569 OG1 THR A 40 -12.696 -7.706 1.961 1.00 0.00 O ATOM 570 CG2 THR A 40 -10.598 -7.069 1.071 1.00 0.00 C ATOM 0 H THR A 40 -13.785 -6.028 3.142 1.00 0.00 H new ATOM 0 HA THR A 40 -11.007 -6.111 3.530 1.00 0.00 H new ATOM 0 HB THR A 40 -12.402 -5.954 0.885 1.00 0.00 H new ATOM 0 HG1 THR A 40 -13.593 -7.603 1.580 1.00 0.00 H new ATOM 0 HG21 THR A 40 -10.792 -7.706 0.208 1.00 0.00 H new ATOM 0 HG22 THR A 40 -9.989 -6.219 0.765 1.00 0.00 H new ATOM 0 HG23 THR A 40 -10.067 -7.640 1.832 1.00 0.00 H new ATOM 578 N LYS A 41 -12.116 -3.489 1.855 1.00 0.00 N ATOM 579 CA LYS A 41 -11.752 -2.154 1.391 1.00 0.00 C ATOM 580 C LYS A 41 -11.174 -1.318 2.528 1.00 0.00 C ATOM 581 O LYS A 41 -10.246 -0.536 2.326 1.00 0.00 O ATOM 582 CB LYS A 41 -12.973 -1.450 0.795 1.00 0.00 C ATOM 583 CG LYS A 41 -12.661 -0.081 0.214 1.00 0.00 C ATOM 584 CD LYS A 41 -13.682 0.322 -0.839 1.00 0.00 C ATOM 585 CE LYS A 41 -13.451 1.744 -1.326 1.00 0.00 C ATOM 586 NZ LYS A 41 -13.483 1.833 -2.812 1.00 0.00 N ATOM 0 H LYS A 41 -13.095 -3.734 1.708 1.00 0.00 H new ATOM 0 HA LYS A 41 -10.988 -2.261 0.621 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -13.399 -2.079 0.013 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -13.734 -1.343 1.568 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -12.648 0.660 1.013 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -11.665 -0.090 -0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -13.627 -0.366 -1.683 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -14.686 0.237 -0.424 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -14.214 2.400 -0.906 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.488 2.101 -0.961 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.645 2.820 -3.097 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -12.575 1.505 -3.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -14.251 1.236 -3.179 1.00 0.00 H new ATOM 600 N ARG A 42 -11.729 -1.488 3.724 1.00 0.00 N ATOM 601 CA ARG A 42 -11.268 -0.747 4.893 1.00 0.00 C ATOM 602 C ARG A 42 -10.036 -1.406 5.506 1.00 0.00 C ATOM 603 O ARG A 42 -9.194 -0.733 6.102 1.00 0.00 O ATOM 604 CB ARG A 42 -12.383 -0.654 5.936 1.00 0.00 C ATOM 605 CG ARG A 42 -12.156 0.433 6.972 1.00 0.00 C ATOM 606 CD ARG A 42 -12.597 1.794 6.458 1.00 0.00 C ATOM 607 NE ARG A 42 -12.154 2.880 7.330 1.00 0.00 N ATOM 608 CZ ARG A 42 -10.907 3.346 7.358 1.00 0.00 C ATOM 609 NH1 ARG A 42 -9.978 2.826 6.566 1.00 0.00 N ATOM 610 NH2 ARG A 42 -10.588 4.335 8.182 1.00 0.00 N ATOM 0 H ARG A 42 -12.498 -2.132 3.909 1.00 0.00 H new ATOM 0 HA ARG A 42 -10.996 0.258 4.570 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -13.330 -0.469 5.428 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.476 -1.614 6.443 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -12.706 0.191 7.881 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -11.100 0.468 7.238 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -12.199 1.949 5.455 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -13.684 1.816 6.376 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.840 3.306 7.953 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -10.217 2.065 5.931 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -9.025 3.188 6.592 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.298 4.738 8.794 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -9.633 4.692 8.204 1.00 0.00 H new ATOM 624 N SER A 43 -9.937 -2.722 5.359 1.00 0.00 N ATOM 625 CA SER A 43 -8.808 -3.469 5.901 1.00 0.00 C ATOM 626 C SER A 43 -7.521 -3.135 5.152 1.00 0.00 C ATOM 627 O SER A 43 -6.518 -2.763 5.759 1.00 0.00 O ATOM 628 CB SER A 43 -9.079 -4.973 5.822 1.00 0.00 C ATOM 629 OG SER A 43 -8.566 -5.644 6.961 1.00 0.00 O ATOM 0 H SER A 43 -10.625 -3.294 4.869 1.00 0.00 H new ATOM 0 HA SER A 43 -8.685 -3.181 6.945 1.00 0.00 H new ATOM 0 HB2 SER A 43 -10.152 -5.149 5.745 1.00 0.00 H new ATOM 0 HB3 SER A 43 -8.623 -5.381 4.920 1.00 0.00 H new ATOM 0 HG SER A 43 -8.753 -6.603 6.888 1.00 0.00 H new ATOM 635 N ILE A 44 -7.558 -3.271 3.830 1.00 0.00 N ATOM 636 CA ILE A 44 -6.394 -2.984 3.000 1.00 0.00 C ATOM 637 C ILE A 44 -5.970 -1.524 3.134 1.00 0.00 C ATOM 638 O ILE A 44 -4.783 -1.222 3.253 1.00 0.00 O ATOM 639 CB ILE A 44 -6.671 -3.296 1.515 1.00 0.00 C ATOM 640 CG1 ILE A 44 -7.179 -4.730 1.357 1.00 0.00 C ATOM 641 CG2 ILE A 44 -5.414 -3.081 0.684 1.00 0.00 C ATOM 642 CD1 ILE A 44 -7.475 -5.113 -0.076 1.00 0.00 C ATOM 0 H ILE A 44 -8.381 -3.578 3.311 1.00 0.00 H new ATOM 0 HA ILE A 44 -5.587 -3.627 3.352 1.00 0.00 H new ATOM 0 HB ILE A 44 -7.443 -2.615 1.156 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -6.435 -5.417 1.762 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -8.084 -4.854 1.952 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.626 -3.305 -0.361 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -5.091 -2.044 0.774 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -4.623 -3.740 1.043 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -7.831 -6.143 -0.111 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -8.241 -4.450 -0.479 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -6.567 -5.022 -0.672 1.00 0.00 H new ATOM 654 N GLU A 45 -6.947 -0.624 3.114 1.00 0.00 N ATOM 655 CA GLU A 45 -6.673 0.803 3.233 1.00 0.00 C ATOM 656 C GLU A 45 -5.989 1.119 4.559 1.00 0.00 C ATOM 657 O GLU A 45 -5.202 2.062 4.654 1.00 0.00 O ATOM 658 CB GLU A 45 -7.969 1.605 3.110 1.00 0.00 C ATOM 659 CG GLU A 45 -7.783 2.965 2.457 1.00 0.00 C ATOM 660 CD GLU A 45 -7.656 4.086 3.471 1.00 0.00 C ATOM 661 OE1 GLU A 45 -8.281 3.985 4.547 1.00 0.00 O ATOM 662 OE2 GLU A 45 -6.930 5.062 3.189 1.00 0.00 O ATOM 0 H GLU A 45 -7.935 -0.857 3.017 1.00 0.00 H new ATOM 0 HA GLU A 45 -6.001 1.086 2.423 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -8.690 1.028 2.530 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -8.397 1.743 4.103 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -6.891 2.944 1.830 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -8.629 3.168 1.801 1.00 0.00 H new ATOM 669 N ASN A 46 -6.294 0.327 5.581 1.00 0.00 N ATOM 670 CA ASN A 46 -5.708 0.524 6.902 1.00 0.00 C ATOM 671 C ASN A 46 -4.266 0.025 6.940 1.00 0.00 C ATOM 672 O ASN A 46 -3.380 0.700 7.464 1.00 0.00 O ATOM 673 CB ASN A 46 -6.540 -0.198 7.964 1.00 0.00 C ATOM 674 CG ASN A 46 -6.793 0.664 9.187 1.00 0.00 C ATOM 675 OD1 ASN A 46 -6.021 1.573 9.489 1.00 0.00 O ATOM 676 ND2 ASN A 46 -7.878 0.380 9.897 1.00 0.00 N ATOM 0 H ASN A 46 -6.943 -0.457 5.520 1.00 0.00 H new ATOM 0 HA ASN A 46 -5.707 1.593 7.116 1.00 0.00 H new ATOM 0 HB2 ASN A 46 -7.494 -0.499 7.531 1.00 0.00 H new ATOM 0 HB3 ASN A 46 -6.026 -1.110 8.266 1.00 0.00 H new ATOM 0 HD21 ASN A 46 -8.099 0.925 10.730 1.00 0.00 H new ATOM 0 HD22 ASN A 46 -8.490 -0.383 9.609 1.00 0.00 H new ATOM 683 N ALA A 47 -4.041 -1.160 6.384 1.00 0.00 N ATOM 684 CA ALA A 47 -2.708 -1.749 6.354 1.00 0.00 C ATOM 685 C ALA A 47 -1.722 -0.844 5.621 1.00 0.00 C ATOM 686 O ALA A 47 -0.574 -0.695 6.037 1.00 0.00 O ATOM 687 CB ALA A 47 -2.752 -3.123 5.702 1.00 0.00 C ATOM 0 H ALA A 47 -4.765 -1.732 5.948 1.00 0.00 H new ATOM 0 HA ALA A 47 -2.364 -1.858 7.382 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -1.750 -3.551 5.687 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -3.416 -3.774 6.271 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -3.122 -3.030 4.681 1.00 0.00 H new ATOM 693 N LEU A 48 -2.179 -0.245 4.527 1.00 0.00 N ATOM 694 CA LEU A 48 -1.337 0.644 3.735 1.00 0.00 C ATOM 695 C LEU A 48 -1.034 1.931 4.497 1.00 0.00 C ATOM 696 O LEU A 48 0.048 2.503 4.366 1.00 0.00 O ATOM 697 CB LEU A 48 -2.016 0.975 2.405 1.00 0.00 C ATOM 698 CG LEU A 48 -1.912 -0.115 1.337 1.00 0.00 C ATOM 699 CD1 LEU A 48 -2.690 0.282 0.092 1.00 0.00 C ATOM 700 CD2 LEU A 48 -0.456 -0.387 0.994 1.00 0.00 C ATOM 0 H LEU A 48 -3.127 -0.359 4.169 1.00 0.00 H new ATOM 0 HA LEU A 48 -0.397 0.130 3.537 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -3.070 1.179 2.593 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.580 1.892 2.010 1.00 0.00 H new ATOM 0 HG LEU A 48 -2.348 -1.031 1.736 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -2.605 -0.505 -0.657 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -3.739 0.426 0.349 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -2.284 1.210 -0.310 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -0.401 -1.165 0.233 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.005 0.525 0.615 1.00 0.00 H new ATOM 0 HD23 LEU A 48 0.073 -0.716 1.888 1.00 0.00 H new ATOM 712 N ASN A 49 -1.998 2.380 5.295 1.00 0.00 N ATOM 713 CA ASN A 49 -1.836 3.599 6.079 1.00 0.00 C ATOM 714 C ASN A 49 -0.668 3.470 7.052 1.00 0.00 C ATOM 715 O ASN A 49 0.155 4.378 7.175 1.00 0.00 O ATOM 716 CB ASN A 49 -3.123 3.913 6.844 1.00 0.00 C ATOM 717 CG ASN A 49 -3.481 5.385 6.794 1.00 0.00 C ATOM 718 OD1 ASN A 49 -3.017 6.177 7.614 1.00 0.00 O ATOM 719 ND2 ASN A 49 -4.312 5.758 5.827 1.00 0.00 N ATOM 0 H ASN A 49 -2.899 1.918 5.416 1.00 0.00 H new ATOM 0 HA ASN A 49 -1.622 4.418 5.392 1.00 0.00 H new ATOM 0 HB2 ASN A 49 -3.943 3.328 6.426 1.00 0.00 H new ATOM 0 HB3 ASN A 49 -3.009 3.605 7.883 1.00 0.00 H new ATOM 0 HD21 ASN A 49 -4.590 6.736 5.742 1.00 0.00 H new ATOM 0 HD22 ASN A 49 -4.672 5.067 5.169 1.00 0.00 H new ATOM 726 N GLN A 50 -0.602 2.337 7.741 1.00 0.00 N ATOM 727 CA GLN A 50 0.463 2.085 8.704 1.00 0.00 C ATOM 728 C GLN A 50 1.820 2.019 8.011 1.00 0.00 C ATOM 729 O GLN A 50 2.763 2.707 8.402 1.00 0.00 O ATOM 730 CB GLN A 50 0.194 0.779 9.456 1.00 0.00 C ATOM 731 CG GLN A 50 0.345 0.901 10.962 1.00 0.00 C ATOM 732 CD GLN A 50 1.794 0.889 11.407 1.00 0.00 C ATOM 733 OE1 GLN A 50 2.249 1.793 12.108 1.00 0.00 O ATOM 734 NE2 GLN A 50 2.531 -0.139 11.000 1.00 0.00 N ATOM 0 H GLN A 50 -1.275 1.576 7.650 1.00 0.00 H new ATOM 0 HA GLN A 50 0.482 2.910 9.416 1.00 0.00 H new ATOM 0 HB2 GLN A 50 -0.816 0.439 9.227 1.00 0.00 H new ATOM 0 HB3 GLN A 50 0.878 0.013 9.092 1.00 0.00 H new ATOM 0 HG2 GLN A 50 -0.126 1.825 11.297 1.00 0.00 H new ATOM 0 HG3 GLN A 50 -0.186 0.080 11.444 1.00 0.00 H new ATOM 0 HE21 GLN A 50 2.114 -0.867 10.420 1.00 0.00 H new ATOM 0 HE22 GLN A 50 3.513 -0.200 11.268 1.00 0.00 H new ATOM 743 N LEU A 51 1.911 1.182 6.981 1.00 0.00 N ATOM 744 CA LEU A 51 3.151 1.017 6.229 1.00 0.00 C ATOM 745 C LEU A 51 3.734 2.365 5.812 1.00 0.00 C ATOM 746 