USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1198 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 117 ASN : amide:sc= -1.5 X(o=-5.7,f=-5.5) USER MOD Set 1.2: A 134 GLN : amide:sc= -4.16 K(o=-5.7,f=-11!) USER MOD Set 2.1: A 128 SER OG : rot -91:sc= 0.172 USER MOD Set 2.2: A 131 GLN : amide:sc= 0.238 K(o=0.41,f=-6.1!) USER MOD Set 3.1: A 108 LYS NZ :NH3+ -159:sc= 0 (180deg=0) USER MOD Set 3.2: A 110 HIS : no HD1:sc= -3.4 K(o=-3.4,f=-7.8!) USER MOD Set 4.1: A 47 HIS : no HE2:sc= -7.26! C(o=-7.8!,f=-11!) USER MOD Set 4.2: A 78 ASN : amide:sc= -0.509 K(o=-7.8,f=-14!) USER MOD Set 5.1: A 72 HIS : no HE2:sc= -2.3 X(o=-6.5,f=-6.9) USER MOD Set 5.2: A 73 ASN : amide:sc= -1.05 X(o=-6.5,f=-6.9) USER MOD Set 5.3: A 140 GLN : amide:sc= -3.18 X(o=-6.5,f=-6.9!) USER MOD Set 6.1: A 71 SER OG : rot -44:sc= 0.0111 USER MOD Set 6.2: A 76 MET CE :methyl -159:sc= -4.25! (180deg=-3.04!) USER MOD Set 7.1: A 24 HIS : no HD1:sc= -5.23! C(o=-13!,f=-21!) USER MOD Set 7.2: A 43 MET CE :methyl 156:sc= -7.56! (180deg=-4.56) USER MOD Set 8.1: A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 8.2: A 3 HIS : no HD1:sc= 0 X(o=0,f=-0.00073) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.383 K(o=-0.38,f=-1.8!) USER MOD Single : A 7 HIS : no HD1:sc= -0.0789 X(o=-0.079,f=-0.2) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -0.474 K(o=-0.47,f=-2.4) USER MOD Single : A 13 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS : no HD1:sc= -1.4 X(o=-1.4,f=-1.8) USER MOD Single : A 27 THR OG1 : rot -4:sc= 0.424 USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 48 LYS NZ :NH3+ 138:sc= -1.17 (180deg=-3.99!) USER MOD Single : A 49 SER OG : rot -80:sc= -3.21! USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -114:sc= -2.74! (180deg=-5.14!) USER MOD Single : A 64 SER OG : rot 159:sc= 0.378 USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.101 USER MOD Single : A 68 SER OG : rot -71:sc= 1.19 USER MOD Single : A 86 LYS NZ :NH3+ 158:sc= -0.19 (180deg=-0.756) USER MOD Single : A 91 SER OG : rot -52:sc= -0.82! USER MOD Single : A 96 TYR OH : rot -122:sc= -1.54 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -5.82! C(o=-5.8!,f=-15!) USER MOD Single : A 119 ASN : amide:sc= -1.12 K(o=-1.1,f=-4.9!) USER MOD Single : A 121 SER OG : rot 50:sc= 0.756 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot -30:sc= -1.02 USER MOD Single : A 126 TYR OH : rot 85:sc= -3.55! USER MOD Single : A 136 MET CE :methyl 173:sc= -7.45! (180deg=-7.83!) USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 144 THR OG1 : rot 180:sc= -0.428 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HD1:sc= -1.23 X(o=-1.2,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.833 -17.929 24.476 1.00 0.00 N ATOM 2 CA MET A 1 -6.614 -16.596 25.094 1.00 0.00 C ATOM 3 C MET A 1 -7.065 -15.475 24.163 1.00 0.00 C ATOM 4 O MET A 1 -6.701 -15.449 22.986 1.00 0.00 O ATOM 5 CB MET A 1 -5.127 -16.446 25.418 1.00 0.00 C ATOM 6 CG MET A 1 -4.856 -15.679 26.702 1.00 0.00 C ATOM 7 SD MET A 1 -3.162 -15.074 26.807 1.00 0.00 S ATOM 8 CE MET A 1 -3.380 -13.370 26.298 1.00 0.00 C ATOM 0 H1 MET A 1 -6.517 -18.672 25.132 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.845 -18.055 24.272 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.290 -17.995 23.591 1.00 0.00 H new ATOM 0 HA MET A 1 -7.207 -16.524 26.006 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.679 -17.437 25.496 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.633 -15.937 24.590 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.543 -14.836 26.768 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.060 -16.325 27.556 1.00 0.00 H new ATOM 0 HE1 MET A 1 -2.417 -12.860 26.312 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.791 -13.341 25.289 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.065 -12.870 26.983 1.00 0.00 H new ATOM 20 N HIS A 2 -7.857 -14.551 24.696 1.00 0.00 N ATOM 21 CA HIS A 2 -8.357 -13.428 23.912 1.00 0.00 C ATOM 22 C HIS A 2 -8.866 -12.314 24.822 1.00 0.00 C ATOM 23 O HIS A 2 -9.525 -12.574 25.829 1.00 0.00 O ATOM 24 CB HIS A 2 -9.473 -13.891 22.973 1.00 0.00 C ATOM 25 CG HIS A 2 -9.135 -13.744 21.522 1.00 0.00 C ATOM 26 ND1 HIS A 2 -8.979 -14.820 20.674 1.00 0.00 N ATOM 27 CD2 HIS A 2 -8.923 -12.639 20.770 1.00 0.00 C ATOM 28 CE1 HIS A 2 -8.683 -14.382 19.461 1.00 0.00 C ATOM 29 NE2 HIS A 2 -8.644 -13.063 19.494 1.00 0.00 N ATOM 0 H HIS A 2 -8.166 -14.558 25.668 1.00 0.00 H new ATOM 0 HA HIS A 2 -7.533 -13.036 23.316 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -9.700 -14.937 23.180 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -10.376 -13.320 23.187 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -8.965 -11.615 21.110 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -8.504 -14.998 18.592 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -8.440 -12.456 18.700 1.00 0.00 H new ATOM 38 N HIS A 3 -8.555 -11.073 24.459 1.00 0.00 N ATOM 39 CA HIS A 3 -8.982 -9.918 25.243 1.00 0.00 C ATOM 40 C HIS A 3 -9.860 -8.990 24.411 1.00 0.00 C ATOM 41 O HIS A 3 -10.972 -8.646 24.812 1.00 0.00 O ATOM 42 CB HIS A 3 -7.764 -9.153 25.765 1.00 0.00 C ATOM 43 CG HIS A 3 -7.066 -9.840 26.897 1.00 0.00 C ATOM 44 ND1 HIS A 3 -7.254 -9.494 28.219 1.00 0.00 N ATOM 45 CD2 HIS A 3 -6.175 -10.861 26.901 1.00 0.00 C ATOM 46 CE1 HIS A 3 -6.510 -10.271 28.987 1.00 0.00 C ATOM 47 NE2 HIS A 3 -5.847 -11.109 28.212 1.00 0.00 N ATOM 0 H HIS A 3 -8.010 -10.841 23.629 1.00 0.00 H new ATOM 0 HA HIS A 3 -9.567 -10.280 26.089 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -7.058 -9.009 24.947 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -8.080 -8.162 26.091 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -5.794 -11.382 26.035 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -6.454 -10.228 30.065 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -5.196 -11.825 28.534 1.00 0.00 H new ATOM 56 N HIS A 4 -9.356 -8.591 23.248 1.00 0.00 N ATOM 57 CA HIS A 4 -10.095 -7.704 22.357 1.00 0.00 C ATOM 58 C HIS A 4 -10.734 -8.489 21.215 1.00 0.00 C ATOM 59 O HIS A 4 -10.223 -9.529 20.803 1.00 0.00 O ATOM 60 CB HIS A 4 -9.169 -6.622 21.798 1.00 0.00 C ATOM 61 CG HIS A 4 -9.368 -5.279 22.430 1.00 0.00 C ATOM 62 ND1 HIS A 4 -10.419 -4.446 22.114 1.00 0.00 N ATOM 63 CD2 HIS A 4 -8.641 -4.625 23.369 1.00 0.00 C ATOM 64 CE1 HIS A 4 -10.331 -3.337 22.828 1.00 0.00 C ATOM 65 NE2 HIS A 4 -9.261 -3.422 23.596 1.00 0.00 N ATOM 0 H HIS A 4 -8.438 -8.868 22.900 1.00 0.00 H new ATOM 0 HA HIS A 4 -10.889 -7.228 22.933 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -8.134 -6.932 21.941 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -9.331 -6.536 20.723 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -7.742 -4.984 23.849 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -11.017 -2.504 22.789 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -8.946 -2.708 24.253 1.00 0.00 H new ATOM 74 N HIS A 5 -11.853 -7.982 20.709 1.00 0.00 N ATOM 75 CA HIS A 5 -12.560 -8.635 19.614 1.00 0.00 C ATOM 76 C HIS A 5 -13.559 -7.682 18.966 1.00 0.00 C ATOM 77 O HIS A 5 -13.603 -7.551 17.743 1.00 0.00 O ATOM 78 CB HIS A 5 -13.282 -9.886 20.122 1.00 0.00 C ATOM 79 CG HIS A 5 -12.955 -11.123 19.342 1.00 0.00 C ATOM 80 ND1 HIS A 5 -12.274 -12.194 19.880 1.00 0.00 N ATOM 81 CD2 HIS A 5 -13.219 -11.456 18.056 1.00 0.00 C ATOM 82 CE1 HIS A 5 -12.133 -13.131 18.961 1.00 0.00 C ATOM 83 NE2 HIS A 5 -12.699 -12.708 17.846 1.00 0.00 N ATOM 0 H HIS A 5 -12.290 -7.121 21.040 1.00 0.00 H new ATOM 0 HA HIS A 5 -11.827 -8.927 18.862 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -13.022 -10.046 21.168 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -14.358 -9.716 20.084 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -13.741 -10.849 17.331 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -11.639 -14.082 19.098 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -12.743 -13.228 16.970 1.00 0.00 H new ATOM 92 N HIS A 6 -14.360 -7.017 19.794 1.00 0.00 N ATOM 93 CA HIS A 6 -15.357 -6.075 19.301 1.00 0.00 C ATOM 94 C HIS A 6 -14.712 -4.745 18.928 1.00 0.00 C ATOM 95 O HIS A 6 -14.201 -4.029 19.790 1.00 0.00 O ATOM 96 CB HIS A 6 -16.443 -5.852 20.355 1.00 0.00 C ATOM 97 CG HIS A 6 -15.909 -5.379 21.672 1.00 0.00 C ATOM 98 ND1 HIS A 6 -15.373 -6.229 22.616 1.00 0.00 N ATOM 99 CD2 HIS A 6 -15.829 -4.134 22.199 1.00 0.00 C ATOM 100 CE1 HIS A 6 -14.987 -5.527 23.668 1.00 0.00 C ATOM 101 NE2 HIS A 6 -15.254 -4.255 23.440 1.00 0.00 N ATOM 0 H HIS A 6 -14.337 -7.114 20.809 1.00 0.00 H new ATOM 0 HA HIS A 6 -15.811 -6.500 18.406 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -17.159 -5.121 19.979 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -16.988 -6.784 20.506 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -16.156 -3.217 21.731 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -14.531 -5.927 24.562 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -15.064 -3.486 24.082 1.00 0.00 H new ATOM 110 N HIS A 7 -14.738 -4.420 17.640 1.00 0.00 N ATOM 111 CA HIS A 7 -14.155 -3.175 17.154 1.00 0.00 C ATOM 112 C HIS A 7 -14.780 -2.763 15.825 1.00 0.00 C ATOM 113 O HIS A 7 -15.125 -3.611 15.001 1.00 0.00 O ATOM 114 CB HIS A 7 -12.641 -3.324 16.996 1.00 0.00 C ATOM 115 CG HIS A 7 -11.869 -2.137 17.482 1.00 0.00 C ATOM 116 ND1 HIS A 7 -12.041 -1.589 18.736 1.00 0.00 N ATOM 117 CD2 HIS A 7 -10.914 -1.391 16.876 1.00 0.00 C ATOM 118 CE1 HIS A 7 -11.228 -0.558 18.879 1.00 0.00 C ATOM 119 NE2 HIS A 7 -10.533 -0.418 17.766 1.00 0.00 N ATOM 0 H HIS A 7 -15.157 -5.001 16.914 1.00 0.00 H new ATOM 0 HA HIS A 7 -14.361 -2.396 17.888 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -12.312 -4.209 17.541 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -12.408 -3.493 15.945 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -10.525 -1.535 15.879 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -11.146 0.065 19.758 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -9.827 0.298 17.595 1.00 0.00 H new ATOM 128 N MET A 8 -14.924 -1.458 15.622 1.00 0.00 N ATOM 129 CA MET A 8 -15.508 -0.934 14.391 1.00 0.00 C ATOM 130 C MET A 8 -14.664 0.206 13.831 1.00 0.00 C ATOM 131 O MET A 8 -13.815 0.763 14.527 1.00 0.00 O ATOM 132 CB MET A 8 -16.937 -0.449 14.648 1.00 0.00 C ATOM 133 CG MET A 8 -17.991 -1.519 14.413 1.00 0.00 C ATOM 134 SD MET A 8 -19.029 -1.809 15.859 1.00 0.00 S ATOM 135 CE MET A 8 -20.072 -0.354 15.825 1.00 0.00 C ATOM 0 H MET A 8 -14.645 -0.743 16.294 1.00 0.00 H new ATOM 0 HA MET A 8 -15.531 -1.739 13.656 1.00 0.00 H new ATOM 0 HB2 MET A 8 -17.013 -0.095 15.676 1.00 0.00 H new ATOM 0 HB3 MET A 8 -17.145 0.403 14.001 1.00 0.00 H new ATOM 0 HG2 MET A 8 -18.620 -1.224 13.573 1.00 0.00 H new ATOM 0 HG3 MET A 8 -17.500 -2.450 14.132 1.00 0.00 H new ATOM 0 HE1 MET A 8 -20.771 -0.388 16.661 1.00 0.00 H new ATOM 0 HE2 MET A 8 -19.453 0.539 15.905 1.00 0.00 H new ATOM 0 HE3 MET A 8 -20.628 -0.327 14.888 1.00 0.00 H new ATOM 145 N SER A 9 -14.904 0.547 12.569 1.00 0.00 N ATOM 146 CA SER A 9 -14.167 1.621 11.914 1.00 0.00 C ATOM 147 C SER A 9 -14.933 2.149 10.706 1.00 0.00 C ATOM 148 O SER A 9 -15.692 1.416 10.071 1.00 0.00 O ATOM 149 CB SER A 9 -12.784 1.127 11.481 1.00 0.00 C ATOM 150 OG SER A 9 -11.802 2.132 11.670 1.00 0.00 O ATOM 0 H SER A 9 -15.603 0.095 11.980 1.00 0.00 H new ATOM 0 HA SER A 9 -14.048 2.435 12.629 1.00 0.00 H new ATOM 0 HB2 SER A 9 -12.516 0.239 12.054 1.00 0.00 H new ATOM 0 HB3 SER A 9 -12.811 0.833 10.432 1.00 0.00 H new ATOM 0 HG SER A 9 -10.927 1.792 11.388 1.00 0.00 H new ATOM 156 N ASP A 10 -14.729 3.424 10.393 1.00 0.00 N ATOM 157 CA ASP A 10 -15.400 4.050 9.260 1.00 0.00 C ATOM 158 C ASP A 10 -14.415 4.328 8.130 1.00 0.00 C ATOM 159 O ASP A 10 -13.203 4.356 8.342 1.00 0.00 O ATOM 160 CB ASP A 10 -16.074 5.353 9.697 1.00 0.00 C ATOM 161 CG ASP A 10 -15.108 6.306 10.373 1.00 0.00 C ATOM 162 OD1 ASP A 10 -14.799 6.091 11.564 1.00 0.00 O ATOM 163 OD2 ASP A 10 -14.661 7.266 9.711 1.00 0.00 O ATOM 0 H ASP A 10 -14.104 4.044 10.908 1.00 0.00 H new ATOM 0 HA ASP A 10 -16.160 3.360 8.893 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -16.513 5.841 8.827 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -16.892 5.124 10.380 1.00 0.00 H new ATOM 168 N GLY A 11 -14.944 4.535 6.928 1.00 0.00 N ATOM 169 CA GLY A 11 -14.099 4.807 5.781 1.00 0.00 C ATOM 170 C GLY A 11 -14.579 5.999 4.977 1.00 0.00 C ATOM 171 O GLY A 11 -15.243 6.889 5.508 1.00 0.00 O ATOM 0 H GLY A 11 -15.944 4.519 6.728 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -13.079 4.988 6.120 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -14.070 3.927 5.138 1.00 0.00 H new ATOM 175 N HIS A 12 -14.241 6.016 3.691 1.00 0.00 N ATOM 176 CA HIS A 12 -14.642 7.108 2.810 1.00 0.00 C ATOM 177 C HIS A 12 -14.797 6.620 1.374 1.00 0.00 C ATOM 178 O HIS A 12 -14.323 5.541 1.021 1.00 0.00 O ATOM 179 CB HIS A 12 -13.618 8.241 2.869 1.00 0.00 C ATOM 180 CG HIS A 12 -13.846 9.196 3.999 1.00 0.00 C ATOM 181 ND1 HIS A 12 -13.405 8.960 5.284 1.00 0.00 N ATOM 182 CD2 HIS A 12 -14.473 10.396 4.034 1.00 0.00 C ATOM 183 CE1 HIS A 12 -13.752 9.973 6.059 1.00 0.00 C ATOM 184 NE2 HIS A 12 -14.400 10.856 5.324 1.00 0.00 N ATOM 0 H HIS A 12 -13.691 5.287 3.236 1.00 0.00 H new ATOM 0 HA HIS A 12 -15.607 7.482 3.153 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -12.620 7.813 2.962 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -13.643 8.791 1.928 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -14.943 10.897 3.201 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -13.541 10.062 7.114 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -14.785 11.739 5.661 1.00 0.00 H new ATOM 193 N ASN A 13 -15.463 7.422 0.549 1.00 0.00 N ATOM 194 CA ASN A 13 -15.677 7.072 -0.850 1.00 0.00 C ATOM 195 C ASN A 13 -14.478 7.474 -1.702 1.00 0.00 C ATOM 196 O ASN A 13 -13.547 8.117 -1.218 1.00 0.00 O ATOM 197 CB ASN A 13 -16.943 7.749 -1.379 1.00 0.00 C ATOM 198 CG ASN A 13 -18.191 7.297 -0.645 1.00 0.00 C ATOM 199 OD1 ASN A 13 -18.777 6.266 -0.971 1.00 0.00 O ATOM 200 ND2 ASN A 13 -18.602 8.069 0.353 1.00 0.00 N ATOM 0 H ASN A 13 -15.864 8.318 0.826 1.00 0.00 H new ATOM 0 HA ASN A 13 -15.798 5.991 -0.913 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -16.840 8.830 -1.284 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -17.051 7.531 -2.442 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -19.435 7.815 0.884 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -18.085 8.916 0.589 1.00 0.00 H new ATOM 207 N GLY A 14 -14.506 7.088 -2.974 1.00 0.00 N ATOM 208 CA GLY A 14 -13.415 7.418 -3.873 1.00 0.00 C ATOM 209 C GLY A 14 -12.251 6.456 -3.745 1.00 0.00 C ATOM 210 O GLY A 14 -12.387 5.266 -4.029 1.00 0.00 O ATOM 0 H GLY A 14 -15.264 6.553 -3.398 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -13.779 7.409 -4.900 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -13.070 8.431 -3.665 1.00 0.00 H new ATOM 214 N LEU A 15 -11.103 6.972 -3.315 1.00 0.00 N ATOM 215 CA LEU A 15 -9.910 6.151 -3.147 1.00 0.00 C ATOM 216 C LEU A 15 -9.460 5.563 -4.482 1.00 0.00 C ATOM 217 O LEU A 15 -10.210 4.840 -5.137 1.00 0.00 O ATOM 218 CB LEU A 15 -10.177 5.021 -2.147 1.00 0.00 C ATOM 219 CG LEU A 15 -9.771 5.321 -0.704 1.00 0.00 C ATOM 220 CD1 LEU A 15 -10.793 6.230 -0.040 1.00 0.00 C ATOM 221 CD2 LEU A 15 -9.611 4.026 0.082 1.00 0.00 C ATOM 0 H LEU A 15 -10.975 7.955 -3.077 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.114 6.789 -2.763 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.241 4.784 -2.167 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -9.645 4.130 -2.480 1.00 0.00 H new ATOM 0 HG LEU A 15 -8.811 5.838 -0.714 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -10.487 6.433 0.986 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -10.858 7.168 -0.591 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.768 5.742 -0.039 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -9.322 4.256 1.107 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -10.556 3.483 0.085 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -8.840 3.411 -0.383 1.00 0.00 H new ATOM 233 N GLY A 16 -8.224 5.869 -4.875 1.00 0.00 N ATOM 234 CA GLY A 16 -7.690 5.357 -6.118 1.00 0.00 C ATOM 235 C GLY A 16 -8.658 5.484 -7.279 1.00 0.00 C ATOM 236 O GLY A 16 -8.956 4.506 -7.962 1.00 0.00 O ATOM 0 H GLY A 16 -7.585 6.465 -4.349 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.771 5.891 -6.359 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.424 4.308 -5.988 1.00 0.00 H new ATOM 240 N LYS A 17 -9.143 6.703 -7.501 1.00 0.00 N ATOM 241 CA LYS A 17 -10.078 6.974 -8.588 1.00 0.00 C ATOM 242 C LYS A 17 -9.600 8.156 -9.424 1.00 0.00 C ATOM 243 O LYS A 17 -9.072 9.131 -8.890 1.00 0.00 O ATOM 244 CB LYS A 17 -11.475 7.256 -8.031 1.00 0.00 C ATOM 245 CG LYS A 17 -12.599 6.826 -8.962 1.00 0.00 C ATOM 246 CD LYS A 17 -13.008 5.382 -8.713 1.00 0.00 C ATOM 247 CE LYS A 17 -14.476 5.275 -8.332 1.00 0.00 C ATOM 248 NZ LYS A 17 -14.985 3.882 -8.470 1.00 0.00 N ATOM 0 H LYS A 17 -8.903 7.521 -6.940 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.125 6.092 -9.227 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.588 6.741 -7.077 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.569 8.323 -7.830 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -13.460 7.479 -8.820 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.279 6.941 -9.998 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -12.820 4.790 -9.609 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -12.393 4.961 -7.918 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -14.610 5.610 -7.303 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -15.064 5.941 -8.963 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -15.989 3.851 -8.