USER MOD reduce.3.24.130724 H: found=0, std=0, add=880, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 878 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 21 MET CE :methyl -147:sc= -0.292 (180deg=-0.644) USER MOD Set 1.2: A 57 CYS SG : rot 130:sc= -2.38 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 6:sc= 0.652 USER MOD Single : A 5 SER OG : rot 9:sc= 1.22 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 ASN : amide:sc= -0.358 X(o=-0.36,f=-0.51) USER MOD Single : A 13 HIS : no HD1:sc= -1.14 K(o=-1.1,f=-0.13) USER MOD Single : A 15 ASN : amide:sc= -0.748 K(o=-0.75,f=-1.7!) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 ASN : amide:sc= -0.127 K(o=-0.13,f=-1.6!) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 39 GLN : amide:sc= -0.14 K(o=-0.14,f=-1.2) USER MOD Single : A 40 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.0764) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -87:sc= 1.3 USER MOD Single : A 62 ASN : amide:sc= -0.334 X(o=-0.33,f=-0.1) USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.047) USER MOD Single : A 71 ASN : amide:sc= -0.0744 K(o=-0.074,f=-0.67) USER MOD Single : A 78 HIS : no HD1:sc= -0.166 X(o=-0.17,f=-0.057) USER MOD Single : A 79 THR OG1 : rot 180:sc= 0.0327 USER MOD Single : A 80 HIS : no HD1:sc= -0.418 X(o=-0.42,f=-0.02) USER MOD Single : A 82 GLN : amide:sc= -0.0237 X(o=-0.024,f=-0.19) USER MOD Single : A 88 LYS NZ :NH3+ 135:sc= -0.271 (180deg=-1.06) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 91 CYS SG : rot 180:sc= 0 USER MOD Single : A 94 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 SER OG : rot 180:sc= 0 USER MOD Single : A 99 MET CE :methyl 178:sc= -1.55 (180deg=-1.58) USER MOD Single : A 105 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 114 SER OG : rot 180:sc= -0.0686 USER MOD Single : A 117 SER OG : rot -56:sc= 0.524 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.445 13.501 -24.700 1.00 0.00 N ATOM 2 CA GLY A 1 -14.380 12.846 -25.436 1.00 0.00 C ATOM 3 C GLY A 1 -13.236 12.412 -24.540 1.00 0.00 C ATOM 4 O GLY A 1 -12.461 13.243 -24.067 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.202 13.778 -25.357 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.827 12.847 -23.987 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.070 14.348 -24.227 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.783 11.975 -25.953 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.001 13.524 -26.201 1.00 0.00 H new ATOM 8 N SER A 2 -13.133 11.108 -24.304 1.00 0.00 N ATOM 9 CA SER A 2 -12.080 10.566 -23.454 1.00 0.00 C ATOM 10 C SER A 2 -10.821 10.278 -24.266 1.00 0.00 C ATOM 11 O SER A 2 -10.585 9.144 -24.685 1.00 0.00 O ATOM 12 CB SER A 2 -12.559 9.288 -22.763 1.00 0.00 C ATOM 13 OG SER A 2 -11.602 8.825 -21.827 1.00 0.00 O ATOM 0 H SER A 2 -13.766 10.407 -24.690 1.00 0.00 H new ATOM 0 HA SER A 2 -11.840 11.311 -22.696 1.00 0.00 H new ATOM 0 HB2 SER A 2 -13.505 9.478 -22.257 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.746 8.516 -23.509 1.00 0.00 H new ATOM 0 HG SER A 2 -11.933 8.008 -21.398 1.00 0.00 H new ATOM 19 N SER A 3 -10.015 11.312 -24.484 1.00 0.00 N ATOM 20 CA SER A 3 -8.781 11.171 -25.249 1.00 0.00 C ATOM 21 C SER A 3 -7.573 11.088 -24.321 1.00 0.00 C ATOM 22 O SER A 3 -7.323 11.993 -23.527 1.00 0.00 O ATOM 23 CB SER A 3 -8.618 12.347 -26.214 1.00 0.00 C ATOM 24 OG SER A 3 -8.235 13.524 -25.523 1.00 0.00 O ATOM 0 H SER A 3 -10.194 12.256 -24.142 1.00 0.00 H new ATOM 0 HA SER A 3 -8.841 10.246 -25.822 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.868 12.103 -26.966 1.00 0.00 H new ATOM 0 HB3 SER A 3 -9.555 12.520 -26.743 1.00 0.00 H new ATOM 0 HG SER A 3 -8.070 13.311 -24.581 1.00 0.00 H new ATOM 30 N GLY A 4 -6.826 9.993 -24.429 1.00 0.00 N ATOM 31 CA GLY A 4 -5.653 9.811 -23.594 1.00 0.00 C ATOM 32 C GLY A 4 -5.510 8.386 -23.098 1.00 0.00 C ATOM 33 O GLY A 4 -5.813 8.090 -21.943 1.00 0.00 O ATOM 0 H GLY A 4 -7.012 9.230 -25.079 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.762 10.087 -24.159 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.711 10.486 -22.740 1.00 0.00 H new ATOM 37 N SER A 5 -5.049 7.499 -23.975 1.00 0.00 N ATOM 38 CA SER A 5 -4.872 6.095 -23.621 1.00 0.00 C ATOM 39 C SER A 5 -3.998 5.382 -24.648 1.00 0.00 C ATOM 40 O SER A 5 -4.047 5.688 -25.840 1.00 0.00 O ATOM 41 CB SER A 5 -6.230 5.398 -23.519 1.00 0.00 C ATOM 42 OG SER A 5 -6.863 5.694 -22.286 1.00 0.00 O ATOM 0 H SER A 5 -4.792 7.728 -24.935 1.00 0.00 H new ATOM 0 HA SER A 5 -4.375 6.050 -22.652 1.00 0.00 H new ATOM 0 HB2 SER A 5 -6.868 5.715 -24.344 1.00 0.00 H new ATOM 0 HB3 SER A 5 -6.097 4.320 -23.614 1.00 0.00 H new ATOM 0 HG SER A 5 -6.359 6.393 -21.819 1.00 0.00 H new ATOM 48 N SER A 6 -3.199 4.430 -24.177 1.00 0.00 N ATOM 49 CA SER A 6 -2.311 3.675 -25.053 1.00 0.00 C ATOM 50 C SER A 6 -3.110 2.802 -26.016 1.00 0.00 C ATOM 51 O SER A 6 -4.326 2.667 -25.886 1.00 0.00 O ATOM 52 CB SER A 6 -1.363 2.805 -24.226 1.00 0.00 C ATOM 53 OG SER A 6 -0.251 2.386 -24.997 1.00 0.00 O ATOM 0 H SER A 6 -3.148 4.163 -23.194 1.00 0.00 H new ATOM 0 HA SER A 6 -1.726 4.386 -25.636 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.017 3.364 -23.357 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.899 1.933 -23.851 1.00 0.00 H new ATOM 0 HG SER A 6 0.340 1.833 -24.445 1.00 0.00 H new ATOM 59 N GLY A 7 -2.416 2.212 -26.984 1.00 0.00 N ATOM 60 CA GLY A 7 -3.077 1.359 -27.956 1.00 0.00 C ATOM 61 C GLY A 7 -2.316 0.073 -28.210 1.00 0.00 C ATOM 62 O GLY A 7 -1.868 -0.180 -29.328 1.00 0.00 O ATOM 0 H GLY A 7 -1.409 2.309 -27.113 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.080 1.120 -27.603 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -3.190 1.902 -28.894 1.00 0.00 H new ATOM 66 N ASN A 8 -2.169 -0.741 -27.170 1.00 0.00 N ATOM 67 CA ASN A 8 -1.455 -2.007 -27.286 1.00 0.00 C ATOM 68 C ASN A 8 -2.014 -2.844 -28.432 1.00 0.00 C ATOM 69 O ASN A 8 -3.024 -3.530 -28.280 1.00 0.00 O ATOM 70 CB ASN A 8 -1.549 -2.791 -25.975 1.00 0.00 C ATOM 71 CG ASN A 8 -1.434 -1.896 -24.756 1.00 0.00 C ATOM 72 OD1 ASN A 8 -0.613 -0.979 -24.721 1.00 0.00 O ATOM 73 ND2 ASN A 8 -2.260 -2.158 -23.750 1.00 0.00 N ATOM 0 H ASN A 8 -2.535 -0.547 -26.238 1.00 0.00 H new ATOM 0 HA ASN A 8 -0.408 -1.787 -27.497 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -2.499 -3.325 -25.942 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -0.760 -3.542 -25.947 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -2.230 -1.589 -22.904 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -2.924 -2.928 -23.823 1.00 0.00 H new ATOM 80 N GLY A 9 -1.348 -2.783 -29.582 1.00 0.00 N ATOM 81 CA GLY A 9 -1.792 -3.539 -30.738 1.00 0.00 C ATOM 82 C GLY A 9 -1.782 -5.035 -30.491 1.00 0.00 C ATOM 83 O GLY A 9 -0.742 -5.612 -30.173 1.00 0.00 O ATOM 0 H GLY A 9 -0.509 -2.223 -29.733 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -2.800 -3.225 -31.008 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -1.148 -3.310 -31.587 1.00 0.00 H new ATOM 87 N GLY A 10 -2.944 -5.665 -30.635 1.00 0.00 N ATOM 88 CA GLY A 10 -3.042 -7.097 -30.420 1.00 0.00 C ATOM 89 C GLY A 10 -2.815 -7.483 -28.971 1.00 0.00 C ATOM 90 O GLY A 10 -3.477 -6.962 -28.073 1.00 0.00 O ATOM 0 H GLY A 10 -3.819 -5.210 -30.896 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -4.027 -7.442 -30.735 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -2.310 -7.606 -31.047 1.00 0.00 H new ATOM 94 N ILE A 11 -1.879 -8.398 -28.744 1.00 0.00 N ATOM 95 CA ILE A 11 -1.568 -8.853 -27.395 1.00 0.00 C ATOM 96 C ILE A 11 -0.130 -8.514 -27.019 1.00 0.00 C ATOM 97 O ILE A 11 0.826 -8.951 -27.661 