O LEU A 51 4.952 2.535 5.762 1.00 0.00 O ATOM 747 CB LEU A 51 2.905 0.151 4.991 1.00 0.00 C ATOM 748 CG LEU A 51 4.166 -0.261 4.227 1.00 0.00 C ATOM 749 CD1 LEU A 51 3.962 -1.606 3.549 1.00 0.00 C ATOM 750 CD2 LEU A 51 4.538 0.802 3.204 1.00 0.00 C ATOM 0 H LEU A 51 1.138 0.606 6.647 1.00 0.00 H new ATOM 0 HA LEU A 51 3.873 0.523 6.880 1.00 0.00 H new ATOM 0 HB2 LEU A 51 2.373 -0.750 5.297 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.248 0.694 4.311 1.00 0.00 H new ATOM 0 HG LEU A 51 4.986 -0.356 4.939 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.868 -1.883 3.011 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.741 -2.363 4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 51 3.130 -1.538 2.848 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.437 0.494 2.669 1.00 0.00 H new ATOM 0 HD22 LEU A 51 3.719 0.927 2.495 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.725 1.747 3.713 1.00 0.00 H new ATOM 762 N PHE A 52 2.859 3.319 5.513 1.00 0.00 N ATOM 763 CA PHE A 52 3.293 4.649 5.099 1.00 0.00 C ATOM 764 C PHE A 52 4.074 5.341 6.212 1.00 0.00 C ATOM 765 O PHE A 52 5.249 5.669 6.047 1.00 0.00 O ATOM 766 CB PHE A 52 2.088 5.504 4.699 1.00 0.00 C ATOM 767 CG PHE A 52 1.290 4.936 3.559 1.00 0.00 C ATOM 768 CD1 PHE A 52 1.910 4.235 2.536 1.00 0.00 C ATOM 769 CD2 PHE A 52 -0.084 5.107 3.511 1.00 0.00 C ATOM 770 CE1 PHE A 52 1.174 3.714 1.489 1.00 0.00 C ATOM 771 CE2 PHE A 52 -0.825 4.589 2.465 1.00 0.00 C ATOM 772 CZ PHE A 52 -0.195 3.892 1.454 1.00 0.00 C ATOM 0 H PHE A 52 1.847 3.197 5.549 1.00 0.00 H new ATOM 0 HA PHE A 52 3.950 4.534 4.237 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.435 5.621 5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 52 2.436 6.500 4.425 1.00 0.00 H new ATOM 0 HD1 PHE A 52 2.981 4.095 2.558 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -0.582 5.651 4.300 1.00 0.00 H new ATOM 0 HE1 PHE A 52 1.669 3.168 0.699 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -1.895 4.730 2.439 1.00 0.00 H new ATOM 0 HZ PHE A 52 -0.772 3.486 0.636 1.00 0.00 H new ATOM 782 N ARG A 53 3.414 5.562 7.344 1.00 0.00 N ATOM 783 CA ARG A 53 4.047 6.219 8.484 1.00 0.00 C ATOM 784 C ARG A 53 5.304 5.471 8.922 1.00 0.00 C ATOM 785 O ARG A 53 6.220 6.061 9.493 1.00 0.00 O ATOM 786 CB ARG A 53 3.065 6.321 9.653 1.00 0.00 C ATOM 787 CG ARG A 53 2.653 4.972 10.223 1.00 0.00 C ATOM 788 CD ARG A 53 2.573 5.005 11.742 1.00 0.00 C ATOM 789 NE ARG A 53 1.209 4.804 12.223 1.00 0.00 N ATOM 790 CZ ARG A 53 0.907 4.454 13.472 1.00 0.00 C ATOM 791 NH1 ARG A 53 1.870 4.268 14.366 1.00 0.00 N ATOM 792 NH2 ARG A 53 -0.360 4.291 13.827 1.00 0.00 N ATOM 0 H ARG A 53 2.441 5.296 7.497 1.00 0.00 H new ATOM 0 HA ARG A 53 4.337 7.223 8.173 1.00 0.00 H new ATOM 0 HB2 ARG A 53 3.517 6.918 10.445 1.00 0.00 H new ATOM 0 HB3 ARG A 53 2.173 6.854 9.322 1.00 0.00 H new ATOM 0 HG2 ARG A 53 1.685 4.684 9.814 1.00 0.00 H new ATOM 0 HG3 ARG A 53 3.369 4.211 9.913 1.00 0.00 H new ATOM 0 HD2 ARG A 53 3.221 4.232 12.156 1.00 0.00 H new ATOM 0 HD3 ARG A 53 2.948 5.963 12.104 1.00 0.00 H new ATOM 0 HE ARG A 53 0.443 4.940 11.564 1.00 0.00 H new ATOM 0 HH11 ARG A 53 2.846 4.393 14.098 1.00 0.00 H new ATOM 0 HH12 ARG A 53 1.634 4.000 15.321 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -1.104 4.434 13.143 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -0.591 4.023 14.784 1.00 0.00 H new ATOM 806 N ASN A 54 5.340 4.170 8.652 1.00 0.00 N ATOM 807 CA ASN A 54 6.486 3.345 9.020 1.00 0.00 C ATOM 808 C ASN A 54 7.623 3.508 8.014 1.00 0.00 C ATOM 809 O ASN A 54 8.795 3.376 8.362 1.00 0.00 O ATOM 810 CB ASN A 54 6.075 1.874 9.108 1.00 0.00 C ATOM 811 CG ASN A 54 5.752 1.450 10.528 1.00 0.00 C ATOM 812 OD1 ASN A 54 4.591 1.866 11.020 1.00 0.00 O flip ATOM 813 ND2 ASN A 54 6.537 0.755 11.175 1.00 0.00 N flip ATOM 0 H ASN A 54 4.590 3.665 8.180 1.00 0.00 H new ATOM 0 HA ASN A 54 6.840 3.676 9.996 1.00 0.00 H new ATOM 0 HB2 ASN A 54 5.205 1.704 8.474 1.00 0.00 H new ATOM 0 HB3 ASN A 54 6.880 1.250 8.719 1.00 0.00 H new ATOM 0 HD21 ASN A 54 7.419 0.458 10.757 1.00 0.00 H new ATOM 0 HD22 ASN A 54 6.305 0.477 12.129 1.00 0.00 H new ATOM 820 N SER A 55 7.266 3.794 6.766 1.00 0.00 N ATOM 821 CA SER A 55 8.256 3.973 5.709 1.00 0.00 C ATOM 822 C SER A 55 9.196 5.131 6.031 1.00 0.00 C ATOM 823 O SER A 55 8.924 5.936 6.921 1.00 0.00 O ATOM 824 CB SER A 55 7.562 4.223 4.370 1.00 0.00 C ATOM 825 OG SER A 55 7.028 5.534 4.307 1.00 0.00 O ATOM 0 H SER A 55 6.299 3.907 6.462 1.00 0.00 H new ATOM 0 HA SER A 55 8.846 3.059 5.641 1.00 0.00 H new ATOM 0 HB2 SER A 55 8.272 4.077 3.556 1.00 0.00 H new ATOM 0 HB3 SER A 55 6.763 3.495 4.230 1.00 0.00 H new ATOM 0 HG SER A 55 6.122 5.537 4.682 1.00 0.00 H new ATOM 831 N SER A 56 10.302 5.208 5.299 1.00 0.00 N ATOM 832 CA SER A 56 11.283 6.267 5.502 1.00 0.00 C ATOM 833 C SER A 56 10.703 7.627 5.127 1.00 0.00 C ATOM 834 O SER A 56 11.113 8.657 5.663 1.00 0.00 O ATOM 835 CB SER A 56 12.541 5.992 4.676 1.00 0.00 C ATOM 836 OG SER A 56 13.675 6.623 5.246 1.00 0.00 O ATOM 0 H SER A 56 10.542 4.548 4.559 1.00 0.00 H new ATOM 0 HA SER A 56 11.547 6.284 6.559 1.00 0.00 H new ATOM 0 HB2 SER A 56 12.712 4.917 4.615 1.00 0.00 H new ATOM 0 HB3 SER A 56 12.396 6.350 3.657 1.00 0.00 H new ATOM 0 HG SER A 56 14.466 6.430 4.700 1.00 0.00 H new ATOM 842 N ILE A 57 9.747 7.624 4.205 1.00 0.00 N ATOM 843 CA ILE A 57 9.109 8.857 3.759 1.00 0.00 C ATOM 844 C ILE A 57 7.836 9.134 4.553 1.00 0.00 C ATOM 845 O ILE A 57 6.797 9.474 3.984 1.00 0.00 O ATOM 846 CB ILE A 57 8.767 8.801 2.257 1.00 0.00 C ATOM 847 CG1 ILE A 57 7.893 7.582 1.956 1.00 0.00 C ATOM 848 CG2 ILE A 57 10.040 8.764 1.424 1.00 0.00 C ATOM 849 CD1 ILE A 57 7.338 7.568 0.549 1.00 0.00 C ATOM 0 H ILE A 57 9.396 6.780 3.751 1.00 0.00 H new ATOM 0 HA ILE A 57 9.822 9.664 3.930 1.00 0.00 H new ATOM 0 HB ILE A 57 8.209 9.700 1.993 1.00 0.00 H new ATOM 0 HG12 ILE A 57 8.479 6.677 2.116 1.00 0.00 H new ATOM 0 HG13 ILE A 57 7.065 7.555 2.665 1.00 0.00 H new ATOM 0 HG21 ILE A 57 9.781 8.725 0.366 1.00 0.00 H new ATOM 0 HG22 ILE A 57 10.629 9.660 1.620 1.00 0.00 H new ATOM 0 HG23 ILE A 57 10.622 7.881 1.688 1.00 0.00 H new ATOM 0 HD11 ILE A 57 6.729 6.675 0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 57 6.725 8.455 0.391 1.00 0.00 H new ATOM 0 HD13 ILE A 57 8.160 7.563 -0.166 1.00 0.00 H new ATOM 861 N LYS A 58 7.924 8.988 5.871 1.00 0.00 N ATOM 862 CA LYS A 58 6.780 9.223 6.745 1.00 0.00 C ATOM 863 C LYS A 58 6.676 10.697 7.122 1.00 0.00 C ATOM 864 O LYS A 58 6.649 11.049 8.301 1.00 0.00 O ATOM 865 CB LYS A 58 6.892 8.364 8.007 1.00 0.00 C ATOM 866 CG LYS A 58 8.093 8.710 8.873 1.00 0.00 C ATOM 867 CD LYS A 58 8.553 7.513 9.690 1.00 0.00 C ATOM 868 CE LYS A 58 9.893 7.775 10.357 1.00 0.00 C ATOM 869 NZ LYS A 58 11.013 7.109 9.636 1.00 0.00 N ATOM 0 H LYS A 58 8.776 8.708 6.357 1.00 0.00 H new ATOM 0 HA LYS A 58 5.876 8.943 6.204 1.00 0.00 H new ATOM 0 HB2 LYS A 58 5.983 8.480 8.597 1.00 0.00 H new ATOM 0 HB3 LYS A 58 6.953 7.315 7.718 1.00 0.00 H new ATOM 0 HG2 LYS A 58 8.911 9.057 8.241 1.00 0.00 H new ATOM 0 HG3 LYS A 58 7.836 9.532 9.542 1.00 0.00 H new ATOM 0 HD2 LYS A 58 7.807 7.281 10.450 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.632 6.639 9.044 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.075 8.849 10.397 1.00 0.00 H new ATOM 0 HE3 LYS A 58 9.862 7.419 11.387 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 11.909 7.313 10.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 10.853 6.081 9.620 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 11.060 7.467 8.661 1.00 0.00 H new ATOM 883 N SER A 59 6.618 11.559 6.110 1.00 0.00 N ATOM 884 CA SER A 59 6.516 12.996 6.335 1.00 0.00 C ATOM 885 C SER A 59 5.825 13.680 5.160 1.00 0.00 C ATOM 886 O SER A 59 4.913 14.486 5.347 1.00 0.00 O ATOM 887 CB SER A 59 7.906 13.600 6.546 1.00 0.00 C ATOM 888 OG SER A 59 7.844 14.736 7.391 1.00 0.00 O ATOM 0 H SER A 59 6.640 11.286 5.127 1.00 0.00 H new ATOM 0 HA SER A 59 5.918 13.158 7.231 1.00 0.00 H new ATOM 0 HB2 SER A 59 8.568 12.853 6.983 1.00 0.00 H new ATOM 0 HB3 SER A 59 8.334 13.881 5.584 1.00 0.00 H new ATOM 0 HG SER A 59 8.745 15.103 7.512 1.00 0.00 H new ATOM 894 N TYR A 60 6.264 13.350 3.949 1.00 0.00 N ATOM 895 CA TYR A 60 5.686 13.932 2.743 1.00 0.00 C ATOM 896 C TYR A 60 4.461 13.142 2.294 1.00 0.00 C ATOM 897 O TYR A 60 3.532 13.696 1.707 1.00 0.00 O ATOM 898 CB TYR A 60 6.724 13.967 1.620 1.00 0.00 C ATOM 899 CG TYR A 60 7.829 14.975 1.846 1.00 0.00 C ATOM 900 CD1 TYR A 60 7.536 16.307 2.106 1.00 0.00 C ATOM 901 CD2 TYR A 60 9.164 14.594 1.799 1.00 0.00 C ATOM 902 CE1 TYR A 60 8.543 17.233 2.312 1.00 0.00 C ATOM 903 CE2 TYR A 60 10.175 15.511 2.003 1.00 0.00 C ATOM 904 CZ TYR A 60 9.860 16.829 2.259 1.00 0.00 C ATOM 905 OH TYR A 60 10.865 17.746 2.464 1.00 0.00 O ATOM 0 H TYR A 60 7.017 12.684 3.777 1.00 0.00 H new ATOM 0 HA TYR A 60 5.376 14.951 2.973 1.00 0.00 H new ATOM 0 HB2 TYR A 60 7.165 12.976 1.513 1.00 0.00 H new ATOM 0 HB3 TYR A 60 6.222 14.196 0.680 1.00 0.00 H new ATOM 0 HD1 TYR A 60 6.505 16.626 2.148 1.00 0.00 H new ATOM 0 HD2 TYR A 60 9.415 13.563 1.599 1.00 0.00 H new ATOM 0 HE1 TYR A 60 8.299 18.266 2.513 1.00 0.00 H new ATOM 0 HE2 TYR A 60 11.208 15.198 1.962 1.00 0.00 H new ATOM 0 HH TYR A 60 11.735 17.299 2.394 1.00 0.00 H new ATOM 915 N PHE A 61 4.466 11.842 2.575 1.00 0.00 N ATOM 916 CA PHE A 61 3.357 10.973 2.201 1.00 0.00 C ATOM 917 C PHE A 61 2.065 11.415 2.883 1.00 0.00 C ATOM 918 O PHE A 61 1.978 11.446 4.110 1.00 0.00 O ATOM 919 CB PHE A 61 3.670 9.522 2.571 1.00 0.00 C ATOM 920 CG PHE A 61 2.800 8.520 1.867 1.00 0.00 C ATOM 921 CD1 PHE A 61 1.447 8.439 2.148 1.00 0.00 C ATOM 922 CD2 PHE A 61 3.338 7.658 0.924 1.00 0.00 C ATOM 923 CE1 PHE A 61 0.644 7.519 1.502 1.00 0.00 C ATOM 924 CE2 PHE A 61 2.540 6.734 0.275 1.00 0.00 C ATOM 925 CZ PHE A 61 1.191 6.664 0.564 1.00 0.00 C ATOM 0 H PHE A 61 5.227 11.368 3.061 1.00 0.00 H new ATOM 0 HA PHE A 61 3.221 11.045 1.122 1.00 0.00 H new ATOM 0 HB2 PHE A 61 4.714 9.313 2.336 1.00 0.00 H new ATOM 0 HB3 PHE A 61 3.555 9.398 3.648 1.00 0.00 H new ATOM 0 HD1 PHE A 61 1.014 9.103 2.881 1.00 0.00 H new ATOM 0 HD2 PHE A 61 4.392 7.709 0.694 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -0.410 7.468 1.730 1.00 0.00 H new ATOM 0 HE2 PHE A 61 2.971 6.067 -0.457 1.00 0.00 H new ATOM 0 HZ PHE A 61 0.566 5.943 0.058 1.00 0.00 H new