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -14.881 3.571 -9.457 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -14.441 3.250 -7.849 1.00 0.00 H new ATOM 262 N GLY A 18 -9.784 8.062 -10.735 1.00 0.00 N ATOM 263 CA GLY A 18 -9.360 9.132 -11.620 1.00 0.00 C ATOM 264 C GLY A 18 -8.127 8.757 -12.417 1.00 0.00 C ATOM 265 O GLY A 18 -8.059 9.000 -13.623 1.00 0.00 O ATOM 0 H GLY A 18 -10.218 7.266 -11.201 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -10.172 9.379 -12.304 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -9.154 10.027 -11.033 1.00 0.00 H new ATOM 269 N PHE A 19 -7.152 8.159 -11.742 1.00 0.00 N ATOM 270 CA PHE A 19 -5.915 7.740 -12.391 1.00 0.00 C ATOM 271 C PHE A 19 -5.896 6.228 -12.591 1.00 0.00 C ATOM 272 O PHE A 19 -5.249 5.720 -13.507 1.00 0.00 O ATOM 273 CB PHE A 19 -4.697 8.175 -11.569 1.00 0.00 C ATOM 274 CG PHE A 19 -4.897 8.061 -10.083 1.00 0.00 C ATOM 275 CD1 PHE A 19 -5.028 6.820 -9.480 1.00 0.00 C ATOM 276 CD2 PHE A 19 -4.952 9.196 -9.290 1.00 0.00 C ATOM 277 CE1 PHE A 19 -5.210 6.714 -8.116 1.00 0.00 C ATOM 278 CE2 PHE A 19 -5.134 9.096 -7.924 1.00 0.00 C ATOM 279 CZ PHE A 19 -5.263 7.853 -7.336 1.00 0.00 C ATOM 0 H PHE A 19 -7.194 7.953 -10.744 1.00 0.00 H new ATOM 0 HA PHE A 19 -5.868 8.222 -13.367 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -3.839 7.568 -11.859 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -4.454 9.209 -11.816 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -4.987 5.926 -10.084 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.851 10.170 -9.745 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -5.311 5.741 -7.659 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -5.175 9.988 -7.317 1.00 0.00 H new ATOM 0 HZ PHE A 19 -5.405 7.772 -6.268 1.00 0.00 H new ATOM 289 N GLY A 20 -6.615 5.514 -11.730 1.00 0.00 N ATOM 290 CA GLY A 20 -6.674 4.068 -11.830 1.00 0.00 C ATOM 291 C GLY A 20 -8.103 3.551 -11.818 1.00 0.00 C ATOM 292 O GLY A 20 -8.845 3.735 -12.783 1.00 0.00 O ATOM 0 H GLY A 20 -7.158 5.912 -10.964 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -6.181 3.748 -12.748 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -6.122 3.625 -11.001 1.00 0.00 H new ATOM 296 N ASP A 21 -8.491 2.907 -10.715 1.00 0.00 N ATOM 297 CA ASP A 21 -9.842 2.363 -10.563 1.00 0.00 C ATOM 298 C ASP A 21 -9.919 1.448 -9.338 1.00 0.00 C ATOM 299 O ASP A 21 -10.264 1.890 -8.244 1.00 0.00 O ATOM 300 CB ASP A 21 -10.267 1.601 -11.824 1.00 0.00 C ATOM 301 CG ASP A 21 -11.238 2.394 -12.678 1.00 0.00 C ATOM 302 OD1 ASP A 21 -12.266 2.852 -12.136 1.00 0.00 O ATOM 303 OD2 ASP A 21 -10.971 2.556 -13.887 1.00 0.00 O ATOM 0 H ASP A 21 -7.885 2.749 -9.910 1.00 0.00 H new ATOM 0 HA ASP A 21 -10.529 3.197 -10.418 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -9.383 1.358 -12.414 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -10.728 0.656 -11.536 1.00 0.00 H new ATOM 308 N HIS A 22 -9.577 0.175 -9.528 1.00 0.00 N ATOM 309 CA HIS A 22 -9.588 -0.802 -8.442 1.00 0.00 C ATOM 310 C HIS A 22 -8.287 -1.596 -8.458 1.00 0.00 C ATOM 311 O HIS A 22 -8.206 -2.660 -9.071 1.00 0.00 O ATOM 312 CB HIS A 22 -10.784 -1.746 -8.581 1.00 0.00 C ATOM 313 CG HIS A 22 -10.904 -2.363 -9.940 1.00 0.00 C ATOM 314 ND1 HIS A 22 -11.521 -1.735 -11.002 1.00 0.00 N ATOM 315 CD2 HIS A 22 -10.484 -3.563 -10.408 1.00 0.00 C ATOM 316 CE1 HIS A 22 -11.475 -2.521 -12.063 1.00 0.00 C ATOM 317 NE2 HIS A 22 -10.851 -3.634 -11.729 1.00 0.00 N ATOM 0 H HIS A 22 -9.287 -0.205 -10.429 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.677 -0.275 -7.492 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.700 -2.538 -7.837 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.698 -1.196 -8.358 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -9.959 -4.322 -9.847 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -11.879 -2.291 -13.038 1.00 0.00 H new ATOM 0 HE2 HIS A 22 -10.670 -4.421 -12.352 1.00 0.00 H new ATOM 326 N ILE A 23 -7.264 -1.048 -7.813 1.00 0.00 N ATOM 327 CA ILE A 23 -5.952 -1.676 -7.784 1.00 0.00 C ATOM 328 C ILE A 23 -5.223 -1.432 -6.457 1.00 0.00 C ATOM 329 O ILE A 23 -5.283 -2.253 -5.532 1.00 0.00 O ATOM 330 CB ILE A 23 -5.089 -1.119 -8.933 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.686 -1.484 -10.289 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.658 -1.604 -8.819 1.00 0.00 C ATOM 333 CD1 ILE A 23 -6.427 -0.333 -10.931 1.00 0.00 C ATOM 0 H ILE A 23 -7.320 -0.167 -7.302 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.103 -2.750 -7.897 1.00 0.00 H new ATOM 0 HB ILE A 23 -5.081 -0.032 -8.853 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.889 -1.814 -10.955 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.367 -2.326 -10.166 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -3.069 -1.197 -9.641 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.235 -1.271 -7.871 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.638 -2.693 -8.863 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -6.830 -0.651 -11.893 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -7.244 -0.019 -10.281 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.742 0.501 -11.082 1.00 0.00 H new ATOM 345 N HIS A 24 -4.516 -0.300 -6.381 1.00 0.00 N ATOM 346 CA HIS A 24 -3.758 0.060 -5.194 1.00 0.00 C ATOM 347 C HIS A 24 -4.663 0.693 -4.152 1.00 0.00 C ATOM 348 O HIS A 24 -4.248 1.577 -3.404 1.00 0.00 O ATOM 349 CB HIS A 24 -2.629 1.026 -5.566 1.00 0.00 C ATOM 350 CG HIS A 24 -1.324 0.358 -5.867 1.00 0.00 C ATOM 351 ND1 HIS A 24 -1.078 -0.326 -7.039 1.00 0.00 N ATOM 352 CD2 HIS A 24 -0.180 0.284 -5.146 1.00 0.00 C ATOM 353 CE1 HIS A 24 0.158 -0.791 -7.026 1.00 0.00 C ATOM 354 NE2 HIS A 24 0.725 -0.434 -5.889 1.00 0.00 N ATOM 0 H HIS A 24 -4.457 0.382 -7.137 1.00 0.00 H new ATOM 0 HA HIS A 24 -3.327 -0.847 -4.771 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -2.936 1.608 -6.435 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.484 1.730 -4.747 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -0.011 0.710 -4.168 1.00 0.00 H new ATOM 0 HE1 HIS A 24 0.625 -1.366 -7.812 1.00 0.00 H new ATOM 0 HE2 HIS A 24 1.680 -0.655 -5.608 1.00 0.00 H new ATOM 363 N TRP A 25 -5.909 0.256 -4.139 1.00 0.00 N ATOM 364 CA TRP A 25 -6.898 0.796 -3.227 1.00 0.00 C ATOM 365 C TRP A 25 -8.067 -0.159 -3.078 1.00 0.00 C ATOM 366 O TRP A 25 -9.162 0.236 -2.678 1.00 0.00 O ATOM 367 CB TRP A 25 -7.376 2.122 -3.781 1.00 0.00 C ATOM 368 CG TRP A 25 -7.126 2.225 -5.250 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.950 1.805 -6.242 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.959 2.753 -5.898 1.00 0.00 C ATOM 371 NE1 TRP A 25 -7.370 2.035 -7.459 1.00 0.00 N ATOM 372 CE2 TRP A 25 -6.159 2.625 -7.278 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.772 3.326 -5.451 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -5.222 3.046 -8.215 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.841 3.745 -6.376 1.00 0.00 C ATOM 376 CH2 TRP A 25 -4.070 3.605 -7.747 1.00 0.00 C ATOM 0 H TRP A 25 -6.261 -0.477 -4.755 1.00 0.00 H new ATOM 0 HA TRP A 25 -6.454 0.935 -2.241 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.442 2.237 -3.584 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -6.867 2.937 -3.266 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.921 1.355 -6.093 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -7.782 1.800 -8.362 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.583 3.441 -4.394 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -5.400 2.934 -9.274 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.918 4.190 -6.035 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -3.322 3.945 -8.448 1.00 0.00 H new ATOM 387 N ARG A 26 -7.825 -1.420 -3.409 1.00 0.00 N ATOM 388 CA ARG A 26 -8.852 -2.443 -3.320 1.00 0.00 C ATOM 389 C ARG A 26 -9.573 -2.359 -1.974 1.00 0.00 C ATOM 390 O ARG A 26 -10.751 -2.696 -1.866 1.00 0.00 O ATOM 391 CB ARG A 26 -8.234 -3.832 -3.498 1.00 0.00 C ATOM 392 CG ARG A 26 -9.242 -4.910 -3.859 1.00 0.00 C ATOM 393 CD ARG A 26 -9.762 -4.733 -5.275 1.00 0.00 C ATOM 394 NE ARG A 26 -11.024 -5.436 -5.488 1.00 0.00 N ATOM 395 CZ ARG A 26 -11.505 -5.748 -6.690 1.00 0.00 C ATOM 396 NH1 ARG A 26 -10.832 -5.425 -7.787 1.00 0.00 N ATOM 397 NH2 ARG A 26 -12.663 -6.387 -6.795 1.00 0.00 N ATOM 0 H ARG A 26 -6.922 -1.758 -3.743 1.00 0.00 H new ATOM 0 HA ARG A 26 -9.577 -2.275 -4.117 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -7.473 -3.784 -4.277 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -7.728 -4.115 -2.575 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -8.778 -5.891 -3.761 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -10.076 -4.880 -3.158 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -9.900 -3.671 -5.480 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -9.019 -5.101 -5.982 1.00 0.00 H new ATOM 0 HE ARG A 26 -11.569 -5.704 -4.668 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -9.941 -4.935 -7.713 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -11.206 -5.667 -8.705 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -13.184 -6.639 -5.955 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -13.032 -6.626 -7.715 1.00 0.00 H new ATOM 411 N THR A 27 -8.845 -1.894 -0.956 1.00 0.00 N ATOM 412 CA THR A 27 -9.392 -1.742 0.392 1.00 0.00 C ATOM 413 C THR A 27 -9.444 -3.077 1.127 1.00 0.00 C ATOM 414 O THR A 27 -9.362 -4.140 0.514 1.00 0.00 O ATOM 415 CB THR A 27 -10.792 -1.121 0.344 1.00 0.00 C ATOM 416 OG1 THR A 27 -10.849 -0.089 -0.624 1.00 0.00 O ATOM 417 CG2 THR A 27 -11.230 -0.532 1.667 1.00 0.00 C ATOM 0 H THR A 27 -7.868 -1.615 -1.042 1.00 0.00 H new ATOM 0 HA THR A 27 -8.726 -1.075 0.939 1.00 0.00 H new ATOM 0 HB THR A 27 -11.463 -1.941 0.088 1.00 0.00 H new ATOM 0 HG1 THR A 27 -9.959 0.045 -1.012 1.00 0.00 H new ATOM 0 HG21 THR A 27 -12.229 -0.109 1.564 1.00 0.00 H new ATOM 0 HG22 THR A 27 -11.243 -1.314 2.427 1.00 0.00 H new ATOM 0 HG23 THR A 27 -10.533 0.252 1.965 1.00 0.00 H new ATOM 425 N LEU A 28 -9.579 -3.008 2.450 1.00 0.00 N ATOM 426 CA LEU A 28 -9.643 -4.205 3.277 1.00 0.00 C ATOM 427 C LEU A 28 -10.916 -4.995 2.993 1.00 0.00 C ATOM 428 O LEU A 28 -10.951 -6.214 3.157 1.00 0.00 O ATOM 429 CB LEU A 28 -9.580 -3.833 4.760 1.00 0.00 C ATOM 430 CG LEU A 28 -8.166 -3.677 5.328 1.00 0.00 C ATOM 431 CD1 LEU A 28 -7.863 -2.216 5.622 1.00 0.00 C ATOM 432 CD2 LEU A 28 -7.999 -4.519 6.585 1.00 0.00 C ATOM 0 H LEU A 28 -9.646 -2.133 2.970 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.785 -4.831 3.031 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -10.120 -2.898 4.908 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.104 -4.598 5.334 1.00 0.00 H new ATOM 0 HG LEU A 28 -7.457 -4.030 4.579 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -6.854 -2.128 6.025 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -7.939 -1.636 4.702 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -8.579 -1.835 6.350 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -6.988 -4.395 6.974 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.719 -4.197 7.337 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -8.170 -5.569 6.345 1.00 0.00 H new ATOM 444 N GLU A 29 -11.963 -4.296 2.563 1.00 0.00 N ATOM 445 CA GLU A 29 -13.235 -4.940 2.253 1.00 0.00 C ATOM 446 C GLU A 29 -13.027 -6.117 1.304 1.00 0.00 C ATOM 447 O GLU A 29 -13.167 -7.276 1.695 1.00 0.00 O ATOM 448 CB GLU A 29 -14.204 -3.928 1.635 1.00 0.00 C ATOM 449 CG GLU A 29 -15.553 -3.877 2.333 1.00 0.00 C ATOM 450 CD GLU A 29 -16.323 -5.176 2.208 1.00 0.00 C ATOM 451 OE1 GLU A 29 -15.765 -6.235 2.567 1.00 0.00 O ATOM 452 OE2 GLU A 29 -17.486 -5.136 1.751 1.00 0.00 O ATOM 0 H GLU A 29 -11.955 -3.286 2.422 1.00 0.00 H new ATOM 0 HA GLU A 29 -13.664 -5.318 3.181 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -13.750 -2.937 1.665 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.356 -4.177 0.585 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -15.404 -3.648 3.388 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -16.146 -3.065 1.911 1.00 0.00 H new ATOM 459 N ASP A 30 -12.686 -5.810 0.058 1.00 0.00 N ATOM 460 CA ASP A 30 -12.451 -6.840 -0.947 1.00 0.00 C ATOM 461 C ASP A 30 -11.004 -7.321 -0.900 1.00 0.00 C ATOM 462 O ASP A 30 -10.710 -8.472 -1.224 1.00 0.00 O ATOM 463 CB ASP A 30 -12.773 -6.301 -2.341 1.00 0.00 C ATOM 464 CG ASP A 30 -13.220 -7.393 -3.292 1.00 0.00 C ATOM 465 OD1 ASP A 30 -12.472 -8.381 -3.456 1.00 0.00 O ATOM 466 OD2 ASP A 30 -14.317 -7.263 -3.875 1.00 0.00 O ATOM 0 H ASP A 30 -12.566 -4.855 -0.281 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.106 -7.684 -0.729 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.556 -5.547 -2.264 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -11.892 -5.806 -2.749 1.00 0.00 H new ATOM 471 N GLY A 31 -10.104 -6.431 -0.497 1.00 0.00 N ATOM 472 CA GLY A 31 -8.697 -6.777 -0.416 1.00 0.00 C ATOM 473 C GLY A 31 -8.403 -7.785 0.679 1.00 0.00 C ATOM 474 O GLY A 31 -7.700 -8.768 0.451 1.00 0.00 O ATOM 0 H GLY A 31 -10.325 -5.473 -0.224 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.371 -7.182 -1.374 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.115 -5.873 -0.238 1.00 0.00 H new ATOM 478 N LYS A 32 -8.938 -7.539 1.871 1.00 0.00 N ATOM 479 CA LYS A 32 -8.724 -8.433 3.004 1.00 0.00 C ATOM 480 C LYS A 32 -9.585 -9.685 2.885 1.00 0.00 C ATOM 481 O LYS A 32 -9.160 -10.780 3.254 1.00 0.00 O ATOM 482 CB LYS A 32 -9.030 -7.712 4.318 1.00 0.00 C ATOM 483 CG LYS A 32 -8.249 -8.254 5.506 1.00 0.00 C ATOM 484 CD LYS A 32 -8.976 -9.412 6.172 1.00 0.00 C ATOM 485 CE LYS A 32 -9.231 -9.141 7.646 1.00 0.00 C ATOM 486 NZ LYS A 32 -10.593 -9.577 8.063 1.00 0.00 N ATOM 0 H LYS A 32 -9.522 -6.729 2.077 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.677 -8.735 2.999 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -8.808 -6.651 4.201 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.097 -7.793 4.527 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -7.264 -8.584 5.175 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.091 -7.457 6.232 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.925 -9.587 5.664 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -8.386 -10.322 6.066 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -8.484 -9.661 8.245 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -9.114 -8.076 7.845 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -10.728 -9.375 9.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.307 -9.062 7.509 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -10.696 -10.598 7.897 1.00 0.00 H new ATOM 500 N LYS A 33 -10.800 -9.519 2.368 1.00 0.00 N ATOM 501 CA LYS A 33 -11.720 -10.641 2.202 1.00 0.00 C ATOM 502 C LYS A 33 -11.081 -11.753 1.376 1.00 0.00 C ATOM 503 O LYS A 33 -11.316 -12.935 1.624 1.00 0.00 O ATOM 504 CB LYS A 33 -13.016 -10.171 1.538 1.00 0.00 C ATOM 505 CG LYS A 33 -14.028 -11.284 1.314 1.00 0.00 C ATOM 506 CD LYS A 33 -14.855 -11.039 0.062 1.00 0.00 C ATOM 507 CE LYS A 33 -15.146 -12.335 -0.677 1.00 0.00 C ATOM 508 NZ LYS A 33 -15.055 -12.166 -2.153 1.00 0.00 N ATOM 0 H LYS A 33 -11.170 -8.620 2.057 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.952 -11.038 3.190 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.471 -9.398 2.157 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.776 -9.712 0.579 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -13.508 -12.238 1.227 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -14.687 -11.357 2.179 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.793 -10.555 0.334 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.323 -10.354 -0.598 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -14.441 -13.102 -0.356 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -16.143 -12.687 -0.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -15.260 -13.073 -2.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -15.745 -11.453 -2.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -14.096 -11.855 -2.408 1.00 0.00 H new ATOM 522 N GLU A 34 -10.274 -11.367 0.394 1.00 0.00 N ATOM 523 CA GLU A 34 -9.604 -12.335 -0.465 1.00 0.00 C ATOM 524 C GLU A 34 -8.173 -12.580 -0.001 1.00 0.00 C ATOM 525 O GLU A 34 -7.687 -13.710 -0.031 1.00 0.00 O ATOM 526 CB GLU A 34 -9.604 -11.852 -1.916 1.00 0.00 C ATOM 527 CG GLU A 34 -9.251 -12.945 -2.909 1.00 0.00 C ATOM 528 CD GLU A 34 -10.251 -13.045 -4.046 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.422 -12.046 -4.775 1.00 0.00 O ATOM 530 OE2 GLU A 34 -10.860 -14.124 -4.207 1.00 0.00 O ATOM 0 H GLU A 34 -10.068 -10.393 0.174 1.00 0.00 H new ATOM 0 HA GLU A 34 -10.153 -13.274 -0.402 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.589 -11.453 -2.159 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.893 -11.032 -2.020 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -8.259 -12.753 -3.318 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -9.201 -13.901 -2.389 1.00 0.00 H new ATOM 537 N ALA A 35 -7.503 -11.516 0.434 1.00 0.00 N ATOM 538 CA ALA A 35 -6.129 -11.621 0.908 1.00 0.00 C ATOM 539 C ALA A 35 -6.012 -12.671 2.005 1.00 0.00 C ATOM 540 O ALA A 35 -4.994 -13.353 2.124 1.00 0.00 O ATOM 541 CB ALA A 35 -5.638 -10.273 1.415 1.00 0.00 C ATOM 0 H ALA A 35 -7.890 -10.573 0.467 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.504 -11.930 0.070 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.610 -10.368 1.765 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.679 -9.543 0.606 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.272 -9.940 2.237 1.00 0.00 H new ATOM 547 N ALA A 36 -7.069 -12.794 2.800 1.00 0.00 N ATOM 548 CA ALA A 36 -7.102 -13.757 3.889 1.00 0.00 C ATOM 549 C ALA A 36 -7.108 -15.187 3.355 1.00 0.00 C ATOM 550 O ALA A 36 -6.520 -16.087 3.954 1.00 0.00 O ATOM 551 CB ALA A 36 -8.320 -13.510 4.766 1.00 0.00 C ATOM 0 H ALA A 36 -7.917 -12.235 2.708 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.202 -13.628 4.490 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.336 -14.236 5.579 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.272 -12.503 5.180 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.226 -13.614 4.168 1.00 0.00 H new ATOM 557 N ALA A 37 -7.775 -15.385 2.220 1.00 0.00 N ATOM 558 CA ALA A 37 -7.854 -16.704 1.605 1.00 0.00 C ATOM 559 C ALA A 37 -6.470 -17.207 1.209 1.00 0.00 C ATOM 560 O ALA A 37 -5.869 -18.018 1.912 1.00 0.00 O ATOM 561 CB ALA A 37 -8.774 -16.666 0.392 1.00 0.00 C ATOM 0 H ALA A 37 -8.266 -14.650 1.711 1.00 0.00 H new ATOM 0 HA ALA A 37 -8.267 -17.397 2.338 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.824 -17.658 -0.058 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.772 -16.357 0.702 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.385 -15.956 -0.338 1.00 0.00 H new ATOM 567 N SER A 38 -5.964 -16.712 0.082 1.00 0.00 N ATOM 568 CA SER A 38 -4.646 -17.107 -0.400 1.00 0.00 C ATOM 569 C SER A 38 -3.567 -16.701 0.598 1.00 0.00 C ATOM 570 O SER A 38 -2.539 -17.365 0.721 1.00 0.00 O ATOM 571 CB SER A 38 -4.365 -16.468 -1.762 1.00 0.00 C ATOM 572 OG SER A 38 -4.763 -17.327 -2.818 1.00 0.00 O ATOM 