1.00 0.00 O ATOM 98 CB ILE A 11 -1.780 -10.371 -27.250 1.00 0.00 C ATOM 99 CG1 ILE A 11 -3.109 -10.786 -27.886 1.00 0.00 C ATOM 100 CG2 ILE A 11 -1.741 -10.774 -25.783 1.00 0.00 C ATOM 101 CD1 ILE A 11 -3.053 -10.878 -29.395 1.00 0.00 C ATOM 0 H ILE A 11 -1.323 -8.839 -29.477 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.250 -8.333 -26.722 1.00 0.00 H new ATOM 0 HB ILE A 11 -0.973 -10.886 -27.770 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -3.410 -11.753 -27.482 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -3.879 -10.068 -27.602 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -1.892 -11.850 -25.697 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.773 -10.509 -25.358 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -2.530 -10.252 -25.241 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -4.029 -11.177 -29.778 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.783 -9.907 -29.809 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -2.307 -11.617 -29.687 1.00 0.00 H new ATOM 113 N PRO A 12 0.031 -7.718 -25.951 1.00 0.00 N ATOM 114 CA PRO A 12 1.350 -7.304 -25.464 1.00 0.00 C ATOM 115 C PRO A 12 2.126 -8.460 -24.841 1.00 0.00 C ATOM 116 O PRO A 12 1.637 -9.588 -24.780 1.00 0.00 O ATOM 117 CB PRO A 12 1.022 -6.249 -24.405 1.00 0.00 C ATOM 118 CG PRO A 12 -0.352 -6.591 -23.942 1.00 0.00 C ATOM 119 CD PRO A 12 -1.063 -7.160 -25.138 1.00 0.00 C ATOM 0 HA PRO A 12 1.985 -6.936 -26.270 1.00 0.00 H new ATOM 0 HB2 PRO A 12 1.736 -6.279 -23.582 1.00 0.00 H new ATOM 0 HB3 PRO A 12 1.060 -5.243 -24.823 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -0.320 -7.314 -23.127 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -0.868 -5.708 -23.565 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -1.782 -7.927 -24.851 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -1.615 -6.392 -25.680 1.00 0.00 H new ATOM 127 N HIS A 13 3.339 -8.171 -24.380 1.00 0.00 N ATOM 128 CA HIS A 13 4.183 -9.187 -23.760 1.00 0.00 C ATOM 129 C HIS A 13 4.092 -9.115 -22.239 1.00 0.00 C ATOM 130 O HIS A 13 5.099 -9.237 -21.541 1.00 0.00 O ATOM 131 CB HIS A 13 5.635 -9.014 -24.205 1.00 0.00 C ATOM 132 CG HIS A 13 6.015 -7.590 -24.472 1.00 0.00 C ATOM 133 ND1 HIS A 13 6.697 -7.192 -25.602 1.00 0.00 N ATOM 134 CD2 HIS A 13 5.801 -6.466 -23.748 1.00 0.00 C ATOM 135 CE1 HIS A 13 6.889 -5.886 -25.561 1.00 0.00 C ATOM 136 NE2 HIS A 13 6.354 -5.421 -24.446 1.00 0.00 N ATOM 0 H HIS A 13 3.759 -7.243 -24.424 1.00 0.00 H new ATOM 0 HA HIS A 13 3.827 -10.166 -24.081 1.00 0.00 H new ATOM 0 HB2 HIS A 13 6.293 -9.419 -23.436 1.00 0.00 H new ATOM 0 HB3 HIS A 13 5.802 -9.601 -25.108 1.00 0.00 H new ATOM 0 HD2 HIS A 13 5.290 -6.403 -22.798 1.00 0.00 H new ATOM 0 HE1 HIS A 13 7.397 -5.298 -26.311 1.00 0.00 H new ATOM 0 HE2 HIS A 13 6.352 -4.444 -24.152 1.00 0.00 H new ATOM 145 N ASP A 14 2.881 -8.915 -21.732 1.00 0.00 N ATOM 146 CA ASP A 14 2.659 -8.827 -20.294 1.00 0.00 C ATOM 147 C ASP A 14 3.462 -9.891 -19.553 1.00 0.00 C ATOM 148 O ASP A 14 3.493 -11.052 -19.959 1.00 0.00 O ATOM 149 CB ASP A 14 1.171 -8.979 -19.975 1.00 0.00 C ATOM 150 CG ASP A 14 0.764 -8.220 -18.727 1.00 0.00 C ATOM 151 OD1 ASP A 14 1.220 -8.599 -17.628 1.00 0.00 O ATOM 152 OD2 ASP A 14 -0.008 -7.247 -18.850 1.00 0.00 O ATOM 0 H ASP A 14 2.037 -8.811 -22.296 1.00 0.00 H new ATOM 0 HA ASP A 14 2.996 -7.846 -19.960 1.00 0.00 H new ATOM 0 HB2 ASP A 14 0.583 -8.623 -20.821 1.00 0.00 H new ATOM 0 HB3 ASP A 14 0.936 -10.036 -19.846 1.00 0.00 H new ATOM 157 N ASN A 15 4.111 -9.487 -18.466 1.00 0.00 N ATOM 158 CA ASN A 15 4.915 -10.406 -17.670 1.00 0.00 C ATOM 159 C ASN A 15 4.405 -10.472 -16.234 1.00 0.00 C ATOM 160 O ASN A 15 3.999 -11.532 -15.756 1.00 0.00 O ATOM 161 CB ASN A 15 6.383 -9.974 -17.682 1.00 0.00 C ATOM 162 CG ASN A 15 7.091 -10.366 -18.965 1.00 0.00 C ATOM 163 OD1 ASN A 15 7.027 -9.652 -19.965 1.00 0.00 O ATOM 164 ND2 ASN A 15 7.771 -11.506 -18.940 1.00 0.00 N ATOM 0 H ASN A 15 4.096 -8.529 -18.116 1.00 0.00 H new ATOM 0 HA ASN A 15 4.831 -11.399 -18.112 1.00 0.00 H new ATOM 0 HB2 ASN A 15 6.442 -8.893 -17.553 1.00 0.00 H new ATOM 0 HB3 ASN A 15 6.898 -10.424 -16.834 1.00 0.00 H new ATOM 0 HD21 ASN A 15 8.268 -11.822 -19.773 1.00 0.00 H new ATOM 0 HD22 ASN A 15 7.796 -12.066 -18.088 1.00 0.00 H new ATOM 171 N LEU A 16 4.428 -9.334 -15.551 1.00 0.00 N ATOM 172 CA LEU A 16 3.967 -9.261 -14.168 1.00 0.00 C ATOM 173 C LEU A 16 2.473 -8.958 -14.108 1.00 0.00 C ATOM 174 O LEU A 16 1.892 -8.455 -15.069 1.00 0.00 O ATOM 175 CB LEU A 16 4.748 -8.189 -13.405 1.00 0.00 C ATOM 176 CG LEU A 16 6.017 -8.661 -12.696 1.00 0.00 C ATOM 177 CD1 LEU A 16 7.222 -8.529 -13.614 1.00 0.00 C ATOM 178 CD2 LEU A 16 6.234 -7.874 -11.412 1.00 0.00 C ATOM 0 H LEU A 16 4.761 -8.448 -15.932 1.00 0.00 H new ATOM 0 HA LEU A 16 4.142 -10.230 -13.701 1.00 0.00 H new ATOM 0 HB2 LEU A 16 5.019 -7.398 -14.105 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.085 -7.744 -12.663 1.00 0.00 H new ATOM 0 HG LEU A 16 5.896 -9.713 -12.438 1.00 0.00 H new ATOM 0 HD11 LEU A 16 8.116 -8.870 -13.092 1.00 0.00 H new ATOM 0 HD12 LEU A 16 7.068 -9.137 -14.506 1.00 0.00 H new ATOM 0 HD13 LEU A 16 7.346 -7.486 -13.903 1.00 0.00 H new ATOM 0 HD21 LEU A 16 7.142 -8.223 -10.920 1.00 0.00 H new ATOM 0 HD22 LEU A 16 6.333 -6.814 -11.647 1.00 0.00 H new ATOM 0 HD23 LEU A 16 5.382 -8.020 -10.748 1.00 0.00 H new ATOM 190 N VAL A 17 1.858 -9.266 -12.971 1.00 0.00 N ATOM 191 CA VAL A 17 0.432 -9.024 -12.783 1.00 0.00 C ATOM 192 C VAL A 17 0.167 -7.572 -12.403 1.00 0.00 C ATOM 193 O VAL A 17 0.998 -6.924 -11.765 1.00 0.00 O ATOM 194 CB VAL A 17 -0.155 -9.944 -11.696 1.00 0.00 C ATOM 195 CG1 VAL A 17 0.678 -9.868 -10.425 1.00 0.00 C ATOM 196 CG2 VAL A 17 -1.604 -9.579 -11.415 1.00 0.00 C ATOM 0 H VAL A 17 2.325 -9.684 -12.166 1.00 0.00 H new ATOM 0 HA VAL A 17 -0.054 -9.242 -13.734 1.00 0.00 H new ATOM 0 HB VAL A 17 -0.127 -10.971 -12.060 1.00 0.00 H new ATOM 0 HG11 VAL A 17 0.248 -10.524 -9.668 1.00 0.00 H new ATOM 0 HG12 VAL A 17 1.699 -10.182 -10.640 1.00 0.00 H new ATOM 0 HG13 VAL A 17 0.684 -8.843 -10.055 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -2.003 -10.239 -10.645 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -1.659 -8.546 -11.072 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -2.191 -9.690 -12.327 1.00 0.00 H new ATOM 206 N LEU A 18 -0.996 -7.066 -12.797 1.00 0.00 N ATOM 207 CA LEU A 18 -1.373 -5.689 -12.497 1.00 0.00 C ATOM 208 C LEU A 18 -2.724 -5.636 -11.791 1.00 0.00 C ATOM 209 O LEU A 18 -3.664 -6.333 -12.175 1.00 0.00 O ATOM 210 CB LEU A 18 -1.423 -4.862 -13.783 1.00 0.00 C ATOM 211 CG LEU A 18 -2.212 -3.554 -13.709 1.00 0.00 C ATOM 212 CD1 LEU A 18 -1.359 -2.450 -13.103 1.00 0.00 C ATOM 213 CD2 LEU A 18 -2.707 -3.151 -15.090 1.00 0.00 C ATOM 0 H LEU A 18 -1.695 -7.589 -13.325 1.00 0.00 H new ATOM 0 HA LEU A 18 -0.620 -5.268 -11.831 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.401 -4.630 -14.082 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -1.854 -5.479 -14.572 1.00 0.00 H new ATOM 0 HG LEU A 18 -3.078 -3.710 -13.066 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -1.937 -1.527 -13.058 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -1.054 -2.737 -12.096 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -0.474 -2.294 -13.719 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -3.266 -2.218 -15.018 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -1.855 -3.013 -15.756 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -3.355 -3.933 -15.487 1.00 0.00 H new ATOM 225 N ILE A 19 -2.814 -4.803 -10.760 1.00 0.00 N ATOM 226 CA ILE A 19 -4.051 -4.656 -10.003 1.00 0.00 C ATOM 227 C ILE A 19 -4.799 -3.391 -10.411 1.00 0.00 C ATOM 228 O ILE A 19 -4.187 -2.365 -10.708 1.00 0.00 O ATOM 229 CB ILE A 19 -3.782 -4.613 -8.487 1.00 0.00 C ATOM 230 CG1 ILE A 19 -3.176 -5.937 -8.017 1.00 0.00 C ATOM 231 CG2 ILE A 19 -5.067 -4.315 -7.729 1.00 0.00 C ATOM 232 CD1 ILE A 19 -4.199 -7.032 -7.812 1.00 0.00 C ATOM 0 H ILE A 19 -2.045 -4.220 -10.430 1.00 0.00 H new ATOM 0 HA ILE A 19 -4.665 -5.528 -10.230 1.00 0.00 H new ATOM 0 HB ILE A 19 -3.069 -3.815 -8.282 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -2.441 -6.271 -8.749 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -2.642 -5.771 -7.082 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -4.860 -4.288 -6.659 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -5.461 -3.350 -8.047 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -5.801 -5.093 -7.937 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -3.698 -7.941 -7.479 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -4.921 -6.719 -7.058 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -4.717 -7.227 -8.751 1.00 0.00 H new ATOM 244 N ARG A 20 -6.125 -3.472 -10.422 1.00 0.00 N ATOM 245 CA ARG A 20 -6.957 -2.333 -10.793 1.00 0.00 C ATOM 246 C ARG A 20 -8.245 -2.312 -9.976 1.00 0.00 C ATOM 247 O ARG A 20 -8.925 -3.329 -9.845 1.00 0.00 O ATOM 248 CB ARG A 20 -7.288 -2.381 -12.286 1.00 0.00 C ATOM 249 CG ARG A 20 -6.270 -1.665 -13.159 1.00 0.00 C ATOM 250 CD ARG A 20 -6.572 -1.855 -14.637 1.00 0.00 C ATOM 251 NE ARG A 20 -7.926 -1.430 -14.978 1.00 0.00 N ATOM 252 CZ ARG A 20 -8.580 -1.852 -16.055 1.00 0.00 C ATOM 253 NH1 ARG A 20 -8.006 -2.706 -16.890 1.00 0.00 N ATOM 254 NH2 ARG A 20 -9.811 -1.419 -16.297 1.00 0.00 N ATOM 0 H ARG A 20 -6.647 -4.314 -10.178 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.398 -1.422 -10.581 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -7.356 -3.422 -12.601 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -8.269 -1.935 -12.446 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -6.269 -0.601 -12.921 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -5.271 -2.042 -12.939 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -5.854 -1.288 -15.229 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -6.444 -2.905 -14.901 1.00 0.00 H new ATOM 0 HE ARG A 20 -8.396 -0.773 -14.355 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -7.060 -3.041 -16.707 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -8.510 -3.028 -17.716 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -10.256 -0.762 -15.656 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -10.312 -1.743 -17.124 1.00 0.00 H new ATOM 268 N MET A 21 -8.573 -1.146 -9.429 1.00 0.00 N ATOM 269 CA MET A 21 -9.780 -0.993 -8.625 1.00 0.00 C ATOM 270 C MET A 21 -10.157 0.479 -8.486 1.00 0.00 C ATOM 271 O MET A 21 -9.429 1.362 -8.938 1.00 0.00 O ATOM 272 CB MET A 21 -9.580 -1.613 -7.241 1.00 0.00 C ATOM 273 CG MET A 21 -8.674 -0.796 -6.334 1.00 0.00 C ATOM 274 SD MET A 21 -6.931 -1.205 -6.543 1.00 0.00 S ATOM 275 CE MET A 21 -6.731 -2.479 -5.300 1.00 0.00 C ATOM 0 H MET A 21 -8.021 -0.294 -9.528 1.00 0.00 H new ATOM 0 HA MET A 21 -10.593 -1.512 -9.133 1.00 0.00 H new ATOM 0 HB2 MET A 21 -10.551 -1.730 -6.761 1.00 0.00 H new ATOM 0 HB3 MET A 21 -9.159 -2.612 -7.357 1.00 0.00 H new ATOM 0 HG2 MET A 21 -8.822 0.264 -6.539 1.00 0.00 H new ATOM 0 HG3 MET A 21 -8.960 -0.963 -5.296 1.00 0.00 H new ATOM 0 HE1 MET A 21 -5.724 -2.429 -4.887 1.00 0.00 H new ATOM 0 HE2 MET A 21 -7.458 -2.327 -4.503 1.00 0.00 H new ATOM 0 HE3 MET A 21 -6.889 -3.458 -5.753 1.00 0.00 H new ATOM 285 N LYS A 22 -11.299 0.736 -7.857 1.00 0.00 N ATOM 286 CA LYS A 22 -11.773 2.100 -7.657 1.00 0.00 C ATOM 287 C LYS A 22 -12.053 2.367 -6.181 1.00 0.00 C ATOM 288 O LYS A 22 -12.372 1.461 -5.411 1.00 0.00 O ATOM 289 CB LYS A 22 -13.038 2.348 -8.480 1.00 0.00 C ATOM 290 CG LYS A 22 -14.267 1.638 -7.937 1.00 0.00 C ATOM 291 CD LYS A 22 -15.461 1.804 -8.862 1.00 0.00 C ATOM 292 CE LYS A 22 -16.093 3.180 -8.715 1.00 0.00 C ATOM 293 NZ LYS A 22 -17.091 3.216 -7.610 1.00 0.00 N ATOM 0 H LYS A 22 -11.914 0.016 -7.477 1.00 0.00 H new ATOM 0 HA LYS A 22 -10.991 2.783 -7.990 1.00 0.00 H new ATOM 0 HB2 LYS A 22 -13.234 3.420 -8.515 1.00 0.00 H new ATOM 0 HB3 LYS A 22 -12.864 2.022 -9.505 1.00 0.00 H new ATOM 0 HG2 LYS A 22 -14.049 0.578 -7.809 1.00 0.00 H new ATOM 0 HG3 LYS A 22 -14.511 2.034 -6.951 1.00 0.00 H new ATOM 0 HD2 LYS A 22 -15.146 1.656 -9.895 1.00 0.00 H new ATOM 0 HD3 LYS A 22 -16.203 1.036 -8.642 1.00 0.00 H new ATOM 0 HE2 LYS A 22 -15.314 3.919 -8.526 1.00 0.00 H new ATOM 0 HE3 LYS A 22 -16.577 3.459 -9.651 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 -17.499 4.170 -7.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 -17.847 2.529 -7.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 -16.624 2.974 -6.713 1.00 0.00 H new ATOM 307 N PRO A 23 -11.933 3.641 -5.777 1.00 0.00 N ATOM 308 CA PRO A 23 -12.171 4.057 -4.391 1.00 0.00 C ATOM 309 C PRO A 23 -13.644 3.970 -4.005 1.00 0.00 C ATOM 310 O PRO A 23 -14.527 4.222 -4.825 1.00 0.00 O ATOM 311 CB PRO A 23 -11.699 5.512 -4.372 1.00 0.00 C ATOM 312 CG PRO A 23 -11.837 5.974 -5.782 1.00 0.00 C ATOM 313 CD PRO A 23 -11.557 4.772 -6.640 1.00 0.00 C ATOM 0 HA PRO A 23 -11.652 3.417 -3.678 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -12.305 6.116 -3.697 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -10.667 5.589 -4.029 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -12.838 6.363 -5.969 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -11.136 6.780 -5.999 1.00 0.00 H new ATOM 0 HD2 PRO A 23 -12.144 4.789 -7.559 1.00 0.00 H new ATOM 0 HD3 PRO A 23 -10.508 4.723 -6.932 1.00 0.00 H new ATOM 321 N ASP A 24 -13.902 3.611 -2.752 1.00 0.00 N ATOM 322 CA ASP A 24 -15.268 3.492 -2.256 1.00 0.00 C ATOM 323 C ASP A 24 -15.920 4.865 -2.125 1.00 0.00 C ATOM 324 O ASP A 24 -15.325 5.882 -2.482 1.00 0.00 O ATOM 325 CB ASP A 24 -15.283 2.776 -0.905 1.00 0.00 C ATOM 326 CG ASP A 24 -16.596 2.067 -0.640 1.00 0.00 C ATOM 327 OD1 ASP A 24 -17.035 1.287 -1.511 1.00 0.00 O ATOM 328 OD2 ASP A 24 -17.185 2.292 0.438 1.00 0.00 O ATOM 0 H ASP A 24 -13.183 3.397 -2.061 1.00 0.00 H new ATOM 0 HA ASP A 24 -15.839 2.905 -2.975 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.469 2.052 -0.872 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -15.098 3.500 -0.111 1.00 0.00 H new ATOM 333 N GLU A 25 -17.146 4.886 -1.613 1.00 0.00 N ATOM 334 CA GLU A 25 -17.879 6.135 -1.437 1.00 0.00 C ATOM 335 C GLU A 25 -17.231 6.999 -0.360 1.00 0.00 C ATOM 336 O GLU A 25 -17.567 8.172 -0.205 1.00 0.00 O ATOM 337 CB GLU A 25 -19.337 5.849 -1.069 1.00 0.00 C ATOM 338 CG GLU A 25 -20.100 5.095 -2.145 1.00 0.00 C ATOM 339 CD GLU A 25 -21.267 4.305 -1.587 1.00 0.00 C ATOM 340 OE1 GLU A 25 -22.284 4.928 -1.218 1.00 0.00 O ATOM 341 OE2 GLU A 25 -21.164 3.062 -1.520 1.00 0.00 O ATOM 0 H GLU A 25 -17.653 4.053 -1.313 1.00 0.00 H new ATOM 0 HA GLU A 25 -17.850 6.680 -2.381 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -19.363 5.272 -0.145 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -19.844 6.793 -0.870 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -20.467 5.803 -2.888 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -19.420 4.417 -2.660 1.00 0.00 H new ATOM 348 N ASN A 26 -16.300 6.409 0.383 1.00 0.00 N ATOM 349 CA ASN A 26 -15.605 7.124 1.447 1.00 0.00 C ATOM 350 C ASN A 26 -14.112 7.228 1.148 1.00 0.00 C ATOM 351 O ASN A 26 -13.323 7.625 2.004 1.00 0.00 O ATOM 352 CB ASN A 26 -15.820 6.420 2.788 1.00 0.00 C ATOM 353 CG ASN A 26 -17.058 6.915 