ATOM 935 N SER A 62 1.065 11.759 2.078 1.00 0.00 N ATOM 936 CA SER A 62 -0.222 12.199 2.603 1.00 0.00 C ATOM 937 C SER A 62 -1.114 11.005 2.924 1.00 0.00 C ATOM 938 O SER A 62 -1.469 10.776 4.080 1.00 0.00 O ATOM 939 CB SER A 62 -0.920 13.117 1.599 1.00 0.00 C ATOM 940 OG SER A 62 -0.621 14.478 1.858 1.00 0.00 O ATOM 0 H SER A 62 1.121 11.741 1.060 1.00 0.00 H new ATOM 0 HA SER A 62 -0.041 12.753 3.524 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.607 12.859 0.587 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.998 12.962 1.649 1.00 0.00 H new ATOM 0 HG SER A 62 -0.957 15.032 1.123 1.00 0.00 H new ATOM 946 N ASP A 63 -1.472 10.247 1.893 1.00 0.00 N ATOM 947 CA ASP A 63 -2.322 9.075 2.065 1.00 0.00 C ATOM 948 C ASP A 63 -2.522 8.345 0.740 1.00 0.00 C ATOM 949 O ASP A 63 -1.983 8.750 -0.291 1.00 0.00 O ATOM 950 CB ASP A 63 -3.678 9.483 2.644 1.00 0.00 C ATOM 951 CG ASP A 63 -4.219 8.462 3.625 1.00 0.00 C ATOM 952 OD1 ASP A 63 -3.845 8.527 4.816 1.00 0.00 O ATOM 953 OD2 ASP A 63 -5.016 7.597 3.204 1.00 0.00 O ATOM 0 H ASP A 63 -1.187 10.423 0.930 1.00 0.00 H new ATOM 0 HA ASP A 63 -1.825 8.398 2.760 1.00 0.00 H new ATOM 0 HB2 ASP A 63 -3.581 10.447 3.144 1.00 0.00 H new ATOM 0 HB3 ASP A 63 -4.392 9.615 1.831 1.00 0.00 H new ATOM 958 N CYS A 64 -3.299 7.268 0.777 1.00 0.00 N ATOM 959 CA CYS A 64 -3.572 6.480 -0.419 1.00 0.00 C ATOM 960 C CYS A 64 -5.062 6.488 -0.746 1.00 0.00 C ATOM 961 O CYS A 64 -5.888 6.852 0.090 1.00 0.00 O ATOM 962 CB CYS A 64 -3.086 5.043 -0.232 1.00 0.00 C ATOM 963 SG CYS A 64 -2.431 4.282 -1.735 1.00 0.00 S ATOM 0 H CYS A 64 -3.751 6.921 1.623 1.00 0.00 H new ATOM 0 HA CYS A 64 -3.033 6.931 -1.252 1.00 0.00 H new ATOM 0 HB2 CYS A 64 -2.312 5.030 0.536 1.00 0.00 H new ATOM 0 HB3 CYS A 64 -3.913 4.437 0.138 1.00 0.00 H new ATOM 0 HG CYS A 64 -2.044 3.069 -1.474 1.00 0.00 H new ATOM 969 N GLN A 65 -5.397 6.083 -1.966 1.00 0.00 N ATOM 970 CA GLN A 65 -6.787 6.044 -2.402 1.00 0.00 C ATOM 971 C GLN A 65 -7.077 4.765 -3.181 1.00 0.00 C ATOM 972 O GLN A 65 -6.631 4.603 -4.317 1.00 0.00 O ATOM 973 CB GLN A 65 -7.106 7.264 -3.267 1.00 0.00 C ATOM 974 CG GLN A 65 -8.557 7.712 -3.174 1.00 0.00 C ATOM 975 CD GLN A 65 -9.364 7.332 -4.400 1.00 0.00 C ATOM 976 OE1 GLN A 65 -10.137 6.374 -4.377 1.00 0.00 O ATOM 977 NE2 GLN A 65 -9.188 8.084 -5.481 1.00 0.00 N ATOM 0 H GLN A 65 -4.725 5.777 -2.670 1.00 0.00 H new ATOM 0 HA GLN A 65 -7.420 6.060 -1.515 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -6.459 8.090 -2.969 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -6.871 7.034 -4.306 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -9.015 7.268 -2.290 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -8.592 8.793 -3.041 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -8.537 8.869 -5.456 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -9.704 7.877 -6.336 1.00 0.00 H new ATOM 986 N VAL A 66 -7.827 3.858 -2.562 1.00 0.00 N ATOM 987 CA VAL A 66 -8.177 2.595 -3.199 1.00 0.00 C ATOM 988 C VAL A 66 -9.268 2.795 -4.248 1.00 0.00 C ATOM 989 O VAL A 66 -10.453 2.871 -3.923 1.00 0.00 O ATOM 990 CB VAL A 66 -8.645 1.553 -2.160 1.00 0.00 C ATOM 991 CG1 VAL A 66 -9.877 2.048 -1.418 1.00 0.00 C ATOM 992 CG2 VAL A 66 -8.916 0.211 -2.827 1.00 0.00 C ATOM 0 H VAL A 66 -8.203 3.975 -1.621 1.00 0.00 H new ATOM 0 HA VAL A 66 -7.277 2.221 -3.688 1.00 0.00 H new ATOM 0 HB VAL A 66 -7.845 1.414 -1.433 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -10.190 1.298 -0.691 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -9.641 2.978 -0.901 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -10.684 2.223 -2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 66 -9.244 -0.508 -2.077 1.00 0.00 H new ATOM 0 HG22 VAL A 66 -9.694 0.330 -3.581 1.00 0.00 H new ATOM 0 HG23 VAL A 66 -8.004 -0.150 -3.301 1.00 0.00 H new ATOM 1002 N LEU A 67 -8.858 2.884 -5.509 1.00 0.00 N ATOM 1003 CA LEU A 67 -9.797 3.079 -6.608 1.00 0.00 C ATOM 1004 C LEU A 67 -10.818 1.946 -6.660 1.00 0.00 C ATOM 1005 O LEU A 67 -12.024 2.181 -6.589 1.00 0.00 O ATOM 1006 CB LEU A 67 -9.047 3.166 -7.938 1.00 0.00 C ATOM 1007 CG LEU A 67 -7.865 4.138 -7.953 1.00 0.00 C ATOM 1008 CD1 LEU A 67 -7.242 4.198 -9.339 1.00 0.00 C ATOM 1009 CD2 LEU A 67 -8.308 5.522 -7.504 1.00 0.00 C ATOM 0 H LEU A 67 -7.881 2.824 -5.795 1.00 0.00 H new ATOM 0 HA LEU A 67 -10.328 4.015 -6.436 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -8.684 2.172 -8.198 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -9.751 3.462 -8.716 1.00 0.00 H new ATOM 0 HG LEU A 67 -7.111 3.776 -7.254 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -6.403 4.894 -9.331 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -6.888 3.207 -9.622 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -7.987 4.537 -10.059 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -7.455 6.200 -7.521 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -9.080 5.893 -8.178 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -8.707 5.466 -6.491 1.00 0.00 H new ATOM 1021 N ALA A 68 -10.325 0.719 -6.787 1.00 0.00 N ATOM 1022 CA ALA A 68 -11.195 -0.450 -6.850 1.00 0.00 C ATOM 1023 C ALA A 68 -10.382 -1.740 -6.851 1.00 0.00 C ATOM 1024 O ALA A 68 -9.151 -1.710 -6.857 1.00 0.00 O ATOM 1025 CB ALA A 68 -12.082 -0.382 -8.083 1.00 0.00 C ATOM 0 H ALA A 68 -9.329 0.508 -6.848 1.00 0.00 H new ATOM 0 HA ALA A 68 -11.827 -0.450 -5.962 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -12.726 -1.261 -8.117 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -12.697 0.517 -8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -11.460 -0.353 -8.978 1.00 0.00 H new ATOM 1031 N PHE A 69 -11.079 -2.872 -6.848 1.00 0.00 N ATOM 1032 CA PHE A 69 -10.420 -4.173 -6.850 1.00 0.00 C ATOM 1033 C PHE A 69 -10.549 -4.846 -8.213 1.00 0.00 C ATOM 1034 O PHE A 69 -11.551 -4.676 -8.907 1.00 0.00 O ATOM 1035 CB PHE A 69 -11.015 -5.072 -5.766 1.00 0.00 C ATOM 1036 CG PHE A 69 -10.751 -4.586 -4.369 1.00 0.00 C ATOM 1037 CD1 PHE A 69 -9.457 -4.525 -3.875 1.00 0.00 C ATOM 1038 CD2 PHE A 69 -11.797 -4.190 -3.550 1.00 0.00 C ATOM 1039 CE1 PHE A 69 -9.212 -4.078 -2.590 1.00 0.00 C ATOM 1040 CE2 PHE A 69 -11.558 -3.742 -2.265 1.00 0.00 C ATOM 1041 CZ PHE A 69 -10.264 -3.687 -1.784 1.00 0.00 C ATOM 0 H PHE A 69 -12.098 -2.915 -6.844 1.00 0.00 H new ATOM 0 HA PHE A 69 -9.362 -4.016 -6.641 1.00 0.00 H new ATOM 0 HB2 PHE A 69 -12.092 -5.147 -5.918 1.00 0.00 H new ATOM 0 HB3 PHE A 69 -10.607 -6.077 -5.875 1.00 0.00 H new ATOM 0 HD1 PHE A 69 -8.631 -4.830 -4.501 1.00 0.00 H new ATOM 0 HD2 PHE A 69 -12.811 -4.232 -3.921 1.00 0.00 H new ATOM 0 HE1 PHE A 69 -8.200 -4.034 -2.217 1.00 0.00 H new ATOM 0 HE2 PHE A 69 -12.382 -3.435 -1.637 1.00 0.00 H new ATOM 0 HZ PHE A 69 -10.075 -3.339 -0.779 1.00 0.00 H new ATOM 1051 N ARG A 70 -9.529 -5.611 -8.589 1.00 0.00 N ATOM 1052 CA ARG A 70 -9.529 -6.309 -9.869 1.00 0.00 C ATOM 1053 C ARG A 70 -9.958 -7.763 -9.695 1.00 0.00 C ATOM 1054 O ARG A 70 -9.448 -8.471 -8.828 1.00 0.00 O ATOM 1055 CB ARG A 70 -8.141 -6.246 -10.509 1.00 0.00 C ATOM 1056 CG ARG A 70 -8.172 -5.962 -12.002 1.00 0.00 C ATOM 1057 CD ARG A 70 -8.198 -4.468 -12.283 1.00 0.00 C ATOM 1058 NE ARG A 70 -8.334 -4.182 -13.710 1.00 0.00 N ATOM 1059 CZ ARG A 70 -8.727 -3.007 -14.196 1.00 0.00 C ATOM 1060 NH1 ARG A 70 -9.024 -2.007 -13.375 1.00 0.00 N ATOM 1061 NH2 ARG A 70 -8.824 -2.831 -15.507 1.00 0.00 N ATOM 0 H ARG A 70 -8.692 -5.763 -8.026 1.00 0.00 H new ATOM 0 HA ARG A 70 -10.245 -5.814 -10.525 1.00 0.00 H new ATOM 0 HB2 ARG A 70 -7.556 -5.472 -10.012 1.00 0.00 H new ATOM 0 HB3 ARG A 70 -7.628 -7.192 -10.338 1.00 0.00 H new ATOM 0 HG2 ARG A 70 -7.298 -6.408 -12.477 1.00 0.00 H new ATOM 0 HG3 ARG A 70 -9.050 -6.432 -12.445 1.00 0.00 H new ATOM 0 HD2 ARG A 70 -9.026 -4.011 -11.741 1.00 0.00 H new ATOM 0 HD3 ARG A 70 -7.282 -4.012 -11.908 1.00 0.00 H new ATOM 0 HE ARG A 70 -8.115 -4.926 -14.372 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -8.952 -2.137 -12.366 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -9.325 -1.109 -13.753 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -8.597 -3.596 -16.142 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -9.125 -1.931 -15.880 1.00 0.00 H new ATOM 1075 N SER A 71 -10.899 -8.201 -10.526 1.00 0.00 N ATOM 1076 CA SER A 71 -11.397 -9.570 -10.464 1.00 0.00 C ATOM 1077 C SER A 71 -10.510 -10.510 -11.275 1.00 0.00 C ATOM 1078 O SER A 71 -10.216 -10.248 -12.442 1.00 0.00 O ATOM 1079 CB SER A 71 -12.835 -9.637 -10.979 1.00 0.00 C ATOM 1080 OG SER A 71 -13.575 -10.638 -10.301 1.00 0.00 O ATOM 0 H SER A 71 -11.332 -7.627 -11.250 1.00 0.00 H new ATOM 0 HA SER A 71 -11.377 -9.889 -9.422 1.00 0.00 H new ATOM 0 HB2 SER A 71 -13.318 -8.669 -10.844 1.00 0.00 H new ATOM 0 HB3 SER A 71 -12.832 -9.845 -12.049 1.00 0.00 H new ATOM 0 HG SER A 71 -13.757 -10.345 -9.383 1.00 0.00 H new ATOM 1086 N VAL A 72 -10.087 -11.604 -10.651 1.00 0.00 N ATOM 1087 CA VAL A 72 -9.234 -12.582 -11.315 1.00 0.00 C ATOM 1088 C VAL A 72 -10.007 -13.858 -11.632 1.00 0.00 C ATOM 1089 O VAL A 72 -10.802 -14.333 -10.822 1.00 0.00 O ATOM 1090 CB VAL A 72 -8.009 -12.939 -10.453 1.00 0.00 C ATOM 1091 CG1 VAL A 72 -7.100 -11.729 -10.291 1.00 0.00 C ATOM 1092 CG2 VAL A 72 -8.447 -13.471 -9.097 1.00 0.00 C ATOM 0 H VAL A 72 -10.321 -11.836 -9.686 1.00 0.00 H new ATOM 0 HA VAL A 72 -8.893 -12.125 -12.244 1.00 0.00 H new ATOM 0 HB VAL A 72 -7.446 -13.723 -10.960 1.00 0.00 H new ATOM 0 HG11 VAL A 72 -6.240 -12.000 -9.679 1.00 0.00 H new ATOM 0 HG12 VAL A 72 -6.758 -11.397 -11.271 1.00 0.00 H new ATOM 0 HG13 VAL A 72 -7.651 -10.923 -9.806 1.00 0.00 H new ATOM 0 HG21 VAL A 72 -7.568 -13.718 -8.502 1.00 0.00 H new ATOM 0 HG22 VAL A 72 -9.033 -12.711 -8.580 1.00 0.00 H new ATOM 0 HG23 VAL A 72 -9.054 -14.366 -9.236 1.00 0.00 H new ATOM 1102 N SER A 73 -9.767 -14.409 -12.819 1.00 0.00 N ATOM 1103 CA SER A 73 -10.441 -15.631 -13.245 1.00 0.00 C ATOM 1104 C SER A 73 -9.464 -16.802 -13.313 1.00 0.00 C ATOM 1105 O SER A 73 -9.863 -17.961 -13.198 1.00 0.00 O ATOM 1106 CB SER A 73 -11.100 -15.423 -14.610 1.00 0.00 C ATOM 1107 OG SER A 73 -12.441 -14.987 -14.468 1.00 0.00 O ATOM 0 H SER A 73 -9.112 -14.029 -13.502 1.00 0.00 H new ATOM 0 HA SER A 73 -11.208 -15.867 -12.508 1.00 0.00 H new ATOM 0 HB2 SER A 73 -10.534 -14.688 -15.182 1.00 0.00 H new ATOM 0 HB3 SER A 73 -11.075 -16.355 -15.175 1.00 0.00 H new ATOM 0 HG