0 H SER A 38 -6.447 -16.038 -0.512 1.00 0.00 H new ATOM 0 HA SER A 38 -4.631 -18.192 -0.508 1.00 0.00 H new ATOM 0 HB2 SER A 38 -4.897 -15.520 -1.840 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.302 -16.245 -1.851 1.00 0.00 H new ATOM 0 HG SER A 38 -4.575 -16.897 -3.678 1.00 0.00 H new ATOM 578 N GLY A 39 -3.812 -15.605 1.308 1.00 0.00 N ATOM 579 CA GLY A 39 -2.859 -15.127 2.291 1.00 0.00 C ATOM 580 C GLY A 39 -1.833 -14.182 1.696 1.00 0.00 C ATOM 581 O GLY A 39 -0.685 -14.146 2.138 1.00 0.00 O ATOM 0 H GLY A 39 -4.656 -15.038 1.220 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.394 -14.619 3.093 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.347 -15.978 2.739 1.00 0.00 H new ATOM 585 N LEU A 40 -2.246 -13.409 0.695 1.00 0.00 N ATOM 586 CA LEU A 40 -1.344 -12.457 0.056 1.00 0.00 C ATOM 587 C LEU A 40 -1.245 -11.181 0.886 1.00 0.00 C ATOM 588 O LEU A 40 -2.163 -10.842 1.633 1.00 0.00 O ATOM 589 CB LEU A 40 -1.808 -12.135 -1.373 1.00 0.00 C ATOM 590 CG LEU A 40 -3.248 -11.628 -1.505 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.366 -10.210 -0.969 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.709 -11.694 -2.955 1.00 0.00 C ATOM 0 H LEU A 40 -3.191 -13.423 0.312 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.355 -12.912 -0.004 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.138 -11.384 -1.793 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.701 -13.033 -1.981 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.895 -12.274 -0.911 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.396 -9.867 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.081 -10.194 0.083 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.706 -9.551 -1.534 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.734 -11.330 -3.028 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -3.059 -11.074 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.665 -12.726 -3.304 1.00 0.00 H new ATOM 604 N PRO A 41 -0.118 -10.457 0.778 1.00 0.00 N ATOM 605 CA PRO A 41 0.101 -9.219 1.533 1.00 0.00 C ATOM 606 C PRO A 41 -0.733 -8.056 1.008 1.00 0.00 C ATOM 607 O PRO A 41 -1.357 -8.147 -0.050 1.00 0.00 O ATOM 608 CB PRO A 41 1.589 -8.941 1.327 1.00 0.00 C ATOM 609 CG PRO A 41 1.912 -9.574 0.019 1.00 0.00 C ATOM 610 CD PRO A 41 1.036 -10.793 -0.079 1.00 0.00 C ATOM 0 HA PRO A 41 -0.191 -9.325 2.578 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.794 -7.871 1.311 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.187 -9.368 2.132 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.719 -8.887 -0.805 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.966 -9.846 -0.033 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.730 -10.986 -1.107 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.551 -11.687 0.273 1.00 0.00 H new ATOM 618 N LEU A 42 -0.744 -6.960 1.758 1.00 0.00 N ATOM 619 CA LEU A 42 -1.497 -5.782 1.366 1.00 0.00 C ATOM 620 C LEU A 42 -0.569 -4.583 1.191 1.00 0.00 C ATOM 621 O LEU A 42 0.123 -4.184 2.125 1.00 0.00 O ATOM 622 CB LEU A 42 -2.571 -5.467 2.411 1.00 0.00 C ATOM 623 CG LEU A 42 -3.978 -5.959 2.064 1.00 0.00 C ATOM 624 CD1 LEU A 42 -4.032 -7.480 2.078 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.999 -5.378 3.030 1.00 0.00 C ATOM 0 H LEU A 42 -0.239 -6.866 2.639 1.00 0.00 H new ATOM 0 HA LEU A 42 -1.982 -5.987 0.411 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.272 -5.909 3.361 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.606 -4.388 2.559 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.223 -5.617 1.058 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -5.040 -7.811 1.829 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.329 -7.876 1.345 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.765 -7.844 3.070 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.994 -5.738 2.768 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.756 -5.689 4.046 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -4.980 -4.290 2.969 1.00 0.00 H new ATOM 637 N MET A 43 -0.563 -4.007 -0.009 1.00 0.00 N ATOM 638 CA MET A 43 0.275 -2.845 -0.286 1.00 0.00 C ATOM 639 C MET A 43 -0.532 -1.562 -0.086 1.00 0.00 C ATOM 640 O MET A 43 -1.756 -1.606 0.008 1.00 0.00 O ATOM 641 CB MET A 43 0.837 -2.916 -1.714 1.00 0.00 C ATOM 642 CG MET A 43 1.579 -1.658 -2.143 1.00 0.00 C ATOM 643 SD MET A 43 2.641 -1.921 -3.577 1.00 0.00 S ATOM 644 CE MET A 43 1.553 -2.855 -4.646 1.00 0.00 C ATOM 0 H MET A 43 -1.125 -4.324 -0.799 1.00 0.00 H new ATOM 0 HA MET A 43 1.115 -2.841 0.409 1.00 0.00 H new ATOM 0 HB2 MET A 43 1.513 -3.768 -1.787 1.00 0.00 H new ATOM 0 HB3 MET A 43 0.017 -3.098 -2.409 1.00 0.00 H new ATOM 0 HG2 MET A 43 0.855 -0.876 -2.372 1.00 0.00 H new ATOM 0 HG3 MET A 43 2.184 -1.298 -1.311 1.00 0.00 H new ATOM 0 HE1 MET A 43 1.868 -2.732 -5.682 1.00 0.00 H new ATOM 0 HE2 MET A 43 1.596 -3.910 -4.376 1.00 0.00 H new ATOM 0 HE3 MET A 43 0.531 -2.493 -4.532 1.00 0.00 H new ATOM 654 N VAL A 44 0.150 -0.424 -0.001 1.00 0.00 N ATOM 655 CA VAL A 44 -0.538 0.846 0.205 1.00 0.00 C ATOM 656 C VAL A 44 -0.002 1.938 -0.709 1.00 0.00 C ATOM 657 O VAL A 44 1.089 1.822 -1.257 1.00 0.00 O ATOM 658 CB VAL A 44 -0.436 1.304 1.680 1.00 0.00 C ATOM 659 CG1 VAL A 44 0.141 2.708 1.812 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.795 1.243 2.332 1.00 0.00 C ATOM 0 H VAL A 44 1.165 -0.354 -0.070 1.00 0.00 H new ATOM 0 HA VAL A 44 -1.586 0.677 -0.044 1.00 0.00 H new ATOM 0 HB VAL A 44 0.249 0.623 2.185 1.00 0.00 H new ATOM 0 HG11 VAL A 44 0.192 2.983 2.866 1.00 0.00 H new ATOM 0 HG12 VAL A 44 1.142 2.732 1.382 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -0.498 3.415 1.283 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.716 1.567 3.370 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.484 1.898 1.799 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -2.169 0.220 2.299 1.00 0.00 H new ATOM 670 N ILE A 45 -0.777 3.009 -0.839 1.00 0.00 N ATOM 671 CA ILE A 45 -0.394 4.145 -1.656 1.00 0.00 C ATOM 672 C ILE A 45 -0.975 5.432 -1.085 1.00 0.00 C ATOM 673 O ILE A 45 -2.074 5.841 -1.440 1.00 0.00 O ATOM 674 CB ILE A 45 -0.856 3.982 -3.122 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.365 5.156 -3.968 1.00 0.00 C ATOM 676 CG2 ILE A 45 -2.366 3.856 -3.208 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.658 5.002 -5.444 1.00 0.00 C ATOM 0 H ILE A 45 -1.683 3.110 -0.382 1.00 0.00 H new ATOM 0 HA ILE A 45 0.695 4.195 -1.644 1.00 0.00 H new ATOM 0 HB ILE A 45 -0.421 3.063 -3.515 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -0.831 6.073 -3.607 1.00 0.00 H new ATOM 0 HG13 ILE A 45 0.710 5.269 -3.829 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -2.663 3.743 -4.251 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -2.691 2.984 -2.641 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -2.830 4.751 -2.794 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -0.282 5.872 -5.982 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -0.170 4.103 -5.820 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -1.734 4.920 -5.595 1.00 0.00 H new ATOM 689 N ILE A 46 -0.237 6.068 -0.190 1.00 0.00 N ATOM 690 CA ILE A 46 -0.694 7.303 0.417 1.00 0.00 C ATOM 691 C ILE A 46 -0.013 8.487 -0.244 1.00 0.00 C ATOM 692 O ILE A 46 1.195 8.473 -0.471 1.00 0.00 O ATOM 693 CB ILE A 46 -0.414 7.340 1.934 1.00 0.00 C ATOM 694 CG1 ILE A 46 -0.348 5.929 2.518 1.00 0.00 C ATOM 695 CG2 ILE A 46 -1.479 8.146 2.647 1.00 0.00 C ATOM 696 CD1 ILE A 46 0.847 5.719 3.414 1.00 0.00 C ATOM 0 H ILE A 46 0.678 5.749 0.130 1.00 0.00 H new ATOM 0 HA ILE A 46 -1.773 7.357 0.270 1.00 0.00 H new ATOM 0 HB ILE A 46 0.554 7.817 2.084 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -1.259 5.733 3.084 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -0.316 5.205 1.703 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -1.268 8.163 3.716 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -1.483 9.166 2.262 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -2.455 7.691 2.477 1.00 0.00 H new ATOM 0 HD11 ILE A 46 0.839 4.699 3.798 1.00 0.00 H new ATOM 0 HD12 ILE A 46 1.762 5.885 2.845 1.00 0.00 H new ATOM 0 HD13 ILE A 46 0.805 6.421 4.247 1.00 0.00 H new ATOM 708 N HIS A 47 -0.784 9.512 -0.553 1.00 0.00 N ATOM 709 CA HIS A 47 -0.224 10.694 -1.187 1.00 0.00 C ATOM 710 C HIS A 47 -0.993 11.944 -0.801 1.00 0.00 C ATOM 711 O HIS A 47 -2.115 12.164 -1.258 1.00 0.00 O ATOM 712 CB HIS A 47 -0.167 10.569 -2.722 1.00 0.00 C ATOM 713 CG HIS A 47 -0.960 9.443 -3.342 1.00 0.00 C ATOM 714 ND1 HIS A 47 -0.811 9.092 -4.669 1.00 0.00 N ATOM 715 CD2 HIS A 47 -1.911 8.607 -2.846 1.00 0.00 C ATOM 716 CE1 HIS A 47 -1.630 8.100 -4.959 1.00 0.00 C ATOM 717 NE2 HIS A 47 -2.306 7.786 -3.874 1.00 0.00 N ATOM 0 H HIS A 47 -1.788 9.553 -0.379 1.00 0.00 H new ATOM 0 HA HIS A 47 0.799 10.779 -0.821 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -0.516 11.508 -3.153 1.00 0.00 H new ATOM 0 HB3 HIS A 47 0.876 10.452 -3.015 1.00 0.00 H new ATOM 0 HD1 HIS A 47 -0.166 9.533 -5.325 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -2.286 8.591 -1.833 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -1.729 7.625 -5.924 1.00 0.00 H new ATOM 726 N LYS A 48 -0.373 12.772 0.033 1.00 0.00 N ATOM 727 CA LYS A 48 -1.008 14.017 0.463 1.00 0.00 C ATOM 728 C LYS A 48 -0.326 15.221 -0.178 1.00 0.00 C ATOM 729 O LYS A 48 0.673 15.076 -0.883 1.00 0.00 O ATOM 730 CB LYS A 48 -1.000 14.149 1.989 1.00 0.00 C ATOM 731 CG LYS A 48 -2.373 14.437 2.575 1.00 0.00 C ATOM 732 CD LYS A 48 -2.638 13.621 3.832 1.00 0.00 C ATOM 733 CE LYS A 48 -1.594 13.888 4.906 1.00 0.00 C ATOM 734 NZ LYS A 48 -2.133 14.733 6.008 1.00 0.00 N ATOM 0 H LYS A 48 0.556 12.609 0.421 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.046 13.989 0.133 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -0.613 13.228 2.424 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -0.316 14.948 2.274 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -2.452 15.499 2.808 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.138 14.216 1.831 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -3.628 13.860 4.219 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -2.641 12.560 3.583 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -1.243 12.940 5.314 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -0.731 14.382 4.459 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -1.805 14.362 6.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -1.798 15.711 5.891 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.173 14.717 5.981 1.00 0.00 H new ATOM 748 N SER A 49 -0.874 16.410 0.061 1.00 0.00 N ATOM 749 CA SER A 49 -0.318 17.632 -0.510 1.00 0.00 C ATOM 750 C SER A 49 -0.388 17.578 -2.033 1.00 0.00 C ATOM 751 O SER A 49 -1.168 16.807 -2.593 1.00 0.00 O ATOM 752 CB SER A 49 1.132 17.821 -0.051 1.00 0.00 C ATOM 753 OG SER A 49 1.262 17.581 1.339 1.00 0.00 O ATOM 0 H SER A 49 -1.699 16.552 0.644 1.00 0.00 H new ATOM 0 HA SER A 49 -0.906 18.481 -0.162 1.00 0.00 H new ATOM 0 HB2 SER A 49 1.783 17.143 -0.603 1.00 0.00 H new ATOM 0 HB3 SER A 49 1.460 18.835 -0.280 1.00 0.00 H new ATOM 0 HG SER A 49 0.969 18.373 1.836 1.00 0.00 H new ATOM 759 N TRP A 50 0.427 18.390 -2.706 1.00 0.00 N ATOM 760 CA TRP A 50 0.447 18.411 -4.167 1.00 0.00 C ATOM 761 C TRP A 50 0.492 16.989 -4.721 1.00 0.00 C ATOM 762 O TRP A 50 -0.254 16.644 -5.636 1.00 0.00 O ATOM 763 CB TRP A 50 1.651 19.210 -4.675 1.00 0.00 C ATOM 764 CG TRP A 50 2.927 18.881 -3.961 1.00 0.00 C ATOM 765 CD1 TRP A 50 3.394 19.451 -2.811 1.00 0.00 C ATOM 766 CD2 TRP A 50 3.903 17.908 -4.351 1.00 0.00 C ATOM 767 NE1 TRP A 50 4.599 18.890 -2.462 1.00 0.00 N ATOM 768 CE2 TRP A 50 4.934 17.941 -3.392 1.00 0.00 C ATOM 769 CE3 TRP A 50 4.006 17.012 -5.418 1.00 0.00 C ATOM 770 CZ2 TRP A 50 6.050 17.113 -3.469 1.00 0.00 C ATOM 771 CZ3 TRP A 50 5.115 16.189 -5.494 1.00 0.00 C ATOM 772 CH2 TRP A 50 6.125 16.246 -4.525 1.00 0.00 C ATOM 0 H TRP A 50 1.079 19.039 -2.265 1.00 0.00 H new ATOM 0 HA TRP A 50 -0.466 18.894 -4.515 1.00 0.00 H new ATOM 0 HB2 TRP A 50 1.780 19.020 -5.741 1.00 0.00 H new ATOM 0 HB3 TRP A 50 1.445 20.274 -4.563 1.00 0.00 H new ATOM 0 HD1 TRP A 50 2.890 20.229 -2.257 1.00 0.00 H new ATOM 0 HE1 TRP A 50 5.154 19.140 -1.643 1.00 0.00 H new ATOM 0 HE3 TRP A 50 3.233 16.963 -6.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 6.829 17.153 -2.722 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 5.204 15.491 -6.314 1.00 0.00 H new ATOM 0 HH2 TRP A 50 6.980 15.592 -4.613 1.00 0.00 H new ATOM 783 N CYS A 51 1.362 16.173 -4.133 1.00 0.00 N ATOM 784 CA CYS A 51 1.521 14.772 -4.523 1.00 0.00 C ATOM 785 C CYS A 51 1.817 14.615 -6.015 1.00 0.00 C ATOM 786 O CYS A 51 1.126 15.175 -6.865 1.00 0.00 O ATOM 787 CB CYS A 51 0.271 13.962 -4.137 1.00 0.00 C ATOM 788 SG CYS A 51 -1.036 13.887 -5.415 1.00 0.00 S ATOM 0 H CYS A 51 1.977 16.462 -3.373 1.00 0.00 H new ATOM 0 HA CYS A 51 2.383 14.383 -3.980 1.00 0.00 H new ATOM 0 HB2 CYS A 51 0.578 12.945 -3.894 1.00 0.00 H new ATOM 0 HB3 CYS A 51 -0.155 14.392 -3.230 1.00 0.00 H new ATOM 793 N GLY A 52 2.836 13.821 -6.324 1.00 0.00 N ATOM 794 CA GLY A 52 3.190 13.568 -7.709 1.00 0.00 C ATOM 795 C GLY A 52 2.806 12.165 -8.122 1.00 0.00 C ATOM 796 O GLY A 52 2.532 11.904 -9.293 1.00 0.00 O ATOM 0 H GLY A 52 3.425 13.347 -5.639 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.689 14.290 -8.353 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.262 13.710 -7.845 1.00 0.00 H new ATOM 800 N ALA A 53 2.768 11.262 -7.146 1.00 0.00 N ATOM 801 CA ALA A 53 2.397 9.878 -7.396 1.00 0.00 C ATOM 802 C ALA A 53 0.984 9.790 -7.930 1.00 0.00 C ATOM 803 O ALA A 53 0.592 8.776 -8.500 1.00 0.00 O ATOM 804 CB ALA A 53 2.548 9.047 -6.130 1.00 0.00 C ATOM 0 H ALA A 53 2.991 11.468 -6.172 1.00 0.00 H new ATOM 0 HA ALA A 53 3.070 9.474 -8.152 1.00 0.00 H new ATOM 0 HB1 ALA A 53 2.266 8.015 -6.337 1.00 0.00 H new ATOM 0 HB2 ALA A 53 3.585 9.080 -5.795 1.00 0.00 H new ATOM 0 HB3 ALA A 53 1.902 9.451 -5.351 1.00 0.00 H new ATOM 810 N CYS A 54 0.225 10.861 -7.758 1.00 0.00 N ATOM 811 CA CYS A 54 -1.137 10.892 -8.242 1.00 0.00 C ATOM 812 C CYS A 54 -1.166 11.453 -9.659 1.00 0.00 C ATOM 813 O CYS A 54 -1.943 11.007 -10.506 1.00 0.00 O ATOM 814 CB CYS A 54 -2.034 11.732 -7.323 1.00 0.00 C ATOM 815 SG CYS A 54 -1.427 11.900 -5.608 1.00 0.00 S ATOM 0 H CYS A 54 0.531 11.713 -7.289 1.00 0.00 H new ATOM 0 HA CYS A 54 -1.523 9.873 -8.247 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -2.142 12.727 -7.755 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -3.028 11.285 -7.300 1.00 0.00 H new ATOM 820 N LYS A 55 -0.304 12.433 -9.907 1.00 0.00 N ATOM 821 CA LYS A 55 -0.218 13.061 -11.216 1.00 0.00 C ATOM 822 C LYS A 55 0.258 12.068 -12.270 1.00 0.00 C ATOM 823 O LYS A 55 -0.452 11.803 -13.241 1.00 0.00 O ATOM 824 CB LYS A 55 0.711 14.274 -11.171 1.00 0.00 C ATOM 825 CG LYS A 55 -0.030 15.597 -11.069 1.00 0.00 C ATOM 826 CD LYS A 55 0.873 16.702 -10.541 1.00 0.00 C ATOM 827 CE LYS A 55 1.325 17.636 -11.654 1.00 0.00 C ATOM 828 NZ LYS A 55 0.827 19.024 -11.450 1.00 0.00 N ATOM 0 H LYS A 55 0.345 12.809 -9.216 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.217 13.397 -11.492 1.00 0.00 H new ATOM 0 HB2 LYS A 55 1.384 14.176 -10.319 1.00 0.00 H new ATOM 0 HB3 LYS A 55 1.331 14.281 -12.067 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.414 15.877 -12.050 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.891 15.483 -10.410 1.00 0.00 H new ATOM 0 HD2 LYS A 55 0.343 17.273 -9.779 1.00 0.00 H new ATOM 0 HD3 LYS A 55 1.745 16.261 -10.059 1.00 0.00 H new ATOM 0 HE2 LYS A 55 2.414 17.644 -11.701 1.00 0.00 H new ATOM 0 HE3 LYS A 55 0.967 17.259 -12.612 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.156 19.629 -12.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -0.213 19.020 -11.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 1.189 19.394 -10.548 1.00 0.00 H new ATOM 842 N ALA A 56 1.453 11.507 -12.082 1.00 0.00 N ATOM 843 CA ALA A 56 1.977 10.543 -13.032 1.00 0.00 C ATOM 844 C ALA A 56 1.053 9.332 -13.136 1.00 0.00 C ATOM 845 O ALA A 56 0.938 8.718 -14.194 1.00 0.00 O ATOM 846 CB ALA A 56 3.379 10.122 -12.621 1.00 0.00 C ATOM 0 H ALA A 56 2.064 11.704 -11.290 1.00 0.00 H new ATOM 0 HA ALA A 56 2.028 11.009 -14.016 1.00 0.00 H new ATOM 0 HB1 ALA A 56 3.767 9.398 -13.338 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.030 10.996 -12.600 1.00 0.00 H new ATOM 0 HB3 ALA A 56 3.347 9.669 -11.630 1.00 0.00 H new ATOM 852 N LEU A 57 0.396 9.009 -12.027 1.00 0.00 N ATOM 853 CA LEU A 57 -0.526 7.876 -11.961 1.00 0.00 C ATOM 854 C LEU A 57 -1.619 7.958 -13.025 1.00 0.00 C ATOM 855 O LEU A 57 -2.042 6.945 -13.573 1.00 0.00 O ATOM 856 CB LEU A 57 -1.172 7.825 -10.573 1.00 0.00 C ATOM 857 CG LEU A 57 -0.793 6.618 -9.712 1.00 0.00 C ATOM 858 CD1 LEU A 57 0.709 6.366 -9.761 1.00 0.00 C ATOM 859 CD2 LEU A 57 -1.259 6.825 -8.277 1.00 0.00 C ATOM 0 H LEU A 57 0.486 9.522 -11.150 1.00 0.00 H new ATOM 0 HA LEU A 57 0.051 6.970 -12.148 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.903 8.733 -10.033 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -2.255 7.836 -10.695 1.00 0.00 H new ATOM 0 HG LEU A 57 -1.294 5.738 -10.115 1.00 0.00 H new ATOM 0 HD11 LEU A 57 0.954 5.503 -9.141 1.00 0.00 H new ATOM 0 HD12 LEU A 57 1.012 6.171 -10.790 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.237 7.243 -9.387 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -0.983 5.959 -7.676 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.786 7.717 -7.866 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -2.342 6.948 -8.260 1.00 0.00 H new ATOM 871 N LYS A 58 -2.103 9.158 -13.288 1.00 0.00 N ATOM 872 CA LYS A 58 -3.176 9.344 -14.260 1.00 0.00 C ATOM 873 C LYS A 58 -2.907 8.624 -15.594 1.00 0.00 C ATOM 874 O LYS A 58 -3.606 7.669 -15.938 1.00 0.00 O ATOM 875 CB LYS A 58 -3.420 10.838 -14.495 1.00 0.00 C ATOM 876 CG LYS A 58 -4.380 11.459 -13.492 1.00 0.00 C ATOM 877 CD LYS A 58 -5.019 12.728 -14.036 1.00 0.00 C ATOM 878 CE LYS A 58 -3.974 13.734 -14.492 1.00 0.00 C ATOM 879 NZ LYS A 58 -4.442 15.137 -14.318 1.00 0.00 N ATOM 0 H LYS A 58 -1.775 10.017 -12.847 1.00 0.00 H new ATOM 0 HA LYS A 58 -4.072 8.890 -13.837 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.467 11.366 -14.449 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.815 10.980 -15.501 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.158 10.739 -13.239 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -3.846 11.687 -12.570 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.672 12.477 -14.872 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -5.646 13.178 -13.266 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -3.055 13.585 -13.926 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -3.734 13.559 -15.