3.510 1.00 0.00 C ATOM 354 OD1 ASN A 26 -17.442 8.078 3.380 1.00 0.00 O ATOM 355 ND2 ASN A 26 -17.689 6.033 4.276 1.00 0.00 N ATOM 0 H ASN A 26 -16.010 5.438 0.268 1.00 0.00 H new ATOM 0 HA ASN A 26 -16.017 8.131 1.503 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -15.905 5.346 2.622 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -14.947 6.576 3.421 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -18.528 6.309 4.786 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -17.335 5.080 4.354 1.00 0.00 H new ATOM 362 N GLY A 27 -13.733 6.868 -0.075 1.00 0.00 N ATOM 363 CA GLY A 27 -12.337 6.928 -0.466 1.00 0.00 C ATOM 364 C GLY A 27 -11.435 6.162 0.482 1.00 0.00 C ATOM 365 O GLY A 27 -10.513 6.729 1.068 1.00 0.00 O ATOM 0 H GLY A 27 -14.368 6.536 -0.801 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -12.227 6.524 -1.473 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -12.018 7.970 -0.504 1.00 0.00 H new ATOM 369 N ARG A 28 -11.703 4.869 0.635 1.00 0.00 N ATOM 370 CA ARG A 28 -10.911 4.024 1.521 1.00 0.00 C ATOM 371 C ARG A 28 -10.796 2.609 0.963 1.00 0.00 C ATOM 372 O ARG A 28 -11.802 1.948 0.706 1.00 0.00 O ATOM 373 CB ARG A 28 -11.537 3.984 2.916 1.00 0.00 C ATOM 374 CG ARG A 28 -12.921 3.357 2.946 1.00 0.00 C ATOM 375 CD ARG A 28 -13.574 3.512 4.310 1.00 0.00 C ATOM 376 NE ARG A 28 -12.954 2.651 5.314 1.00 0.00 N ATOM 377 CZ ARG A 28 -13.149 1.339 5.379 1.00 0.00 C ATOM 378 NH1 ARG A 28 -13.943 0.739 4.503 1.00 0.00 N ATOM 379 NH2 ARG A 28 -12.549 0.623 6.322 1.00 0.00 N ATOM 0 H ARG A 28 -12.462 4.384 0.157 1.00 0.00 H new ATOM 0 HA ARG A 28 -9.911 4.451 1.591 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -10.880 3.426 3.584 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -11.599 5.000 3.306 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -13.549 3.822 2.186 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -12.848 2.299 2.695 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -13.503 4.552 4.630 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -14.635 3.274 4.233 1.00 0.00 H new ATOM 0 HE ARG A 28 -12.337 3.081 6.003 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -14.406 1.285 3.777 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -14.091 -0.269 4.555 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -11.937 1.080 6.998 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -12.700 -0.385 6.371 1.00 0.00 H new ATOM 393 N PHE A 29 -9.563 2.150 0.777 1.00 0.00 N ATOM 394 CA PHE A 29 -9.315 0.814 0.248 1.00 0.00 C ATOM 395 C PHE A 29 -9.362 -0.229 1.361 1.00 0.00 C ATOM 396 O PHE A 29 -9.559 0.103 2.529 1.00 0.00 O ATOM 397 CB PHE A 29 -7.958 0.765 -0.456 1.00 0.00 C ATOM 398 CG PHE A 29 -7.787 1.827 -1.504 1.00 0.00 C ATOM 399 CD1 PHE A 29 -8.379 1.692 -2.749 1.00 0.00 C ATOM 400 CD2 PHE A 29 -7.033 2.960 -1.244 1.00 0.00 C ATOM 401 CE1 PHE A 29 -8.224 2.668 -3.716 1.00 0.00 C ATOM 402 CE2 PHE A 29 -6.875 3.939 -2.206 1.00 0.00 C ATOM 403 CZ PHE A 29 -7.470 3.793 -3.444 1.00 0.00 C ATOM 0 H PHE A 29 -8.719 2.684 0.985 1.00 0.00 H new ATOM 0 HA PHE A 29 -10.099 0.585 -0.474 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -7.168 0.869 0.288 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -7.833 -0.214 -0.919 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -8.969 0.814 -2.967 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -6.564 3.079 -0.279 1.00 0.00 H new ATOM 0 HE1 PHE A 29 -8.692 2.551 -4.682 1.00 0.00 H new ATOM 0 HE2 PHE A 29 -6.286 4.818 -1.990 1.00 0.00 H new ATOM 0 HZ PHE A 29 -7.346 4.557 -4.198 1.00 0.00 H new ATOM 413 N GLY A 30 -9.181 -1.492 0.988 1.00 0.00 N ATOM 414 CA GLY A 30 -9.207 -2.565 1.965 1.00 0.00 C ATOM 415 C GLY A 30 -8.024 -3.503 1.827 1.00 0.00 C ATOM 416 O GLY A 30 -8.176 -4.646 1.395 1.00 0.00 O ATOM 0 H GLY A 30 -9.017 -1.791 0.027 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -9.214 -2.139 2.968 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -10.131 -3.132 1.853 1.00 0.00 H new ATOM 420 N PHE A 31 -6.842 -3.020 2.194 1.00 0.00 N ATOM 421 CA PHE A 31 -5.627 -3.822 2.107 1.00 0.00 C ATOM 422 C PHE A 31 -4.489 -3.174 2.890 1.00 0.00 C ATOM 423 O PHE A 31 -4.193 -1.994 2.711 1.00 0.00 O ATOM 424 CB PHE A 31 -5.216 -4.006 0.644 1.00 0.00 C ATOM 425 CG PHE A 31 -4.576 -2.787 0.044 1.00 0.00 C ATOM 426 CD1 PHE A 31 -3.234 -2.517 0.255 1.00 0.00 C ATOM 427 CD2 PHE A 31 -5.318 -1.909 -0.731 1.00 0.00 C ATOM 428 CE1 PHE A 31 -2.642 -1.396 -0.296 1.00 0.00 C ATOM 429 CE2 PHE A 31 -4.732 -0.787 -1.285 1.00 0.00 C ATOM 430 CZ PHE A 31 -3.392 -0.530 -1.066 1.00 0.00 C ATOM 0 H PHE A 31 -6.699 -2.077 2.555 1.00 0.00 H new ATOM 0 HA PHE A 31 -5.834 -4.799 2.545 1.00 0.00 H new ATOM 0 HB2 PHE A 31 -4.522 -4.844 0.572 1.00 0.00 H new ATOM 0 HB3 PHE A 31 -6.096 -4.270 0.058 1.00 0.00 H new ATOM 0 HD1 PHE A 31 -2.643 -3.191 0.858 1.00 0.00 H new ATOM 0 HD2 PHE A 31 -6.366 -2.104 -0.904 1.00 0.00 H new ATOM 0 HE1 PHE A 31 -1.594 -1.198 -0.124 1.00 0.00 H new ATOM 0 HE2 PHE A 31 -5.320 -0.112 -1.888 1.00 0.00 H new ATOM 0 HZ PHE A 31 -2.932 0.347 -1.497 1.00 0.00 H new ATOM 440 N ASN A 32 -3.856 -3.956 3.758 1.00 0.00 N ATOM 441 CA ASN A 32 -2.751 -3.458 4.570 1.00 0.00 C ATOM 442 C ASN A 32 -1.409 -3.878 3.978 1.00 0.00 C ATOM 443 O ASN A 32 -1.324 -4.858 3.238 1.00 0.00 O ATOM 444 CB ASN A 32 -2.873 -3.974 6.005 1.00 0.00 C ATOM 445 CG ASN A 32 -3.679 -3.042 6.889 1.00 0.00 C ATOM 446 OD1 ASN A 32 -4.546 -2.311 6.410 1.00 0.00 O ATOM 447 ND2 ASN A 32 -3.395 -3.064 8.186 1.00 0.00 N ATOM 0 H ASN A 32 -4.089 -4.936 3.917 1.00 0.00 H new ATOM 0 HA ASN A 32 -2.799 -2.369 4.578 1.00 0.00 H new ATOM 0 HB2 ASN A 32 -3.343 -4.958 5.996 1.00 0.00 H new ATOM 0 HB3 ASN A 32 -1.877 -4.100 6.428 1.00 0.00 H new ATOM 0 HD21 ASN A 32 -3.904 -2.458 8.830 1.00 0.00 H new ATOM 0 HD22 ASN A 32 -2.668 -3.687 8.538 1.00 0.00 H new ATOM 454 N VAL A 33 -0.362 -3.130 4.310 1.00 0.00 N ATOM 455 CA VAL A 33 0.977 -3.425 3.813 1.00 0.00 C ATOM 456 C VAL A 33 1.995 -3.429 4.948 1.00 0.00 C ATOM 457 O VAL A 33 1.813 -2.758 5.964 1.00 0.00 O ATOM 458 CB VAL A 33 1.417 -2.405 2.747 1.00 0.00 C ATOM 459 CG1 VAL A 33 0.492 -2.459 1.541 1.00 0.00 C ATOM 460 CG2 VAL A 33 1.457 -1.002 3.335 1.00 0.00 C ATOM 0 H VAL A 33 -0.415 -2.315 4.921 1.00 0.00 H new ATOM 0 HA VAL A 33 0.936 -4.416 3.361 1.00 0.00 H new ATOM 0 HB VAL A 33 2.423 -2.665 2.416 1.00 0.00 H new ATOM 0 HG11 VAL A 33 0.819 -1.731 0.799 1.00 0.00 H new ATOM 0 HG12 VAL A 33 0.519 -3.458 1.106 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -0.526 -2.227 1.853 1.00 0.00 H new ATOM 0 HG21 VAL A 33 1.770 -0.294 2.567 1.00 0.00 H new ATOM 0 HG22 VAL A 33 0.465 -0.730 3.696 1.00 0.00 H new ATOM 0 HG23 VAL A 33 2.165 -0.975 4.164 1.00 0.00 H new ATOM 470 N LYS A 34 3.069 -4.190 4.768 1.00 0.00 N ATOM 471 CA LYS A 34 4.120 -4.282 5.775 1.00 0.00 C ATOM 472 C LYS A 34 5.498 -4.146 5.137 1.00 0.00 C ATOM 473 O LYS A 34 5.703 -4.536 3.989 1.00 0.00 O ATOM 474 CB LYS A 34 4.022 -5.613 6.524 1.00 0.00 C ATOM 475 CG LYS A 34 4.272 -6.826 5.645 1.00 0.00 C ATOM 476 CD LYS A 34 4.179 -8.118 6.438 1.00 0.00 C ATOM 477 CE LYS A 34 4.015 -9.323 5.524 1.00 0.00 C ATOM 478 NZ LYS A 34 5.329 -9.894 5.118 1.00 0.00 N ATOM 0 H LYS A 34 3.235 -4.753 3.933 1.00 0.00 H new ATOM 0 HA LYS A 34 3.984 -3.463 6.482 1.00 0.00 H new ATOM 0 HB2 LYS A 34 4.742 -5.613 7.342 1.00 0.00 H new ATOM 0 HB3 LYS A 34 3.031 -5.697 6.971 1.00 0.00 H new ATOM 0 HG2 LYS A 34 3.545 -6.844 4.833 1.00 0.00 H new ATOM 0 HG3 LYS A 34 5.259 -6.748 5.189 1.00 0.00 H new ATOM 0 HD2 LYS A 34 5.077 -8.239 7.044 1.00 0.00 H new ATOM 0 HD3 LYS A 34 3.335 -8.064 7.126 1.00 0.00 H new ATOM 0 HE2 LYS A 34 3.428 -10.088 6.033 1.00 0.00 H new ATOM 0 HE3 LYS A 34 3.456 -9.031 4.