SER A 73 -12.839 -14.860 -15.354 1.00 0.00 H new ATOM 1112 N ASN A 74 -8.184 -16.495 -13.502 1.00 0.00 N ATOM 1113 CA ASN A 74 -7.152 -17.523 -13.587 1.00 0.00 C ATOM 1114 C ASN A 74 -7.180 -18.431 -12.360 1.00 0.00 C ATOM 1115 O ASN A 74 -7.545 -19.603 -12.450 1.00 0.00 O ATOM 1116 CB ASN A 74 -5.771 -16.879 -13.732 1.00 0.00 C ATOM 1117 CG ASN A 74 -4.981 -17.460 -14.887 1.00 0.00 C ATOM 1118 OD1 ASN A 74 -4.647 -16.757 -15.841 1.00 0.00 O ATOM 1119 ND2 ASN A 74 -4.676 -18.750 -14.807 1.00 0.00 N ATOM 0 H ASN A 74 -7.836 -15.541 -13.599 1.00 0.00 H new ATOM 0 HA ASN A 74 -7.355 -18.132 -14.468 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -5.887 -15.805 -13.879 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -5.211 -17.015 -12.807 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.145 -19.196 -15.555 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -4.973 -19.295 -13.998 1.00 0.00 H new ATOM 1126 N ASN A 75 -6.791 -17.881 -11.213 1.00 0.00 N ATOM 1127 CA ASN A 75 -6.771 -18.641 -9.969 1.00 0.00 C ATOM 1128 C ASN A 75 -8.115 -18.553 -9.252 1.00 0.00 C ATOM 1129 O ASN A 75 -8.508 -19.471 -8.533 1.00 0.00 O ATOM 1130 CB ASN A 75 -5.658 -18.130 -9.052 1.00 0.00 C ATOM 1131 CG ASN A 75 -5.300 -19.126 -7.967 1.00 0.00 C ATOM 1132 OD1 ASN A 75 -5.760 -19.015 -6.831 1.00 0.00 O ATOM 1133 ND2 ASN A 75 -4.472 -20.106 -8.312 1.00 0.00 N ATOM 0 H ASN A 75 -6.486 -16.912 -11.120 1.00 0.00 H new ATOM 0 HA ASN A 75 -6.580 -19.685 -10.216 1.00 0.00 H new ATOM 0 HB2 ASN A 75 -4.772 -17.912 -9.648 1.00 0.00 H new ATOM 0 HB3 ASN A 75 -5.972 -17.193 -8.592 1.00 0.00 H new ATOM 0 HD21 ASN A 75 -4.194 -20.805 -7.623 1.00 0.00 H new ATOM 0 HD22 ASN A 75 -4.115 -20.160 -9.266 1.00 0.00 H new ATOM 1140 N ASN A 76 -8.816 -17.441 -9.454 1.00 0.00 N ATOM 1141 CA ASN A 76 -10.116 -17.231 -8.826 1.00 0.00 C ATOM 1142 C ASN A 76 -9.988 -17.192 -7.306 1.00 0.00 C ATOM 1143 O ASN A 76 -10.929 -17.524 -6.585 1.00 0.00 O ATOM 1144 CB ASN A 76 -11.092 -18.335 -9.242 1.00 0.00 C ATOM 1145 CG ASN A 76 -12.094 -17.859 -10.275 1.00 0.00 C ATOM 1146 OD1 ASN A 76 -12.151 -18.380 -11.388 1.00 0.00 O ATOM 1147 ND2 ASN A 76 -12.892 -16.863 -9.910 1.00 0.00 N ATOM 0 H ASN A 76 -8.505 -16.672 -10.048 1.00 0.00 H new ATOM 0 HA ASN A 76 -10.503 -16.269 -9.163 1.00 0.00 H new ATOM 0 HB2 ASN A 76 -10.532 -19.179 -9.645 1.00 0.00 H new ATOM 0 HB3 ASN A 76 -11.625 -18.696 -8.362 1.00 0.00 H new ATOM 0 HD21 ASN A 76 -13.587 -16.501 -10.563 1.00 0.00 H new ATOM 0 HD22 ASN A 76 -12.810 -16.460 -8.976 1.00 0.00 H new ATOM 1154 N ASN A 77 -8.818 -16.781 -6.824 1.00 0.00 N ATOM 1155 CA ASN A 77 -8.570 -16.696 -5.390 1.00 0.00 C ATOM 1156 C ASN A 77 -7.707 -15.482 -5.051 1.00 0.00 C ATOM 1157 O ASN A 77 -7.118 -15.411 -3.972 1.00 0.00 O ATOM 1158 CB ASN A 77 -7.887 -17.973 -4.894 1.00 0.00 C ATOM 1159 CG ASN A 77 -7.981 -18.132 -3.389 1.00 0.00 C ATOM 1160 OD1 ASN A 77 -9.198 -18.069 -2.862 1.00 0.00 O flip ATOM 1161 ND2 ASN A 77 -6.971 -18.309 -2.707 1.00 0.00 N flip ATOM 0 H ASN A 77 -8.028 -16.502 -7.406 1.00 0.00 H new ATOM 0 HA ASN A 77 -9.532 -16.584 -4.889 1.00 0.00 H new ATOM 0 HB2 ASN A 77 -8.343 -18.837 -5.377 1.00 0.00 H new ATOM 0 HB3 ASN A 77 -6.838 -17.959 -5.190 1.00 0.00 H new ATOM 0 HD21 ASN A 77 -6.055 -18.351 -3.154 1.00 0.00 H new ATOM 0 HD22 ASN A 77 -7.051 -18.414 -1.696 1.00 0.00 H new ATOM 1168 N HIS A 78 -7.639 -14.527 -5.975 1.00 0.00 N ATOM 1169 CA HIS A 78 -6.850 -13.317 -5.769 1.00 0.00 C ATOM 1170 C HIS A 78 -7.723 -12.074 -5.897 1.00 0.00 C ATOM 1171 O HIS A 78 -8.938 -12.173 -6.067 1.00 0.00 O ATOM 1172 CB HIS A 78 -5.700 -13.251 -6.776 1.00 0.00 C ATOM 1173 CG HIS A 78 -4.974 -14.551 -6.947 1.00 0.00 C ATOM 1174 ND1 HIS A 78 -4.819 -15.598 -6.103 1.00 0.00 N flip ATOM 1175 CD2 HIS A 78 -4.296 -14.887 -8.101 1.00 0.00 C flip ATOM 1176 CE1 HIS A 78 -4.060 -16.537 -6.756 1.00 0.00 C flip ATOM 1177 NE2 HIS A 78 -3.758 -16.086 -7.959 1.00 0.00 N flip ATOM 0 H HIS A 78 -8.121 -14.568 -6.873 1.00 0.00 H new ATOM 0 HA HIS A 78 -6.437 -13.350 -4.761 1.00 0.00 H new ATOM 0 HB2 HIS A 78 -6.093 -12.934 -7.742 1.00 0.00 H new ATOM 0 HB3 HIS A 78 -4.991 -12.488 -6.455 1.00 0.00 H new ATOM 0 HD2 HIS A 78 -4.217 -14.267 -8.982 1.00 0.00 H new ATOM 0 HE1 HIS A 78 -3.758 -17.491 -6.350 1.00 0.00 H new ATOM 0 HE2 HIS A 78 -3.204 -16.579 -8.660 1.00 0.00 H new ATOM 1186 N THR A 79 -7.099 -10.904 -5.816 1.00 0.00 N ATOM 1187 CA THR A 79 -7.824 -9.643 -5.925 1.00 0.00 C ATOM 1188 C THR A 79 -6.870 -8.484 -6.194 1.00 0.00 C ATOM 1189 O THR A 79 -6.002 -8.179 -5.376 1.00 0.00 O ATOM 1190 CB THR A 79 -8.619 -9.376 -4.646 1.00 0.00 C ATOM 1191 OG1 THR A 79 -9.495 -10.453 -4.365 1.00 0.00 O ATOM 1192 CG2 THR A 79 -9.450 -8.113 -4.710 1.00 0.00 C ATOM 0 H THR A 79 -6.094 -10.802 -5.675 1.00 0.00 H new ATOM 0 HA THR A 79 -8.514 -9.723 -6.765 1.00 0.00 H new ATOM 0 HB THR A 79 -7.872 -9.260 -3.861 1.00 0.00 H new ATOM 0 HG1 THR A 79 -9.660 -10.963 -5.185 1.00 0.00 H new ATOM 0 HG21 THR A 79 -9.988 -7.984 -3.771 1.00 0.00 H new ATOM 0 HG22 THR A 79 -8.797 -7.256 -4.875 1.00 0.00 H new ATOM 0 HG23 THR A 79 -10.164 -8.188 -5.530 1.00 0.00 H new ATOM 1200 N GLY A 80 -7.041 -7.838 -7.343 1.00 0.00 N ATOM 1201 CA GLY A 80 -6.192 -6.716 -7.695 1.00 0.00 C ATOM 1202 C GLY A 80 -6.410 -5.522 -6.786 1.00 0.00 C ATOM 1203 O GLY A 80 -7.543 -5.221 -6.412 1.00 0.00 O ATOM 0 H GLY A 80 -7.752 -8.072 -8.036 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -5.148 -7.023 -7.643 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -6.388 -6.425 -8.727 1.00 0.00 H new ATOM 1207 N VAL A 81 -5.327 -4.843 -6.425 1.00 0.00 N ATOM 1208 CA VAL A 81 -5.415 -3.679 -5.551 1.00 0.00 C ATOM 1209 C VAL A 81 -5.053 -2.398 -6.293 1.00 0.00 C ATOM 1210 O VAL A 81 -3.897 -1.972 -6.289 1.00 0.00 O ATOM 1211 CB VAL A 81 -4.495 -3.823 -4.325 1.00 0.00 C ATOM 1212 CG1 VAL A 81 -4.730 -2.686 -3.342 1.00 0.00 C ATOM 1213 CG2 VAL A 81 -4.707 -5.171 -3.655 1.00 0.00 C ATOM 0 H VAL A 81 -4.380 -5.078 -6.723 1.00 0.00 H new ATOM 0 HA VAL A 81 -6.450 -3.620 -5.216 1.00 0.00 H new ATOM 0 HB VAL A 81 -3.460 -3.770 -4.662 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -4.070 -2.806 -2.483 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -4.521 -1.734 -3.830 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -5.767 -2.702 -3.008 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -4.048 -5.255 -2.791 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -5.744 -5.257 -3.331 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -4.481 -5.969 -4.363 1.00 0.00 H new ATOM 1223 N ASP A 82 -6.047 -1.782 -6.923 1.00 0.00 N ATOM 1224 CA ASP A 82 -5.833 -0.543 -7.661 1.00 0.00 C ATOM 1225 C ASP A 82 -5.907 0.656 -6.722 1.00 0.00 C ATOM 1226 O ASP A 82 -6.959 1.278 -6.573 1.00 0.00 O ATOM 1227 CB ASP A 82 -6.872 -0.400 -8.775 1.00 0.00 C ATOM 1228 CG ASP A 82 -6.309 0.284 -10.005 1.00 0.00 C ATOM 1229 OD1 ASP A 82 -5.768 1.401 -9.868 1.00 0.00 O ATOM 1230 OD2 ASP A 82 -6.407 -0.298 -11.105 1.00 0.00 O ATOM 0 H ASP A 82 -7.009 -2.121 -6.937 1.00 0.00 H new ATOM 0 HA ASP A 82 -4.840 -0.577 -8.109 1.00 0.00 H new ATOM 0 HB2 ASP A 82 -7.244 -1.387 -9.050 1.00 0.00 H new ATOM 0 HB3 ASP A 82 -7.723 0.170 -8.403 1.00 0.00 H new ATOM 1235 N SER A 83 -4.783 0.971 -6.085 1.00 0.00 N ATOM 1236 CA SER A 83 -4.720 2.090 -5.152 1.00 0.00 C ATOM 1237 C SER A 83 -4.019 3.290 -5.781 1.00 0.00 C ATOM 1238 O SER A 83 -3.652 3.262 -6.956 1.00 0.00 O ATOM 1239 CB SER A 83 -3.995 1.669 -3.873 1.00 0.00 C ATOM 1240 OG SER A 83 -3.032 0.664 -4.138 1.00 0.00 O ATOM 0 H SER A 83 -3.904 0.467 -6.198 1.00 0.00 H new ATOM 0 HA SER A 83 -5.740 2.383 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 83 -3.507 2.535 -3.426 1.00 0.00 H new ATOM 0 HB3 SER A 83 -4.719 1.301 -3.146 1.00 0.00 H new ATOM 0 HG SER A 83 -3.162 -0.085 -3.520 1.00 0.00 H new ATOM 1246 N LEU A 84 -3.842 4.343 -4.991 1.00 0.00 N ATOM 1247 CA LEU A 84 -3.190 5.557 -5.469 1.00 0.00 C ATOM 1248 C LEU A 84 -2.275 6.146 -4.400 1.00 0.00 C ATOM 1249 O LEU A 84 -2.738 6.805 -3.469 1.00 0.00 O ATOM 1250 CB LEU A 84 -4.242 6.591 -5.881 1.00 0.00 C ATOM 1251 CG LEU A 84 -3.737 7.707 -6.799 1.00 0.00 C ATOM 1252 CD1 LEU A 84 -2.712 8.570 -6.081 1.00 0.00 C ATOM 1253 CD2 LEU A 84 -3.146 7.120 -8.073 1.00 0.00 C ATOM 0 H LEU A 84 -4.141 4.381 -4.016 1.00 0.00 H new ATOM 0 HA LEU A 84 -2.581 5.296 -6.335 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -5.060 6.073 -6.382 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -4.655 7.043 -4.980 1.00 0.00 H new ATOM 0 HG LEU A 84 -4.583 8.339 -7.070 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -2.366 9.357 -6.751 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.168 9.019 -5.199 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.866 7.954 -5.778 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -2.792 7.927 -8.715 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -2.312 6.465 -7.819 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -3.910 6.547 -8.598 1.00 0.00 H new ATOM 1265 N CYS A 85 -0.974 5.912 -4.542 1.00 0.00 N ATOM 1266 CA CYS A 85 0.001 6.429 -3.589 1.00 0.00 C ATOM 1267 C CYS A 85 0.079 7.950 -3.680 1.00 0.00 C ATOM 1268 O CYS A 85 1.024 8.502 -4.243 1.00 0.00 O ATOM 1269 CB CYS A 85 1.380 5.812 -3.847 1.00 0.00 C ATOM 1270 SG CYS A 85 1.609 4.185 -3.095 1.00 0.00 S ATOM 0 H CYS A 85 -0.572 5.369 -5.306 1.00 0.00 H new ATOM 0 HA CYS A 85 -0.321 6.156 -2.584 1.00 0.00 H new ATOM 0 HB2 CYS A 85 1.534 5.729 -4.923 1.00 0.00 H new ATOM 0 HB3 CYS A 85 2.146 6.488 -3.467 1.00 0.00 H new ATOM 0 HG CYS A 85 2.172 4.320 -1.931 1.00 0.00 H new ATOM 1276 N ASN A 86 -0.929 8.622 -3.128 1.00 0.00 N ATOM 1277 CA ASN A 86 -0.984 10.079 -3.152 1.00 0.00 C ATOM 1278 C ASN A 86 0.083 10.685 -2.248 1.00 0.00 C ATOM 1279 O ASN A 86 0.545 10.047 -1.301 1.00 0.00 O ATOM 1280 CB ASN A 86 -2.369 10.565 -2.721 1.00 0.00 C ATOM 1281 CG ASN A 86 -3.299 10.780 -3.899 1.00 0.00 C ATOM 1282 OD1 ASN A 86 -2.988 11.534 -4.820 1.00 0.00 O ATOM 1283 ND2 ASN A 86 -4.450 10.116 -3.874 1.00 0.00 N ATOM 0 H ASN A 86 -1.719 8.179 -2.659 1.00 0.00 H new ATOM 0 HA ASN A 86 -0.792 10.405 -4.174 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -2.811 9.837 -2.041 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -2.267 11.498 -2.167 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -5.116 10.221 -4.639 