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -3.702 15.792 -14.640 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -5.305 15.287 -14.879 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -4.647 15.313 -13.314 1.00 0.00 H new ATOM 893 N PRO A 59 -1.909 9.081 -16.377 1.00 0.00 N ATOM 894 CA PRO A 59 -1.590 8.490 -17.689 1.00 0.00 C ATOM 895 C PRO A 59 -0.834 7.163 -17.629 1.00 0.00 C ATOM 896 O PRO A 59 -0.819 6.416 -18.608 1.00 0.00 O ATOM 897 CB PRO A 59 -0.708 9.556 -18.332 1.00 0.00 C ATOM 898 CG PRO A 59 -0.023 10.201 -17.182 1.00 0.00 C ATOM 899 CD PRO A 59 -1.031 10.223 -16.065 1.00 0.00 C ATOM 0 HA PRO A 59 -2.503 8.243 -18.231 1.00 0.00 H new ATOM 0 HB2 PRO A 59 0.008 9.116 -19.026 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.300 10.275 -18.898 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.868 9.643 -16.894 1.00 0.00 H new ATOM 0 HG3 PRO A 59 0.302 11.210 -17.436 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.555 10.110 -15.091 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.585 11.161 -16.042 1.00 0.00 H new ATOM 907 N LYS A 60 -0.197 6.869 -16.504 1.00 0.00 N ATOM 908 CA LYS A 60 0.562 5.626 -16.377 1.00 0.00 C ATOM 909 C LYS A 60 -0.238 4.567 -15.644 1.00 0.00 C ATOM 910 O LYS A 60 -0.364 3.439 -16.117 1.00 0.00 O ATOM 911 CB LYS A 60 1.877 5.872 -15.652 1.00 0.00 C ATOM 912 CG LYS A 60 1.694 6.110 -14.163 1.00 0.00 C ATOM 913 CD LYS A 60 2.898 6.789 -13.516 1.00 0.00 C ATOM 914 CE LYS A 60 3.653 7.706 -14.478 1.00 0.00 C ATOM 915 NZ LYS A 60 4.494 6.941 -15.443 1.00 0.00 N ATOM 0 H LYS A 60 -0.188 7.463 -15.675 1.00 0.00 H new ATOM 0 HA LYS A 60 0.773 5.265 -17.384 1.00 0.00 H new ATOM 0 HB2 LYS A 60 2.534 5.015 -15.800 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.374 6.735 -16.095 1.00 0.00 H new ATOM 0 HG2 LYS A 60 0.808 6.725 -14.005 1.00 0.00 H new ATOM 0 HG3 LYS A 60 1.512 5.156 -13.668 1.00 0.00 H new ATOM 0 HD2 LYS A 60 2.563 7.370 -12.657 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.579 6.026 -13.139 1.00 0.00 H new ATOM 0 HE2 LYS A 60 2.939 8.320 -15.028 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.285 8.386 -13.908 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.499 7.139 -15.261 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.315 5.923 -15.328 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 4.255 7.227 -16.414 1.00 0.00 H new ATOM 929 N PHE A 61 -0.795 4.930 -14.493 1.00 0.00 N ATOM 930 CA PHE A 61 -1.591 3.994 -13.736 1.00 0.00 C ATOM 931 C PHE A 61 -2.786 3.579 -14.577 1.00 0.00 C ATOM 932 O PHE A 61 -3.306 2.475 -14.435 1.00 0.00 O ATOM 933 CB PHE A 61 -2.017 4.585 -12.397 1.00 0.00 C ATOM 934 CG PHE A 61 -2.279 3.537 -11.355 1.00 0.00 C ATOM 935 CD1 PHE A 61 -3.409 2.740 -11.424 1.00 0.00 C ATOM 936 CD2 PHE A 61 -1.385 3.336 -10.316 1.00 0.00 C ATOM 937 CE1 PHE A 61 -3.645 1.765 -10.473 1.00 0.00 C ATOM 938 CE2 PHE A 61 -1.615 2.364 -9.362 1.00 0.00 C ATOM 939 CZ PHE A 61 -2.747 1.578 -9.441 1.00 0.00 C ATOM 0 H PHE A 61 -0.707 5.856 -14.075 1.00 0.00 H new ATOM 0 HA PHE A 61 -0.995 3.111 -13.505 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -1.239 5.260 -12.039 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.917 5.183 -12.539 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -4.114 2.882 -12.230 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -0.497 3.947 -10.251 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -4.531 1.150 -10.537 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -0.911 2.219 -8.556 1.00 0.00 H new ATOM 0 HZ PHE A 61 -2.930 0.818 -8.696 1.00 0.00 H new ATOM 949 N ALA A 62 -3.170 4.450 -15.517 1.00 0.00 N ATOM 950 CA ALA A 62 -4.244 4.127 -16.439 1.00 0.00 C ATOM 951 C ALA A 62 -3.822 2.907 -17.262 1.00 0.00 C ATOM 952 O ALA A 62 -4.646 2.202 -17.843 1.00 0.00 O ATOM 953 CB ALA A 62 -4.544 5.315 -17.342 1.00 0.00 C ATOM 0 H ALA A 62 -2.754 5.371 -15.652 1.00 0.00 H new ATOM 0 HA ALA A 62 -5.155 3.897 -15.887 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -5.351 5.056 -18.027 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -4.844 6.168 -16.733 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -3.652 5.572 -17.913 1.00 0.00 H new ATOM 959 N GLU A 63 -2.505 2.674 -17.264 1.00 0.00 N ATOM 960 CA GLU A 63 -1.879 1.558 -17.956 1.00 0.00 C ATOM 961 C GLU A 63 -1.856 0.330 -17.058 1.00 0.00 C ATOM 962 O GLU A 63 -1.612 -0.789 -17.514 1.00 0.00 O ATOM 963 CB GLU A 63 -0.453 1.943 -18.358 1.00 0.00 C ATOM 964 CG GLU A 63 0.091 1.140 -19.526 1.00 0.00 C ATOM 965 CD GLU A 63 0.924 1.981 -20.474 1.00 0.00 C ATOM 966 OE1 GLU A 63 2.071 2.321 -20.114 1.00 0.00 O ATOM 967 OE2 GLU A 63 0.430 2.300 -21.575 1.00 0.00 O ATOM 0 H GLU A 63 -1.838 3.270 -16.774 1.00 0.00 H new ATOM 0 HA GLU A 63 -2.454 1.322 -18.851 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -0.431 3.002 -18.615 1.00 0.00 H new ATOM 0 HB3 GLU A 63 0.205 1.810 -17.499 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.698 0.318 -19.146 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -0.739 0.695 -20.075 1.00 0.00 H new ATOM 974 N SER A 64 -2.117 0.551 -15.773 1.00 0.00 N ATOM 975 CA SER A 64 -2.138 -0.512 -14.787 1.00 0.00 C ATOM 976 C SER A 64 -3.119 -1.623 -15.158 1.00 0.00 C ATOM 977 O SER A 64 -3.283 -2.573 -14.397 1.00 0.00 O ATOM 978 CB SER A 64 -2.508 0.064 -13.426 1.00 0.00 C ATOM 979 OG SER A 64 -1.572 1.043 -13.010 1.00 0.00 O ATOM 0 H SER A 64 -2.319 1.475 -15.391 1.00 0.00 H new ATOM 0 HA SER A 64 -1.141 -0.952 -14.753 1.00 0.00 H new ATOM 0 HB2 SER A 64 -3.503 0.506 -13.474 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.551 -0.738 -12.689 1.00 0.00 H new ATOM 0 HG SER A 64 -1.981 1.619 -12.331 1.00 0.00 H new ATOM 985 N THR A 65 -3.764 -1.523 -16.323 1.00 0.00 N ATOM 986 CA THR A 65 -4.696 -2.556 -16.758 1.00 0.00 C ATOM 987 C THR A 65 -4.053 -3.920 -16.562 1.00 0.00 C ATOM 988 O THR A 65 -4.699 -4.869 -16.117 1.00 0.00 O ATOM 989 CB THR A 65 -5.075 -2.354 -18.224 1.00 0.00 C ATOM 990 OG1 THR A 65 -4.855 -1.010 -18.620 1.00 0.00 O ATOM 991 CG2 THR A 65 -6.520 -2.686 -18.515 1.00 0.00 C ATOM 0 H THR A 65 -3.657 -0.744 -16.973 1.00 0.00 H new ATOM 0 HA THR A 65 -5.607 -2.493 -16.162 1.00 0.00 H new ATOM 0 HB THR A 65 -4.439 -3.039 -18.785 1.00 0.00 H new ATOM 0 HG1 THR A 65 -5.102 -0.902 -19.562 1.00 0.00 H new ATOM 0 HG21 THR A 65 -6.725 -2.522 -19.573 1.00 0.00 H new ATOM 0 HG22 THR A 65 -6.711 -3.730 -18.266 1.00 0.00 H new ATOM 0 HG23 THR A 65 -7.168 -2.046 -17.916 1.00 0.00 H new ATOM 999 N GLU A 66 -2.760 -3.991 -16.857 1.00 0.00 N ATOM 1000 CA GLU A 66 -2.007 -5.219 -16.671 1.00 0.00 C ATOM 1001 C GLU A 66 -1.641 -5.354 -15.205 1.00 0.00 C ATOM 1002 O GLU A 66 -1.578 -6.462 -14.671 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.751 -5.235 -17.543 1.00 0.00 C ATOM 1004 CG GLU A 66 0.239 -4.143 -17.188 1.00 0.00 C ATOM 1005 CD GLU A 66 0.351 -3.081 -18.264 1.00 0.00 C ATOM 1006 OE1 GLU A 66 0.149 -3.415 -19.451 1.00 0.00 O ATOM 1007 OE2 GLU A 66 0.641 -1.916 -17.922 1.00 0.00 O ATOM 0 H GLU A 66 -2.215 -3.212 -17.225 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.624 -6.065 -16.975 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.262 -6.204 -17.446 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -1.041 -5.127 -18.588 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.064 -3.675 -16.251 1.00 0.00 H new ATOM 0 HG3 GLU A 66 1.220 -4.588 -17.020 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.448 -4.216 -14.542 1.00 0.00 N ATOM 1015 CA ILE A 67 -1.145 -4.232 -13.124 1.00 0.00 C ATOM 1016 C ILE A 67 -2.365 -4.736 -12.362 1.00 0.00 C ATOM 1017 O ILE A 67 -2.257 -5.190 -11.222 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.730 -2.838 -12.604 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.549 -2.368 -13.309 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.532 -2.860 -11.092 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.137 -1.097 -12.727 1.00 0.00 C ATOM 0 H ILE A 67 -1.496 -3.287 -14.961 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.298 -4.899 -12.962 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.531 -2.134 -12.829 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.295 -3.161 -13.254 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.332 -2.207 -14.365 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.240 -1.867 -10.749 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.464 -3.152 -10.607 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.249 -3.576 -10.838 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.039 -0.828 -13.277 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.409 -0.290 -12.806 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.387 -1.259 -11.678 1.00 0.00 H new ATOM 1033 N SER A 68 -3.526 -4.693 -13.021 1.00 0.00 N ATOM 1034 CA SER A 68 -4.752 -5.188 -12.421 1.00 0.00 C ATOM 1035 C SER A 68 -4.643 -6.696 -12.272 1.00 0.00 C ATOM 1036 O SER A 68 -5.153 -7.282 -11.318 1.00 0.00 O ATOM 1037 CB SER A 68 -5.963 -4.820 -13.281 1.00 0.00 C ATOM 1038 OG SER A 68 -6.163 -5.765 -14.319 1.00 0.00 O ATOM 0 H SER A 68 -3.635 -4.321 -13.965 1.00 0.00 H new ATOM 0 HA SER A 68 -4.891 -4.729 -11.442 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.854 -4.769 -12.655 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.819 -3.829 -13.711 1.00 0.00 H new ATOM 0 HG SER A 68 -5.455 -5.669 -14.989 1.00 0.00 H new ATOM 1044 N GLU A 69 -3.936 -7.310 -13.219 1.00 0.00 N ATOM 1045 CA GLU A 69 -3.712 -8.743 -13.198 1.00 0.00 C ATOM 1046 C GLU A 69 -2.622 -9.065 -12.191 1.00 0.00 C ATOM 1047 O GLU A 69 -2.694 -10.066 -11.475 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.320 -9.250 -14.588 1.00 0.00 C ATOM 1049 CG GLU A 69 -4.264 -8.800 -15.689 1.00 0.00 C ATOM 1050 CD GLU A 69 -5.638 -9.430 -15.573 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -6.404 -9.024 -14.675 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -5.947 -10.330 -16.382 1.00 0.00 O ATOM 0 H GLU A 69 -3.509 -6.830 -14.011 1.00 0.00 H new ATOM 0 HA GLU A 69 -4.635 -9.244 -12.906 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.313 -8.904 -14.821 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -3.287 -10.339 -14.572 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.362 -7.715 -15.657 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -3.833 -9.053 -16.658 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.621 -8.192 -12.126 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.521 -8.360 -11.185 1.00 0.00 C ATOM 1061 C LEU A 70 -1.051 -8.417 -9.754 1.00 0.00 C ATOM 1062 O LEU A 70 -0.392 -8.937 -8.856 1.00 0.00 O ATOM 1063 CB LEU A 70 0.484 -7.213 -11.322 1.00 0.00 C ATOM 1064 CG LEU A 70 1.570 -7.429 -12.378 1.00 0.00 C ATOM 1065 CD1 LEU A 70 0.948 -7.548 -13.760 1.00 0.00 C ATOM 1066 CD2 LEU A 70 2.588 -6.298 -12.341 1.00 0.00 C ATOM 0 H LEU A 70 -1.550 -7.362 -12.714 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.016 -9.298 -11.414 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -0.060 -6.300 -11.563 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.964 -7.053 -10.356 1.00 0.00 H new ATOM 0 HG LEU A 70 2.090 -8.360 -12.153 1.00 0.00 H new ATOM 0 HD11 LEU A 70 1.733 -7.701 -14.500 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.262 -8.395 -13.778 1.00 0.00 H new ATOM 0 HD13 LEU A 70 0.403 -6.634 -13.994 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.352 -6.471 -13.099 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.087 -5.351 -12.540 1.00 0.00 H new ATOM 0 HD23 LEU A 70 3.056 -6.262 -11.357 1.00 0.00 H new ATOM 1078 N SER A 71 -2.250 -7.882 -9.553 1.00 0.00 N ATOM 1079 CA SER A 71 -2.872 -7.879 -8.237 1.00 0.00 C ATOM 1080 C SER A 71 -3.094 -9.297 -7.727 1.00 0.00 C ATOM 1081 O SER A 71 -3.270 -9.512 -6.527 1.00 0.00 O ATOM 1082 CB SER A 71 -4.211 -7.163 -8.285 1.00 0.00 C ATOM 1083 OG SER A 71 -4.276 -6.127 -7.319 1.00 0.00 O ATOM 0 H SER A 71 -2.810 -7.445 -10.285 1.00 0.00 H new ATOM 0 HA SER A 71 -2.195 -7.358 -7.559 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.367 -6.746 -9.280 1.00 0.00 H new ATOM 0 HB3 SER A 71 -5.015 -7.878 -8.109 1.00 0.00 H new ATOM 0 HG SER A 71 -3.906 -6.448 -6.470 1.00 0.00 H new ATOM 1089 N HIS A 72 -3.075 -10.272 -8.635 1.00 0.00 N ATOM 1090 CA HIS A 72 -3.267 -11.664 -8.248 1.00 0.00 C ATOM 1091 C HIS A 72 -2.219 -12.052 -7.215 1.00 0.00 C ATOM 1092 O HIS A 72 -2.364 -13.041 -6.495 1.00 0.00 O ATOM 1093 CB HIS A 72 -3.194 -12.584 -9.475 1.00 0.00 C ATOM 1094 CG HIS A 72 -1.800 -12.959 -9.881 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -1.264 -14.211 -9.660 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -0.833 -12.244 -10.502 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -0.028 -14.248 -10.125 1.00 0.00 C ATOM 1098 NE2 HIS A 72 0.257 -13.068 -10.642 1.00 0.00 N ATOM 0 H HIS A 72 -2.930 -10.124 -9.634 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.257 -11.779 -7.808 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -3.757 -13.494 -9.267 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -3.685 -12.091 -10.314 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -1.747 -14.987 -9.208 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -0.905 -11.217 -10.827 1.00 0.00 H new ATOM 0 HE1 HIS A 72 0.636 -15.099 -10.088 1.00 0.00 H new ATOM 1107 N ASN A 73 -1.167 -11.246 -7.150 1.00 0.00 N ATOM 1108 CA ASN A 73 -0.084 -11.461 -6.216 1.00 0.00 C ATOM 1109 C ASN A 73 -0.440 -10.886 -4.847 1.00 0.00 C ATOM 1110 O ASN A 73 -0.037 -11.415 -3.812 1.00 0.00 O ATOM 1111 CB ASN A 73 1.178 -10.803 -6.759 1.00 0.00 C ATOM 1112 CG ASN A 73 1.634 -11.434 -8.061 1.00 0.00 C ATOM 1113 OD1 ASN A 73 2.318 -12.458 -8.060 1.00 0.00 O ATOM 1114 ND2 ASN A 73 1.256 -10.827 -9.180 1.00 0.00 N ATOM 0 H ASN A 73 -1.046 -10.427 -7.746 1.00 0.00 H new ATOM 0 HA ASN A 73 0.088 -12.531 -6.098 1.00 0.00 H new ATOM 0 HB2 ASN A 73 0.994 -9.740 -6.916 1.00 0.00 H new ATOM 0 HB3 ASN A 73 1.975 -10.882 -6.019 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.532 -11.208 -10.085 1.00 0.00 H new ATOM 0 HD22 ASN A 73 0.689 -9.980 -9.134 1.00 0.00 H new ATOM 1121 N PHE A 74 -1.207 -9.798 -4.860 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.637 -9.140 -3.641 1.00 0.00 C ATOM 1123 C PHE A 74 -2.561 -7.962 -3.948 1.00 0.00 C ATOM 1124 O PHE A 74 -2.738 -7.586 -5.105 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.426 -8.681 -2.831 1.00 0.00 C ATOM 1126 CG PHE A 74 0.613 -7.915 -3.607 1.00 0.00 C ATOM 1127 CD1 PHE A 74 0.256 -6.958 -4.544 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.959 -8.152 -3.382 1.00 0.00 C ATOM 1129 CE1 PHE A 74 1.221 -6.254 -5.239 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.927 -7.452 -4.075 1.00 0.00 C ATOM 1131 CZ PHE A 74 2.557 -6.502 -5.004 1.00 0.00 C ATOM 0 H PHE A 74 -1.543 -9.354 -5.714 1.00 0.00 H new ATOM 0 HA PHE A 74 -2.201 -9.859 -3.046 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.775 -8.057 -2.008 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.048 -9.557 -2.388 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -0.789 -6.760 -4.733 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.255 -8.894 -2.655 1.00 0.00 H new ATOM 0 HE1 PHE A 74 0.929 -5.510 -5.966 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.973 -7.648 -3.890 1.00 0.00 H new ATOM 0 HZ PHE A 74 3.313 -5.953 -5.547 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.144 -7.379 -2.903 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.040 -6.236 -3.071 1.00 0.00 C ATOM 1143 C VAL A 75 -3.483 -5.028 -2.332 1.00 0.00 C ATOM 1144 O VAL A 75 -2.796 -5.181 -1.326 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.463 -6.543 -2.559 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -6.079 -7.687 -3.348 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -5.447 -6.858 -1.071 1.00 0.00 C ATOM 0 H VAL A 75 -3.014 -7.677 -1.936 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.105 -6.022 -4.138 1.00 0.00 H new ATOM 0 HB VAL A 75 -6.078 -5.656 -2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -7.082 -7.889 -2.973 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -6.134 -7.414 -4.402 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.463 -8.579 -3.236 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -6.461 -7.071 -0.733 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.814 -7.727 -0.890 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -5.054 -6.002 -0.522 1.00 0.00 H new ATOM 1157 N MET A 76 -3.748 -3.821 -2.835 1.00 0.00 N ATOM 1158 CA MET A 76 -3.218 -2.626 -2.190 1.00 0.00 C ATOM 1159 C MET A 76 -4.327 -1.680 -1.719 1.00 0.00 C ATOM 1160 O MET A 76 -5.515 -1.929 -1.943 1.00 0.00 O ATOM 1161 CB MET A 76 -2.233 -1.904 -3.117 1.00 0.00 C ATOM 1162 CG MET A 76 -2.059 -2.566 -4.485 1.00 0.00 C ATOM 1163 SD MET A 76 -1.282 -4.190 -4.400 1.00 0.00 S ATOM 1164 CE MET A 76 -1.778 -4.875 -5.979 1.00 0.00 C ATOM 0 H MET A 76 -4.313 -3.650 -3.667 1.00 0.00 H new ATOM 0 HA MET A 76 -2.681 -2.950 -1.298 1.00 0.00 H new ATOM 0 HB2 MET A 76 -2.573 -0.879 -3.263 1.00 0.00 H new ATOM 0 HB3 MET A 76 -1.262 -1.851 -2.626 1.00 0.00 H new ATOM 0 HG2 MET A 76 -3.035 -2.663 -4.960 1.00 0.00 H new ATOM 0 HG3 MET A 76 -1.458 -1.916 -5.121 1.00 0.00 H new ATOM 0 HE1 MET A 76 -1.713 -5.962 -5.940 1.00 0.00 H new ATOM 0 HE2 MET A 76 -2.805 -4.580 -6.197 1.00 0.00 H new ATOM 0 HE3 MET A 76 -1.119 -4.500 -6.762 1.00 0.00 H new ATOM 1174 N VAL A 77 -3.927 -0.602 -1.042 1.00 0.00 N ATOM 1175 CA VAL A 77 -4.875 0.377 -0.512 1.00 0.00 C ATOM 1176 C VAL A 77 -4.353 1.805 -0.666 1.00 0.00 C ATOM 1177 O VAL A 77 -3.180 2.066 -0.422 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.158 0.116 0.981 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.921 1.276 1.610 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.922 -1.182 1.155 1.00 0.00 C ATOM 0 H VAL A 77 -2.949 -0.385 -0.848 1.00 0.00 H new ATOM 0 HA VAL A 77 -5.794 0.268 -1.088 1.00 0.00 H new ATOM 0 HB VAL A 77 -4.201 0.029 1.495 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -6.105 1.062 2.663 