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 5.174 -10.713 4.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 5.879 -9.172 4.610 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 5.853 -10.196 5.964 1.00 0.00 H new ATOM 492 N GLY A 35 6.442 -3.591 5.891 1.00 0.00 N ATOM 493 CA GLY A 35 7.790 -3.415 5.383 1.00 0.00 C ATOM 494 C GLY A 35 7.975 -2.086 4.677 1.00 0.00 C ATOM 495 O GLY A 35 7.030 -1.308 4.546 1.00 0.00 O ATOM 0 H GLY A 35 6.297 -3.260 6.845 1.00 0.00 H new ATOM 0 HA2 GLY A 35 8.498 -3.486 6.209 1.00 0.00 H new ATOM 0 HA3 GLY A 35 8.023 -4.225 4.692 1.00 0.00 H new ATOM 499 N GLY A 36 9.196 -1.823 4.222 1.00 0.00 N ATOM 500 CA GLY A 36 9.480 -0.578 3.533 1.00 0.00 C ATOM 501 C GLY A 36 10.957 -0.395 3.251 1.00 0.00 C ATOM 502 O GLY A 36 11.702 -1.370 3.146 1.00 0.00 O ATOM 0 H GLY A 36 9.994 -2.451 4.318 1.00 0.00 H new ATOM 0 HA2 GLY A 36 8.928 -0.552 2.593 1.00 0.00 H new ATOM 0 HA3 GLY A 36 9.122 0.257 4.136 1.00 0.00 H new ATOM 506 N TYR A 37 11.383 0.857 3.125 1.00 0.00 N ATOM 507 CA TYR A 37 12.781 1.165 2.849 1.00 0.00 C ATOM 508 C TYR A 37 13.611 1.126 4.129 1.00 0.00 C ATOM 509 O TYR A 37 14.697 0.548 4.161 1.00 0.00 O ATOM 510 CB TYR A 37 12.902 2.540 2.190 1.00 0.00 C ATOM 511 CG TYR A 37 14.260 3.181 2.372 1.00 0.00 C ATOM 512 CD1 TYR A 37 14.539 3.959 3.488 1.00 0.00 C ATOM 513 CD2 TYR A 37 15.263 3.009 1.426 1.00 0.00 C ATOM 514 CE1 TYR A 37 15.778 4.547 3.658 1.00 0.00 C ATOM 515 CE2 TYR A 37 16.505 3.592 1.588 1.00 0.00 C ATOM 516 CZ TYR A 37 16.757 4.360 2.705 1.00 0.00 C ATOM 517 OH TYR A 37 17.993 4.944 2.869 1.00 0.00 O ATOM 0 H TYR A 37 10.780 1.675 3.210 1.00 0.00 H new ATOM 0 HA TYR A 37 13.165 0.408 2.166 1.00 0.00 H new ATOM 0 HB2 TYR A 37 12.695 2.442 1.124 1.00 0.00 H new ATOM 0 HB3 TYR A 37 12.139 3.200 2.603 1.00 0.00 H new ATOM 0 HD1 TYR A 37 13.774 4.107 4.236 1.00 0.00 H new ATOM 0 HD2 TYR A 37 15.068 2.409 0.549 1.00 0.00 H new ATOM 0 HE1 TYR A 37 15.978 5.149 4.532 1.00 0.00 H new ATOM 0 HE2 TYR A 37 17.274 3.447 0.844 1.00 0.00 H new ATOM 0 HH TYR A 37 18.567 4.713 2.109 1.00 0.00 H new ATOM 527 N ASP A 38 13.090 1.746 5.182 1.00 0.00 N ATOM 528 CA ASP A 38 13.780 1.782 6.466 1.00 0.00 C ATOM 529 C ASP A 38 13.985 0.373 7.013 1.00 0.00 C ATOM 530 O ASP A 38 14.904 0.129 7.794 1.00 0.00 O ATOM 531 CB ASP A 38 12.990 2.623 7.471 1.00 0.00 C ATOM 532 CG ASP A 38 13.299 2.250 8.907 1.00 0.00 C ATOM 533 OD1 ASP A 38 14.387 2.619 9.396 1.00 0.00 O ATOM 534 OD2 ASP A 38 12.452 1.589 9.544 1.00 0.00 O ATOM 0 H ASP A 38 12.192 2.230 5.172 1.00 0.00 H new ATOM 0 HA ASP A 38 14.758 2.238 6.312 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.217 3.678 7.316 1.00 0.00 H new ATOM 0 HB3 ASP A 38 11.923 2.496 7.287 1.00 0.00 H new ATOM 539 N GLN A 39 13.123 -0.549 6.598 1.00 0.00 N ATOM 540 CA GLN A 39 13.209 -1.933 7.048 1.00 0.00 C ATOM 541 C GLN A 39 13.986 -2.783 6.048 1.00 0.00 C ATOM 542 O GLN A 39 14.161 -3.986 6.243 1.00 0.00 O ATOM 543 CB GLN A 39 11.808 -2.514 7.250 1.00 0.00 C ATOM 544 CG GLN A 39 11.178 -2.133 8.580 1.00 0.00 C ATOM 545 CD GLN A 39 11.853 -2.805 9.759 1.00 0.00 C ATOM 546 OE1 GLN A 39 12.603 -3.767 9.594 1.00 0.00 O ATOM 547 NE2 GLN A 39 11.590 -2.300 10.959 1.00 0.00 N ATOM 0 H GLN A 39 12.357 -0.363 5.951 1.00 0.00 H new ATOM 0 HA GLN A 39 13.741 -1.947 7.999 1.00 0.00 H new ATOM 0 HB2 GLN A 39 11.162 -2.173 6.441 1.00 0.00 H new ATOM 0 HB3 GLN A 39 11.861 -3.600 7.180 1.00 0.00 H new ATOM 0 HG2 GLN A 39 11.229 -1.051 8.705 1.00 0.00 H new ATOM 0 HG3 GLN A 39 10.122 -2.403 8.568 1.00 0.00 H new ATOM 0 HE21 GLN A 39 10.962 -1.501 11.050 1.00 0.00 H new ATOM 0 HE22 GLN A 39 12.016 -2.711 11.790 1.00 0.00 H new ATOM 556 N LYS A 40 14.449 -2.151 4.975 1.00 0.00 N ATOM 557 CA LYS A 40 15.208 -2.848 3.944 1.00 0.00 C ATOM 558 C LYS A 40 14.482 -4.111 3.494 1.00 0.00 C ATOM 559 O LYS A 40 15.094 -5.167 3.335 1.00 0.00 O ATOM 560 CB LYS A 40 16.603 -3.205 4.462 1.00 0.00 C ATOM 561 CG LYS A 40 17.409 -2.001 4.917 1.00 0.00 C ATOM 562 CD LYS A 40 18.901 -2.230 4.739 1.00 0.00 C ATOM 563 CE LYS A 40 19.504 -2.939 5.942 1.00 0.00 C ATOM 564 NZ LYS A 40 19.635 -2.030 7.114 1.00 0.00 N ATOM 0 H LYS A 40 14.312 -1.156 4.797 1.00 0.00 H new ATOM 0 HA LYS A 40 15.305 -2.182 3.087 1.00 0.00 H new ATOM 0 HB2 LYS A 40 16.505 -3.902 5.294 1.00 0.00 H new ATOM 0 HB3 LYS A 40 17.152 -3.723 3.676 1.00 0.00 H new ATOM 0 HG2 LYS A 40 17.104 -1.122 4.349 1.00 0.00 H new ATOM 0 HG3 LYS A 40 17.194 -1.793 5.965 1.00 0.00 H new ATOM 0 HD2 LYS A 40 19.074 -2.823 3.841 1.00 0.00 H new ATOM 0 HD3 LYS A 40 19.402 -1.273 4.591 1.00 0.00 H new ATOM 0 HE2 LYS A 40 18.880 -3.791 6.211 1.00 0.00 H new ATOM 0 HE3 LYS A 40 20.485 -3.333 5.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 20.242 -2.475 7.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 20.060 -1.131 6.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 18.695 -1.849 7.520 1.00 0.00 H new ATOM 578 N MET A 41 13.174 -3.996 3.290 1.00 0.00 N ATOM 579 CA MET A 41 12.365 -5.129 2.856 1.00 0.00 C ATOM 580 C MET A 41 11.289 -4.684 1.870 1.00 0.00 C ATOM 581 O MET A 41 10.841 -3.538 1.880 1.00 0.00 O ATOM 582 CB MET A 41 11.718 -5.813 4.061 1.00 0.00 C ATOM 583 CG MET A 41 10.449 -5.126 4.540 1.00 0.00 C ATOM 584 SD MET A 41 9.596 -6.061 5.825 1.00 0.00 S ATOM 585 CE MET A 41 8.635 -7.201 4.832 1.00 0.00 C ATOM 0 H MET A 41 12.651 -3.129 3.418 1.00 0.00 H new ATOM 0 HA MET A 41 13.021 -5.840 2.353 1.00 0.00 H new ATOM 0 HB2 MET A 41 11.486 -6.846 3.801 1.00 0.00 H new ATOM 0 HB3 MET A 41 12.436 -5.844 4.880 1.00 0.00 H new ATOM 0 HG2 MET A 41 10.698 -4.136 4.921 1.00 0.00 H new ATOM 0 HG3 MET A 41 9.777 -4.982 3.694 1.00 0.00 H new ATOM 0 HE1 MET A 41 8.051 -7.849 5.485 1.00 0.00 H new ATOM 0 HE2 MET A 41 7.963 -6.640 4.182 1.00 0.00 H new ATOM 0 HE3 MET A 41 9.305 -7.808 4.224 1.00 0.00 H new ATOM 595 N PRO A 42 10.864 -5.611 0.999 1.00 0.00 N ATOM 596 CA PRO A 42 9.835 -5.336 -0.009 1.00 0.00 C ATOM 597 C PRO A 42 8.455 -5.143 0.609 1.00 0.00 C ATOM 598 O PRO A 42 8.177 -5.641 1.700 1.00 0.00 O ATOM 599 CB PRO A 42 9.857 -6.589 -0.888 1.00 0.00 C ATOM 600 CG PRO A 42 10.380 -7.665 -0.001 1.00 0.00 C ATOM 601 CD PRO A 42 11.354 -6.997 0.930 1.00 0.00 C ATOM 0 HA PRO A 42 10.034 -4.413 -0.553 1.00 0.00 H new ATOM 0 HB2 PRO A 42 8.861 -6.830 -1.258 1.00 0.00 H new ATOM 0 HB3 PRO A 42 10.496 -6.450 -1.760 1.00 0.00 H new ATOM 0 HG2 PRO A 42 9.572 -8.140 0.555 1.00 0.00 H new ATOM 0 HG3 PRO A 42 10.869 -8.447 -0.582 1.00 0.00 H new ATOM 0 HD2 PRO A 42 11.360 -7.470 1.912 1.00 0.00 H new ATOM 0 HD3 PRO A 42 12.373 -7.044 0.547 1.00 0.00 H new ATOM 609 N VAL A 43 7.592 -4.417 -0.095 1.00 0.00 N ATOM 610 CA VAL A 43 6.240 -4.159 0.385 1.00 0.00 C ATOM 611 C VAL A 43 5.294 -5.289 -0.006 1.00 0.00 C ATOM 612 O VAL A 43 5.070 -5.543 -1.190 1.00 0.00 O ATOM 613 CB VAL A 43 5.692 -2.830 -0.169 1.00 0.00 C ATOM 614 CG1 VAL A 43 4.358 -2.491 0.479 1.00 0.00 C ATOM 615 CG2 VAL A 43 6.697 -1.709 0.044 1.00 0.00 C ATOM 0 H VAL A 43 7.806 -3.997 -1.000 1.00 0.00 H new ATOM 0 HA VAL A 43 6.296 -4.095 1.472 1.00 0.00 H new ATOM 0 HB VAL A 43 5.530 -2.943 -1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 43 3.986 -1.549 0.075 1.00 0.00 H new ATOM 0 HG12 VAL A 43 3.640 -3.284 0.270 1.00 0.00 H new ATOM 0 HG13 VAL A 43 4.491 -2.397 1.557 1.00 0.00 H new ATOM 0 HG21 VAL A 43 6.293 -0.778 -0.353 1.00 0.00 H new ATOM 0 HG22 VAL A 43 6.893 -1.594 1.110 1.00 0.00 H new ATOM 0 HG23 VAL A 43 7.626 -1.951 -0.472 1.00 0.00 