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -4.667 9.501 -3.090 1.00 0.00 H new ATOM 1290 N PHE A 87 0.471 11.921 -2.548 1.00 0.00 N ATOM 1291 CA PHE A 87 1.486 12.615 -1.764 1.00 0.00 C ATOM 1292 C PHE A 87 1.114 14.081 -1.570 1.00 0.00 C ATOM 1293 O PHE A 87 0.401 14.665 -2.388 1.00 0.00 O ATOM 1294 CB PHE A 87 2.851 12.506 -2.446 1.00 0.00 C ATOM 1295 CG PHE A 87 3.605 11.263 -2.071 1.00 0.00 C ATOM 1296 CD1 PHE A 87 3.169 10.018 -2.497 1.00 0.00 C ATOM 1297 CD2 PHE A 87 4.748 11.338 -1.291 1.00 0.00 C ATOM 1298 CE1 PHE A 87 3.857 8.871 -2.153 1.00 0.00 C ATOM 1299 CE2 PHE A 87 5.442 10.195 -0.943 1.00 0.00 C ATOM 1300 CZ PHE A 87 4.997 8.960 -1.375 1.00 0.00 C ATOM 0 H PHE A 87 0.098 12.462 -3.328 1.00 0.00 H new ATOM 0 HA PHE A 87 1.541 12.141 -0.784 1.00 0.00 H new ATOM 0 HB2 PHE A 87 2.712 12.526 -3.527 1.00 0.00 H new ATOM 0 HB3 PHE A 87 3.450 13.378 -2.186 1.00 0.00 H new ATOM 0 HD1 PHE A 87 2.280 9.944 -3.106 1.00 0.00 H new ATOM 0 HD2 PHE A 87 5.100 12.301 -0.951 1.00 0.00 H new ATOM 0 HE1 PHE A 87 3.506 7.907 -2.491 1.00 0.00 H new ATOM 0 HE2 PHE A 87 6.331 10.267 -0.334 1.00 0.00 H new ATOM 0 HZ PHE A 87 5.539 8.065 -1.105 1.00 0.00 H new ATOM 1310 N SER A 88 1.601 14.670 -0.484 1.00 0.00 N ATOM 1311 CA SER A 88 1.321 16.069 -0.182 1.00 0.00 C ATOM 1312 C SER A 88 2.164 16.995 -1.055 1.00 0.00 C ATOM 1313 O SER A 88 3.114 16.555 -1.703 1.00 0.00 O ATOM 1314 CB SER A 88 1.588 16.354 1.299 1.00 0.00 C ATOM 1315 OG SER A 88 0.402 16.752 1.964 1.00 0.00 O ATOM 0 H SER A 88 2.192 14.201 0.202 1.00 0.00 H new ATOM 0 HA SER A 88 0.270 16.260 -0.397 1.00 0.00 H new ATOM 0 HB2 SER A 88 1.995 15.462 1.776 1.00 0.00 H new ATOM 0 HB3 SER A 88 2.341 17.137 1.392 1.00 0.00 H new ATOM 0 HG SER A 88 -0.024 15.969 2.371 1.00 0.00 H new ATOM 1321 N PRO A 89 1.828 18.296 -1.083 1.00 0.00 N ATOM 1322 CA PRO A 89 2.562 19.283 -1.882 1.00 0.00 C ATOM 1323 C PRO A 89 3.972 19.522 -1.354 1.00 0.00 C ATOM 1324 O PRO A 89 4.872 19.897 -2.105 1.00 0.00 O ATOM 1325 CB PRO A 89 1.717 20.553 -1.749 1.00 0.00 C ATOM 1326 CG PRO A 89 0.973 20.381 -0.470 1.00 0.00 C ATOM 1327 CD PRO A 89 0.711 18.907 -0.340 1.00 0.00 C ATOM 0 HA PRO A 89 2.696 18.953 -2.912 1.00 0.00 H new ATOM 0 HB2 PRO A 89 2.344 21.445 -1.726 1.00 0.00 H new ATOM 0 HB3 PRO A 89 1.035 20.665 -2.592 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.556 20.750 0.374 1.00 0.00 H new ATOM 0 HG3 PRO A 89 0.040 20.944 -0.482 1.00 0.00 H new ATOM 0 HD2 PRO A 89 0.701 18.591 0.703 1.00 0.00 H new ATOM 0 HD3 PRO A 89 -0.254 18.631 -0.766 1.00 0.00 H new ATOM 1335 N LEU A 90 4.158 19.304 -0.056 1.00 0.00 N ATOM 1336 CA LEU A 90 5.459 19.496 0.574 1.00 0.00 C ATOM 1337 C LEU A 90 6.511 18.592 -0.061 1.00 0.00 C ATOM 1338 O LEU A 90 7.693 18.930 -0.099 1.00 0.00 O ATOM 1339 CB LEU A 90 5.369 19.220 2.075 1.00 0.00 C ATOM 1340 CG LEU A 90 4.958 20.420 2.930 1.00 0.00 C ATOM 1341 CD1 LEU A 90 3.442 20.516 3.020 1.00 0.00 C ATOM 1342 CD2 LEU A 90 5.571 20.319 4.319 1.00 0.00 C ATOM 0 H LEU A 90 3.423 18.994 0.580 1.00 0.00 H new ATOM 0 HA LEU A 90 5.759 20.533 0.421 1.00 0.00 H new ATOM 0 HB2 LEU A 90 4.653 18.414 2.239 1.00 0.00 H new ATOM 0 HB3 LEU A 90 6.338 18.861 2.422 1.00 0.00 H new ATOM 0 HG LEU A 90 5.332 21.327 2.455 1.00 0.00 H new ATOM 0 HD11 LEU A 90 3.168 21.375 3.632 1.00 0.00 H new ATOM 0 HD12 LEU A 90 3.025 20.635 2.020 1.00 0.00 H new ATOM 0 HD13 LEU A 90 3.046 19.607 3.473 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.268 21.181 4.914 1.00 0.00 H new ATOM 0 HD22 LEU A 90 5.227 19.405 4.803 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.658 20.299 4.237 1.00 0.00 H new ATOM 1354 N ALA A 91 6.072 17.439 -0.559 1.00 0.00 N ATOM 1355 CA ALA A 91 6.977 16.486 -1.193 1.00 0.00 C ATOM 1356 C ALA A 91 7.719 17.130 -2.360 1.00 0.00 C ATOM 1357 O ALA A 91 7.357 18.215 -2.815 1.00 0.00 O ATOM 1358 CB ALA A 91 6.207 15.262 -1.665 1.00 0.00 C ATOM 0 H ALA A 91 5.096 17.143 -0.536 1.00 0.00 H new ATOM 0 HA ALA A 91 7.715 16.174 -0.454 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.894 14.559 -2.136 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.727 14.783 -0.812 1.00 0.00 H new ATOM 0 HB3 ALA A 91 5.448 15.565 -2.386 1.00 0.00 H new ATOM 1364 N ARG A 92 8.761 16.458 -2.839 1.00 0.00 N ATOM 1365 CA ARG A 92 9.552 16.969 -3.951 1.00 0.00 C ATOM 1366 C ARG A 92 10.529 15.915 -4.460 1.00 0.00 C ATOM 1367 O ARG A 92 11.319 15.364 -3.694 1.00 0.00 O ATOM 1368 CB ARG A 92 10.313 18.226 -3.525 1.00 0.00 C ATOM 1369 CG ARG A 92 10.333 19.316 -4.585 1.00 0.00 C ATOM 1370 CD ARG A 92 10.384 20.700 -3.959 1.00 0.00 C ATOM 1371 NE ARG A 92 11.028 21.674 -4.838 1.00 0.00 N ATOM 1372 CZ ARG A 92 10.455 22.182 -5.927 1.00 0.00 C ATOM 1373 NH1 ARG A 92 9.231 21.808 -6.276 1.00 0.00 N ATOM 1374 NH2 ARG A 92 11.109 23.064 -6.669 1.00 0.00 N ATOM 0 H ARG A 92 9.076 15.559 -2.474 1.00 0.00 H new ATOM 0 HA ARG A 92 8.869 17.222 -4.762 1.00 0.00 H new ATOM 0 HB2 ARG A 92 9.861 18.623 -2.616 1.00 0.00 H new ATOM 0 HB3 ARG A 92 11.339 17.953 -3.278 1.00 0.00 H new ATOM 0 HG2 ARG A 92 11.197 19.177 -5.235 1.00 0.00 H new ATOM 0 HG3 ARG A 92 9.446 19.232 -5.212 1.00 0.00 H new ATOM 0 HD2 ARG A 92 9.371 21.032 -3.730 1.00 0.00 H new ATOM 0 HD3 ARG A 92 10.925 20.651 -3.014 1.00 0.00 H new ATOM 0 HE ARG A 92 11.971 21.983 -4.603 1.00 0.00 H new ATOM 0 HH11 ARG A 92 8.724 21.128 -5.709 1.00 0.00 H new ATOM 0 HH12 ARG A 92 8.797 22.200 -7.111 1.00 0.00 H new ATOM 0 HH21 ARG A 92 12.051 23.353 -6.406 1.00 0.00 H new ATOM 0 HH22 ARG A 92 10.670 23.453 -7.503 1.00 0.00 H new ATOM 1388 N ARG A 93 10.474 15.644 -5.761 1.00 0.00 N ATOM 1389 CA ARG A 93 11.356 14.660 -6.377 1.00 0.00 C ATOM 1390 C ARG A 93 11.113 13.267 -5.800 1.00 0.00 C ATOM 1391 O ARG A 93 12.055 12.540 -5.485 1.00 0.00 O ATOM 1392 CB ARG A 93 12.819 15.065 -6.180 1.00 0.00 C ATOM 1393 CG ARG A 93 13.638 15.034 -7.462 1.00 0.00 C ATOM 1394 CD ARG A 93 14.506 13.789 -7.544 1.00 0.00 C ATOM 1395 NE ARG A 93 14.252 13.024 -8.763 1.00 0.00 N ATOM 1396 CZ ARG A 93 15.097 12.126 -9.263 1.00 0.00 C ATOM 1397 NH1 ARG A 93 16.250 11.875 -8.655 1.00 0.00 N ATOM 1398 NH2 ARG A 93 14.788 11.475 -10.377 1.00 0.00 N ATOM 0 H ARG A 93 9.827 16.093 -6.409 1.00 0.00 H new ATOM 0 HA ARG A 93 11.136 14.629 -7.444 1.00 0.00 H new ATOM 0 HB2 ARG A 93 12.856 16.070 -5.760 1.00 0.00 H new ATOM 0 HB3 ARG A 93 13.277 14.397 -5.450 1.00 0.00 H new ATOM 0 HG2 ARG A 93 12.969 15.069 -8.322 1.00 0.00 H new ATOM 0 HG3 ARG A 93 14.269 15.922 -7.513 1.00 0.00 H new ATOM 0 HD2 ARG A 93 15.557 14.077 -7.509 1.00 0.00 H new ATOM 0 HD3 ARG A 93 14.319 13.159 -6.675 1.00 0.00 H new ATOM 0 HE ARG A 93 13.376 13.188 -9.259 1.00 0.00 H new ATOM 0 HH11 ARG A 93 16.494 12.372 -7.798 1.00 0.00 H new ATOM 0 HH12 ARG A 93 16.892 11.185 -9.045 1.00 0.00 H new ATOM 0 HH21 ARG A 93 13.904 11.663 -10.849 1.00 0.00 H new ATOM 0 HH22 ARG A 93 15.435 10.786 -10.761 1.00 0.00 H new ATOM 1412 N VAL A 94 9.842 12.900 -5.666 1.00 0.00 N ATOM 1413 CA VAL A 94 9.475 11.595 -5.130 1.00 0.00 C ATOM 1414 C VAL A 94 9.471 10.533 -6.226 1.00 0.00 C ATOM 1415 O VAL A 94 8.451 10.299 -6.874 1.00 0.00 O ATOM 1416 CB VAL A 94 8.088 11.632 -4.460 1.00 0.00 C ATOM 1417 CG1 VAL A 94 7.776 10.299 -3.792 1.00 0.00 C ATOM 1418 CG2 VAL A 94 8.010 12.769 -3.452 1.00 0.00 C ATOM 0 H VAL A 94 9.049 13.489 -5.922 1.00 0.00 H new ATOM 0 HA VAL A 94 10.224 11.338 -4.381 1.00 0.00 H new ATOM 0 HB VAL A 94 7.340 11.808 -5.233 1.00 0.00 H new ATOM 0 HG11 VAL A 94 6.792 10.347 -3.325 1.00 0.00 H new ATOM 0 HG12 VAL A 94 7.784 9.506 -4.540 1.00 0.00 H new ATOM 0 HG13 VAL A 94 8.528 10.088 -3.032 1.00 0.00 H new ATOM 0 HG21 VAL A 94 7.023 12.778 -2.990 1.00 0.00 H new ATOM 0 HG22 VAL A 94 8.769 12.626 -2.683 1.00 0.00 H new ATOM 0 HG23 VAL A 94 8.182 13.718 -3.960 1.00 0.00 H new ATOM 1428 N ASP A 95 10.618 9.893 -6.427 1.00 0.00 N ATOM 1429 CA ASP A 95 10.746 8.856 -7.445 1.00 0.00 C ATOM 1430 C ASP A 95 9.847 7.666 -7.125 1.00 0.00 C ATOM 1431 O ASP A 95 9.596 7.361 -5.959 1.00 0.00 O ATOM 1432 CB ASP A 95 12.201 8.397 -7.555 1.00 0.00 C ATOM 1433 CG ASP A 95 13.085 9.434 -8.219 1.00 0.00 C ATOM 1434 OD1 ASP A 95 13.513 10.380 -7.525 1.00 0.00 O ATOM 1435 OD2 ASP A 95 13.350 9.300 -9.432 1.00 0.00 O ATOM 0 H ASP A 95 11.472 10.074 -5.899 1.00 0.00 H new ATOM 0 HA ASP A 95 10.433 9.278 -8.400 1.00 0.00 H new ATOM 0 HB2 ASP A 95 12.587 8.179 -6.559 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.244 7.468 -8.124 1.00 0.00 H new ATOM 1440 N ARG A 96 9.366 6.997 -8.168 1.00 0.00 N ATOM 1441 CA ARG A 96 8.495 5.838 -7.998 1.00 0.00 C ATOM 1442 C ARG A 96 9.193 4.746 -7.193 1.00 0.00 C ATOM 1443 O ARG A 96 8.553 4.007 -6.445 1.00 0.00 O ATOM 1444 CB ARG A 96 8.071 5.289 -9.362 1.00 0.00 C ATOM 1445 CG ARG A 96 9.242 4.936 -10.266 1.00 0.00 C ATOM 1446 CD ARG A 96 8.769 4.396 -11.605 1.00 0.00 C ATOM 1447 NE ARG A 96 9.856 4.318 -12.579 1.00 0.00 N ATOM 1448 CZ ARG A 96 9.746 3.732 -13.768 1.00 0.00 C ATOM 1449 NH1 ARG A 96 8.600 3.172 -14.137 1.00 0.00 N ATOM 1450 NH2 ARG A 96 10.784 3.708 -14.593 1.00 0.00 N ATOM 0 H ARG A 96 9.564 7.237 -9.139 1.00 0.00 H new ATOM 0 HA ARG A 96 7.609 6.158 -7.450 1.00 0.00 H new ATOM 0 HB2 ARG A 96 7.458 4.401 -9.212 1.00 0.00 H new ATOM 0 HB3 ARG A 96 7.445 6.028 -9.863 1.00 0.00 H new ATOM 0 HG2 ARG A 96 9.859 5.820 -10.427 1.00 0.00 H new ATOM 0 HG3 ARG A 96 9.871 4.194 -9.775 1.00 0.00 H new ATOM 0 HD2 ARG A 96 8.337 3.405 -11.464 1.00 0.00 H new ATOM 0 HD3 ARG A 96 7.978 5.036 -11.995 1.00 0.00 H new ATOM 0 HE ARG A 96 10.752 4.738 -12.332 1.00 0.00 H new ATOM 0 HH11 ARG A 96 7.798 3.190 -13.507 1.00 0.00 H new ATOM 0 HH12 ARG A 96 8.522 2.724 -15.050 1.00 0.00 H new ATOM 0 HH21 ARG A 96 11.666 4.139 -14.316 1.00 0.00 H new ATOM 0 HH22 ARG A 96 10.700 3.259 -15.505 1.00 0.00 H new ATOM 1464 N VAL A 97 10.509 4.653 -7.351 1.00 0.00 N ATOM 1465 CA VAL A 97 11.296 3.652 -6.640 1.00 0.00 C ATOM 1466 C VAL A 97 11.166 3.819 -5.128 1.00 0.00 C ATOM 1467 O VAL A 97 11.310 2.858 -4.374 1.00 0.00 O ATOM 1468 CB VAL A 97 12.785 3.732 -7.025 1.00 0.00 C ATOM 1469 CG1 VAL A 97 13.549 2.547 -6.455 1.00 0.00 C ATOM 1470 CG2 VAL A 97 12.944 3.802 -8.537 1.00 0.00 C ATOM 0 H VAL A 97 11.053 5.259 -7.965 1.00 0.00 H new ATOM 0 HA VAL A 97 10.903 2.678 -6.931 1.00 0.00 H new ATOM 0 HB VAL A 97 13.203 4.643 -6.597 1.00 0.00 H new ATOM 0 HG11 VAL A 97 14.599 