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.332 2.189 1.523 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.872 1.408 1.095 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -6.114 -1.352 2.214 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.870 -1.121 0.620 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.332 -2.007 0.756 1.00 0.00 H new ATOM 1190 N ASN A 78 -5.231 2.730 -1.048 1.00 0.00 N ATOM 1191 CA ASN A 78 -4.839 4.125 -1.199 1.00 0.00 C ATOM 1192 C ASN A 78 -5.384 4.974 -0.061 1.00 0.00 C ATOM 1193 O ASN A 78 -6.592 5.172 0.063 1.00 0.00 O ATOM 1194 CB ASN A 78 -5.317 4.700 -2.535 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.275 6.215 -2.570 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -6.141 6.863 -3.157 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -4.257 6.780 -1.938 1.00 0.00 N ATOM 0 H ASN A 78 -6.211 2.539 -1.257 1.00 0.00 H new ATOM 0 HA ASN A 78 -3.750 4.152 -1.175 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -4.696 4.305 -3.339 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -6.336 4.365 -2.726 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -4.166 7.796 -1.924 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -3.564 6.199 -1.466 1.00 0.00 H new ATOM 1204 N LEU A 79 -4.478 5.486 0.752 1.00 0.00 N ATOM 1205 CA LEU A 79 -4.852 6.337 1.873 1.00 0.00 C ATOM 1206 C LEU A 79 -4.595 7.809 1.530 1.00 0.00 C ATOM 1207 O LEU A 79 -3.594 8.148 0.890 1.00 0.00 O ATOM 1208 CB LEU A 79 -4.080 5.915 3.127 1.00 0.00 C ATOM 1209 CG LEU A 79 -4.087 6.921 4.278 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -5.510 7.353 4.602 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -3.414 6.327 5.507 1.00 0.00 C ATOM 0 H LEU A 79 -3.475 5.328 0.659 1.00 0.00 H new ATOM 0 HA LEU A 79 -5.917 6.222 2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -4.496 4.974 3.488 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -3.045 5.719 2.846 1.00 0.00 H new ATOM 0 HG LEU A 79 -3.524 7.802 3.970 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -5.495 8.069 5.424 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -5.958 7.818 3.724 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -6.098 6.482 4.891 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -3.427 7.056 6.317 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -3.950 5.430 5.817 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -2.382 6.069 5.268 1.00 0.00 H new ATOM 1223 N GLU A 80 -5.511 8.684 1.941 1.00 0.00 N ATOM 1224 CA GLU A 80 -5.379 10.110 1.657 1.00 0.00 C ATOM 1225 C GLU A 80 -5.852 10.963 2.833 1.00 0.00 C ATOM 1226 O GLU A 80 -6.100 10.453 3.925 1.00 0.00 O ATOM 1227 CB GLU A 80 -6.170 10.471 0.398 1.00 0.00 C ATOM 1228 CG GLU A 80 -5.378 11.297 -0.600 1.00 0.00 C ATOM 1229 CD GLU A 80 -6.095 11.450 -1.928 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -6.583 10.429 -2.459 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -6.171 12.588 -2.434 1.00 0.00 O ATOM 0 H GLU A 80 -6.347 8.432 2.468 1.00 0.00 H new ATOM 0 HA GLU A 80 -4.322 10.320 1.494 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -6.505 9.554 -0.086 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -7.064 11.024 0.686 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -5.186 12.284 -0.179 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -4.408 10.828 -0.766 1.00 0.00 H new ATOM 1238 N ASP A 81 -5.966 12.267 2.597 1.00 0.00 N ATOM 1239 CA ASP A 81 -6.401 13.202 3.629 1.00 0.00 C ATOM 1240 C ASP A 81 -7.761 12.810 4.198 1.00 0.00 C ATOM 1241 O ASP A 81 -8.069 13.106 5.352 1.00 0.00 O ATOM 1242 CB ASP A 81 -6.464 14.623 3.065 1.00 0.00 C ATOM 1243 CG ASP A 81 -6.284 15.679 4.137 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -6.870 15.522 5.229 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -5.557 16.664 3.886 1.00 0.00 O ATOM 0 H ASP A 81 -5.762 12.701 1.697 1.00 0.00 H new ATOM 0 HA ASP A 81 -5.671 13.167 4.438 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -5.691 14.744 2.306 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -7.423 14.772 2.570 1.00 0.00 H new ATOM 1250 N GLU A 82 -8.575 12.141 3.384 1.00 0.00 N ATOM 1251 CA GLU A 82 -9.902 11.710 3.816 1.00 0.00 C ATOM 1252 C GLU A 82 -9.828 11.008 5.169 1.00 0.00 C ATOM 1253 O GLU A 82 -10.760 11.081 5.972 1.00 0.00 O ATOM 1254 CB GLU A 82 -10.525 10.781 2.773 1.00 0.00 C ATOM 1255 CG GLU A 82 -11.701 11.398 2.032 1.00 0.00 C ATOM 1256 CD GLU A 82 -11.370 11.746 0.594 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -10.191 12.047 0.314 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -12.288 11.716 -0.251 1.00 0.00 O ATOM 0 H GLU A 82 -8.340 11.886 2.425 1.00 0.00 H new ATOM 0 HA GLU A 82 -10.531 12.594 3.920 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.761 10.496 2.050 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.856 9.866 3.265 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -12.541 10.703 2.049 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.022 12.299 2.555 1.00 0.00 H new ATOM 1265 N GLU A 83 -8.709 10.337 5.415 1.00 0.00 N ATOM 1266 CA GLU A 83 -8.497 9.625 6.669 1.00 0.00 C ATOM 1267 C GLU A 83 -7.044 9.751 7.112 1.00 0.00 C ATOM 1268 O GLU A 83 -6.174 9.026 6.632 1.00 0.00 O ATOM 1269 CB GLU A 83 -8.869 8.149 6.516 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.358 7.913 6.316 1.00 0.00 C ATOM 1271 CD GLU A 83 -10.661 7.118 5.062 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -10.300 7.583 3.961 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -11.258 6.026 5.181 1.00 0.00 O ATOM 0 H GLU A 83 -7.931 10.271 4.759 1.00 0.00 H new ATOM 0 HA GLU A 83 -9.138 10.072 7.429 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -8.327 7.733 5.667 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.540 7.606 7.402 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.757 7.385 7.182 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -10.870 8.874 6.265 1.00 0.00 H new ATOM 1280 N GLU A 84 -6.784 10.680 8.027 1.00 0.00 N ATOM 1281 CA GLU A 84 -5.431 10.900 8.524 1.00 0.00 C ATOM 1282 C GLU A 84 -5.273 10.362 9.945 1.00 0.00 C ATOM 1283 O GLU A 84 -5.267 11.127 10.909 1.00 0.00 O ATOM 1284 CB GLU A 84 -5.091 12.390 8.490 1.00 0.00 C ATOM 1285 CG GLU A 84 -3.627 12.675 8.197 1.00 0.00 C ATOM 1286 CD GLU A 84 -2.873 13.174 9.415 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -2.993 12.544 10.487 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -2.165 14.196 9.297 1.00 0.00 O ATOM 0 H GLU A 84 -7.490 11.291 8.438 1.00 0.00 H new ATOM 0 HA GLU A 84 -4.742 10.360 7.875 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -5.706 12.877 7.733 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -5.354 12.836 9.449 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -3.151 11.767 7.827 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -3.558 13.418 7.402 1.00 0.00 H new ATOM 1295 N PRO A 85 -5.137 9.033 10.091 1.00 0.00 N ATOM 1296 CA PRO A 85 -4.971 8.399 11.402 1.00 0.00 C ATOM 1297 C PRO A 85 -3.590 8.660 11.994 1.00 0.00 C ATOM 1298 O PRO A 85 -2.577 8.252 11.430 1.00 0.00 O ATOM 1299 CB PRO A 85 -5.150 6.911 11.099 1.00 0.00 C ATOM 1300 CG PRO A 85 -4.727 6.767 9.679 1.00 0.00 C ATOM 1301 CD PRO A 85 -5.127 8.046 8.995 1.00 0.00 C ATOM 0 HA PRO A 85 -5.676 8.785 12.138 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -4.540 6.295 11.759 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -6.185 6.599 11.239 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -3.651 6.606 9.607 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -5.210 5.908 9.213 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -4.419 8.321 8.213 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -6.106 7.960 8.523 1.00 0.00 H new ATOM 1309 N LYS A 86 -3.559 9.347 13.133 1.00 0.00 N ATOM 1310 CA LYS A 86 -2.299 9.666 13.799 1.00 0.00 C ATOM 1311 C LYS A 86 -1.452 8.412 14.001 1.00 0.00 C ATOM 1312 O LYS A 86 -1.598 7.706 15.000 1.00 0.00 O ATOM 1313 CB LYS A 86 -2.570 10.341 15.147 1.00 0.00 C ATOM 1314 CG LYS A 86 -1.919 11.708 15.281 1.00 0.00 C ATOM 1315 CD LYS A 86 -2.902 12.748 15.794 1.00 0.00 C ATOM 1316 CE LYS A 86 -2.377 14.161 15.589 1.00 0.00 C ATOM 1317 NZ LYS A 86 -2.089 14.445 14.158 1.00 0.00 N ATOM 0 H LYS A 86 -4.390 9.693 13.613 1.00 0.00 H new ATOM 0 HA LYS A 86 -1.743 10.353 13.161 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.647 10.445 15.283 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -2.209 9.695 15.947 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -1.070 11.642 15.961 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -1.528 12.022 14.313 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -3.855 12.635 15.278 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -3.091 12.579 16.854 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -3.109 14.878 15.961 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -1.469 14.299 16.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -2.098 15.473 13.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -1.153 14.065 13.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -2.814 13.996 13.562 1.00 0.00 H new ATOM 1331 N ASP A 87 -0.569 8.141 13.046 1.00 0.00 N ATOM 1332 CA ASP A 87 0.299 6.971 13.118 1.00 0.00 C ATOM 1333 C ASP A 87 1.341 6.992 12.004 1.00 0.00 C ATOM 1334 O ASP A 87 1.082 7.477 10.904 1.00 0.00 O ATOM 1335 CB ASP A 87 -0.530 5.689 13.034 1.00 0.00 C ATOM 1336 CG ASP A 87 0.123 4.532 13.763 1.00 0.00 C ATOM 1337 OD1 ASP A 87 1.260 4.166 13.397 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.501 3.991 14.699 1.00 0.00 O ATOM 0 H ASP A 87 -0.435 8.715 12.214 1.00 0.00 H new ATOM 0 HA ASP A 87 0.820 6.997 14.075 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -1.518 5.870 13.456 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -0.675 5.421 11.988 1.00 0.00 H new ATOM 1343 N GLU A 88 2.520 6.457 12.301 1.00 0.00 N ATOM 1344 CA GLU A 88 3.612 6.404 11.333 1.00 0.00 C ATOM 1345 C GLU A 88 3.227 5.600 10.091 1.00 0.00 C ATOM 1346 O GLU A 88 3.916 5.655 9.071 1.00 0.00 O ATOM 1347 CB GLU A 88 4.858 5.798 11.977 1.00 0.00 C ATOM 1348 CG GLU A 88 5.453 6.656 13.079 1.00 0.00 C ATOM 1349 CD GLU A 88 5.992 7.976 12.564 1.00 0.00 C ATOM 1350 OE1 GLU A 88 5.193 8.923 12.407 1.00 0.00 O ATOM 1351 OE2 GLU A 88 7.213 8.063 12.316 1.00 0.00 O ATOM 0 H GLU A 88 2.746 6.051 13.209 1.00 0.00 H new ATOM 0 HA GLU A 88 3.824 7.426 11.019 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.606 4.820 12.386 1.00 0.00 H new ATOM 0 HB3 GLU A 88 5.612 5.636 11.207 1.00 0.00 H new ATOM 0 HG2 GLU A 88 4.692 6.849 13.835 1.00 0.00 H new ATOM 0 HG3 GLU A 88 6.257 6.106 13.569 1.00 0.00 H new ATOM 1358 N ASP A 89 2.136 4.838 10.182 1.00 0.00 N ATOM 1359 CA ASP A 89 1.678 4.012 9.065 1.00 0.00 C ATOM 1360 C ASP A 89 1.710 4.768 7.731 1.00 0.00 C ATOM 1361 O ASP A 89 1.797 4.150 6.671 1.00 0.00 O ATOM 1362 CB ASP A 89 0.258 3.490 9.331 1.00 0.00 C ATOM 1363 CG ASP A 89 0.246 2.067 9.867 1.00 0.00 C ATOM 1364 OD1 ASP A 89 0.620 1.875 11.043 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -0.140 1.141 9.110 1.00 0.00 O ATOM 0 H ASP A 89 1.554 4.776 11.017 1.00 0.00 H new ATOM 0 HA ASP A 89 2.369 3.172 8.987 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.238 4.147 10.045 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -0.319 3.531 8.407 1.00 0.00 H new ATOM 1370 N PHE A 90 1.632 6.100 7.779 1.00 0.00 N ATOM 1371 CA PHE A 90 1.646 6.896 6.551 1.00 0.00 C ATOM 1372 C PHE A 90 3.058 7.346 6.167 1.00 0.00 C ATOM 1373 O PHE A 90 3.308 7.696 5.011 1.00 0.00 O ATOM 1374 CB PHE A 90 0.719 8.109 6.670 1.00 0.00 C ATOM 1375 CG PHE A 90 0.786 8.814 7.995 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.988 9.307 8.475 1.00 0.00 C ATOM 1377 CD2 PHE A 90 -0.358 8.992 8.756 1.00 0.00 C ATOM 1378 CE1 PHE A 90 2.049 9.964 9.688 1.00 0.00 C ATOM 1379 CE2 PHE A 90 -0.304 9.646 9.970 1.00 0.00 C ATOM 1380 CZ PHE A 90 0.901 10.134 10.437 1.00 0.00 C ATOM 0 H PHE A 90 1.560 6.642 8.640 1.00 0.00 H new ATOM 0 HA PHE A 90 1.279 6.248 5.755 1.00 0.00 H new ATOM 0 HB2 PHE A 90 0.967 8.819 5.881 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.307 7.785 6.496 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.889 9.176 7.893 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -1.303 8.614 8.395 1.00 0.00 H new ATOM 0 HE1 PHE A 90 2.993 10.344 10.050 1.00 0.00 H new ATOM 0 HE2 PHE A 90 -1.203 9.776 10.554 1.00 0.00 H new ATOM 0 HZ PHE A 90 0.945 10.648 11.386 1.00 0.00 H new ATOM 1390 N SER A 91 3.978 7.333 7.130 1.00 0.00 N ATOM 1391 CA SER A 91 5.360 7.738 6.873 1.00 0.00 C ATOM 1392 C SER A 91 6.276 7.309 8.017 1.00 0.00 C ATOM 1393 O SER A 91 6.609 8.111 8.891 1.00 0.00 O ATOM 1394 CB SER A 91 5.459 9.255 6.667 1.00 0.00 C ATOM 1395 OG SER A 91 4.208 9.802 6.288 1.00 0.00 O ATOM 0 H SER A 91 3.793 7.048 8.092 1.00 0.00 H new ATOM 0 HA SER A 91 5.684 7.240 5.959 1.00 0.00 H new ATOM 0 HB2 SER A 91 5.802 9.728 7.587 1.00 0.00 H new ATOM 0 HB3 SER A 91 6.202 9.473 5.900 1.00 0.00 H new ATOM 0 HG SER A 91 3.850 9.303 5.524 1.00 0.00 H new ATOM 1401 N PRO A 92 6.696 6.033 8.027 1.00 0.00 N ATOM 1402 CA PRO A 92 7.575 5.499 9.070 1.00 0.00 C ATOM 1403 C PRO A 92 9.021 5.966 8.913 1.00 0.00 C ATOM 1404 O PRO A 92 9.652 6.393 9.878 1.00 0.00 O ATOM 1405 CB PRO A 92 7.477 3.988 8.873 1.00 0.00 C ATOM 1406 CG PRO A 92 7.165 3.814 7.426 1.00 0.00 C ATOM 1407 CD PRO A 92 6.343 5.009 7.025 1.00 0.00 C ATOM 0 HA PRO A 92 7.278 5.835 10.063 1.00 0.00 H new ATOM 0 HB2 PRO A 92 8.411 3.493 9.139 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.697 3.557 9.501 1.00 0.00 H new ATOM 0 HG2 PRO A 92 8.079 3.755 6.835 1.00 0.00 H new ATOM 0 HG3 PRO A 92 6.615 2.889 7.255 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.584 5.339 6.014 1.00 0.00 H new ATOM 0 HD3 PRO A 92 5.277 4.784 7.041 1.00 0.00 H new ATOM 1415 N ASP A 93 9.537 5.886 7.690 1.00 0.00 N ATOM 1416 CA ASP A 93 10.907 6.301 7.409 1.00 0.00 C ATOM 1417 C ASP A 93 10.951 7.279 6.240 1.00 0.00 C ATOM 1418 O ASP A 93 11.281 6.902 5.116 1.00 0.00 O ATOM 1419 CB ASP A 93 11.781 5.083 7.098 1.00 0.00 C ATOM 1420 CG ASP A 93 13.197 5.242 7.616 1.00 0.00 C ATOM 1421 OD1 ASP A 93 14.014 5.885 6.922 1.00 0.00 O ATOM 1422 OD2 ASP A 93 13.491 4.722 8.712 1.00 0.00 O ATOM 0 H ASP A 93 9.027 5.538 6.878 1.00 0.00 H new ATOM 0 HA ASP A 93 11.295 6.802 8.296 1.00 0.00 H new ATOM 0 HB2 ASP A 93 11.332 4.194 7.541 1.00 0.00 H new ATOM 0 HB3 ASP A 93 11.807 4.923 6.020 1.00 0.00 H new ATOM 1427 N GLY A 94 10.614 8.536 6.508 1.00 0.00 N ATOM 1428 CA GLY A 94 10.622 9.537 5.462 1.00 0.00 C ATOM 1429 C GLY A 94 10.555 10.948 6.005 1.00 0.00 C ATOM 1430 O GLY A 94 11.494 11.418 6.647 1.00 0.00 O ATOM 0 H GLY A 94 10.337 8.877 7.428 1.00 0.00 H new ATOM 0 HA2 GLY A 94 11.526 9.425 4.864 1.00 0.00 H new ATOM 0 HA3 GLY A 94 9.776 9.368 4.796 1.00 0.00 H new ATOM 1434 N GLY A 95 9.442 11.629 5.747 1.00 0.00 N ATOM 1435 CA GLY A 95 9.285 12.988 6.224 1.00 0.00 C ATOM 1436 C GLY A 95 8.085 13.696 5.626 1.00 0.00 C ATOM 1437 O GLY A 95 7.258 14.241 6.359 1.00 0.00 O ATOM 0 H GLY A 95 8.650 11.264 5.218 1.00 0.00 H new ATOM 0 HA2 GLY A 95 9.188 12.976 7.310 1.00 0.00 H new ATOM 0 HA3 GLY A 95 10.186 13.555 5.991 1.00 0.00 H new ATOM 1441 N TYR A 96 7.984 13.709 4.297 1.00 0.00 N ATOM 1442 CA TYR A 96 6.865 14.381 3.643 1.00 0.00 C ATOM 1443 C TYR A 96 5.540 13.726 4.026 1.00 0.00 C ATOM 1444 O TYR A 96 5.504 12.815 4.851 1.00 0.00 O ATOM 1445 CB TYR A 96 7.034 14.430 2.115 1.00 0.00 C ATOM 1446 CG TYR A 96 7.590 13.171 1.483 1.00 0.00 C ATOM 1447 CD1 TYR A 96 6.744 12.157 1.049 1.00 0.00 C ATOM 1448 CD2 TYR A 96 8.958 13.005 1.297 1.00 0.00 C ATOM 1449 CE1 TYR A 96 7.245 11.017 0.453 1.00 0.00 C ATOM 1450 CE2 TYR A 96 9.463 11.869 0.700 1.00 0.00 C ATOM 1451 CZ TYR A 96 8.603 10.878 0.281 1.00 0.00 C ATOM 1452 OH TYR A 96 9.101 9.745 -0.315 1.00 0.00 O ATOM 0 H TYR A 96 8.651 13.270 3.663 1.00 0.00 H new ATOM 0 HA TYR A 96 6.855 15.412 3.997 1.00 0.00 H new ATOM 0 HB2 TYR A 96 6.064 14.644 1.666 1.00 0.00 H new ATOM 0 HB3 TYR A 96 7.692 15.263 1.866 1.00 0.00 H new ATOM 0 HD1 TYR A 96 5.677 12.263 1.180 1.00 0.00 H new ATOM 0 HD2 TYR A 96 9.636 13.779 1.626 1.00 0.00 H new ATOM 0 HE1 TYR A 96 6.574 10.238 0.123 1.00 0.00 H new ATOM 0 HE2 TYR A 96 10.528 11.757 0.562 1.00 0.00 H new ATOM 0 HH TYR A 96 9.726 9.302 0.296 1.00 0.00 H new ATOM 1462 N ILE A 97 4.448 14.212 3.442 1.00 0.00 N ATOM 1463 CA ILE A 97 3.121 13.687 3.749 1.00 0.00 C ATOM 1464 C ILE A 97 2.286 13.485 2.440 1.00 0.00 C ATOM 1465 O ILE A 97 1.694 14.504 2.109 1.00 0.00 O ATOM 1466 CB ILE A 97 2.407 14.626 4.771 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.925 15.934 4.126 1.00 0.00 C ATOM 1468 CG2 ILE A 97 3.348 14.938 5.925 1.00 0.00 C ATOM 1469 CD1 ILE A 97 2.962 16.625 3.265 1.00 0.00 C ATOM 0 H ILE A 97 4.456 14.966 2.756 1.00 0.00 H new ATOM 0 HA ILE A 97 3.217 12.705 4.211 1.00 0.00 H new ATOM 0 HB ILE A 97 1.525 14.100 5.137 1.00 0.00 H new ATOM 0 HG12 ILE A 97 1.047 15.722 3.516 1.00 0.00 H new ATOM 0 HG13 ILE A 97 1.609 16.619 4.913 1.00 0.00 H new ATOM 0 HG21 ILE A 97 2.846 15.594 6.637 1.00 0.00 H new ATOM 0 HG22 ILE A 97 3.632 14.011 6.424 1.00 0.00 H new ATOM 0 HG23 ILE A 97 4.241 15.433 5.543 1.00 0.00 H new ATOM 0 HD11 ILE A 97 2.539 17.539 2.849 1.00 0.00 H new ATOM 0 HD12 ILE A 97 3.833 16.872 3.872 1.00 0.00 H new ATOM 0 HD13 ILE A 97 3.262 15.962 2.453 1.00 0.00 H new ATOM 1481 N PRO A 98 1.542 12.333 2.420 1.00 0.00 N ATOM 1482 CA PRO A 98 1.831 10.887 2.716 1.00 0.00 C ATOM 1483 C PRO A 98 2.512 10.213 1.537 1.00 0.00 C ATOM 1484 O PRO A 98 2.580 10.793 0.449 1.00 0.00 O ATOM 1485 CB PRO A 98 0.470 10.272 2.954 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.035 11.257 3.866 1.00 0.00 C ATOM 1487 CD PRO A 98 1.119 12.214 3.886 1.00 0.00 C ATOM 0 HA PRO A 98 2.503 10.771 3.567 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -0.125 10.189 2.044 1.00 0.00 H new ATOM 0 HB3 PRO A 98 0.524 9.275 3.391 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -0.955 11.721 3.510 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -0.248 10.842 4.851 1.00 0.00 H new ATOM 0 HD2 PRO A 98 0.826 13.181 4.294 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.934 11.840 4.505 1.00 0.00 H new ATOM 1495 N ARG A 99 3.026 8.999 1.769 1.00 0.00 N ATOM 1496 CA ARG A 99 3.738 8.239 0.739 1.00 0.00 C ATOM 1497 C ARG A 99 3.070 6.892 0.467 1.00 0.00 