H new ATOM 625 N ILE A 44 4.740 -5.963 0.996 1.00 0.00 N ATOM 626 CA ILE A 44 3.816 -7.065 0.757 1.00 0.00 C ATOM 627 C ILE A 44 2.546 -6.907 1.586 1.00 0.00 C ATOM 628 O ILE A 44 2.595 -6.496 2.745 1.00 0.00 O ATOM 629 CB ILE A 44 4.464 -8.423 1.084 1.00 0.00 C ATOM 630 CG1 ILE A 44 5.766 -8.595 0.298 1.00 0.00 C ATOM 631 CG2 ILE A 44 3.499 -9.558 0.774 1.00 0.00 C ATOM 632 CD1 ILE A 44 6.939 -7.859 0.906 1.00 0.00 C ATOM 0 H ILE A 44 4.915 -5.765 1.981 1.00 0.00 H new ATOM 0 HA ILE A 44 3.561 -7.039 -0.302 1.00 0.00 H new ATOM 0 HB ILE A 44 4.698 -8.450 2.148 1.00 0.00 H new ATOM 0 HG12 ILE A 44 6.006 -9.656 0.236 1.00 0.00 H new ATOM 0 HG13 ILE A 44 5.615 -8.242 -0.722 1.00 0.00 H new ATOM 0 HG21 ILE A 44 3.971 -10.512 1.010 1.00 0.00 H new ATOM 0 HG22 ILE A 44 2.596 -9.442 1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 44 3.238 -9.535 -0.284 1.00 0.00 H new ATOM 0 HD11 ILE A 44 7.828 -8.025 0.297 1.00 0.00 H new ATOM 0 HD12 ILE A 44 6.719 -6.792 0.944 1.00 0.00 H new ATOM 0 HD13 ILE A 44 7.117 -8.229 1.916 1.00 0.00 H new ATOM 644 N VAL A 45 1.408 -7.238 0.983 1.00 0.00 N ATOM 645 CA VAL A 45 0.124 -7.136 1.666 1.00 0.00 C ATOM 646 C VAL A 45 0.128 -7.934 2.965 1.00 0.00 C ATOM 647 O VAL A 45 0.514 -9.103 2.987 1.00 0.00 O ATOM 648 CB VAL A 45 -1.028 -7.635 0.774 1.00 0.00 C ATOM 649 CG1 VAL A 45 -2.345 -7.604 1.534 1.00 0.00 C ATOM 650 CG2 VAL A 45 -1.116 -6.802 -0.496 1.00 0.00 C ATOM 0 H VAL A 45 1.350 -7.579 0.023 1.00 0.00 H new ATOM 0 HA VAL A 45 -0.032 -6.081 1.891 1.00 0.00 H new ATOM 0 HB VAL A 45 -0.824 -8.668 0.491 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -3.147 -7.960 0.887 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -2.274 -8.247 2.411 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -2.559 -6.583 1.849 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.935 -7.168 -1.115 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -1.296 -5.759 -0.235 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.180 -6.881 -1.049 1.00 0.00 H new ATOM 660 N SER A 46 -0.305 -7.295 4.047 1.00 0.00 N ATOM 661 CA SER A 46 -0.349 -7.944 5.352 1.00 0.00 C ATOM 662 C SER A 46 -1.682 -8.656 5.561 1.00 0.00 C ATOM 663 O SER A 46 -1.724 -9.867 5.779 1.00 0.00 O ATOM 664 CB SER A 46 -0.128 -6.916 6.464 1.00 0.00 C ATOM 665 OG SER A 46 -0.142 -7.534 7.740 1.00 0.00 O ATOM 0 H SER A 46 -0.630 -6.328 4.046 1.00 0.00 H new ATOM 0 HA SER A 46 0.449 -8.686 5.388 1.00 0.00 H new ATOM 0 HB2 SER A 46 0.826 -6.410 6.312 1.00 0.00 H new ATOM 0 HB3 SER A 46 -0.905 -6.153 6.418 1.00 0.00 H new ATOM 0 HG SER A 46 0.003 -6.857 8.433 1.00 0.00 H new ATOM 671 N ARG A 47 -2.769 -7.895 5.491 1.00 0.00 N ATOM 672 CA ARG A 47 -4.104 -8.452 5.673 1.00 0.00 C ATOM 673 C ARG A 47 -5.114 -7.748 4.772 1.00 0.00 C ATOM 674 O ARG A 47 -4.948 -6.577 4.431 1.00 0.00 O ATOM 675 CB ARG A 47 -4.537 -8.329 7.135 1.00 0.00 C ATOM 676 CG ARG A 47 -5.766 -9.155 7.479 1.00 0.00 C ATOM 677 CD ARG A 47 -5.390 -10.572 7.881 1.00 0.00 C ATOM 678 NE ARG A 47 -6.560 -11.439 7.988 1.00 0.00 N ATOM 679 CZ ARG A 47 -7.186 -11.961 6.938 1.00 0.00 C ATOM 680 NH1 ARG A 47 -6.756 -11.704 5.711 1.00 0.00 N ATOM 681 NH2 ARG A 47 -8.244 -12.741 7.116 1.00 0.00 N ATOM 0 H ARG A 47 -2.752 -6.891 5.310 1.00 0.00 H new ATOM 0 HA ARG A 47 -4.070 -9.506 5.399 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -3.711 -8.637 7.777 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -4.740 -7.282 7.358 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -6.311 -8.677 8.293 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -6.437 -9.185 6.621 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -4.698 -10.986 7.147 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -4.866 -10.551 8.836 1.00 0.00 H new ATOM 0 HE ARG A 47 -6.916 -11.656 8.919 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -5.943 -11.104 5.571 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -7.238 -12.106 4.907 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -8.578 -12.941 8.059 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -8.724 -13.141 6.310 1.00 0.00 H new ATOM 695 N VAL A 48 -6.162 -8.471 4.388 1.00 0.00 N ATOM 696 CA VAL A 48 -7.200 -7.916 3.527 1.00 0.00 C ATOM 697 C VAL A 48 -8.590 -8.247 4.059 1.00 0.00 C ATOM 698 O VAL A 48 -8.984 -9.411 4.113 1.00 0.00 O ATOM 699 CB VAL A 48 -7.074 -8.444 2.086 1.00 0.00 C ATOM 700 CG1 VAL A 48 -8.095 -7.771 1.180 1.00 0.00 C ATOM 701 CG2 VAL A 48 -5.662 -8.231 1.562 1.00 0.00 C ATOM 0 H VAL A 48 -6.314 -9.442 4.660 1.00 0.00 H new ATOM 0 HA VAL A 48 -7.064 -6.834 3.523 1.00 0.00 H new ATOM 0 HB VAL A 48 -7.277 -9.515 2.091 1.00 0.00 H new ATOM 0 HG11 VAL A 48 -7.991 -8.156 0.166 1.00 0.00 H new ATOM 0 HG12 VAL A 48 -9.100 -7.980 1.546 1.00 0.00 H new ATOM 0 HG13 VAL A 48 -7.926 -6.694 1.178 1.00 0.00 H new ATOM 0 HG21 VAL A 48 -5.591 -8.610 0.542 1.00 0.00 H new ATOM 0 HG22 VAL A 48 -5.427 -7.167 1.571 1.00 0.00 H new ATOM 0 HG23 VAL A 48 -4.954 -8.764 2.197 1.00 0.00 H new ATOM 711 N ALA A 49 -9.329 -7.214 4.449 1.00 0.00 N ATOM 712 CA ALA A 49 -10.677 -7.394 4.974 1.00 0.00 C ATOM 713 C ALA A 49 -11.694 -7.519 3.845 1.00 0.00 C ATOM 714 O ALA A 49 -11.553 -6.915 2.781 1.00 0.00 O ATOM 715 CB ALA A 49 -11.045 -6.238 5.893 1.00 0.00 C ATOM 0 H ALA A 49 -9.017 -6.244 4.411 1.00 0.00 H new ATOM 0 HA ALA A 49 -10.695 -8.320 5.548 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -12.054 -6.386 6.278 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -10.342 -6.197 6.725 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -11.003 -5.302 5.336 1.00 0.00 H new ATOM 721 N PRO A 50 -12.743 -8.320 4.078 1.00 0.00 N ATOM 722 CA PRO A 50 -13.804 -8.543 3.092 1.00 0.00 C ATOM 723 C PRO A 50 -14.671 -7.306 2.883 1.00 0.00 C ATOM 724 O PRO A 50 -14.650 -6.378 3.691 1.00 0.00 O ATOM 725 CB PRO A 50 -14.629 -9.676 3.707 1.00 0.00 C ATOM 726 CG PRO A 50 -14.386 -9.568 5.173 1.00 0.00 C ATOM 727 CD PRO A 50 -12.975 -9.071 5.324 1.00 0.00 C ATOM 0 HA PRO A 50 -13.401 -8.777 2.107 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -15.688 -9.567 3.472 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -14.315 -10.647 3.324 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -15.094 -8.880 5.636 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -14.514 -10.534 5.662 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -12.865 -8.436 6.203 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -12.269 -9.894 5.435 1.00 0.00 H new ATOM 735 N GLY A 51 -15.434 -7.300 1.794 1.00 0.00 N ATOM 736 CA GLY A 51 -16.298 -6.171 1.500 1.00 0.00 C ATOM 737 C GLY A 51 -15.518 -4.908 1.197 1.00 0.00 C ATOM 738 O GLY A 51 -15.891 -3.818 1.634 1.00 0.00 O ATOM 0 H GLY A 51 -15.469 -8.056 1.110 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.933 -6.415 0.648 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.958 -5.992 2.349 1.00 0.00 H new ATOM 742 N THR A 52 -14.429 -5.051 0.448 1.00 0.00 N ATOM 743 CA THR A 52 -13.592 -3.913 0.090 1.00 0.00 C ATOM 744 C THR A 52 -13.287 -3.904 -1.404 1.00 0.00 C ATOM 745 O THR A 52 -13.302 -4.938 -2.071 1.00 0.00 O ATOM 746 CB THR A 52 -12.266 -3.922 0.873 1.00 0.00 C ATOM 747 OG1 THR A 52 -11.687 -5.231 0.842 1.00 0.00 O ATOM 748 CG2 THR A 52 -12.488 -3.494 2.316 1.00 0.00 C ATOM 0 H THR A 52 -14.106 -5.945 0.077 1.00 0.00 H new ATOM 0 HA THR A 52 -14.152 -3.015 0.350 1.00 0.00 H new ATOM 0 HB THR A 52 -11.585 -3.214 0.401 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.054 -5.768 1.575 1.00 0.00 H new ATOM 0 HG21 THR A 52 -11.538 -3.508 2.850 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.901 -2.486 2.337 1.00 0.00 H new ATOM 0 HG23 THR A 52 -13.184 -4.182 2.796 1.00 0.00 H new ATOM 756 N PRO A 53 -13.002 -2.709 -1.943 1.00 0.00 N ATOM 757 CA PRO A 53 -12.686 -2.537 -3.364 1.00 0.00 C ATOM 758 C PRO A 53 -11.333 -3.136 -3.734 1.00 0.00 C ATOM 759 O PRO A 53 -10.921 -3.094 -4.892 1.00 0.00 O ATOM 760 CB PRO A 53 -12.663 -1.017 -3.541 1.00 0.00 C ATOM 761 CG PRO A 53 -12.339 -0.483 -2.188 1.00 0.00 C ATOM 762 CD PRO A 53 -12.965 -1.434 -1.206 1.00 0.00 C ATOM 0 HA PRO A 53 -13.407 -3.044 -4.006 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.916 -0.715 -4.275 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -13.625 -0.645 -3.894 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.261 -0.423 -2.040 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.734 0.525 -2.061 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -12.375 -1.515 -0.293 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -13.964 -1.110 -0.913 1.00 0.00 H new ATOM 770 N ALA A 54 -10.647 -3.695 -2.742 1.00 0.00 N ATOM 771 CA ALA A 54 -9.342 -4.305 -2.964 1.00 0.00 C ATOM 772 C ALA A 54 -9.435 -5.827 -2.930 1.00 0.00 C ATOM 773 O ALA A 54 -8.458 -6.524 -3.204 1.00 0.00 O ATOM 774 CB ALA A 54 -8.346 -3.812 -1.925 1.00 0.00 C ATOM 0 H ALA A 54 -10.974 -3.738 -1.777 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.994 -4.010 -3.954 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -7.376 -4.276 -2.103 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.250 -2.729 -1.999 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -8.698 -4.078 -0.928 1.00 0.00 H new ATOM 780 N ASP A 55 -10.615 -6.335 -2.592 1.00 0.00 N ATOM 781 CA ASP A 55 -10.835 -7.775 -2.523 1.00 0.00 C ATOM 782 C ASP A 55 -11.700 -8.249 -3.687 1.00 0.00 C ATOM 783 O ASP A 55 -11.325 -9.163 -4.422 1.00 0.00 O ATOM 784 CB ASP A 55 -11.495 -8.149 -1.195 1.00 0.00 C ATOM 785 CG ASP A 55 -11.270 -9.601 -0.825 1.00 0.00 C ATOM 786 OD1 ASP A 55 -10.095 -10.012 -0.722 1.00 0.00 O ATOM 787 OD2 ASP A 55 -12.269 -10.328 -0.639 1.00 0.00 O ATOM 0 H ASP A 55 -11.433 -5.772 -2.362 1.00 0.00 H new ATOM 0 HA ASP A 55 -9.866 -8.269 -2.589 1.00 0.00 H new ATOM 0 HB2 ASP A 55 -11.101 -7.510 -0.404 1.00 0.00 H new ATOM 0 HB3 ASP A 55 -12.566 -7.955 -1.258 1.00 0.00 H new ATOM 792 N LEU A 56 -12.860 -7.622 -3.848 1.00 0.00 N ATOM 793 CA LEU A 56 -13.781 -7.980 -4.922 1.00 0.00 C ATOM 794 C LEU A 56 -13.195 -7.619 -6.284 1.00 0.00 C ATOM 795 O LEU A 56 -13.583 -8.185 -7.307 1.00 0.00 O ATOM 796 CB LEU A 56 -15.123 -7.272 -4.728 1.00 0.00 C ATOM 797 CG LEU A 56 -15.754 -7.399 -3.341 1.00 0.00 C ATOM 798 CD1 LEU A 56 -16.808 -6.322 -3.133 1.00 0.00 C ATOM 799 CD2 LEU A 56 -16.359 -8.783 -3.155 1.00 0.00 C ATOM 0 H LEU A 56 -13.185 -6.863 -3.249 1.00 0.00 H new ATOM 0 HA LEU A 56 -13.938 -9.058 -4.888 1.00 0.00 H new ATOM 0 HB2 LEU A 56 -14.988 -6.213 -4.948 1.00 0.00 H new ATOM 0 HB3 LEU A 56 -15.827 -7.663 -5.463 1.00 0.00 H new ATOM 0 HG LEU A 56 -14.972 -7.262 -2.594 1.00 0.00 H new ATOM 0 HD11 LEU A 56 -17.246 -6.428 -2.141 1.00 0.00 H new ATOM 0 HD12 LEU A 56 -16.346 -5.339 -3.222 1.00 0.00 H new ATOM 0 HD13 LEU A 56 -17.588 -6.426 -3.887 1.00 0.00 H new ATOM 0 HD21 LEU A 56 -16.804 -8.855 -2.162 1.00 0.00 H new ATOM 0 HD22 LEU A 56 -17.128 -8.948 -3.910 1.00 0.00 H new ATOM 0 HD23 LEU A 56 -15.580 -9.538 -3.259 1.00 0.00 H new ATOM 811 N CYS A 57 -12.259 -6.677 -6.288 1.00 0.00 N ATOM 812 CA CYS A 57 -11.618 -6.242 -7.524 1.00 0.00 C ATOM 813 C CYS A 57 -10.897 -7.404 -8.201 1.00 0.00 C ATOM 814 O CYS A 57 -10.760 -8.483 -7.625 1.00 0.00 O ATOM 815 CB CYS A 57 -10.631 -5.110 -7.240 1.00 0.00 C ATOM 816 SG CYS A 57 -9.310 -5.553 -6.088 1.00 0.00 S ATOM 0 H CYS A 57 -11.927 -6.200 -5.450 1.00 0.00 H new ATOM 0 HA CYS A 57 -12.394 -5.877 -8.198 1.00 0.00 H new ATOM 0 HB2 CYS A 57 -10.185 -4.787 -8.181 1.00 0.00 H new ATOM 0 HB3 CYS A 57 -11.178 -4.258 -6.838 1.00 0.00 H new ATOM 0 HG CYS A 57 -8.161 -5.219 -6.596 1.00 0.00 H new ATOM 822 N VAL A 58 -10.439 -7.175 -9.428 1.00 0.00 N ATOM 823 CA VAL A 58 -9.733 -8.202 -10.184 1.00 0.00 C ATOM 824 C VAL A 58 -8.568 -7.606 -10.966 1.00 0.00 C ATOM 825 O VAL A 58 -8.695 -6.574 -11.627 1.00 0.00 O ATOM 826 CB VAL A 58 -10.676 -8.928 -11.162 1.00 0.00 C ATOM 827 CG1 VAL A 58 -9.931 -10.025 -11.907 1.00 0.00 C ATOM 828 CG2 VAL A 58 -11.877 -9.496 -10.420 1.00 0.00 C ATOM 0 H VAL A 58 -10.544 -6.287 -9.919 1.00 0.00 H new ATOM 0 HA VAL A 58 -9.350 -8.921 -9.459 1.00 0.00 H new ATOM 0 HB VAL A 58 -11.038 -8.207 -11.894 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -10.613 -10.527 -12.593 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -9.107 -9.587 -12.470 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -9.538 -10.748 -11.192 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -12.533 -10.006 -11.126 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -11.536 -10.204 -9.665 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -12.423 -8.686 -9.937 1.00 0.00 H new ATOM 838 N PRO A 59 -7.404 -8.268 -10.893 1.00 0.00 N ATOM 839 CA PRO A 59 -7.241 -9.496 -10.109 1.00 0.00 C ATOM 840 C PRO A 59 -7.302 -9.238 -8.607 1.00 0.00 C ATOM 841 O PRO A 59 -6.759 -8.249 -8.116 1.00 0.00 O ATOM 842 CB PRO A 59 -5.849 -9.991 -10.511 1.00 0.00 C ATOM 843 CG PRO A 59 -5.123 -8.765 -10.946 1.00 0.00 C ATOM 844 CD PRO A 59 -6.158 -7.869 -11.568 1.00 0.00 C ATOM 0 HA PRO A 59 -8.037 -10.214 -10.306 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -5.344 -10.475 -9.675 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -5.906 -10.724 -11.316 1.00 0.00 H new ATOM 0 HG2 PRO A 59 -4.641 -8.276 -10.099 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -4.338 -9.010 -11.662 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -5.930 -6.816 -11.402 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -6.220 -8.015 -12.646 1.00 0.00 H new ATOM 852 N ARG A 60 -7.965 -10.134 -7.884 1.00 0.00 N ATOM 853 CA ARG A 60 -8.097 -10.003 -6.438 1.00 0.00 C ATOM 854 C ARG A 60 -6.730 -9.844 -5.780 1.00 0.00 C ATOM 855 O ARG A 60 -5.816 -10.633 -6.023 1.00 0.00 O ATOM 856 CB ARG A 60 -8.816 -11.222 -5.857 1.00 0.00 C ATOM 857 CG ARG A 60 -8.926 -11.198 -4.341 1.00 0.00 C ATOM 858 CD ARG A 60 -9.777 -12.349 -3.827 1.00 0.00 C ATOM 859 NE ARG A 60 -9.761 -12.432 -2.369 1.00 0.00 N ATOM 860 CZ ARG A 60 -10.339 -13.412 -1.682 1.00 0.00 C ATOM 861 NH1 ARG A 60 -10.974 -14.387 -2.318 1.00 0.00 N ATOM 862 NH2 ARG A 60 -10.282 -13.417 -0.357 1.00 0.00 N ATOM 0 H ARG A 60 -8.419 -10.959 -8.276 1.00 0.00 H new ATOM 0 HA ARG A 60 -8.687 -9.110 -6.232 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -9.817 -11.281 -6.285 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -8.286 -12.125 -6.160 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -7.930 -11.256 -3.902 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -9.361 -10.251 -4.021 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -10.803 -12.223 -4.172 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -9.412 -13.286 -4.248 1.00 0.00 H new ATOM 0 HE ARG A 60 -9.280 -11.698 -1.850 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -11.020 -14.386 -3.337 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -11.417 -15.138 -1.788 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -9.794 -12.668 0.135 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -10.726 -14.169 0.170 1.00 0.00 H new ATOM 876 N LEU A 61 -6.596 -8.818 -4.946 1.00 0.00 N ATOM 877 CA LEU A 61 -5.340 -8.555 -4.252 1.00 0.00 C ATOM 878 C LEU A 61 -5.203 -9.441 -3.018 1.00 0.00 C ATOM 879 O LEU A 61 -5.565 -9.042 -1.912 1.00 0.00 O ATOM 880 