2.621 -6.738 1.00 0.00 H new ATOM 0 HG12 VAL A 97 13.465 2.548 -5.368 1.00 0.00 H new ATOM 0 HG13 VAL A 97 13.131 1.621 -6.850 1.00 0.00 H new ATOM 0 HG21 VAL A 97 14.003 3.858 -8.789 1.00 0.00 H new ATOM 0 HG22 VAL A 97 12.510 2.911 -8.990 1.00 0.00 H new ATOM 0 HG23 VAL A 97 12.433 4.687 -8.916 1.00 0.00 H new ATOM 1480 N ALA A 98 10.894 5.046 -4.693 1.00 0.00 N ATOM 1481 CA ALA A 98 10.746 5.337 -3.272 1.00 0.00 C ATOM 1482 C ALA A 98 9.621 4.515 -2.655 1.00 0.00 C ATOM 1483 O ALA A 98 9.851 3.705 -1.758 1.00 0.00 O ATOM 1484 CB ALA A 98 10.494 6.822 -3.064 1.00 0.00 C ATOM 0 H ALA A 98 10.772 5.853 -5.304 1.00 0.00 H new ATOM 0 HA ALA A 98 11.674 5.062 -2.771 1.00 0.00 H new ATOM 0 HB1 ALA A 98 10.385 7.027 -1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 98 11.334 7.393 -3.459 1.00 0.00 H new ATOM 0 HB3 ALA A 98 9.581 7.113 -3.584 1.00 0.00 H new ATOM 1490 N ILE A 99 8.402 4.728 -3.142 1.00 0.00 N ATOM 1491 CA ILE A 99 7.241 4.005 -2.637 1.00 0.00 C ATOM 1492 C ILE A 99 7.314 2.526 -3.005 1.00 0.00 C ATOM 1493 O ILE A 99 6.727 1.679 -2.331 1.00 0.00 O ATOM 1494 CB ILE A 99 5.923 4.597 -3.180 1.00 0.00 C ATOM 1495 CG1 ILE A 99 5.901 6.114 -2.991 1.00 0.00 C ATOM 1496 CG2 ILE A 99 4.729 3.953 -2.489 1.00 0.00 C ATOM 1497 CD1 ILE A 99 5.104 6.843 -4.051 1.00 0.00 C ATOM 0 H ILE A 99 8.193 5.395 -3.885 1.00 0.00 H new ATOM 0 HA ILE A 99 7.252 4.109 -1.552 1.00 0.00 H new ATOM 0 HB ILE A 99 5.860 4.384 -4.247 1.00 0.00 H new ATOM 0 HG12 ILE A 99 5.483 6.344 -2.011 1.00 0.00 H new ATOM 0 HG13 ILE A 99 6.925 6.488 -2.996 1.00 0.00 H new ATOM 0 HG21 ILE A 99 3.807 4.381 -2.882 1.00 0.00 H new ATOM 0 HG22 ILE A 99 4.738 2.879 -2.673 1.00 0.00 H new ATOM 0 HG23 ILE A 99 4.786 4.138 -1.416 1.00 0.00 H new ATOM 0 HD11 ILE A 99 5.132 7.915 -3.854 1.00 0.00 H new ATOM 0 HD12 ILE A 99 5.535 6.643 -5.032 1.00 0.00 H new ATOM 0 HD13 ILE A 99 4.071 6.497 -4.031 1.00 0.00 H new ATOM 1509 N TYR A 100 8.039 2.222 -4.077 1.00 0.00 N ATOM 1510 CA TYR A 100 8.191 0.846 -4.536 1.00 0.00 C ATOM 1511 C TYR A 100 9.144 0.071 -3.633 1.00 0.00 C ATOM 1512 O TYR A 100 8.889 -1.083 -3.289 1.00 0.00 O ATOM 1513 CB TYR A 100 8.708 0.824 -5.975 1.00 0.00 C ATOM 1514 CG TYR A 100 8.718 -0.555 -6.597 1.00 0.00 C ATOM 1515 CD1 TYR A 100 7.535 -1.257 -6.794 1.00 0.00 C ATOM 1516 CD2 TYR A 100 9.909 -1.153 -6.988 1.00 0.00 C ATOM 1517 CE1 TYR A 100 7.540 -2.516 -7.363 1.00 0.00 C ATOM 1518 CE2 TYR A 100 9.922 -2.412 -7.558 1.00 0.00 C ATOM 1519 CZ TYR A 100 8.736 -3.089 -7.743 1.00 0.00 C ATOM 1520 OH TYR A 100 8.744 -4.343 -8.309 1.00 0.00 O ATOM 0 H TYR A 100 8.531 2.912 -4.645 1.00 0.00 H new ATOM 0 HA TYR A 100 7.213 0.367 -4.497 1.00 0.00 H new ATOM 0 HB2 TYR A 100 8.089 1.483 -6.584 1.00 0.00 H new ATOM 0 HB3 TYR A 100 9.720 1.229 -5.994 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.597 -0.811 -6.498 1.00 0.00 H new ATOM 0 HD2 TYR A 100 10.840 -0.625 -6.844 1.00 0.00 H new ATOM 0 HE1 TYR A 100 6.612 -3.049 -7.510 1.00 0.00 H new ATOM 0 HE2 TYR A 100 10.857 -2.863 -7.857 1.00 0.00 H new ATOM 0 HH TYR A 100 9.666 -4.601 -8.520 1.00 0.00 H new ATOM 1530 N GLU A 101 10.246 0.712 -3.256 1.00 0.00 N ATOM 1531 CA GLU A 101 11.242 0.081 -2.397 1.00 0.00 C ATOM 1532 C GLU A 101 10.761 0.018 -0.950 1.00 0.00 C ATOM 1533 O GLU A 101 10.745 -1.050 -0.338 1.00 0.00 O ATOM 1534 CB GLU A 101 12.565 0.845 -2.473 1.00 0.00 C ATOM 1535 CG GLU A 101 13.453 0.411 -3.627 1.00 0.00 C ATOM 1536 CD GLU A 101 14.901 0.233 -3.215 1.00 0.00 C ATOM 1537 OE1 GLU A 101 15.654 1.230 -3.250 1.00 0.00 O ATOM 1538 OE2 GLU A 101 15.283 -0.901 -2.857 1.00 0.00 O ATOM 0 H GLU A 101 10.472 1.668 -3.532 1.00 0.00 H new ATOM 0 HA GLU A 101 11.394 -0.938 -2.751 1.00 0.00 H new ATOM 0 HB2 GLU A 101 12.355 1.910 -2.568 1.00 0.00 H new ATOM 0 HB3 GLU A 101 13.107 0.709 -1.537 1.00 0.00 H new ATOM 0 HG2 GLU A 101 13.078 -0.527 -4.036 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.395 1.152 -4.424 1.00 0.00 H new ATOM 1545 N GLU A 102 10.372 1.168 -0.409 1.00 0.00 N ATOM 1546 CA GLU A 102 9.892 1.245 0.967 1.00 0.00 C ATOM 1547 C GLU A 102 8.740 0.272 1.205 1.00 0.00 C ATOM 1548 O GLU A 102 8.552 -0.225 2.315 1.00 0.00 O ATOM 1549 CB GLU A 102 9.447 2.672 1.294 1.00 0.00 C ATOM 1550 CG GLU A 102 10.499 3.485 2.030 1.00 0.00 C ATOM 1551 CD GLU A 102 11.805 3.577 1.267 1.00 0.00 C ATOM 1552 OE1 GLU A 102 11.764 3.567 0.017 1.00 0.00 O ATOM 1553 OE2 GLU A 102 12.868 3.658 1.916 1.00 0.00 O ATOM 0 H GLU A 102 10.380 2.061 -0.903 1.00 0.00 H new ATOM 0 HA GLU A 102 10.715 0.967 1.625 1.00 0.00 H new ATOM 0 HB2 GLU A 102 9.187 3.184 0.367 1.00 0.00 H new ATOM 0 HB3 GLU A 102 8.542 2.631 1.900 1.00 0.00 H new ATOM 0 HG2 GLU A 102 10.116 4.490 2.210 1.00 0.00 H new ATOM 0 HG3 GLU A 102 10.684 3.035 3.005 1.00 0.00 H new ATOM 1560 N PHE A 103 7.970 0.006 0.155 1.00 0.00 N ATOM 1561 CA PHE A 103 6.835 -0.905 0.252 1.00 0.00 C ATOM 1562 C PHE A 103 7.295 -2.359 0.213 1.00 0.00 C ATOM 1563 O PHE A 103 6.836 -3.186 1.001 1.00 0.00 O ATOM 1564 CB PHE A 103 5.846 -0.642 -0.884 1.00 0.00 C ATOM 1565 CG PHE A 103 4.584 -1.451 -0.781 1.00 0.00 C ATOM 1566 CD1 PHE A 103 3.677 -1.218 0.239 1.00 0.00 C ATOM 1567 CD2 PHE A 103 4.305 -2.445 -1.707 1.00 0.00 C ATOM 1568 CE1 PHE A 103 2.516 -1.960 0.336 1.00 0.00 C ATOM 1569 CE2 PHE A 103 3.147 -3.191 -1.614 1.00 0.00 C ATOM 1570 CZ PHE A 103 2.250 -2.947 -0.592 1.00 0.00 C ATOM 0 H PHE A 103 8.111 0.408 -0.772 1.00 0.00 H new ATOM 0 HA PHE A 103 6.340 -0.726 1.207 1.00 0.00 H new ATOM 0 HB2 PHE A 103 5.589 0.417 -0.893 1.00 0.00 H new ATOM 0 HB3 PHE A 103 6.331 -0.861 -1.835 1.00 0.00 H new ATOM 0 HD1 PHE A 103 3.880 -0.447 0.967 1.00 0.00 H new ATOM 0 HD2 PHE A 103 5.001 -2.638 -2.510 1.00 0.00 H new ATOM 0 HE1 PHE A 103 1.817 -1.768 1.137 1.00 0.00 H new ATOM 0 HE2 PHE A 103 2.943 -3.965 -2.339 1.00 0.00 H new ATOM 0 HZ PHE A 103 1.342 -3.527 -0.519 1.00 0.00 H new ATOM 1580 N LEU A 104 8.200 -2.665 -0.711 1.00 0.00 N ATOM 1581 CA LEU A 104 8.718 -4.022 -0.858 1.00 0.00 C ATOM 1582 C LEU A 104 9.418 -4.488 0.416 1.00 0.00 C ATOM 1583 O LEU A 104 9.113 -5.556 0.946 1.00 0.00 O ATOM 1584 CB LEU A 104 9.689 -4.092 -2.037 1.00 0.00 C ATOM 1585 CG LEU A 104 9.042 -3.956 -3.417 1.00 0.00 C ATOM 1586 CD1 LEU A 104 10.020 -3.342 -4.406 1.00 0.00 C ATOM 1587 CD2 LEU A 104 8.557 -5.310 -3.913 1.00 0.00 C ATOM 0 H LEU A 104 8.591 -1.992 -1.370 1.00 0.00 H new ATOM 0 HA LEU A 104 7.873 -4.684 -1.046 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.434 -3.304 -1.922 1.00 0.00 H new ATOM 0 HB3 LEU A 104 10.221 -5.042 -1.994 1.00 0.00 H new ATOM 0 HG LEU A 104 8.181 -3.293 -3.331 1.00 0.00 H new ATOM 0 HD11 LEU A 104 9.543 -3.253 -5.382 1.00 0.00 H new ATOM 0 HD12 LEU A 104 10.319 -2.354 -4.056 1.00 0.00 H new ATOM 0 HD13 LEU A 104 10.901 -3.979 -4.490 1.00 0.00 H new ATOM 0 HD21 LEU A 104 8.100 -5.195 -4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 104 9.402 -5.995 -3.984 1.00 0.00 H new ATOM 0 HD23 LEU A 104 7.822 -5.711 -3.215 1.00 0.00 H new ATOM 1599 N ARG A 105 10.361 -3.685 0.897 1.00 0.00 N ATOM 1600 CA ARG A 105 11.111 -4.019 2.104 1.00 0.00 C ATOM 1601 C ARG A 105 10.176 -4.287 3.282 1.00 0.00 C ATOM 1602 O ARG A 105 10.377 -5.236 4.040 1.00 0.00 O ATOM 1603 CB ARG A 105 12.081 -2.888 2.455 1.00 0.00 C ATOM 1604 CG ARG A 105 13.515 -3.163 2.027 1.00 0.00 C ATOM 1605 CD ARG A 105 14.504 -2.865 3.144 1.00 0.00 C ATOM 1606 NE ARG A 105 15.184 -4.072 3.609 1.00 0.00 N ATOM 1607 CZ ARG A 105 15.812 -4.165 4.780 1.00 0.00 C ATOM 1608 NH1 ARG A 105 15.846 -3.128 5.607 1.00 0.00 N ATOM 1609 NH2 ARG A 105 16.405 -5.300 5.125 1.00 0.00 N ATOM 0 H ARG A 105 10.625 -2.797 0.470 1.00 0.00 H new ATOM 0 HA ARG A 105 11.676 -4.929 1.905 1.00 0.00 H new ATOM 0 HB2 ARG A 105 11.739 -1.967 1.982 1.00 0.00 H new ATOM 0 HB3 ARG A 105 12.057 -2.721 3.532 1.00 0.00 H new ATOM 0 HG2 ARG A 105 13.611 -4.206 1.725 1.00 0.00 H new ATOM 0 HG3 ARG A 105 13.757 -2.555 1.155 1.00 0.00 H new ATOM 0 HD2 ARG A 105 15.243 -2.145 2.792 1.00 0.00 H new ATOM 0 HD3 ARG A 105 13.979 -2.400 3.979 1.00 0.00 H new ATOM 0 HE ARG A 105 15.177 -4.891 3.001 1.00 0.00 H new ATOM 0 HH11 ARG A 105 15.390 -2.253 5.347 1.00 0.00 H new ATOM 0 HH12 ARG A 105 16.328 -3.205 6.502 1.00 0.00 H new ATOM 0 HH21 ARG A 105 16.380 -6.101 4.494 1.00 0.00 H new ATOM 0 HH22 ARG A 105 16.886 -5.372 6.022 1.00 0.00 H new ATOM 1623 N MET A 106 9.159 -3.446 3.430 1.00 0.00 N ATOM 1624 CA MET A 106 8.200 -3.595 4.519 1.00 0.00 C ATOM 1625 C MET A 106 7.285 -4.794 4.290 1.00 0.00 C ATOM 1626 O MET A 106 6.799 -5.405 5.243 1.00 0.00 O ATOM 1627 CB MET A 106 7.363 -2.323 4.665 1.00 0.00 C ATOM 1628 CG MET A 106 6.792 -2.132 6.062 1.00 0.00 C ATOM 1629 SD MET A 106 7.672 -0.874 7.009 1.00 0.00 S ATOM 1630 CE MET A 106 7.365 0.579 6.009 1.00 0.00 C ATOM 0 H MET A 106 8.977 -2.656 2.811 1.00 0.00 H new ATOM 0 HA MET A 106 8.761 -3.764 5.438 1.00 0.00 H new ATOM 0 HB2 MET A 106 7.979 -1.460 4.411 1.00 0.00 H new ATOM 0 HB3 MET A 106 6.544 -2.352 3.947 1.00 0.00 H new ATOM 0 HG2 MET A 106 5.741 -1.854 5.985 1.00 0.00 H new ATOM 0 HG3 MET A 106 6.833 -3.080 6.599 1.00 0.00 H new ATOM 0 HE1 MET A 106 8.295 1.132 5.876 1.00 0.00 H new ATOM 0 HE2 MET A 106 6.981 0.276 5.035 1.00 0.00 H new ATOM 0 HE3 MET A 106 6.632 1.215 6.506 1.00 0.00 H new ATOM 1640 N THR A 107 7.051 -5.125 3.025 1.00 0.00 N ATOM 1641 CA THR A 107 6.189 -6.251 2.678 1.00 0.00 C ATOM 1642 C THR A 107 6.994 -7.539 2.506 1.00 0.00 C ATOM 1643 O THR A 107 6.494 -8.522 1.960 1.00 0.00 O ATOM 1644 CB THR A 107 5.414 -5.949 1.397 1.00 0.00 C ATOM 1645 OG1 THR A 107 6.299 -5.617 0.342 1.00 0.00 O ATOM 1646 CG2 THR A 107 4.431 -4.808 1.548 1.00 0.00 C ATOM 0 H THR A 107 7.445 -4.632 2.224 1.00 0.00 H new ATOM 0 HA THR A 107 5.487 -6.396 3.499 1.00 0.00 H new ATOM 0 HB THR A 107 4.858 -6.860 1.174 1.00 0.00 H new ATOM 0 HG1 THR A 107 6.304 -4.646 0.213 1.00 0.00 H new ATOM 0 HG21 THR A 107 3.914 -4.646 0.602 1.00 0.00 H new ATOM 0 HG22 THR A 107 3.704 -5.054 2.321 1.00 0.00 H new ATOM 0 HG23 THR A 107 4.966 -3.901 1.829 1.00 0.00 H new ATOM 1654 N HIS A 108 8.239 -7.532 2.976 1.00 0.00 N ATOM 1655 CA HIS A 108 9.103 -8.704 2.873 1.00 0.00 C ATOM 1656 C HIS A 108 9.240 -9.164 1.425 1.00 0.00 C ATOM 1657 O HIS A 108 8.593 -10.123 1.004 1.00 0.00 O ATOM 1658 CB HIS A 108 8.552 -9.843 3.732 1.00 0.00 C ATOM 1659 CG HIS A 108 8.927 -9.739 5.177 