C ATOM 1498 O ARG A 99 1.998 6.602 0.991 1.00 0.00 O ATOM 1499 CB ARG A 99 5.197 8.007 1.163 1.00 0.00 C ATOM 1500 CG ARG A 99 5.636 8.835 2.367 1.00 0.00 C ATOM 1501 CD ARG A 99 6.569 8.054 3.279 1.00 0.00 C ATOM 1502 NE ARG A 99 7.974 8.239 2.924 1.00 0.00 N ATOM 1503 CZ ARG A 99 8.581 9.422 2.859 1.00 0.00 C ATOM 1504 NH1 ARG A 99 7.936 10.532 3.193 1.00 0.00 N ATOM 1505 NH2 ARG A 99 9.852 9.489 2.488 1.00 0.00 N ATOM 0 H ARG A 99 2.960 8.521 2.668 1.00 0.00 H new ATOM 0 HA ARG A 99 3.708 8.827 -0.178 1.00 0.00 H new ATOM 0 HB2 ARG A 99 5.333 6.950 1.393 1.00 0.00 H new ATOM 0 HB3 ARG A 99 5.850 8.236 0.321 1.00 0.00 H new ATOM 0 HG2 ARG A 99 6.137 9.740 2.023 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.758 9.152 2.930 1.00 0.00 H new ATOM 0 HD2 ARG A 99 6.413 8.369 4.311 1.00 0.00 H new ATOM 0 HD3 ARG A 99 6.320 6.994 3.228 1.00 0.00 H new ATOM 0 HE ARG A 99 8.526 7.408 2.712 1.00 0.00 H new ATOM 0 HH11 ARG A 99 6.966 10.484 3.503 1.00 0.00 H new ATOM 0 HH12 ARG A 99 8.411 11.433 3.140 1.00 0.00 H new ATOM 0 HH21 ARG A 99 10.361 8.636 2.254 1.00 0.00 H new ATOM 0 HH22 ARG A 99 10.321 10.393 2.437 1.00 0.00 H new ATOM 1519 N ILE A 100 3.725 6.069 -0.351 1.00 0.00 N ATOM 1520 CA ILE A 100 3.207 4.746 -0.693 1.00 0.00 C ATOM 1521 C ILE A 100 4.102 3.657 -0.101 1.00 0.00 C ATOM 1522 O ILE A 100 5.324 3.705 -0.242 1.00 0.00 O ATOM 1523 CB ILE A 100 3.069 4.561 -2.237 1.00 0.00 C ATOM 1524 CG1 ILE A 100 3.089 3.080 -2.630 1.00 0.00 C ATOM 1525 CG2 ILE A 100 4.159 5.307 -2.992 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.150 2.740 -3.766 1.00 0.00 C ATOM 0 H ILE A 100 4.617 6.296 -0.790 1.00 0.00 H new ATOM 0 HA ILE A 100 2.210 4.659 -0.262 1.00 0.00 H new ATOM 0 HB ILE A 100 2.104 4.983 -2.516 1.00 0.00 H new ATOM 0 HG12 ILE A 100 4.104 2.802 -2.914 1.00 0.00 H new ATOM 0 HG13 ILE A 100 2.825 2.479 -1.760 1.00 0.00 H new ATOM 0 HG21 ILE A 100 4.029 5.154 -4.063 1.00 0.00 H new ATOM 0 HG22 ILE A 100 4.094 6.372 -2.767 1.00 0.00 H new ATOM 0 HG23 ILE A 100 5.136 4.931 -2.687 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.219 1.675 -3.988 1.00 0.00 H new ATOM 0 HD12 ILE A 100 1.128 2.986 -3.479 1.00 0.00 H new ATOM 0 HD13 ILE A 100 2.426 3.314 -4.651 1.00 0.00 H new ATOM 1538 N LEU A 101 3.491 2.679 0.574 1.00 0.00 N ATOM 1539 CA LEU A 101 4.255 1.602 1.186 1.00 0.00 C ATOM 1540 C LEU A 101 3.422 0.346 1.396 1.00 0.00 C ATOM 1541 O LEU A 101 2.197 0.377 1.285 1.00 0.00 O ATOM 1542 CB LEU A 101 4.915 2.102 2.489 1.00 0.00 C ATOM 1543 CG LEU A 101 4.180 1.877 3.828 1.00 0.00 C ATOM 1544 CD1 LEU A 101 4.305 3.108 4.707 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.713 1.542 3.656 1.00 0.00 C ATOM 0 H LEU A 101 2.482 2.615 0.707 1.00 0.00 H new ATOM 0 HA LEU A 101 5.047 1.309 0.497 1.00 0.00 H new ATOM 0 HB2 LEU A 101 5.894 1.629 2.566 1.00 0.00 H new ATOM 0 HB3 LEU A 101 5.086 3.173 2.382 1.00 0.00 H new ATOM 0 HG LEU A 101 4.659 1.018 4.297 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.783 2.937 5.648 1.00 0.00 H new ATOM 0 HD12 LEU A 101 5.358 3.307 4.907 1.00 0.00 H new ATOM 0 HD13 LEU A 101 3.864 3.965 4.198 1.00 0.00 H new ATOM 0 HD21 LEU A 101 2.256 1.396 4.635 1.00 0.00 H new ATOM 0 HD22 LEU A 101 2.211 2.360 3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.615 0.628 3.070 1.00 0.00 H new ATOM 1557 N PHE A 102 4.096 -0.768 1.665 1.00 0.00 N ATOM 1558 CA PHE A 102 3.399 -2.042 1.853 1.00 0.00 C ATOM 1559 C PHE A 102 2.817 -2.212 3.263 1.00 0.00 C ATOM 1560 O PHE A 102 2.905 -1.323 4.122 1.00 0.00 O ATOM 1561 CB PHE A 102 4.335 -3.206 1.535 1.00 0.00 C ATOM 1562 CG PHE A 102 4.600 -3.364 0.066 1.00 0.00 C ATOM 1563 CD1 PHE A 102 5.439 -2.484 -0.598 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.005 -4.389 -0.653 1.00 0.00 C ATOM 1565 CE1 PHE A 102 5.681 -2.623 -1.950 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.243 -4.533 -2.004 1.00 0.00 C ATOM 1567 CZ PHE A 102 5.082 -3.649 -2.653 1.00 0.00 C ATOM 0 H PHE A 102 5.111 -0.818 1.757 1.00 0.00 H new ATOM 0 HA PHE A 102 2.556 -2.038 1.162 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.281 -3.056 2.055 1.00 0.00 H new ATOM 0 HB3 PHE A 102 3.902 -4.129 1.921 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.909 -1.680 -0.052 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.348 -5.083 -0.150 1.00 0.00 H new ATOM 0 HE1 PHE A 102 6.337 -1.931 -2.456 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.774 -5.336 -2.553 1.00 0.00 H new ATOM 0 HZ PHE A 102 5.270 -3.760 -3.711 1.00 0.00 H new ATOM 1577 N LEU A 103 2.211 -3.373 3.498 1.00 0.00 N ATOM 1578 CA LEU A 103 1.619 -3.660 4.794 1.00 0.00 C ATOM 1579 C LEU A 103 1.149 -5.105 4.898 1.00 0.00 C ATOM 1580 O LEU A 103 0.820 -5.740 3.897 1.00 0.00 O ATOM 1581 CB LEU A 103 0.467 -2.694 5.071 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.892 -3.033 4.468 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.997 -2.868 5.501 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -1.163 -2.164 3.246 1.00 0.00 C ATOM 0 H LEU A 103 2.119 -4.122 2.812 1.00 0.00 H new ATOM 0 HA LEU A 103 2.391 -3.519 5.551 1.00 0.00 H new ATOM 0 HB2 LEU A 103 0.346 -2.615 6.151 1.00 0.00 H new ATOM 0 HB3 LEU A 103 0.760 -1.708 4.710 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.877 -4.076 4.153 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.958 -3.115 5.049 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -1.810 -3.534 6.343 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -2.016 -1.836 5.852 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -2.137 -2.418 2.827 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -1.157 -1.114 3.538 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -0.390 -2.337 2.498 1.00 0.00 H new ATOM 1596 N ASP A 104 1.119 -5.617 6.125 1.00 0.00 N ATOM 1597 CA ASP A 104 0.685 -6.988 6.363 1.00 0.00 C ATOM 1598 C ASP A 104 -0.785 -7.148 5.984 1.00 0.00 C ATOM 1599 O ASP A 104 -1.518 -6.157 5.896 1.00 0.00 O ATOM 1600 CB ASP A 104 0.908 -7.377 7.826 1.00 0.00 C ATOM 1601 CG ASP A 104 1.797 -8.596 7.970 1.00 0.00 C ATOM 1602 OD1 ASP A 104 3.030 -8.451 7.830 1.00 0.00 O ATOM 1603 OD2 ASP A 104 1.263 -9.695 8.224 1.00 0.00 O ATOM 0 H ASP A 104 1.389 -5.106 6.965 1.00 0.00 H new ATOM 0 HA ASP A 104 1.280 -7.654 5.739 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.357 -6.538 8.358 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -0.055 -7.575 8.297 1.00 0.00 H new ATOM 1608 N PRO A 105 -1.238 -8.399 5.750 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.625 -8.691 5.365 1.00 0.00 C ATOM 1610 C PRO A 105 -3.618 -8.532 6.516 1.00 0.00 C ATOM 1611 O PRO A 105 -4.549 -9.324 6.655 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.588 -10.159 4.903 1.00 0.00 C ATOM 1613 CG PRO A 105 -1.147 -10.557 4.892 1.00 0.00 C ATOM 1614 CD PRO A 105 -0.435 -9.626 5.830 1.00 0.00 C ATOM 0 HA PRO A 105 -2.966 -7.994 4.599 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -3.162 -10.794 5.578 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -3.029 -10.266 3.912 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -1.029 -11.593 5.211 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.733 -10.484 3.886 1.00 0.00 H new ATOM 0 HD2 PRO A 105 -0.403 -10.022 6.845 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.596 -9.454 5.522 1.00 0.00 H new ATOM 1622 N SER A 106 -3.425 -7.499 7.328 1.00 0.00 N ATOM 1623 CA SER A 106 -4.311 -7.231 8.451 1.00 0.00 C ATOM 1624 C SER A 106 -4.309 -5.741 8.786 1.00 0.00 C ATOM 1625 O SER A 106 -4.657 -5.345 9.897 1.00 0.00 O ATOM 1626 CB SER A 106 -3.885 -8.046 9.674 1.00 0.00 C ATOM 1627 OG SER A 106 -5.012 -8.565 10.357 1.00 0.00 O ATOM 0 H SER A 106 -2.660 -6.832 7.228 1.00 0.00 H new ATOM 0 HA SER A 106 -5.322 -7.526 8.170 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.236 -8.864 9.362 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.304 -7.418 10.349 1.00 0.00 H new ATOM 0 HG SER A 106 -4.714 -9.083 11.134 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.912 -4.920 7.814 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.867 -3.487 8.024 1.00 0.00 C ATOM 1635 C GLY A 107 -2.619 -3.047 8.766 1.00 0.00 C ATOM 1636 O GLY A 107 -2.697 -2.257 9.707 1.00 0.00 O ATOM 0 H GLY A 107 -3.621 -5.226 6.885 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.910 -2.980 7.060 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.748 -3.178 8.586 1.00 0.00 H new ATOM 1640 N LYS A 108 -1.462 -3.564 8.349 1.00 0.00 N ATOM 1641 CA LYS A 108 -0.200 -3.214 9.001 1.00 0.00 C ATOM 1642 C LYS A 108 0.679 -2.354 8.092 1.00 0.00 C ATOM 1643 O LYS A 108 1.826 -2.701 7.804 1.00 0.00 O ATOM 1644 CB LYS A 108 0.542 -4.483 9.419 1.00 0.00 C ATOM 1645 CG LYS A 108 0.598 -4.666 10.924 1.00 0.00 C ATOM 1646 CD LYS A 108 1.991 -5.059 11.391 1.00 0.00 C ATOM 1647 CE LYS A 108 2.073 -5.126 12.908 1.00 0.00 C ATOM 1648 NZ LYS A 108 3.483 -5.138 13.388 1.00 0.00 N ATOM 0 H LYS A 108 -1.373 -4.219 7.572 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.429 -2.626 9.890 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.053 -5.348 8.971 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.557 -4.451 9.024 1.00 0.00 H new ATOM 0 HG2 LYS A 108 0.297 -3.740 11.415 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.116 -5.433 11.224 1.00 0.00 H new ATOM 0 HD2 LYS A 108 2.258 -6.028 10.968 1.00 0.00 H new ATOM 0 HD3 LYS A 108 2.718 -4.337 11.018 1.00 0.00 H new ATOM 0 HE2 LYS A 108 1.550 -4.271 13.338 1.00 0.00 H new ATOM 0 HE3 LYS A 108 1.562 -6.022 13.260 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 3.519 -5.532 14.350 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 4.061 -5.723 12.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 3.855 -4.167 13.398 1.00 0.00 H new ATOM 1662 N VAL A 109 0.111 -1.245 7.621 1.00 0.00 N ATOM 1663 CA VAL A 109 0.814 -0.325 6.717 1.00 0.00 C ATOM 1664 C VAL A 109 2.006 0.334 7.371 1.00 0.00 C ATOM 1665 O VAL A 109 1.932 1.459 7.855 1.00 0.00 O ATOM 1666 CB VAL A 109 -0.115 0.762 6.125 1.00 0.00 C ATOM 1667 CG1 VAL A 109 -0.031 0.722 4.615 1.00 0.00 C ATOM 1668 CG2 VAL A 109 -1.562 0.592 6.574 1.00 0.00 C ATOM 0 H VAL A 109 -0.840 -0.957 7.850 1.00 0.00 H new ATOM 0 HA VAL A 109 1.170 -0.953 5.900 1.00 0.00 H new ATOM 0 HB VAL A 109 0.223 1.730 6.495 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -0.684 1.486 4.194 1.00 0.00 H new ATOM 0 HG12 VAL A 109 0.996 0.910 4.303 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -0.344 -0.259 4.259 1.00 0.00 H new ATOM 0 HG21 VAL A 109 -2.175 1.378 6.133 1.00 0.00 H new ATOM 0 HG22 VAL A 109 -1.932 -0.381 6.250 1.00 0.00 H new ATOM 0 HG23 VAL A 109 -1.616 0.657 7.661 1.00 0.00 H new ATOM 1678 N HIS A 110 3.120 -0.378 7.344 1.00 0.00 N ATOM 1679 CA HIS A 110 4.364 0.136 7.908 1.00 0.00 C ATOM 1680 C HIS A 110 5.511 -0.878 7.835 1.00 0.00 C ATOM 1681 O HIS A 110 6.306 -0.964 8.773 1.00 0.00 O ATOM 1682 CB HIS A 110 4.157 0.574 9.362 1.00 0.00 C ATOM 1683 CG HIS A 110 3.463 -0.447 10.211 1.00 0.00 C ATOM 1684 ND1 HIS A 110 2.091 -0.581 10.257 1.00 0.00 N ATOM 1685 CD2 HIS A 110 3.957 -1.378 11.060 1.00 0.00 C ATOM 1686 CE1 HIS A 110 1.773 -1.546 11.098 1.00 0.00 C ATOM 1687 NE2 HIS A 110 2.887 -2.048 11.598 1.00 0.00 N ATOM 0 H HIS A 110 3.192 -1.312 6.939 1.00 0.00 H new ATOM 0 HA HIS A 110 4.646 0.996 7.300 1.00 0.00 H new ATOM 0 HB2 HIS A 110 5.127 0.801 9.804 1.00 0.00 H new ATOM 0 HB3 HIS A 110 3.577 1.497 9.374 1.00 0.00 H new ATOM 0 HD2 HIS A 110 5.000 -1.560 11.274 1.00 0.00 H new ATOM 0 HE1 HIS A 110 0.771 -1.871 11.337 1.00 0.00 H new ATOM 0 HE2 HIS A 110 2.943 -2.810 12.274 1.00 0.00 H new ATOM 1696 N PRO A 111 5.639 -1.671 6.753 1.00 0.00 N ATOM 1697 CA PRO A 111 6.707 -2.646 6.651 1.00 0.00 C ATOM 1698 C PRO A 111 7.966 -2.071 6.029 1.00 0.00 C ATOM 1699 O PRO A 111 8.891 -2.806 5.687 1.00 0.00 O ATOM 1700 CB PRO A 111 6.106 -3.699 5.737 1.00 0.00 C ATOM 1701 CG PRO A 111 5.282 -2.908 4.786 1.00 0.00 C ATOM 1702 CD PRO A 111 4.784 -1.705 5.557 1.00 0.00 C ATOM 0 HA PRO A 111 7.021 -3.017 7.627 1.00 0.00 H new ATOM 0 HB2 PRO A 111 6.878 -4.269 5.220 1.00 0.00 H new ATOM 0 HB3 PRO A 111 5.500 -4.414 6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 111 5.872 -2.600 3.923 1.00 0.00 H new ATOM 0 HG3 PRO A 111 4.449 -3.500 4.408 1.00 0.00 H new ATOM 0 HD2 PRO A 111 4.878 -0.790 4.973 1.00 0.00 H new ATOM 0 HD3 PRO A 111 3.732 -1.808 5.821 1.00 0.00 H new ATOM 1710 N GLU A 112 7.983 -0.753 5.862 1.00 0.00 N ATOM 1711 CA GLU A 112 9.115 -0.066 5.257 1.00 0.00 C ATOM 1712 C GLU A 112 9.080 -0.233 3.743 1.00 0.00 C ATOM 1713 O GLU A 112 9.085 0.756 3.016 1.00 0.00 O ATOM 1714 CB GLU A 112 10.449 -0.575 5.819 1.00 0.00 C ATOM 1715 CG GLU A 112 10.494 -0.608 7.339 1.00 0.00 C ATOM 1716 CD GLU A 112 11.912 -0.640 7.878 1.00 0.00 C ATOM 1717 OE1 GLU A 112 12.836 -0.235 7.143 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.097 -1.069 9.036 1.00 0.00 O ATOM 0 H GLU A 112 7.219 -0.137 6.140 1.00 0.00 H new ATOM 0 HA GLU A 112 9.035 0.993 5.503 1.00 0.00 H new ATOM 0 HB2 GLU A 112 10.636 -1.578 5.436 1.00 0.00 H new ATOM 0 HB3 GLU A 112 11.255 0.061 5.453 1.00 0.00 H new ATOM 0 HG2 GLU A 112 9.979 0.268 7.734 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.953 -1.484 7.696 1.00 0.00 H new ATOM 1725 N ILE A 113 9.033 -1.492 3.277 1.00 0.00 N ATOM 1726 CA ILE A 113 8.984 -1.800 1.839 1.00 0.00 C ATOM 1727 C ILE A 113 8.720 -0.546 1.015 1.00 0.00 C ATOM 1728 O ILE A 113 7.560 -0.159 0.800 1.00 0.00 O ATOM 1729 CB ILE A 113 7.902 -2.850 1.510 1.00 0.00 C ATOM 1730 CG1 ILE A 113 7.869 -3.948 2.576 1.00 0.00 C ATOM 1731 CG2 ILE A 113 8.151 -3.454 0.134 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.184 -4.679 2.728 1.00 0.00 C ATOM 0 H ILE A 113 9.028 -2.316 3.879 1.00 0.00 H new ATOM 0 HA ILE A 113 9.961 -2.209 1.580 1.00 0.00 H new ATOM 0 HB ILE A 113 6.933 -2.352 1.503 1.00 0.00 H new ATOM 0 HG12 ILE A 113 7.595 -3.506 3.534 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.090 -4.667 2.322 1.00 0.00 H new ATOM 0 HG21 ILE A 113 7.380 -4.193 -0.084 1.00 0.00 H new ATOM 0 HG22 ILE A 113 8.123 -2.667 -0.619 1.00 0.00 H new ATOM 0 HG23 ILE A 113 9.129 -3.935 0.119 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.089 -5.443 3.500 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.450 -5.150 1.782 1.00 0.00 H new ATOM 0 HD13 ILE A 113 9.963 -3.971 3.012 1.00 0.00 H new ATOM 1744 N ILE A 114 9.817 0.091 0.596 1.00 0.00 N ATOM 1745 CA ILE A 114 9.770 1.326 -0.174 1.00 0.00 C ATOM 1746 C ILE A 114 9.996 1.077 -1.669 1.00 0.00 C ATOM 1747 O ILE A 114 9.834 -0.039 -2.162 1.00 0.00 O ATOM 1748 CB ILE A 114 10.832 2.328 0.339 1.00 0.00 C ATOM 1749 CG1 ILE A 114 12.238 1.905 -0.119 1.00 0.00 C ATOM 1750 CG2 ILE A 114 10.766 2.443 1.852 1.00 0.00 C ATOM 1751 CD1 ILE A 114 13.343 2.227 0.869 1.00 0.00 C ATOM 0 H ILE A 114 10.763 -0.241 0.785 1.00 0.00 H new ATOM 0 HA ILE A 114 8.772 1.744 -0.041 1.00 0.00 H new ATOM 0 HB ILE A 114 10.618 3.309 -0.086 1.00 0.00 H new ATOM 0 HG12 ILE A 114 12.238 0.831 -0.308 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.461 2.395 -1.067 1.00 0.00 H new ATOM 0 HG21 ILE A 114 11.519 3.152 2.196 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.777 2.793 2.147 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.954 1.467 2.300 1.00 0.00 H new ATOM 0 HD11 ILE A 114 14.300 1.895 0.466 1.00 0.00 H new ATOM 0 HD12 ILE A 114 13.376 3.303 1.041 1.00 0.00 H new ATOM 0 HD13 ILE A 114 13.149 1.715 1.812 1.00 0.00 H new ATOM 1763 N ASN A 115 10.372 2.141 -2.376 1.00 0.00 N ATOM 1764 CA ASN A 115 10.629 2.086 -3.808 1.00 0.00 C ATOM 1765 C ASN A 115 11.839 1.209 -4.123 1.00 0.00 C ATOM 1766 O ASN A 115 11.766 0.308 -4.958 1.00 0.00 O ATOM 1767 CB ASN A 115 10.849 3.513 -4.324 1.00 0.00 C ATOM 1768 CG ASN A 115 11.225 3.573 -5.793 1.00 0.00 C ATOM 1769 OD1 ASN A 115 11.977 2.735 -6.292 1.00 0.00 O ATOM 1770 ND2 ASN A 115 10.699 4.572 -6.492 1.00 0.00 N ATOM 0 H ASN A 115 10.506 3.066 -1.968 1.00 0.00 H new ATOM 0 HA ASN A 115 9.769 1.640 -4.307 1.00 0.00 H new ATOM 0 HB2 ASN A 115 9.940 4.093 -4.166 1.00 0.00 H new ATOM 0 HB3 ASN A 115 11.635 3.987 -3.736 1.00 0.00 H new ATOM 0 HD21 ASN A 115 10.913 4.668 -7.485 1.00 0.00 H new ATOM 0 HD22 ASN A 115 10.081 5.243 -6.036 1.00 0.00 H new ATOM 1777 N GLU A 116 12.946 1.491 -3.452 1.00 0.00 N ATOM 1778 CA GLU A 116 14.183 0.745 -3.652 1.00 0.00 C ATOM 1779 C GLU A 116 14.740 0.989 -5.047 1.00 0.00 C ATOM 1780 O GLU A 116 15.330 0.098 -5.662 1.00 0.00 O ATOM 1781 CB GLU A 116 13.958 -0.752 -3.419 1.00 0.00 C ATOM 1782 CG GLU A 116 14.324 -1.207 -2.014 1.00 0.00 C ATOM 1783 CD GLU A 116 15.759 -0.880 -1.652 1.00 0.00 C ATOM 1784 OE1 GLU A 116 16.648 -1.708 -1.941 1.00 0.00 O ATOM 1785 OE2 GLU A 116 15.992 0.205 -1.080 1.00 0.00 O ATOM 0 H GLU A 116 13.014 2.236 -2.759 1.00 0.00 H new ATOM 0 HA GLU A 116 14.913 1.099 -2.924 1.00 0.00 H new ATOM 0 HB2 GLU A 116 12.911 -0.988 -3.608 1.00 0.00 H new ATOM 0 HB3 GLU A 116 14.548 -1.317 -4.141 1.00 0.00 H new ATOM 0 HG2 GLU A 116 13.655 -0.733 -1.296 1.00 0.00 H new ATOM 0 HG3 GLU A 116 14.168 -2.283 -1.932 1.00 0.00 H new ATOM 1792 N ASN A 117 14.551 2.207 -5.536 1.00 0.00 N ATOM 1793 CA ASN A 117 15.034 2.590 -6.858 1.00 0.00 C ATOM 1794 C ASN A 117 15.149 4.108 -6.985 1.00 0.00 C ATOM 1795 O ASN A 117 16.037 4.616 -7.671 1.00 0.00 O ATOM 1796 CB ASN A 117 14.100 2.051 -7.943 1.00 0.00 C ATOM 1797 CG ASN A 117 14.812 1.852 -9.268 1.00 0.00 C ATOM 1798 OD1 ASN A 117 14.455 2.462 -10.275 1.00 0.00 O ATOM 1799 ND2 ASN A 117 15.827 0.994 -9.273 1.00 0.00 N ATOM 0 H ASN A 117 14.064 2.951 -5.035 1.00 0.00 H new ATOM 0 HA ASN A 117 16.026 2.157 -6.988 1.00 0.00 H new ATOM 0 HB2 ASN A 117 13.675 1.102 -7.615 1.00 0.00 H new ATOM 0 HB3 ASN A 117 13.268 2.742 -8.080 1.00 0.00 H new ATOM 0 HD21 ASN A 117 16.344 0.820 -10.135 1.00 0.00 H new ATOM 0 HD22 ASN A 117 16.089 0.510 -8.415 1.00 0.00 H new ATOM 1806 N GLY A 118 14.246 4.827 -6.325 1.00 0.00 N ATOM 1807 CA GLY A 118 14.266 6.277 -6.384 1.00 0.00 C ATOM 1808 C GLY A 118 15.513 6.869 -5.759 1.00 0.00 C ATOM 1809 O GLY A 118 16.549 6.209 -5.674 1.00 0.00 O ATOM 0 H GLY A 118 13.501 4.431 -5.751 1.00 0.00 H new ATOM 0 HA2 GLY A 118 14.199 6.595 -7.424 1.00 0.00 H new ATOM 0 HA3 GLY A 118 13.387 6.670 -5.873 1.00 0.00 H new ATOM 1813 N ASN A 119 15.414 8.121 -5.322 1.00 0.00 N ATOM 1814 CA ASN A 119 16.541 8.808 -4.704 1.00 0.00 C ATOM 1815 C ASN A 119 16.600 8.518 -3.205 1.00 0.00 C ATOM 