1.00 0.00 C ATOM 1660 ND1 HIS A 108 8.028 -9.399 6.166 1.00 0.00 N ATOM 1661 CD2 HIS A 108 10.114 -9.931 5.802 1.00 0.00 C ATOM 1662 CE1 HIS A 108 8.644 -9.387 7.335 1.00 0.00 C ATOM 1663 NE2 HIS A 108 9.911 -9.706 7.141 1.00 0.00 N ATOM 0 H HIS A 108 8.671 -6.728 3.431 1.00 0.00 H new ATOM 0 HA HIS A 108 10.092 -8.425 3.236 1.00 0.00 H new ATOM 0 HB2 HIS A 108 7.465 -9.858 3.647 1.00 0.00 H new ATOM 0 HB3 HIS A 108 8.915 -10.792 3.338 1.00 0.00 H new ATOM 0 HD2 HIS A 108 11.047 -10.209 5.334 1.00 0.00 H new ATOM 0 HE1 HIS A 108 8.189 -9.156 8.287 1.00 0.00 H new ATOM 0 HE2 HIS A 108 10.623 -9.774 7.868 1.00 0.00 H new ATOM 1672 N ASN A 109 10.091 -8.478 0.668 1.00 0.00 N ATOM 1673 CA ASN A 109 10.320 -8.819 -0.732 1.00 0.00 C ATOM 1674 C ASN A 109 9.022 -8.773 -1.534 1.00 0.00 C ATOM 1675 O ASN A 109 8.868 -9.487 -2.525 1.00 0.00 O ATOM 1676 CB ASN A 109 10.948 -10.210 -0.843 1.00 0.00 C ATOM 1677 CG ASN A 109 12.118 -10.394 0.104 1.00 0.00 C ATOM 1678 OD1 ASN A 109 12.028 -10.078 1.290 1.00 0.00 O ATOM 1679 ND2 ASN A 109 13.226 -10.907 -0.418 1.00 0.00 N ATOM 0 H ASN A 109 10.634 -7.682 1.001 1.00 0.00 H new ATOM 0 HA ASN A 109 11.005 -8.079 -1.147 1.00 0.00 H new ATOM 0 HB2 ASN A 109 10.191 -10.965 -0.632 1.00 0.00 H new ATOM 0 HB3 ASN A 109 11.284 -10.373 -1.867 1.00 0.00 H new ATOM 0 HD21 ASN A 109 14.047 -11.053 0.170 1.00 0.00 H new ATOM 0 HD22 ASN A 109 13.257 -11.155 -1.407 1.00 0.00 H new ATOM 1686 N GLY A 110 8.091 -7.927 -1.103 1.00 0.00 N ATOM 1687 CA GLY A 110 6.822 -7.805 -1.797 1.00 0.00 C ATOM 1688 C GLY A 110 6.086 -9.126 -1.904 1.00 0.00 C ATOM 1689 O GLY A 110 5.507 -9.438 -2.945 1.00 0.00 O ATOM 0 H GLY A 110 8.193 -7.324 -0.286 1.00 0.00 H new ATOM 0 HA2 GLY A 110 6.194 -7.085 -1.273 1.00 0.00 H new ATOM 0 HA3 GLY A 110 6.996 -7.408 -2.797 1.00 0.00 H new ATOM 1693 N THR A 111 6.111 -9.906 -0.828 1.00 0.00 N ATOM 1694 CA THR A 111 5.441 -11.202 -0.810 1.00 0.00 C ATOM 1695 C THR A 111 4.375 -11.257 0.281 1.00 0.00 C ATOM 1696 O THR A 111 3.350 -11.920 0.123 1.00 0.00 O ATOM 1697 CB THR A 111 6.459 -12.324 -0.599 1.00 0.00 C ATOM 1698 OG1 THR A 111 7.179 -12.129 0.605 1.00 0.00 O ATOM 1699 CG2 THR A 111 7.466 -12.437 -1.723 1.00 0.00 C ATOM 0 H THR A 111 6.587 -9.664 0.041 1.00 0.00 H new ATOM 0 HA THR A 111 4.952 -11.338 -1.774 1.00 0.00 H new ATOM 0 HB THR A 111 5.873 -13.242 -0.564 1.00 0.00 H new ATOM 0 HG1 THR A 111 7.973 -11.583 0.427 1.00 0.00 H new ATOM 0 HG21 THR A 111 8.158 -13.252 -1.511 1.00 0.00 H new ATOM 0 HG22 THR A 111 6.945 -12.638 -2.659 1.00 0.00 H new ATOM 0 HG23 THR A 111 8.021 -11.503 -1.810 1.00 0.00 H new ATOM 1707 N GLN A 112 4.622 -10.565 1.388 1.00 0.00 N ATOM 1708 CA GLN A 112 3.679 -10.546 2.500 1.00 0.00 C ATOM 1709 C GLN A 112 3.450 -9.127 3.008 1.00 0.00 C ATOM 1710 O GLN A 112 4.365 -8.485 3.523 1.00 0.00 O ATOM 1711 CB GLN A 112 4.189 -11.431 3.640 1.00 0.00 C ATOM 1712 CG GLN A 112 3.137 -11.732 4.695 1.00 0.00 C ATOM 1713 CD GLN A 112 3.722 -11.826 6.090 1.00 0.00 C ATOM 1714 OE1 GLN A 112 4.785 -11.270 6.368 1.00 0.00 O ATOM 1715 NE2 GLN A 112 3.030 -12.531 6.977 1.00 0.00 N ATOM 0 H GLN A 112 5.465 -10.011 1.539 1.00 0.00 H new ATOM 0 HA GLN A 112 2.727 -10.935 2.138 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.553 -12.370 3.224 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.039 -10.942 4.116 1.00 0.00 H new ATOM 0 HG2 GLN A 112 2.375 -10.953 4.676 1.00 0.00 H new ATOM 0 HG3 GLN A 112 2.639 -12.670 4.450 1.00 0.00 H new ATOM 0 HE21 GLN A 112 2.153 -12.975 6.703 1.00 0.00 H new ATOM 0 HE22 GLN A 112 3.375 -12.628 7.932 1.00 0.00 H new ATOM 1724 N LEU A 113 2.219 -8.644 2.863 1.00 0.00 N ATOM 1725 CA LEU A 113 1.865 -7.302 3.313 1.00 0.00 C ATOM 1726 C LEU A 113 1.162 -7.357 4.665 1.00 0.00 C ATOM 1727 O LEU A 113 -0.045 -7.589 4.738 1.00 0.00 O ATOM 1728 CB LEU A 113 0.968 -6.614 2.278 1.00 0.00 C ATOM 1729 CG LEU A 113 0.466 -5.213 2.657 1.00 0.00 C ATOM 1730 CD1 LEU A 113 -0.800 -5.305 3.493 1.00 0.00 C ATOM 1731 CD2 LEU A 113 1.542 -4.432 3.400 1.00 0.00 C ATOM 0 H LEU A 113 1.450 -9.162 2.437 1.00 0.00 H new ATOM 0 HA LEU A 113 2.782 -6.723 3.424 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.518 -6.541 1.339 1.00 0.00 H new ATOM 0 HB3 LEU A 113 0.104 -7.252 2.093 1.00 0.00 H new ATOM 0 HG LEU A 113 0.233 -4.678 1.737 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -1.139 -4.302 3.751 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -1.576 -5.815 2.923 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -0.594 -5.864 4.406 1.00 0.00 H new ATOM 0 HD21 LEU A 113 1.162 -3.443 3.657 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.814 -4.964 4.311 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.421 -4.328 2.764 1.00 0.00 H new ATOM 1743 N LEU A 114 1.927 -7.150 5.733 1.00 0.00 N ATOM 1744 CA LEU A 114 1.384 -7.180 7.088 1.00 0.00 C ATOM 1745 C LEU A 114 0.815 -8.558 7.415 1.00 0.00 C ATOM 1746 O LEU A 114 1.464 -9.365 8.080 1.00 0.00 O ATOM 1747 CB LEU A 114 0.300 -6.112 7.256 1.00 0.00 C ATOM 1748 CG LEU A 114 0.817 -4.678 7.380 1.00 0.00 C ATOM 1749 CD1 LEU A 114 -0.330 -3.719 7.655 1.00 0.00 C ATOM 1750 CD2 LEU A 114 1.868 -4.585 8.477 1.00 0.00 C ATOM 0 H LEU A 114 2.928 -6.959 5.686 1.00 0.00 H new ATOM 0 HA LEU A 114 2.198 -6.968 7.781 1.00 0.00 H new ATOM 0 HB2 LEU A 114 -0.376 -6.166 6.403 1.00 0.00 H new ATOM 0 HB3 LEU A 114 -0.287 -6.348 8.144 1.00 0.00 H new ATOM 0 HG LEU A 114 1.280 -4.395 6.435 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.057 -2.704 7.740 1.00 0.00 H new ATOM 0 HD12 LEU A 114 -1.048 -3.766 6.836 1.00 0.00 H new ATOM 0 HD13 LEU A 114 -0.823 -3.999 8.586 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.226 -3.558 8.552 1.00 0.00 H new ATOM 0 HD22 LEU A 114 1.429 -4.887 9.428 1.00 0.00 H new ATOM 0 HD23 LEU A 114 2.703 -5.243 8.238 1.00 0.00 H new ATOM 1762 N ASN A 115 -0.399 -8.819 6.944 1.00 0.00 N ATOM 1763 CA ASN A 115 -1.054 -10.098 7.184 1.00 0.00 C ATOM 1764 C ASN A 115 -1.778 -10.581 5.931 1.00 0.00 C ATOM 1765 O ASN A 115 -2.790 -11.276 6.015 1.00 0.00 O ATOM 1766 CB ASN A 115 -2.041 -9.977 8.348 1.00 0.00 C ATOM 1767 CG ASN A 115 -1.899 -11.108 9.346 1.00 0.00 C ATOM 1768 OD1 ASN A 115 -1.890 -10.886 10.558 1.00 0.00 O ATOM 1769 ND2 ASN A 115 -1.786 -12.332 8.843 1.00 0.00 N ATOM 0 H ASN A 115 -0.950 -8.160 6.393 1.00 0.00 H new ATOM 0 HA ASN A 115 -0.289 -10.830 7.442 1.00 0.00 H new ATOM 0 HB2 ASN A 115 -1.884 -9.026 8.856 1.00 0.00 H new ATOM 0 HB3 ASN A 115 -3.059 -9.966 7.958 1.00 0.00 H new ATOM 0 HD21 ASN A 115 -1.687 -13.133 9.467 1.00 0.00 H new ATOM 0 HD22 ASN A 115 -1.798 -12.471 7.833 1.00 0.00 H new ATOM 1776 N PHE A 116 -1.252 -10.205 4.769 1.00 0.00 N ATOM 1777 CA PHE A 116 -1.847 -10.598 3.498 1.00 0.00 C ATOM 1778 C PHE A 116 -0.769 -10.901 2.462 1.00 0.00 C ATOM 1779 O PHE A 116 -0.109 -9.994 1.955 1.00 0.00 O ATOM 1780 CB PHE A 116 -2.769 -9.493 2.981 1.00 0.00 C ATOM 1781 CG PHE A 116 -4.120 -9.484 3.636 1.00 0.00 C ATOM 1782 CD1 PHE A 116 -5.100 -10.384 3.248 1.00 0.00 C ATOM 1783 CD2 PHE A 116 -4.411 -8.576 4.642 1.00 0.00 C ATOM 1784 CE1 PHE A 116 -6.344 -10.378 3.850 1.00 0.00 C ATOM 1785 CE2 PHE A 116 -5.652 -8.563 5.247 1.00 0.00 C ATOM 1786 CZ PHE A 116 -6.620 -9.467 4.850 1.00 0.00 C ATOM 0 H PHE A 116 -0.415 -9.629 4.682 1.00 0.00 H new ATOM 0 HA PHE A 116 -2.431 -11.503 3.663 1.00 0.00 H new ATOM 0 HB2 PHE A 116 -2.290 -8.527 3.141 1.00 0.00 H new ATOM 0 HB3 PHE A 116 -2.897 -9.611 1.905 1.00 0.00 H new ATOM 0 HD1 PHE A 116 -4.889 -11.098 2.466 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -3.657 -7.869 4.957 1.00 0.00 H new ATOM 0 HE1 PHE A 116 -7.099 -11.085 3.539 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -5.866 -7.849 6.028 1.00 0.00 H new ATOM 0 HZ PHE A 116 -7.591 -9.460 5.322 1.00 0.00 H new ATOM 1796 N THR A 117 -0.598 -12.181 2.149 1.00 0.00 N ATOM 1797 CA THR A 117 0.399 -12.602 1.173 1.00 0.00 C ATOM 1798 C THR A 117 -0.020 -12.202 -0.238 1.00 0.00 C ATOM 1799 O THR A 117 -1.011 -12.706 -0.767 1.00 0.00 O ATOM 1800 CB THR A 117 0.608 -14.116 1.245 1.00 0.00 C ATOM 1801 OG1 THR A 117 -0.634 -14.795 1.212 1.00 0.00 O ATOM 1802 CG2 THR A 117 1.342 -14.559 2.492 1.00 0.00 C ATOM 0 H THR A 117 -1.137 -12.944 2.557 1.00 0.00 H new ATOM 0 HA THR A 117 1.338 -12.102 1.411 1.00 0.00 H new ATOM 0 HB THR A 117 1.217 -14.366 0.377 1.00 0.00 H new ATOM 0 HG1 THR A 117 -0.480 -15.762 1.257 1.00 0.00 H new ATOM 0 HG21 THR A 117 1.457 -15.643 2.481 1.00 0.00 H new ATOM 0 HG22 THR A 117 2.325 -14.090 2.521 1.00 0.00 H new ATOM 0 HG23 THR A 117 0.773 -14.264 3.373 1.00 0.00 H new ATOM 1810 N LEU A 118 0.736 -11.292 -0.841 1.00 0.00 N ATOM 1811 CA LEU A 118 0.437 -10.826 -2.191 1.00 0.00 C ATOM 1812 C LEU A 118 1.642 -11.005 -3.110 1.00 0.00 C ATOM 1813 O LEU A 118 2.777 -11.124 -2.648 1.00 0.00 O ATOM 1814 CB LEU A 118 0.007 -9.358 -2.164 1.00 0.00 C ATOM 1815 CG LEU A 118 1.033 -8.387 -1.577 1.00 0.00 C ATOM 1816 CD1 LEU A 118 1.951 -7.858 -2.667 1.00 0.00 C ATOM 1817 CD2 LEU A 118 0.329 -7.242 -0.865 1.00 0.00 C ATOM 0 H LEU A 118 1.559 -10.863 -0.418 1.00 0.00 H new ATOM 0 HA LEU A 118 -0.383 -11.427 -2.583 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.224 -9.045 -3.182 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -0.916 -9.277 -1.589 1.00 0.00 H new ATOM 0 HG LEU A 118 1.642 -8.923 -0.849 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.674 -7.169 -2.231 1.00 0.00 H new ATOM 0 HD12 LEU A 118 2.478 -8.690 -3.134 1.00 0.00 H new ATOM 0 HD13 LEU A 118 1.360 -7.335 -3.419 1.00 0.00 H new ATOM 0 HD21 LEU A 118 1.071 -6.559 -0.452 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -0.303 -6.706 -1.574 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -0.287 -7.639 -0.058 1.00 0.00 H new ATOM 1829 N ASP A 119 1.384 -11.027 -4.413 1.00 0.00 N ATOM 1830 CA ASP A 119 2.444 -11.196 -5.402 1.00 0.00 C ATOM 1831 C ASP A 119 3.409 -10.016 -5.377 1.00 0.00 C ATOM 1832 O ASP A 119 3.061 -8.923 -4.931 1.00 0.00 O ATOM 1833 CB ASP A 119 1.845 -11.349 -6.801 1.00 0.00 C ATOM 1834 CG ASP A 119 2.601 -12.354 -7.647 1.00 0.00 C ATOM 1835 OD1 ASP A 119 2.276 -13.558 -7.570 1.00 0.00 O ATOM 1836 OD2 ASP A 119 3.519 -11.938 -8.384 1.00 0.00 O ATOM 0 H ASP A 119 0.449 -10.930 -4.810 1.00 0.00 H new ATOM 0 HA ASP A 119 2.999 -12.100 -5.150 1.00 0.00 H new ATOM 0 HB2 ASP A 119 0.804 -11.660 -6.715 1.00 0.00 H new ATOM 0 HB3 ASP A 119 1.848 -10.381 -7.302 1.00 0.00 H new ATOM 1841 N ARG A 120 4.626 -10.246 -5.863 1.00 0.00 N ATOM 1842 CA ARG A 120 5.645 -9.203 -5.899 1.00 0.00 C ATOM 1843 C ARG A 120 5.690 -8.537 -7.271 1.00 0.00 C ATOM 1844 O ARG A 120 5.630 -7.312 -7.380 1.00 0.00 O ATOM 1845 CB ARG A 120 7.016 -9.791 -5.556 1.00 0.00 C ATOM 1846 CG ARG A 120 8.147 -8.776 -5.617 1.00 0.00 C ATOM 1847 CD ARG A 120 8.961 -8.923 -6.893 1.00 0.00 C ATOM 1848 NE ARG A 120 10.251 -9.564 -6.649 1.00 0.00 N ATOM 1849 CZ ARG A 120 11.315 -8.931 -6.161 1.00 0.00 C ATOM 1850 NH1 ARG A 120 11.246 -7.639 -5.860 1.00 0.00 N ATOM 1851 NH2 ARG A 120 12.450 -9.589 -5.972 1.00 0.00 N ATOM 0 H ARG A 120 4.930 -11.145 -6.237 1.00 0.00 H new ATOM 0 HA ARG A 120 5.387 -8.447 -5.157 1.00 0.00 H new ATOM 0 HB2 ARG A 120 6.978 -10.220 -4.555 1.00 0.00 H new ATOM 0 HB3 ARG A 120 7.234 -10.607 -6.244 1.00 0.00 H new ATOM 0 HG2 ARG A 120 7.736 -7.768 -5.561 1.00 0.00 H new ATOM 0 HG3 ARG A 120 8.798 -8.903 -4.752 1.00 0.00 H new ATOM 0 HD2 ARG A 120 8.396 -9.509 -7.618 1.00 0.00 H new ATOM 0 HD3 ARG A 120 9.123 -7.940 -7.335 1.00 0.00 H new ATOM 0 HE ARG A 120 10.342 -10.557 -6.866 1.00 0.00 H new ATOM 0 HH11 ARG A 120 10.375 -7.128 -6.003 1.00 0.00 H new ATOM 0 HH12 ARG A 120 12.064 -7.158 -5.486 1.00 0.00 H new ATOM 0 HH21 ARG A 120 12.508 -10.581 -6.201 1.00 0.00 H new ATOM 0 HH22 ARG A 120 13.265 -9.103 -5.598 1.00 0.00 H new ATOM 1865 N LYS A 121 5.795 -9.352 -8.316 1.00 0.00 N ATOM 1866 CA LYS A 121 5.848 -8.843 -9.682 1.00 0.00 C ATOM 1867 C LYS A 121 4.618 -7.998 -9.997 1.00 0.00 C ATOM 1868 O LYS A 121 4.678 -7.073 -10.808 1.00 0.00 O ATOM 1869 CB LYS A 121 5.956 -10.001 -10.677 1.00 0.00 C ATOM 1870 CG LYS A 121 7.388 -10.343 -11.059 1.00 0.00 C ATOM 1871 CD LYS A 121 7.624 -11.845 -11.055 1.00 0.00 C ATOM 1872 CE LYS A 121 7.857 -12.368 -9.647 1.00 0.00 C ATOM 1873 NZ LYS A 121 9.219 -12.035 -9.147 1.00 0.00 N ATOM 0 H LYS A 121 5.845 -10.368 -8.243 1.00 0.00 H new ATOM 0 HA LYS A 121 6.732 -8.212 -9.773 1.00 0.00 H new ATOM 0 HB2 LYS A 121 5.483 -10.884 -10.247 1.00 0.00 H new ATOM 0 HB3 LYS A 121 5.399 -9.748 -11.579 1.00 0.00 H new ATOM 0 HG2 LYS A 121 7.607 -9.942 -12.049 1.00 0.00 H new ATOM 0 HG3 LYS A 121 8.076 -9.864 -10.362 1.00 0.00 H new ATOM 0 HD2 LYS A 121 6.764 -12.351 -11.495 1.00 0.00 H new ATOM 0 HD3 LYS A 121 8.486 -12.081 -11.679 1.00 0.00 H new ATOM 0 HE2 LYS A 121 7.111 -11.945 -8.975 1.00 0.00 H new ATOM 0 HE3 LYS A 121 7.721 -13.449 -9.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 9.714 -12.910 -8.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 9.754 -11.550 -9.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 9.142 -11.413 -8.317 1.00 0.00 H new ATOM 1887 N SER A 122 3.502 -8.321 -9.350 1.00 0.00 N ATOM 1888 CA SER A 122 2.259 -7.589 -9.560 1.00 0.00 C ATOM 1889 C SER A 122 2.373 -6.162 -9.034 1.00 0.00 C ATOM 1890 O SER A 122 1.750 -5.242 -9.564 1.00 0.00 O ATOM 1891 CB SER A 122 1.097 -8.308 -8.870 1.00 0.00 C ATOM 1892 OG SER A 122 -0.151 -7.841 -9.353 1.00 0.00 O ATOM 0 H SER A 122 3.434 -9.084 -8.677 1.00 0.00 H new ATOM 0 HA SER A 122 2.067 -7.548 -10.632 1.00 0.00 H new ATOM 0 HB2 SER A 122 1.177 -9.382 -9.040 1.00 0.00 H new ATOM 0 HB3 SER A 122 1.156 -8.150 -7.793 1.00 0.00 H new ATOM 0 HG SER A 122 -0.037 -6.951 -9.747 1.00 0.00 H new ATOM 1898 N VAL A 123 3.174 -5.986 -7.988 1.00 0.00 N ATOM 1899 CA VAL A 123 3.372 -4.671 -7.390 1.00 0.00 C ATOM 1900 C VAL A 123 4.035 -3.716 -8.376 1.00 0.00 C ATOM 1901 O VAL A 123 5.117 -3.994 -8.893 1.00 0.00 O ATOM 1902 CB VAL A 123 4.234 -4.757 -6.116 1.00 0.00 C ATOM 1903 CG1 VAL A 123 4.299 -3.406 -5.421 1.00 0.00 C ATOM 1904 CG2 VAL A 123 3.694 -5.823 -5.175 1.00 0.00 C ATOM 0 H VAL A 123 3.696 -6.737 -7.537 1.00 0.00 H new ATOM 0 HA VAL A 123 2.385 -4.290 -7.126 1.00 0.00 H new ATOM 0 HB VAL A 123 5.246 -5.040 -6.405 1.00 0.00 H new ATOM 0 HG11 VAL A 123 4.912 -3.488 -4.524 1.00 0.00 H new ATOM 0 HG12 VAL A 123 4.738 -2.671 -6.095 1.00 0.00 H new ATOM 0 HG13 VAL A 123 3.293 -3.090 -5.145 1.00 0.00 H new ATOM 0 HG21 VAL A 123 4.316 -5.868 -4.281 1.00 0.00 H new ATOM 0 HG22 VAL A 123 2.671 -5.575 -4.893 1.00 0.00 H new ATOM 0 HG23 VAL A 123 3.707 -6.791 -5.676 1.00 0.00 H new ATOM 1914 N PHE A 124 3.378 -2.590 -8.634 1.00 0.00 N ATOM 1915 CA PHE A 124 3.906 -1.593 -9.558 1.00 0.00 C ATOM 1916 C PHE A 124 3.373 -0.204 -9.222 1.00 0.00 C ATOM 1917 O PHE A 124 2.164 -0.005 -9.095 1.00 0.00 O ATOM 1918 CB PHE A 124 3.538 -1.957 -10.998 1.00 0.00 C ATOM 1919 CG PHE A 124 4.428 -1.317 -12.025 1.00 0.00 C ATOM 1920 CD1 PHE A 124 4.484 0.062 -12.148 1.00 0.00 C ATOM 1921 CD2 PHE A 124 5.208 -2.093 -12.866 1.00 0.00 C ATOM 1922 CE1 PHE A 124 5.301 0.654 -13.092 1.00 0.00 C ATOM 1923 CE2 PHE A 124 6.027 -1.507 -13.812 1.00 0.00 C ATOM 1924 CZ PHE A 124 6.074 -0.132 -13.925 1.00 0.00 C ATOM 0 H PHE A 124 2.480 -2.345 -8.217 1.00 0.00 H new ATOM 0 HA PHE A 124 4.991 -1.581 -9.459 1.00 0.00 H new ATOM 0 HB2 PHE A 124 3.584 -3.040 -11.113 1.00 0.00 H new ATOM 0 HB3 PHE A 124 2.507 -1.660 -11.187 1.00 0.00 H new ATOM 0 HD1 PHE A 124 3.882 0.681 -11.499 1.00 0.00 H new ATOM 0 HD2 PHE A 124 5.176 -3.169 -12.781 1.00 0.00 H new ATOM 0 HE1 PHE A 124 5.335 1.730 -13.179 1.00 0.00 H new ATOM 0 HE2 PHE A 124 6.630 -2.124 -14.462 1.00 0.00 H new ATOM 0 HZ PHE A 124 6.714 0.329 -14.663 1.00 0.00 H new ATOM 1934 N VAL A 125 4.283 0.754 -9.079 1.00 0.00 N ATOM 1935 CA VAL A 125 3.904 2.125 -8.758 1.00 0.00 C ATOM 1936 C VAL A 125 4.392 3.095 -9.831 1.00 0.00 C ATOM 1937 O VAL A 125 5.592 3.340 -9.962 1.00 0.00 O ATOM 1938 CB VAL A 125 4.462 2.555 -7.386 1.00 0.00 C ATOM 1939 CG1 VAL A 125 5.984 2.526 -7.391 1.00 0.00 C ATOM 1940 CG2 VAL A 125 3.947 3.935 -7.006 1.00 0.00 C ATOM 0 H VAL A 125 5.287 0.606 -9.180 1.00 0.00 H new ATOM 0 HA VAL A 125 2.815 2.155 -8.719 1.00 0.00 H new ATOM 0 HB VAL A 125 4.113 1.845 -6.636 1.00 0.00 H new ATOM 0 HG11 VAL A 125 6.357 2.833 -6.414 1.00 0.00 H new ATOM 0 HG12 VAL A 125 6.328 1.515 -7.610 1.00 0.00 H new ATOM 0 HG13 VAL A 125 6.358 3.209 -8.153 1.00 0.00 H new ATOM 0 HG21 VAL A 125 4.352 4.220 -6.035 1.00 0.00 H new ATOM 0 HG22 VAL A 125 4.261 4.660 -7.757 1.00 0.00 H new ATOM 0 HG23 VAL A 125 2.858 3.915 -6.953 1.00 0.00 H new ATOM 1950 N ASP A 126 3.454 3.639 -10.599 1.00 0.00 N ATOM 1951 CA ASP A 126 3.787 4.581 -11.663 1.00 0.00 C ATOM 1952 C ASP A 126 3.212 5.962 -11.367 1.00 0.00 C ATOM 1953 O ASP A 126 2.241 6.095 -10.623 1.00 0.00 O ATOM 1954 CB ASP A 126 3.259 4.073 -13.005 1.00 0.00 C ATOM 1955 CG ASP A 126 3.827 4.844 -14.180 1.00 0.00 C ATOM 1956 OD1 ASP A 126 3.469 6.030 -14.341 1.00 0.00 O ATOM 1957 OD2 ASP A 126 4.632 4.263 -14.939 1.00 0.00 O ATOM 0 H ASP A 126 2.457 3.444 -10.505 1.00 0.00 H new ATOM 0 HA ASP A 126 4.873 4.663 -11.715 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.507 3.017 -13.113 1.00 0.00 H new ATOM 0 HB3 ASP A 126 2.172 4.148 -13.016 1.00 0.00 H new ATOM 1962 N SER A 127 3.819 6.989 -11.956 1.00 0.00 N ATOM 1963 CA SER A 127 3.366 8.360 -11.756 1.00 0.00 C ATOM 1964 C SER A 127 1.980 8.570 -12.355 1.00 0.00 C ATOM 1965 O SER A 127 1.841 8.811 -13.555 1.00 0.00 O ATOM 1966 CB SER A 127 4.359 9.343 -12.381 1.00 0.00 C ATOM 1967 OG SER A 127 5.696 8.953 -12.121 1.00 0.00 O ATOM 0 H SER A 127 4.625 6.897 -12.575 1.00 0.00 H new ATOM 0 HA SER A 127 3.308 8.544 -10.683 1.00 0.00 H new ATOM 0 HB2 SER A 127 4.195 9.395 -13.457 1.00 0.00 H new ATOM 0 HB3 SER A 127 4.185 10.343 -11.983 1.00 0.00 H new ATOM 0 HG SER A 127 6.310 9.596 -12.532 1.00 0.00 H new ATOM 1973 N GLY A 128 0.956 8.474 -11.514 1.00 0.00 N ATOM 1974 CA GLY A 128 -0.408 8.655 -11.978 1.00 0.00 C ATOM 1975 C GLY A 128 -0.789 7.665 -13.062 1.00 0.00 C ATOM 1976 O GLY A 128 0.012 6.810 -13.435 1.00 0.00 O ATOM 0 H GLY A 128 1.046 8.274 -10.518 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -1.092 8.548 -11.136 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -0.527 9.669 -12.359 1.00 0.00 H new ATOM 1980 N PRO A 129 -2.022 7.756 -13.590 1.00 0.00 N ATOM 1981 CA PRO A 129 -2.501 6.856 -14.639 1.00 0.00 C ATOM 1982 C PRO A 129 -1.973 7.237 -16.019 1.00 0.00 C ATOM 1983 O PRO A 129 -1.553 8.372 -16.241 1.00 0.00 O ATOM 1984 CB PRO A 129 -4.015 7.033 -14.577 1.00 0.00 C ATOM 1985 CG PRO A 129 -4.210 8.436 -14.110 1.00 0.00 C ATOM 1986 CD PRO A 129 -3.047 8.746 -13.202 1.00 0.00 C ATOM 0 HA PRO A 129 -2.167 5.830 -14.486 1.00 0.00 H new ATOM 0 HB2 PRO A 129 -4.473 6.873 -15.553 1.00 0.00 H new ATOM 0 HB3 PRO A 129 -4.470 6.319 -13.890 1.00 0.00 H new ATOM 0 HG2 PRO A 129 -4.239 9.126 -14.953 1.00 0.00 H new ATOM 0 HG3 PRO A 129 -5.156 8.541 -13.579 1.00 0.00 H new ATOM 0 HD2 PRO A 129 -2.691 9.766 -13.343 1.00 0.00 H new ATOM 0 HD3 PRO A 129 -3.322 8.646 -12.152 1.00 0.00 H new ATOM 1994 N SER A 130 -2.000 6.281 -16.942 1.00 0.00 N ATOM 1995 CA SER A 130 -1.525 6.518 -18.300 1.00 0.00 C ATOM 1996 C SER A 130 -0.059 6.939 -18.300 1.00 0.00 C ATOM 1997 O SER A 130 0.262 8.106 -18.071 1.00 0.00 O ATOM 1998 CB SER A 130 -2.376 7.590 -18.981 1.00 0.00 C ATOM 1999 OG SER A 130 -3.509 7.018 -19.612 1.00 0.00 O ATOM 0 H SER A 130 -2.345 5.336 -16.774 1.00 0.00 H new ATOM 0 HA SER A 130 -1.615 5.585 -18.856 1.00 0.00 H new ATOM 0 HB2 SER A 130 -2.699 8.325 -18.244 1.00 0.00 H new ATOM 0 HB3 SER A 130 -1.775 8.122 -19.719 1.00 0.00 H new ATOM 0 HG SER A 130 -4.037 7.725 -20.038 1.00 0.00 H new ATOM 2005 N SER A 131 0.827 5.983 -18.558 1.00 0.00 N ATOM 2006 CA SER A 131 2.260 6.256 -18.588 1.00 0.00 C ATOM 2007 C SER A 131 2.897 5.677 -19.847 1.00 0.00 C ATOM 2008 O SER A 131 3.679 6.346 -20.522 1.00 0.00 O ATOM 2009 CB SER A 131 2.937 5.675 -17.346 1.00 0.00 C ATOM 2010 OG SER A 131 4.220 6.245 -17.150 1.00 0.00 O ATOM 0 H SER A 131 0.579 5.012 -18.749 1.00 0.00 H new ATOM 0 HA SER A 131 2.399 7.337 -18.596 1.00 0.00 H new ATOM 0 HB2 SER A 131 2.316 5.860 -16.470 1.00 0.00 H new ATOM 0 HB3 SER A 131 3.028 4.594 -17.450 1.00 0.00 H new ATOM 0 HG SER A 131 4.353 6.432 -16.197 1.00 0.00 H new ATOM 2016 N GLY A 132 2.556 4.431 -20.157 1.00 0.00 N ATOM 2017 CA GLY A 132 3.104 3.783 -21.334 1.00 0.00 C ATOM 2018 C GLY A 132 3.533 2.355 -21.064 1.00 0.00 C ATOM 0 H GLY A 132 1.910 3.858 -19.614 1.00 0.00 H new ATOM 0 HA2 GLY A 132 2.359 3.791 -22.129 1.00 0.00 H new ATOM 0 HA3 GLY A 132 3.960 4.354 -21.694 1.00 0.00 H new TER 2022 GLY A 132