1816 O ASN A 119 15.591 8.164 -2.592 1.00 0.00 O ATOM 1817 CB ASN A 119 16.433 10.316 -4.938 1.00 0.00 C ATOM 1818 CG ASN A 119 15.162 10.901 -4.355 1.00 0.00 C ATOM 1819 OD1 ASN A 119 15.037 11.059 -3.141 1.00 0.00 O ATOM 1820 ND2 ASN A 119 14.208 11.225 -5.221 1.00 0.00 N ATOM 0 H ASN A 119 14.563 8.680 -5.385 1.00 0.00 H new ATOM 0 HA ASN A 119 17.458 8.439 -5.164 1.00 0.00 H new ATOM 0 HB2 ASN A 119 17.296 10.813 -4.494 1.00 0.00 H new ATOM 0 HB3 ASN A 119 16.465 10.518 -6.009 1.00 0.00 H new ATOM 0 HD21 ASN A 119 13.330 11.622 -4.887 1.00 0.00 H new ATOM 0 HD22 ASN A 119 14.354 11.077 -6.220 1.00 0.00 H new ATOM 1827 N PRO A 120 17.793 8.661 -2.594 1.00 0.00 N ATOM 1828 CA PRO A 120 17.985 8.412 -1.162 1.00 0.00 C ATOM 1829 C PRO A 120 17.456 9.552 -0.293 1.00 0.00 C ATOM 1830 O PRO A 120 18.168 10.078 0.561 1.00 0.00 O ATOM 1831 CB PRO A 120 19.504 8.304 -1.034 1.00 0.00 C ATOM 1832 CG PRO A 120 20.032 9.175 -2.120 1.00 0.00 C ATOM 1833 CD PRO A 120 19.046 9.075 -3.254 1.00 0.00 C ATOM 0 HA PRO A 120 17.445 7.528 -0.823 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.845 8.640 -0.055 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.840 7.274 -1.152 1.00 0.00 H new ATOM 0 HG2 PRO A 120 20.131 10.206 -1.779 1.00 0.00 H new ATOM 0 HG3 PRO A 120 21.023 8.847 -2.435 1.00 0.00 H new ATOM 0 HD2 PRO A 120 18.931 10.029 -3.769 1.00 0.00 H new ATOM 0 HD3 PRO A 120 19.366 8.346 -3.999 1.00 0.00 H new ATOM 1841 N SER A 121 16.199 9.921 -0.514 1.00 0.00 N ATOM 1842 CA SER A 121 15.562 10.989 0.246 1.00 0.00 C ATOM 1843 C SER A 121 14.087 11.062 -0.116 1.00 0.00 C ATOM 1844 O SER A 121 13.493 12.139 -0.154 1.00 0.00 O ATOM 1845 CB SER A 121 16.245 12.329 -0.038 1.00 0.00 C ATOM 1846 OG SER A 121 17.190 12.644 0.972 1.00 0.00 O ATOM 0 H SER A 121 15.598 9.493 -1.218 1.00 0.00 H new ATOM 0 HA SER A 121 15.660 10.774 1.310 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.743 12.289 -1.007 1.00 0.00 H new ATOM 0 HB3 SER A 121 15.495 13.118 -0.098 1.00 0.00 H new ATOM 0 HG SER A 121 17.780 11.875 1.119 1.00 0.00 H new ATOM 1852 N TYR A 122 13.513 9.900 -0.397 1.00 0.00 N ATOM 1853 CA TYR A 122 12.115 9.799 -0.779 1.00 0.00 C ATOM 1854 C TYR A 122 11.675 8.339 -0.737 1.00 0.00 C ATOM 1855 O TYR A 122 10.727 7.980 -0.037 1.00 0.00 O ATOM 1856 CB TYR A 122 11.933 10.384 -2.180 1.00 0.00 C ATOM 1857 CG TYR A 122 11.179 11.696 -2.215 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.792 11.724 -2.268 1.00 0.00 C ATOM 1859 CD2 TYR A 122 11.859 12.908 -2.201 1.00 0.00 C ATOM 1860 CE1 TYR A 122 9.103 12.921 -2.303 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.177 14.109 -2.236 1.00 0.00 C ATOM 1862 CZ TYR A 122 9.799 14.111 -2.286 1.00 0.00 C ATOM 1863 OH TYR A 122 9.117 15.305 -2.323 1.00 0.00 O ATOM 0 H TYR A 122 14.003 9.006 -0.366 1.00 0.00 H new ATOM 0 HA TYR A 122 11.496 10.362 -0.081 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.915 10.531 -2.630 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.404 9.658 -2.798 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.242 10.794 -2.282 1.00 0.00 H new ATOM 0 HD2 TYR A 122 12.938 12.911 -2.162 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.024 12.925 -2.344 1.00 0.00 H new ATOM 0 HE2 TYR A 122 11.721 15.042 -2.224 1.00 0.00 H new ATOM 0 HH TYR A 122 9.756 16.048 -2.303 1.00 0.00 H new ATOM 1873 N LYS A 123 12.396 7.498 -1.470 1.00 0.00 N ATOM 1874 CA LYS A 123 12.123 6.059 -1.510 1.00 0.00 C ATOM 1875 C LYS A 123 10.623 5.745 -1.625 1.00 0.00 C ATOM 1876 O LYS A 123 10.087 5.623 -2.724 1.00 0.00 O ATOM 1877 CB LYS A 123 12.711 5.400 -0.252 1.00 0.00 C ATOM 1878 CG LYS A 123 14.154 4.951 -0.409 1.00 0.00 C ATOM 1879 CD LYS A 123 14.329 4.050 -1.618 1.00 0.00 C ATOM 1880 CE LYS A 123 15.052 4.763 -2.750 1.00 0.00 C ATOM 1881 NZ LYS A 123 16.378 4.150 -3.034 1.00 0.00 N ATOM 0 H LYS A 123 13.182 7.788 -2.051 1.00 0.00 H new ATOM 0 HA LYS A 123 12.596 5.654 -2.405 1.00 0.00 H new ATOM 0 HB2 LYS A 123 12.648 6.104 0.578 1.00 0.00 H new ATOM 0 HB3 LYS A 123 12.099 4.538 0.014 1.00 0.00 H new ATOM 0 HG2 LYS A 123 14.799 5.824 -0.509 1.00 0.00 H new ATOM 0 HG3 LYS A 123 14.471 4.421 0.489 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.890 3.161 -1.331 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.352 3.713 -1.965 1.00 0.00 H new ATOM 0 HE2 LYS A 123 14.437 4.732 -3.650 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.185 5.813 -2.491 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 16.839 4.664 -3.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.974 4.202 -2.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.249 3.155 -3.306 1.00 0.00 H new ATOM 1895 N TYR A 124 9.970 5.596 -0.470 1.00 0.00 N ATOM 1896 CA TYR A 124 8.537 5.273 -0.374 1.00 0.00 C ATOM 1897 C TYR A 124 7.690 5.880 -1.498 1.00 0.00 C ATOM 1898 O TYR A 124 6.637 5.348 -1.837 1.00 0.00 O ATOM 1899 CB TYR A 124 7.984 5.759 0.964 1.00 0.00 C ATOM 1900 CG TYR A 124 8.529 5.025 2.172 1.00 0.00 C ATOM 1901 CD1 TYR A 124 9.786 5.324 2.687 1.00 0.00 C ATOM 1902 CD2 TYR A 124 7.781 4.042 2.805 1.00 0.00 C ATOM 1903 CE1 TYR A 124 10.280 4.661 3.793 1.00 0.00 C ATOM 1904 CE2 TYR A 124 8.267 3.375 3.915 1.00 0.00 C ATOM 1905 CZ TYR A 124 9.517 3.688 4.402 1.00 0.00 C ATOM 1906 OH TYR A 124 10.005 3.025 5.506 1.00 0.00 O ATOM 0 H TYR A 124 10.423 5.697 0.438 1.00 0.00 H new ATOM 0 HA TYR A 124 8.469 4.189 -0.464 1.00 0.00 H new ATOM 0 HB2 TYR A 124 8.205 6.821 1.070 1.00 0.00 H new ATOM 0 HB3 TYR A 124 6.899 5.658 0.952 1.00 0.00 H new ATOM 0 HD1 TYR A 124 10.386 6.088 2.214 1.00 0.00 H new ATOM 0 HD2 TYR A 124 6.802 3.793 2.424 1.00 0.00 H new ATOM 0 HE1 TYR A 124 11.259 4.904 4.179 1.00 0.00 H new ATOM 0 HE2 TYR A 124 7.671 2.614 4.397 1.00 0.00 H new ATOM 0 HH TYR A 124 10.982 2.977 5.453 1.00 0.00 H new ATOM 1916 N PHE A 125 8.126 7.004 -2.049 1.00 0.00 N ATOM 1917 CA PHE A 125 7.375 7.675 -3.106 1.00 0.00 C ATOM 1918 C PHE A 125 7.598 7.018 -4.473 1.00 0.00 C ATOM 1919 O PHE A 125 8.705 7.057 -5.013 1.00 0.00 O ATOM 1920 CB PHE A 125 7.785 9.145 -3.167 1.00 0.00 C ATOM 1921 CG PHE A 125 6.964 9.963 -4.117 1.00 0.00 C ATOM 1922 CD1 PHE A 125 5.630 10.223 -3.854 1.00 0.00 C ATOM 1923 CD2 PHE A 125 7.529 10.477 -5.271 1.00 0.00 C ATOM 1924 CE1 PHE A 125 4.874 10.981 -4.724 1.00 0.00 C ATOM 1925 CE2 PHE A 125 6.779 11.235 -6.146 1.00 0.00 C ATOM 1926 CZ PHE A 125 5.450 11.488 -5.873 1.00 0.00 C ATOM 0 H PHE A 125 8.993 7.471 -1.784 1.00 0.00 H new ATOM 0 HA PHE A 125 6.315 7.590 -2.869 1.00 0.00 H new ATOM 0 HB2 PHE A 125 7.706 9.576 -2.169 1.00 0.00 H new ATOM 0 HB3 PHE A 125 8.833 9.208 -3.460 1.00 0.00 H new ATOM 0 HD1 PHE A 125 5.176 9.828 -2.957 1.00 0.00 H new ATOM 0 HD2 PHE A 125 8.569 10.282 -5.489 1.00 0.00 H new ATOM 0 HE1 PHE A 125 3.834 11.178 -4.508 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.231 11.630 -7.044 1.00 0.00 H new ATOM 0 HZ PHE A 125 4.861 12.081 -6.557 1.00 0.00 H new ATOM 1936 N TYR A 126 6.538 6.433 -5.044 1.00 0.00 N ATOM 1937 CA TYR A 126 6.635 5.799 -6.361 1.00 0.00 C ATOM 1938 C TYR A 126 5.702 6.476 -7.355 1.00 0.00 C ATOM 1939 O TYR A 126 4.531 6.111 -7.455 1.00 0.00 O ATOM 1940 CB TYR A 126 6.278 4.302 -6.344 1.00 0.00 C ATOM 1941 CG TYR A 126 6.576 3.555 -5.067 1.00 0.00 C ATOM 1942 CD1 TYR A 126 7.576 3.960 -4.201 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.838 2.429 -4.736 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.834 3.264 -3.034 1.00 0.00 C ATOM 1945 CE2 TYR A 126 6.087 1.724 -3.576 1.00 0.00 C ATOM 1946 CZ TYR A 126 7.083 2.147 -2.727 1.00 0.00 C ATOM 1947 OH TYR A 126 7.330 1.451 -1.568 1.00 0.00 O ATOM 0 H TYR A 126 5.612 6.386 -4.618 1.00 0.00 H new ATOM 0 HA TYR A 126 7.679 5.908 -6.655 1.00 0.00 H new ATOM 0 HB2 TYR A 126 5.214 4.202 -6.558 1.00 0.00 H new ATOM 0 HB3 TYR A 126 6.814 3.814 -7.158 1.00 0.00 H new ATOM 0 HD1 TYR A 126 8.164 4.833 -4.440 1.00 0.00 H new ATOM 0 HD2 TYR A 126 5.053 2.097 -5.399 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.618 3.592 -2.367 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.504 0.847 -3.337 1.00 0.00 H new ATOM 0 HH TYR A 126 6.843 1.867 -0.826 1.00 0.00 H new ATOM 1957 N VAL A 127 6.217 7.433 -8.111 1.00 0.00 N ATOM 1958 CA VAL A 127 5.397 8.105 -9.113 1.00 0.00 C ATOM 1959 C VAL A 127 5.218 7.180 -10.315 1.00 0.00 C ATOM 1960 O VAL A 127 4.289 6.373 -10.353 1.00 0.00 O ATOM 1961 CB VAL A 127 5.994 9.459 -9.573 1.00 0.00 C ATOM 1962 CG1 VAL A 127 5.333 10.611 -8.835 1.00 0.00 C ATOM 1963 CG2 VAL A 127 7.507 9.496 -9.387 1.00 0.00 C ATOM 0 H VAL A 127 7.182 7.759 -8.054 1.00 0.00 H new ATOM 0 HA VAL A 127 4.435 8.328 -8.653 1.00 0.00 H new ATOM 0 HB VAL A 127 5.791 9.567 -10.639 1.00 0.00 H new ATOM 0 HG11 VAL A 127 5.765 11.554 -9.171 1.00 0.00 H new ATOM 0 HG12 VAL A 127 4.263 10.608 -9.041 1.00 0.00 H new ATOM 0 HG13 VAL A 127 5.497 10.498 -7.763 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.891 10.460 -9.720 1.00 0.00 H new ATOM 0 HG22 VAL A 127 7.748 9.354 -8.333 1.00 0.00 H new ATOM 0 HG23 VAL A 127 7.965 8.700 -9.974 1.00 0.00 H new ATOM 1973 N SER A 128 6.119 7.295 -11.284 1.00 0.00 N ATOM 1974 CA SER A 128 6.080 6.461 -12.482 1.00 0.00 C ATOM 1975 C SER A 128 5.777 4.993 -12.154 1.00 0.00 C ATOM 1976 O SER A 128 6.164 4.473 -11.097 1.00 0.00 O ATOM 1977 CB SER A 128 7.410 6.561 -13.234 1.00 0.00 C ATOM 1978 OG SER A 128 8.328 5.579 -12.789 1.00 0.00 O ATOM 0 H SER A 128 6.891 7.962 -11.264 1.00 0.00 H new ATOM 0 HA SER A 128 5.271 6.832 -13.111 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.236 6.441 -14.303 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.838 7.553 -13.090 1.00 0.00 H new ATOM 0 HG SER A 128 8.864 5.942 -12.053 1.00 0.00 H new ATOM 1984 N ALA A 129 5.088 4.331 -13.078 1.00 0.00 N ATOM 1985 CA ALA A 129 4.731 2.930 -12.916 1.00 0.00 C ATOM 1986 C ALA A 129 5.978 2.055 -12.877 1.00 0.00 C ATOM 1987 O ALA A 129 5.936 0.914 -12.420 1.00 0.00 O ATOM 1988 CB ALA A 129 3.811 2.488 -14.045 1.00 0.00 C ATOM 0 H ALA A 129 4.765 4.747 -13.951 1.00 0.00 H new ATOM 0 HA ALA A 129 4.205 2.817 -11.968 1.00 0.00 H new ATOM 0 HB1 ALA A 129 3.551 1.438 -13.912 1.00 0.00 H new ATOM 0 HB2 ALA A 129 2.903 3.091 -14.032 1.00 0.00 H new ATOM 0 HB3 ALA A 129 4.319 2.618 -15.000 1.00 0.00 H new ATOM 1994 N GLU A 130 7.087 2.600 -13.373 1.00 0.00 N ATOM 1995 CA GLU A 130 8.350 1.878 -13.412 1.00 0.00 C ATOM 1996 C GLU A 130 8.789 1.422 -12.022 1.00 0.00 C ATOM 1997 O GLU A 130 9.210 0.277 -11.843 1.00 0.00 O ATOM 1998 CB GLU A 130 9.439 2.752 -14.038 1.00 0.00 C ATOM 1999 CG GLU A 130 9.525 2.621 -15.551 1.00 0.00 C ATOM 2000 CD GLU A 130 10.913 2.920 -16.083 1.00 0.00 C ATOM 2001 OE1 GLU A 130 11.834 2.118 -15.825 1.00 0.00 O ATOM 2002 OE2 GLU A 130 11.079 3.959 -16.757 1.00 0.00 O ATOM 0 H GLU A 130 7.133 3.545 -13.755 1.00 0.00 H new ATOM 0 HA GLU A 130 8.198 0.988 -14.023 1.00 0.00 H new ATOM 0 HB2 GLU A 130 9.250 3.794 -13.781 1.00 0.00 H new ATOM 0 HB3 GLU A 130 10.402 2.486 -13.603 1.00 0.00 H new ATOM 0 HG2 GLU A 130 9.238 1.610 -15.842 1.00 0.00 H new ATOM 0 HG3 GLU A 130 8.809 3.301 -16.012 1.00 0.00 H new ATOM 2009 N GLN A 131 8.709 2.309 -11.034 1.00 0.00 N ATOM 2010 CA GLN A 131 9.125 1.938 -9.695 1.00 0.00 C ATOM 2011 C GLN A 131 8.059 1.135 -8.974 1.00 0.00 C ATOM 2012 O GLN A 131 8.348 0.078 -8.416 1.00 0.00 O ATOM 2013 CB GLN A 131 9.488 3.143 -8.849 1.00 0.00 C ATOM 2014 CG GLN A 131 8.561 4.335 -9.012 1.00 0.00 C ATOM 2015 CD GLN A 131 9.238 5.513 -9.682 1.00 0.00 C ATOM 2016 OE1 GLN A 131 9.756 5.399 -10.793 1.00 0.00 O ATOM 2017 NE2 GLN A 131 9.242 6.656 -9.004 1.00 0.00 N ATOM 0 H GLN A 131 8.368 3.265 -11.135 1.00 0.00 H new ATOM 0 HA GLN A 131 10.014 1.321 -9.825 1.00 0.00 H new ATOM 0 HB2 GLN A 131 9.494 2.845 -7.800 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.503 3.452 -9.098 1.00 0.00 H new ATOM 0 HG2 GLN A 131 7.693 4.037 -9.600 1.00 0.00 H new ATOM 0 HG3 GLN A 131 8.193 4.641 -8.033 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.801 6.706 -8.086 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.686 7.483 -9.402 1.00 0.00 H new ATOM 2026 N VAL A 132 6.824 1.629 -8.971 1.00 0.00 N ATOM 2027 CA VAL A 132 5.746 0.918 -8.290 1.00 0.00 C ATOM 2028 C VAL A 132 5.611 -0.498 -8.829 1.00 0.00 C ATOM 2029 O VAL A 132 5.090 -1.381 -8.151 1.00 0.00 O ATOM 2030 CB VAL A 132 4.397 1.650 -8.401 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.070 1.967 -9.848 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.283 0.835 -7.758 1.00 0.00 C ATOM 0 H VAL A 132 6.548 2.501 -9.423 1.00 0.00 H new ATOM 0 HA VAL A 132 6.014 0.880 -7.234 1.00 0.00 H new ATOM 0 HB VAL A 132 4.480 2.593 -7.861 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.112 2.484 -9.900 1.00 0.00 H new ATOM 0 HG12 VAL A 132 4.849 2.604 -10.266 1.00 0.00 H new ATOM 0 HG13 VAL A 132 4.013 1.041 -10.420 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.339 1.373 -7.849 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.201 -0.129 -8.260 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.510 0.677 -6.704 1.00 0.00 H new ATOM 2042 N VAL A 133 6.101 -0.716 -10.044 1.00 0.00 N ATOM 2043 CA VAL A 133 6.043 -2.033 -10.647 1.00 0.00 C ATOM 2044 C VAL A 133 7.187 -2.906 -10.148 1.00 0.00 C ATOM 2045 O VAL A 133 7.032 -4.121 -10.029 1.00 0.00 O ATOM 2046 CB VAL A 133 6.082 -1.974 -12.187 1.00 0.00 C ATOM 2047 CG1 VAL A 133 7.462 -1.564 -12.674 1.00 0.00 C ATOM 2048 CG2 VAL A 133 5.684 -3.320 -12.775 1.00 0.00 C ATOM 0 H VAL A 133 6.539 -0.000 -10.624 1.00 0.00 H new ATOM 0 HA VAL A 133 5.090 -2.469 -10.349 1.00 0.00 H new ATOM 0 HB VAL A 133 5.367 -1.223 -12.523 1.00 0.00 H new ATOM 0 HG11 VAL A 133 7.468 -1.529 -13.763 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.710 -0.579 -12.278 1.00 0.00 H new ATOM 0 HG13 VAL A 133 8.199 -2.290 -12.331 1.00 0.00 H new ATOM 0 HG21 VAL A 133 5.715 -3.265 -13.863 1.00 0.00 H new ATOM 0 HG22 VAL A 133 6.377 -4.087 -12.430 1.00 0.00 H new ATOM 0 HG23 VAL A 133 4.674 -3.573 -12.454 1.00 0.00 H new ATOM 2058 N GLN A 134 8.340 -2.295 -9.848 1.00 0.00 N ATOM 2059 CA GLN A 134 9.469 -3.080 -9.359 1.00 0.00 C ATOM 2060 C GLN A 134 9.278 -3.377 -7.886 1.00 0.00 C ATOM 2061 O GLN A 134 9.643 -4.445 -7.401 1.00 0.00 O ATOM 2062 CB GLN A 134 10.799 -2.368 -9.594 1.00 0.00 C ATOM 2063 CG GLN A 134 10.764 -0.896 -9.250 1.00 0.00 C ATOM 2064 CD GLN A 134 12.126 -0.238 -9.360 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.270 0.819 -9.973 1.00 0.00 O ATOM 2066 NE2 GLN A 134 13.137 -0.864 -8.764 1.00 0.00 N ATOM 0 H GLN A 134 8.509 -1.293 -9.933 1.00 0.00 H new ATOM 0 HA GLN A 134 9.502 -4.015 -9.918 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.572 -2.854 -8.999 1.00 0.00 H new ATOM 0 HB3 GLN A 134 11.083 -2.482 -10.640 1.00 0.00 H new ATOM 0 HG2 GLN A 134 10.065 -0.388 -9.914 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.386 -0.773 -8.235 1.00 0.00 H new ATOM 0 HE21 GLN A 134 12.973 -1.739 -8.266 1.00 0.00 H new ATOM 0 HE22 GLN A 134 14.077 -0.469 -8.805 1.00 0.00 H new ATOM 2075 N GLY A 135 8.671 -2.431 -7.187 1.00 0.00 N ATOM 2076 CA GLY A 135 8.405 -2.615 -5.782 1.00 0.00 C ATOM 2077 C GLY A 135 7.264 -3.583 -5.570 1.00 0.00 C ATOM 2078 O GLY A 135 7.185 -4.239 -4.532 1.00 0.00 O ATOM 0 H GLY A 135 8.359 -1.539 -7.571 1.00 0.00 H new ATOM 0 HA2 GLY A 135 9.300 -2.988 -5.284 1.00 0.00 H new ATOM 0 HA3 GLY A 135 8.162 -1.655 -5.325 1.00 0.00 H new ATOM 2082 N MET A 136 6.375 -3.683 -6.565 1.00 0.00 N ATOM 2083 CA MET A 136 5.237 -4.593 -6.464 1.00 0.00 C ATOM 2084 C MET A 136 5.575 -5.965 -7.049 1.00 0.00 C ATOM 2085 O MET A 136 5.092 -6.990 -6.565 1.00 0.00 O ATOM 2086 CB MET A 136 4.001 -3.999 -7.156 1.00 0.00 C ATOM 2087 CG MET A 136 4.058 -4.023 -8.677 1.00 0.00 C ATOM 2088 SD MET A 136 2.791 -5.080 -9.407 1.00 0.00 S ATOM 2089 CE MET A 136 3.072 -6.616 -8.530 1.00 0.00 C ATOM 0 H MET A 136 6.423 -3.153 -7.435 1.00 0.00 H new ATOM 0 HA MET A 136 5.008 -4.725 -5.407 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.118 -4.548 -6.829 1.00 0.00 H new ATOM 0 HB3 MET A 136 3.875 -2.968 -6.826 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.941 -3.008 -9.057 1.00 0.00 H new ATOM 0 HG3 MET A 136 5.041 -4.370 -8.994 1.00 0.00 H new ATOM 0 HE1 MET A 136 2.286 -7.328 -8.783 1.00 0.00 H new ATOM 0 HE2 MET A 136 4.040 -7.027 -8.817 1.00 0.00 H new ATOM 0 HE3 MET A 136 3.061 -6.429 -7.456 1.00 0.00 H new ATOM 2099 N LYS A 137 6.408 -5.979 -8.084 1.00 0.00 N ATOM 2100 CA LYS A 137 6.807 -7.227 -8.730 1.00 0.00 C ATOM 2101 C LYS A 137 7.848 -7.982 -7.898 1.00 0.00 C ATOM 2102 O LYS A 137 8.106 -9.161 -8.141 1.00 0.00 O ATOM 2103 CB LYS A 137 7.330 -6.961 -10.146 1.00 0.00 C ATOM 2104 CG LYS A 137 8.774 -6.486 -10.209 1.00 0.00 C ATOM 2105 CD LYS A 137 9.064 -5.745 -11.509 1.00 0.00 C ATOM 2106 CE LYS A 137 8.706 -6.577 -12.732 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.912 -7.174 -13.372 1.00 0.00 N ATOM 0 H LYS A 137 6.821 -5.141 -8.494 1.00 0.00 H new ATOM 0 HA LYS A 137 5.922 -7.860 -8.803 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.236 -7.876 -10.732 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.694 -6.213 -10.619 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.980 -5.831 -9.362 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.443 -7.342 -10.120 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.501 -4.812 -11.528 1.00 0.00 H new ATOM 0 HD3 LYS A 137 10.121 -5.480 -11.547 1.00 0.00 H new ATOM 0 HE2 LYS A 137 8.019 -7.371 -12.442 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.183 -5.952 -13.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.625 -7.733 -14.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.557 -6.415 -13.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 10.397 -7.791 -12.690 1.00 0.00 H new ATOM 2121 N GLU A 138 8.435 -7.304 -6.913 1.00 0.00 N ATOM 2122 CA GLU A 138 9.435 -7.923 -6.048 1.00 0.00 C ATOM 2123 C GLU A 138 8.814 -8.321 -4.717 1.00 0.00 C ATOM 2124 O GLU A 138 8.793 -9.498 -4.353 1.00 0.00 O ATOM 2125 CB GLU A 138 10.610 -6.972 -5.810 1.00 0.00 C ATOM 2126 CG GLU A 138 11.968 -7.616 -6.033 1.00 0.00 C ATOM 2127 CD GLU A 138 13.079 -6.914 -5.277 1.00 0.00 C ATOM 2128 OE1 GLU A 138 13.006 -5.675 -5.130 1.00 0.00 O ATOM 2129 OE2 GLU A 138 14.022 -7.600 -4.833 1.00 0.00 O ATOM 0 H GLU A 138 8.235 -6.328 -6.695 1.00 0.00 H new ATOM 0 HA GLU A 138 9.806 -8.818 -6.548 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.511 -6.113 -6.473 1.00 0.00 H new ATOM 0 HB3 GLU A 138 10.560 -6.594 -4.789 1.00 0.00 H new ATOM 0 HG2 GLU A 138 11.926 -8.660 -5.722 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.198 -7.609 -7.098 1.00 0.00 H new ATOM 2136 N ALA A 139 8.302 -7.330 -4.000 1.00 0.00 N ATOM 2137 CA ALA A 139 7.666 -7.565 -2.709 1.00 0.00 C ATOM 2138 C ALA A 139 6.609 -8.660 -2.819 1.00 0.00 C ATOM 2139 O ALA A 139 6.302 -9.344 -1.844 1.00 0.00 O ATOM 2140 CB ALA A 139 7.046 -6.278 -2.184 1.00 0.00 C ATOM 0 H ALA A 139 8.314 -6.352 -4.291 1.00 0.00 H new ATOM 0 HA ALA A 139 8.429 -7.897 -2.005 1.00 0.00 H new ATOM 0 HB1 ALA A 139 6.575 -6.468 -1.220 1.00 0.00 H new ATOM 0 HB2 ALA A 139 7.822 -5.522 -2.066 1.00 0.00 H new ATOM 0 HB3 ALA A 139 6.296 -5.921 -2.890 1.00 0.00 H new ATOM 2146 N GLN A 140 6.056 -8.816 -4.017 1.00 0.00 N ATOM 2147 CA GLN A 140 5.035 -9.821 -4.268 1.00 0.00 C ATOM 2148 C GLN A 140 5.555 -11.237 -4.010 1.00 0.00 C ATOM 2149 O GLN A 140 4.771 -12.182 -3.922 1.00 0.00 O ATOM 2150 CB GLN A 140 4.540 -9.705 -5.708 1.00 0.00 C ATOM 2151 CG GLN A 140 5.655 -9.707 -6.738 1.00 0.00 C ATOM 2152 CD GLN A 140 6.211 -11.094 -6.998 1.00 0.00 C ATOM 2153 OE1 GLN A 140 7.417 -11.320 -6.906 1.00 0.00 O ATOM 2154 NE2 GLN A 140 5.330 -12.033 -7.326 1.00 0.00 N ATOM 0 H GLN A 140 6.301 -8.255 -4.833 1.00 0.00 H new ATOM 0 HA GLN A 140 4.211 -9.639 -3.577 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.862 -10.532 -5.918 1.00 0.00 H new ATOM 0 HB3 GLN A 140 3.963 -8.786 -5.812 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.281 -9.289 -7.673 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.460 -9.056 -6.397 1.00 0.00 H new ATOM 0 HE21 GLN A 140 4.339 -11.802 -7.391 1.00 0.00 H new ATOM 0 HE22 GLN A 140 5.645 -12.985 -7.513 1.00 0.00 H new ATOM 2163 N GLU A 141 6.873 -11.385 -3.906 1.00 0.00 N ATOM 2164 CA GLU A 141 7.476 -12.696 -3.679 1.00 0.00 C ATOM 2165 C GLU A 141 8.077 -12.809 -2.276 1.00 0.00 C ATOM 2166 O GLU A 141 8.027 -13.870 -1.656 1.00 0.00 O ATOM 2167 CB GLU A 141 8.545 -12.965 -4.751 1.00 0.00 C ATOM 2168 CG GLU A 141 9.853 -13.525 -4.214 1.00 0.00 C ATOM 2169 CD GLU A 141 10.941 -13.584 -5.268 1.00 0.00 C ATOM 2170 OE1 GLU A 141 11.569 -12.538 -5.532 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.164 -14.677 -5.830 1.00 0.00 O ATOM 0 H GLU A 141 7.541 -10.618 -3.975 1.00 0.00 H new ATOM 0 HA GLU A 141 6.692 -13.449 -3.753 1.00 0.00 H new ATOM 0 HB2 GLU A 141 8.139 -13.663 -5.483 1.00 0.00 H new ATOM 0 HB3 GLU A 141 8.753 -12.035 -5.279 1.00 0.00 H new ATOM 0 HG2 GLU A 141 10.193 -12.909 -3.381 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.680 -14.526 -3.820 1.00 0.00 H new ATOM 2178 N ARG A 142 8.665 -11.721 -1.793 1.00 0.00 N ATOM 2179 CA ARG A 142 9.294 -11.719 -0.475 1.00 0.00 C ATOM 2180 C ARG A 142 8.305 -11.365 0.631 1.00 0.00 C ATOM 2181 O ARG A 142 8.327 -11.961 1.708 1.00 0.00 O ATOM 2182 CB ARG A 142 10.469 -10.741 -0.456 1.00 0.00 C ATOM 2183 CG ARG A 142 10.142 -9.382 -1.052 1.00 0.00 C ATOM 2184 CD ARG A 142 11.248 -8.379 -0.787 1.00 0.00 C ATOM 2185 NE ARG A 142 12.519 -8.800 -1.371 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.540 -7.975 -1.597 1.00 0.00 C ATOM 2187 NH1 ARG A 142 13.444 -6.688 -1.290 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.661 -8.440 -2.132 1.00 0.00 N ATOM 0 H ARG A 142 8.720 -10.832 -2.290 1.00 0.00 H new ATOM 0 HA ARG A 142 9.655 -12.730 -0.283 1.00 0.00 H new ATOM 0 HB2 ARG A 142 10.801 -10.606 0.573 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.303 -11.178 -1.006 1.00 0.00 H new ATOM 0 HG2 ARG A 142 9.990 -9.482 -2.127 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.207 -9.014 -0.630 1.00 0.00 H new ATOM 0 HD2 ARG A 142 10.964 -7.410 -1.196 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.369 -8.248 0.288 1.00 0.00 H new ATOM 0 HE ARG A 142 12.631 -9.783 -1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.584 -6.325 -0.878 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.230 -6.062 -1.466 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.741 -9.429 -2.370 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.443 -7.809 -2.305 1.00 0.00 H new ATOM 2202 N LEU A 143 7.446 -10.387 0.369 1.00 0.00 N ATOM 2203 CA LEU A 143 6.465 -9.954 1.355 1.00 0.00 C ATOM 2204 C LEU A 143 5.419 -11.036 1.614 1.00 0.00 C ATOM 2205 O LEU A 143 4.815 -11.080 2.686 1.00 0.00 O ATOM 2206 CB LEU A 143 5.783 -8.667 0.894 1.00 0.00 C ATOM 2207 CG LEU A 143 4.852 -8.023 1.922 1.00 0.00 C ATOM 2208 CD1 LEU A 143 5.533 -7.921 3.278 1.00 0.00 C ATOM 2209 CD2 LEU A 143 4.410 -6.652 1.443 1.00 0.00 C ATOM 0 H LEU A 143 7.409 -9.880 -0.516 1.00 0.00 H new ATOM 0 HA LEU A 143 6.994 -9.765 2.289 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.552 -7.945 0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.210 -8.881 -0.009 1.00 0.00 H new ATOM 0 HG LEU A 143 3.971 -8.655 2.033 1.00 0.00 H new ATOM 0 HD11 LEU A 143 4.852 -7.460 3.993 1.00 0.00 H new ATOM 0 HD12 LEU A 143 5.803 -8.918 3.625 1.00 0.00 H new ATOM 0 HD13 LEU A 143 6.432 -7.312 3.189 1.00 0.00 H new ATOM 0 HD21 LEU A 143 3.748 -6.204 2.184 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.284 -6.015 1.306 1.00 0.00 H new ATOM 0 HD23 LEU A 143 3.881 -6.751 0.495 1.00 0.00 H new ATOM 2221 N THR A 144 5.209 -11.908 0.633 1.00 0.00 N ATOM 2222 CA THR A 144 4.238 -12.986 0.764 1.00 0.00 C ATOM 2223 C THR A 144 4.529 -13.834 2.000 1.00 0.00 C ATOM 2224 O THR A 144 3.619 -14.405 2.601 1.00 0.00 O ATOM 2225 CB THR A 144 4.255 -13.858 -0.484 1.00 0.00 C ATOM 2226 OG1 THR A 144 5.583 -14.200 -0.843 1.00 0.00 O ATOM 2227 CG2 THR A 144 3.609 -13.200 -1.683 1.00 0.00 C ATOM 0 H THR A 144 5.699 -11.888 -0.261 1.00 0.00 H new ATOM 0 HA THR A 144 3.248 -12.544 0.878 1.00 0.00 H new ATOM 0 HB THR A 144 3.678 -14.745 -0.222 1.00 0.00 H new ATOM 0 HG1 THR A 144 5.570 -14.761 -1.646 1.00 0.00 H new ATOM 0 HG21 THR A 144 3.655 -13.875 -2.537 1.00 0.00 H new ATOM 0 HG22 THR A 144 2.567 -12.973 -1.456 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.138 -12.277 -1.921 1.00 0.00 H new ATOM 2235 N GLY A 145 5.803 -13.908 2.374 1.00 0.00 N ATOM 2236 CA GLY A 145 6.190 -14.683 3.538 1.00 0.00 C ATOM 2237 C GLY A 145 6.623 -13.808 4.697 1.00 0.00 C ATOM 2238 O GLY A 145 5.837 -13.009 5.206 1.00 0.00 O ATOM 0 H GLY A 145 6.573 -13.445 1.892 1.00 0.00 H new ATOM 0 HA2 GLY A 145 5.353 -15.307 3.850 1.00 0.00 H new ATOM 0 HA3 GLY A 145 7.005 -15.355 3.269 1.00 0.00 H new ATOM 2242 N ASP A 146 7.876 -13.955 5.114 1.00 0.00 N ATOM 2243 CA ASP A 146 8.411 -13.166 6.220 1.00 0.00 C ATOM 2244 C ASP A 146 9.909 -12.931 6.055 1.00 0.00 C ATOM 2245 O ASP A 146 10.614 -12.660 7.027 1.00 0.00 O ATOM 2246 CB ASP A 146 8.138 -13.865 7.554 1.00 0.00 C ATOM 2247 CG ASP A 146 8.442 -15.349 7.506 1.00 0.00 C ATOM 2248 OD1 ASP A 146 7.534 -16.132 7.153 1.00 0.00 O ATOM 2249 OD2 ASP A 146 9.590 -15.730 7.819 1.00 0.00 O ATOM 0 H ASP A 146 8.540 -14.612 4.704 1.00 0.00 H new ATOM 0 HA ASP A 146 7.909 -12.198 6.213 1.00 0.00 H new ATOM 0 HB2 ASP A 146 8.740 -13.399 8.334 1.00 0.00 H new ATOM 0 HB3 ASP A 146 7.093 -13.720 7.829 1.00 0.00 H new ATOM 2254 N ALA A 147 10.390 -13.030 4.821 1.00 0.00 N ATOM 2255 CA ALA A 147 11.804 -12.818 4.534 1.00 0.00 C ATOM 2256 C ALA A 147 12.108 -11.334 4.359 1.00 0.00 C ATOM 2257 O ALA A 147 13.248 -10.900 4.529 1.00 0.00 O ATOM 2258 CB ALA A 147 12.212 -13.595 3.291 1.00 0.00 C ATOM 0 H ALA A 147 9.822 -13.255 4.004 1.00 0.00 H new ATOM 0 HA ALA A 147 12.383 -13.184 5.382 1.00 0.00 H new ATOM 0 HB1 ALA A 147 13.270 -13.428 3.088 1.00 0.00 H new ATOM 0 HB2 ALA A 147 12.037 -14.659 3.453 1.00 0.00 H new ATOM 0 HB3 ALA A 147 11.621 -13.256 2.440 1.00 0.00 H new ATOM 2264 N PHE A 148 11.081 -10.561 4.018 1.00 0.00 N ATOM 2265 CA PHE A 148 11.236 -9.125 3.819 1.00 0.00 C ATOM 2266 C PHE A 148 11.770 -8.452 5.080 1.00 0.00 C ATOM 2267 O PHE A 148 12.582 -7.529 5.005 1.00 0.00 O ATOM 2268 CB PHE A 148 9.899 -8.498 3.414 1.00 0.00 C ATOM 2269 CG PHE A 148 8.818 -8.655 4.445 1.00 0.00 C ATOM 2270 CD1 PHE A 148 8.077 -9.823 4.524 1.00 0.00 C ATOM 2271 CD2 PHE A 148 8.540 -7.628 5.335 1.00 0.00 C ATOM 2272 CE1 PHE A 148 7.081 -9.966 5.471 1.00 0.00 C ATOM 2273 CE2 PHE A 148 7.545 -7.766 6.283 1.00 0.00 C ATOM 2274 CZ PHE A 148 6.814 -8.936 6.352 1.00 0.00 C ATOM 0 H PHE A 148 10.132 -10.906 3.874 1.00 0.00 H new ATOM 0 HA PHE A 148 11.958 -8.971 3.017 1.00 0.00 H new ATOM 0 HB2 PHE A 148 10.051 -7.436 3.219 1.00 0.00 H new ATOM 0 HB3 PHE A 148 9.565 -8.949 2.480 1.00 0.00 H new ATOM 0 HD1 PHE A 148 8.280 -10.631 3.837 1.00 0.00 H new ATOM 0 HD2 PHE A 148 9.108 -6.711 5.286 1.00 0.00 H new ATOM 0 HE1 PHE A 148 6.512 -10.882 5.522 1.00 0.00 H new ATOM 0 HE2 PHE A 148 7.339 -6.959 6.970 1.00 0.00 H new ATOM 0 HZ PHE A 148 6.036 -9.045 7.093 1.00 0.00 H new ATOM 2284 N ARG A 149 11.312 -8.918 6.239 1.00 0.00 N ATOM 2285 CA ARG A 149 11.745 -8.363 7.511 1.00 0.00 C ATOM 2286 C ARG A 149 13.246 -8.540 7.702 1.00 0.00 C ATOM 2287 O ARG A 149 14.006 -7.573 7.681 1.00 0.00 O ATOM 2288 CB ARG A 149 10.989 -9.034 8.656 1.00 0.00 C ATOM 2289 CG ARG A 149 9.484 -9.074 8.456 1.00 0.00 C ATOM 2290 CD ARG A 149 8.763 -9.421 9.746 1.00 0.00 C ATOM 2291 NE ARG A 149 8.308 -10.811 9.763 1.00 0.00 N ATOM 2292 CZ ARG A 149 8.457 -11.635 10.801 1.00 0.00 C ATOM 2293 NH1 ARG A 149 9.044 -11.219 11.918 1.00 0.00 N ATOM 2294 NH2 ARG A 149 8.012 -12.881 10.722 1.00 0.00 N ATOM 0 H ARG A 149 10.639 -9.681 6.320 1.00 0.00 H new ATOM 0 HA ARG A 149 11.526 -7.295 7.511 1.00 0.00 H new ATOM 0 HB2 ARG A 149 11.358 -10.053 8.775 1.00 0.00 H new ATOM 0 HB3 ARG A 149 11.209 -8.505 9.583 1.00 0.00 H new ATOM 0 HG2 ARG A 149 9.138 -8.106 8.093 1.00 0.00 H new ATOM 0 HG3 ARG A 149 9.237 -9.809 7.690 1.00 0.00 H new ATOM 0 HD2 ARG A 149 9.429 -9.247 10.591 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.907 -8.758 9.873 1.00 0.00 H new ATOM 0 HE ARG A 149 7.848 -11.173 8.928 1.00 0.00 H new ATOM 0 HH11 ARG A 149 9.386 -10.261 11.988 1.00 0.00 H new ATOM 0 HH12 ARG A 149 9.153 -11.858 12.706 1.00 0.00 H new ATOM 0 HH21 ARG A 149 7.557 -13.207 9.869 1.00 0.00 H new ATOM 0 HH22 ARG A 149 8.124 -13.514 11.514 1.00 0.00 H new ATOM 2308 N LYS A 150 13.662 -9.786 7.894 1.00 0.00 N ATOM 2309 CA LYS A 150 15.071 -10.105 8.093 1.00 0.00 C ATOM 2310 C LYS A 150 15.260 -11.603 8.304 1.00 0.00 C ATOM 2311 O LYS A 150 15.745 -12.310 7.420 1.00 0.00 O ATOM 2312 CB LYS A 150 15.628 -9.334 9.295 1.00 0.00 C ATOM 2313 CG LYS A 150 16.420 -8.094 8.908 1.00 0.00 C ATOM 2314 CD LYS A 150 17.895 -8.247 9.239 1.00 0.00 C ATOM 2315 CE LYS A 150 18.186 -7.857 10.680 1.00 0.00 C ATOM 2316 NZ LYS A 150 19.483 -7.135 10.809 1.00 0.00 N ATOM 0 H LYS A 150 13.041 -10.595 7.916 1.00 0.00 H new ATOM 0 HA LYS A 150 15.617 -9.808 7.197 1.00 0.00 H new ATOM 0 HB2 LYS A 150 14.802 -9.040 9.942 1.00 0.00 H new ATOM 0 HB3 LYS A 150 16.268 -9.997 9.877 1.00 0.00 H new ATOM 0 HG2 LYS A 150 16.304 -7.906 7.841 1.00 0.00 H new ATOM 0 HG3 LYS A 150 16.017 -7.226 9.431 1.00 0.00 H new ATOM 0 HD2 LYS A 150 18.201 -9.280 9.071 1.00 0.00 H new ATOM 0 HD3 LYS A 150 18.486 -7.626 8.566 1.00 0.00 H new ATOM 0 HE2 LYS A 150 17.380 -7.226 11.055 1.00 0.00 H new ATOM 0 HE3 LYS A 150 18.205 -8.752 11.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 19.644 -6.887 11.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 20.255 -7.746 10.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 19.456 -6.267 10.236 1.00 0.00 H new ATOM 2330 N LYS A 151 14.871 -12.075 9.480 1.00 0.00 N ATOM 2331 CA LYS A 151 14.991 -13.488 9.818 1.00 0.00 C ATOM 2332 C LYS A 151 14.099 -13.841 11.003 1.00 0.00 C ATOM 2333 O LYS A 151 13.135 -14.594 10.864 1.00 0.00 O ATOM 2334 CB LYS A 151 16.448 -13.837 10.132 1.00 0.00 C ATOM 2335 CG LYS A 151 17.077 -14.783 9.124 1.00 0.00 C ATOM 2336 CD LYS A 151 18.584 -14.869 9.304 1.00 0.00 C ATOM 2337 CE LYS A 151 19.100 -16.270 9.023 1.00 0.00 C ATOM 2338 NZ LYS A 151 19.596 -16.411 7.626 1.00 0.00 N ATOM 0 H LYS A 151 14.468 -11.499 10.219 1.00 0.00 H new ATOM 0 HA LYS A 151 14.665 -14.072 8.958 1.00 0.00 H new ATOM 0 HB2 LYS A 151 17.033 -12.918 10.170 1.00 0.00 H new ATOM 0 HB3 LYS A 151 16.499 -14.288 11.123 1.00 0.00 H new ATOM 0 HG2 LYS A 151 16.640 -15.775 9.233 1.00 0.00 H new ATOM 0 HG3 LYS A 151 16.849 -14.443 8.114 1.00 0.00 H new ATOM 0 HD2 LYS A 151 19.072 -14.160 8.636 1.00 0.00 H new ATOM 0 HD3 LYS A 151 18.847 -14.581 10.322 1.00 0.00 H new ATOM 0 HE2 LYS A 151 19.905 -16.507 9.719 1.00 0.00 H new ATOM 0 HE3 LYS A 151 18.303 -16.992 9.200 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 19.939 -17.381 7.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 18.822 -16.210 6.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 20.374 -15.740 7.464 1.00 0.00 H new ATOM 2352 N HIS A 152 14.426 -13.292 12.170 1.00 0.00 N ATOM 2353 CA HIS A 152 13.653 -13.549 13.379 1.00 0.00 C ATOM 2354 C HIS A 152 13.618 -15.041 13.699 1.00 0.00 C ATOM 2355 O HIS A 152 14.219 -15.851 12.993 1.00 0.00 O ATOM 2356 CB HIS A 152 12.230 -13.016 13.225 1.00 0.00 C ATOM 2357 CG HIS A 152 12.149 -11.521 13.195 1.00 0.00 C ATOM 2358 ND1 HIS A 152 13.036 -10.732 12.494 1.00 0.00 N ATOM 2359 CD2 HIS A 152 11.277 -10.669 13.786 1.00 0.00 C ATOM 2360 CE1 HIS A 152 12.715 -9.460 12.656 1.00 0.00 C ATOM 2361 NE2 HIS A 152 11.651 -9.395 13.435 1.00 0.00 N ATOM 0 H HIS A 152 15.221 -12.667 12.303 1.00 0.00 H new ATOM 0 HA HIS A 152 14.140 -13.030 14.205 1.00 0.00 H new ATOM 0 HB2 HIS A 152 11.800 -13.413 12.306 1.00 0.00 H new ATOM 0 HB3 HIS A 152 11.621 -13.388 14.049 1.00 0.00 H new ATOM 0 HD2 HIS A 152 10.443 -10.941 14.416 1.00 0.00 H new ATOM 0 HE1 HIS A 152 13.235 -8.617 12.225 1.00 0.00 H new ATOM 0 HE2 HIS A 152 11.183 -8.538 13.729 1.00 0.00 H new ATOM 2370 N LEU A 153 12.910 -15.396 14.766 1.00 0.00 N ATOM 2371 CA LEU A 153 12.796 -16.790 15.179 1.00 0.00 C ATOM 2372 C LEU A 153 11.465 -17.042 15.879 1.00 0.00 C ATOM 2373 O LEU A 153 11.181 -16.458 16.924 1.00 0.00 O ATOM 2374 CB LEU A 153 13.956 -17.165 16.103 1.00 0.00 C ATOM 2375 CG LEU A 153 14.554 -18.553 15.860 1.00 0.00 C ATOM 2376 CD1 LEU A 153 16.070 -18.513 15.995 1.00 0.00 C ATOM 2377 CD2 LEU A 153 13.959 -19.566 16.825 1.00 0.00 C ATOM 0 H LEU A 153 12.406 -14.738 15.360 1.00 0.00 H new ATOM 0 HA LEU A 153 12.838 -17.414 14.286 1.00 0.00 H new ATOM 0 HB2 LEU A 153 14.745 -16.421 15.991 1.00 0.00 H new ATOM 0 HB3 LEU A 153 13.611 -17.110 17.135 1.00 0.00 H new ATOM 0 HG LEU A 153 14.308 -18.860 14.844 1.00 0.00 H new ATOM 0 HD11 LEU A 153 16.477 -19.509 15.819 1.00 0.00 H new ATOM 0 HD12 LEU A 153 16.482 -17.818 15.264 1.00 0.00 H new ATOM 0 HD13 LEU A 153 16.337 -18.184 16.999 1.00 0.00 H new ATOM 0 HD21 LEU A 153 14.396 -20.547 16.638 1.00 0.00 H new ATOM 0 HD22 LEU A 153 14.174 -19.263 17.850 1.00 0.00 H new ATOM 0 HD23 LEU A 153 12.880 -19.616 16.681 1.00 0.00 H new ATOM 2389 N GLU A 154 10.651 -17.917 15.297 1.00 0.00 N ATOM 2390 CA GLU A 154 9.350 -18.248 15.865 1.00 0.00 C ATOM 2391 C GLU A 154 9.503 -18.853 17.258 1.00 0.00 C ATOM 2392 O GLU A 154 9.842 -20.028 17.402 1.00 0.00 O ATOM 2393 CB GLU A 154 8.602 -19.221 14.950 1.00 0.00 C ATOM 2394 CG GLU A 154 7.509 -18.560 14.125 1.00 0.00 C ATOM 2395 CD GLU A 154 7.987 -18.152 12.746 1.00 0.00 C ATOM 2396 OE1 GLU A 154 8.538 -17.039 12.614 1.00 0.00 O ATOM 2397 OE2 GLU A 154 7.807 -18.944 11.798 1.00 0.00 O ATOM 0 H GLU A 154 10.870 -18.410 14.431 1.00 0.00 H new ATOM 0 HA GLU A 154 8.773 -17.327 15.951 1.00 0.00 H new ATOM 0 HB2 GLU A 154 9.316 -19.697 14.278 1.00 0.00 H new ATOM 0 HB3 GLU A 154 8.160 -20.011 15.557 1.00 0.00 H new ATOM 0 HG2 GLU A 154 6.668 -19.246 14.026 1.00 0.00 H new ATOM 0 HG3 GLU A 154 7.142 -17.680 14.653 1.00 0.00 H new ATOM 2404 N ASP A 155 9.248 -18.043 18.281 1.00 0.00 N ATOM 2405 CA ASP A 155 9.356 -18.498 19.662 1.00 0.00 C ATOM 2406 C ASP A 155 8.943 -17.397 20.633 1.00 0.00 C ATOM 2407 O ASP A 155 7.995 -17.556 21.401 1.00 0.00 O ATOM 2408 CB ASP A 155 10.788 -18.948 19.963 1.00 0.00 C ATOM 2409 CG ASP A 155 10.833 -20.194 20.824 1.00 0.00 C ATOM 2410 OD1 ASP A 155 10.479 -21.281 20.318 1.00 0.00 O ATOM 2411 OD2 ASP A 155 11.222 -20.085 22.006 1.00 0.00 O ATOM 0 H ASP A 155 8.965 -17.068 18.179 1.00 0.00 H new ATOM 0 HA ASP A 155 8.681 -19.344 19.792 1.00 0.00 H new ATOM 0 HB2 ASP A 155 11.311 -19.138 19.026 1.00 0.00 H new ATOM 0 HB3 ASP A 155 11.321 -18.142 20.467 1.00 0.00 H new ATOM 2416 N GLU A 156 9.660 -16.278 20.590 1.00 0.00 N ATOM 2417 CA GLU A 156 9.368 -15.149 21.465 1.00 0.00 C ATOM 2418 C GLU A 156 9.486 -15.553 22.932 1.00 0.00 C ATOM 2419 O GLU A 156 8.594 -16.198 23.483 1.00 0.00 O ATOM 2420 CB GLU A 156 7.963 -14.608 21.180 1.00 0.00 C ATOM 2421 CG GLU A 156 7.955 -13.158 20.724 1.00 0.00 C ATOM 2422 CD GLU A 156 8.709 -12.951 19.426 1.00 0.00 C ATOM 2423 OE1 GLU A 156 9.938 -12.738 19.481 1.00 0.00 O ATOM 2424 OE2 GLU A 156 8.071 -13.000 18.353 1.00 0.00 O ATOM 0 H GLU A 156 10.447 -16.130 19.958 1.00 0.00 H new ATOM 0 HA GLU A 156 10.098 -14.365 21.265 1.00 0.00 H new ATOM 0 HB2 GLU A 156 7.493 -15.225 20.414 1.00 0.00 H new ATOM 0 HB3 GLU A 156 7.356 -14.701 22.081 1.00 0.00 H new ATOM 0 HG2 GLU A 156 6.924 -12.826 20.598 1.00 0.00 H new ATOM 0 HG3 GLU A 156 8.398 -12.534 21.501 1.00 0.00 H new ATOM 2431 N LEU A 157 10.592 -15.168 23.559 1.00 0.00 N ATOM 2432 CA LEU A 157 10.828 -15.489 24.961 1.00 0.00 C ATOM 2433 C LEU A 157 10.847 -16.999 25.179 1.00 0.00 C ATOM 2434 O LEU A 157 11.954 -17.563 25.307 1.00 0.00 O ATOM 2435 CB LEU A 157 9.752 -14.848 25.840 1.00 0.00 C ATOM 2436 CG LEU A 157 10.241 -14.345 27.200 1.00 0.00 C ATOM 2437 CD1 LEU A 157 10.897 -15.472 27.983 1.00 0.00 C ATOM 2438 CD2 LEU A 157 11.209 -13.184 27.019 1.00 0.00 C ATOM 2439 OXT LEU A 157 9.755 -17.604 25.219 1.00 0.00 O ATOM 0 H LEU A 157 11.340 -14.633 23.118 1.00 0.00 H new ATOM 0 HA LEU A 157 11.802 -15.088 25.240 1.00 0.00 H new ATOM 0 HB2 LEU A 157 9.312 -14.011 25.297 1.00 0.00 H new ATOM 0 HB3 LEU A 157 8.957 -15.576 26.003 1.00 0.00 H new ATOM 0 HG LEU A 157 9.380 -13.991 27.768 1.00 0.00 H new ATOM 0 HD11 LEU A 157 11.238 -15.095 28.947 1.00 0.00 H new ATOM 0 HD12 LEU A 157 10.175 -16.273 28.142 1.00 0.00 H new ATOM 0 HD13 LEU A 157 11.749 -15.857 27.422 1.00 0.00 H new ATOM 0 HD21 LEU A 157 11.548 -12.837 27.995 1.00 0.00 H new ATOM 0 HD22 LEU A 157 12.067 -13.514 26.433 1.00 0.00 H new ATOM 0 HD23 LEU A 157 10.706 -12.369 26.499 1.00 0.00 H new TER 2451 LEU A 157