CB LEU A 61 -5.258 -7.082 -3.848 1.00 0.00 C ATOM 881 CG LEU A 61 -3.952 -6.639 -3.186 1.00 0.00 C ATOM 882 CD1 LEU A 61 -2.838 -6.541 -4.218 1.00 0.00 C ATOM 883 CD2 LEU A 61 -4.139 -5.309 -2.472 1.00 0.00 C ATOM 0 H LEU A 61 -7.342 -8.155 -4.734 1.00 0.00 H new ATOM 0 HA LEU A 61 -4.521 -8.785 -4.934 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.416 -6.473 -4.738 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -6.080 -6.867 -3.165 1.00 0.00 H new ATOM 0 HG LEU A 61 -3.670 -7.388 -2.446 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -1.916 -6.225 -3.730 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.686 -7.515 -4.683 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -3.112 -5.813 -4.982 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.199 -5.010 -2.007 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -4.446 -4.550 -3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.906 -5.413 -1.705 1.00 0.00 H new ATOM 895 N ASN A 62 -4.677 -10.645 -3.216 1.00 0.00 N ATOM 896 CA ASN A 62 -4.490 -11.588 -2.119 1.00 0.00 C ATOM 897 C ASN A 62 -3.207 -11.283 -1.352 1.00 0.00 C ATOM 898 O ASN A 62 -2.376 -10.495 -1.803 1.00 0.00 O ATOM 899 CB ASN A 62 -4.450 -13.021 -2.652 1.00 0.00 C ATOM 900 CG ASN A 62 -4.955 -14.029 -1.638 1.00 0.00 C ATOM 901 OD1 ASN A 62 -4.267 -14.997 -1.312 1.00 0.00 O ATOM 902 ND2 ASN A 62 -6.163 -13.807 -1.134 1.00 0.00 N ATOM 0 H ASN A 62 -4.373 -10.991 -4.126 1.00 0.00 H new ATOM 0 HA ASN A 62 -5.334 -11.485 -1.437 1.00 0.00 H new ATOM 0 HB2 ASN A 62 -5.054 -13.086 -3.557 1.00 0.00 H new ATOM 0 HB3 ASN A 62 -3.427 -13.273 -2.933 1.00 0.00 H new ATOM 0 HD21 ASN A 62 -6.556 -14.452 -0.448 1.00 0.00 H new ATOM 0 HD22 ASN A 62 -6.698 -12.992 -1.433 1.00 0.00 H new ATOM 909 N GLU A 63 -3.054 -11.913 -0.192 1.00 0.00 N ATOM 910 CA GLU A 63 -1.872 -11.708 0.638 1.00 0.00 C ATOM 911 C GLU A 63 -0.629 -12.286 -0.034 1.00 0.00 C ATOM 912 O GLU A 63 -0.653 -13.401 -0.553 1.00 0.00 O ATOM 913 CB GLU A 63 -2.068 -12.351 2.012 1.00 0.00 C ATOM 914 CG GLU A 63 -3.265 -11.806 2.773 1.00 0.00 C ATOM 915 CD GLU A 63 -4.566 -12.474 2.370 1.00 0.00 C ATOM 916 OE1 GLU A 63 -4.667 -13.710 2.515 1.00 0.00 O ATOM 917 OE2 GLU A 63 -5.482 -11.761 1.910 1.00 0.00 O ATOM 0 H GLU A 63 -3.733 -12.569 0.195 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.730 -10.635 0.765 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -2.187 -13.427 1.887 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -1.168 -12.197 2.608 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -3.105 -11.945 3.842 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -3.343 -10.733 2.600 1.00 0.00 H new ATOM 924 N GLY A 64 0.456 -11.518 -0.019 1.00 0.00 N ATOM 925 CA GLY A 64 1.693 -11.970 -0.629 1.00 0.00 C ATOM 926 C GLY A 64 2.029 -11.204 -1.893 1.00 0.00 C ATOM 927 O GLY A 64 3.148 -11.287 -2.399 1.00 0.00 O ATOM 0 H GLY A 64 0.501 -10.591 0.405 1.00 0.00 H new ATOM 0 HA2 GLY A 64 2.508 -11.861 0.086 1.00 0.00 H new ATOM 0 HA3 GLY A 64 1.613 -13.032 -0.862 1.00 0.00 H new ATOM 931 N ASP A 65 1.058 -10.457 -2.406 1.00 0.00 N ATOM 932 CA ASP A 65 1.256 -9.673 -3.620 1.00 0.00 C ATOM 933 C ASP A 65 2.254 -8.544 -3.381 1.00 0.00 C ATOM 934 O ASP A 65 1.867 -7.414 -3.084 1.00 0.00 O ATOM 935 CB ASP A 65 -0.076 -9.098 -4.104 1.00 0.00 C ATOM 936 CG ASP A 65 -0.959 -10.148 -4.751 1.00 0.00 C ATOM 937 OD1 ASP A 65 -1.321 -11.125 -4.062 1.00 0.00 O ATOM 938 OD2 ASP A 65 -1.288 -9.992 -5.945 1.00 0.00 O ATOM 0 H ASP A 65 0.126 -10.378 -2.000 1.00 0.00 H new ATOM 0 HA ASP A 65 1.659 -10.334 -4.388 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -0.604 -8.653 -3.261 1.00 0.00 H new ATOM 0 HB3 ASP A 65 0.115 -8.298 -4.819 1.00 0.00 H new ATOM 943 N GLN A 66 3.538 -8.859 -3.512 1.00 0.00 N ATOM 944 CA GLN A 66 4.592 -7.872 -3.308 1.00 0.00 C ATOM 945 C GLN A 66 4.435 -6.702 -4.275 1.00 0.00 C ATOM 946 O GLN A 66 4.585 -6.860 -5.486 1.00 0.00 O ATOM 947 CB GLN A 66 5.967 -8.517 -3.488 1.00 0.00 C ATOM 948 CG GLN A 66 7.107 -7.513 -3.541 1.00 0.00 C ATOM 949 CD GLN A 66 8.340 -8.067 -4.228 1.00 0.00 C ATOM 950 OE1 GLN A 66 8.707 -9.226 -4.031 1.00 0.00 O ATOM 951 NE2 GLN A 66 8.988 -7.239 -5.040 1.00 0.00 N ATOM 0 H GLN A 66 3.874 -9.790 -3.759 1.00 0.00 H new ATOM 0 HA GLN A 66 4.508 -7.493 -2.290 1.00 0.00 H new ATOM 0 HB2 GLN A 66 6.144 -9.212 -2.667 1.00 0.00 H new ATOM 0 HB3 GLN A 66 5.967 -9.103 -4.407 1.00 0.00 H new ATOM 0 HG2 GLN A 66 6.774 -6.618 -4.067 1.00 0.00 H new ATOM 0 HG3 GLN A 66 7.366 -7.209 -2.527 1.00 0.00 H new ATOM 0 HE21 GLN A 66 8.649 -6.287 -5.174 1.00 0.00 H new ATOM 0 HE22 GLN A 66 9.825 -7.556 -5.529 1.00 0.00 H new ATOM 960 N VAL A 67 4.132 -5.528 -3.730 1.00 0.00 N ATOM 961 CA VAL A 67 3.956 -4.331 -4.544 1.00 0.00 C ATOM 962 C VAL A 67 5.296 -3.806 -5.046 1.00 0.00 C ATOM 963 O VAL A 67 6.066 -3.213 -4.290 1.00 0.00 O ATOM 964 CB VAL A 67 3.243 -3.216 -3.755 1.00 0.00 C ATOM 965 CG1 VAL A 67 2.930 -2.036 -4.663 1.00 0.00 C ATOM 966 CG2 VAL A 67 1.976 -3.751 -3.105 1.00 0.00 C ATOM 0 H VAL A 67 4.003 -5.380 -2.729 1.00 0.00 H new ATOM 0 HA VAL A 67 3.338 -4.615 -5.396 1.00 0.00 H new ATOM 0 HB VAL A 67 3.910 -2.869 -2.966 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.427 -1.258 -4.089 1.00 0.00 H new ATOM 0 HG12 VAL A 67 3.857 -1.639 -5.076 1.00 0.00 H new ATOM 0 HG13 VAL A 67 2.282 -2.364 -5.475 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.485 -2.950 -2.552 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.302 -4.126 -3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 67 2.232 -4.561 -2.421 1.00 0.00 H new ATOM 976 N VAL A 68 5.570 -4.027 -6.328 1.00 0.00 N ATOM 977 CA VAL A 68 6.817 -3.575 -6.933 1.00 0.00 C ATOM 978 C VAL A 68 6.783 -2.075 -7.207 1.00 0.00 C ATOM 979 O VAL A 68 7.773 -1.373 -7.001 1.00 0.00 O ATOM 980 CB VAL A 68 7.104 -4.319 -8.251 1.00 0.00 C ATOM 981 CG1 VAL A 68 8.378 -3.794 -8.894 1.00 0.00 C ATOM 982 CG2 VAL A 68 7.198 -5.818 -8.006 1.00 0.00 C ATOM 0 H VAL A 68 4.944 -4.517 -6.968 1.00 0.00 H new ATOM 0 HA VAL A 68 7.612 -3.794 -6.220 1.00 0.00 H new ATOM 0 HB VAL A 68 6.278 -4.137 -8.939 1.00 0.00 H new ATOM 0 HG11 VAL A 68 8.564 -4.331 -9.824 1.00 0.00 H new ATOM 0 HG12 VAL A 68 8.267 -2.730 -9.106 1.00 0.00 H new ATOM 0 HG13 VAL A 68 9.217 -3.943 -8.214 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.401 -6.329 -8.947 1.00 0.00 H new ATOM 0 HG22 VAL A 68 8.004 -6.022 -7.301 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.256 -6.179 -7.593 1.00 0.00 H new ATOM 992 N LEU A 69 5.636 -1.590 -7.671 1.00 0.00 N ATOM 993 CA LEU A 69 5.472 -0.172 -7.972 1.00 0.00 C ATOM 994 C LEU A 69 4.010 0.245 -7.846 1.00 0.00 C ATOM 995 O LEU A 69 3.113 -0.445 -8.331 1.00 0.00 O ATOM 996 CB LEU A 69 5.981 0.132 -9.383 1.00 0.00 C ATOM 997 CG LEU A 69 7.428 -0.267 -9.675 1.00 0.00 C ATOM 998 CD1 LEU A 69 7.716 -0.177 -11.165 1.00 0.00 C ATOM 999 CD2 LEU A 69 8.392 0.610 -8.889 1.00 0.00 C ATOM 0 H LEU A 69 4.807 -2.157 -7.847 1.00 0.00 H new ATOM 0 HA LEU A 69 6.057 0.398 -7.250 1.00 0.00 H new ATOM 0 HB2 LEU A 69 5.334 -0.376 -10.098 1.00 0.00 H new ATOM 0 HB3 LEU A 69 5.877 1.202 -9.562 1.00 0.00 H new ATOM 0 HG LEU A 69 7.570 -1.301 -9.360 1.00 0.00 H new ATOM 0 HD11 LEU A 69 8.750 -0.465 -11.354 1.00 0.00 H new ATOM 0 HD12 LEU A 69 7.048 -0.848 -11.706 1.00 0.00 H new ATOM 0 HD13 LEU A 69 7.556 0.846 -11.505 1.00 0.00 H new ATOM 0 HD21 LEU A 69 9.417 0.312 -9.109 1.00 0.00 H new ATOM 0 HD22 LEU A 69 8.249 1.653 -9.172 1.00 0.00 H new ATOM 0 HD23 LEU A 69 8.202 0.494 -7.822 1.00 0.00 H new ATOM 1011 N ILE A 70 3.779 1.380 -7.193 1.00 0.00 N ATOM 1012 CA ILE A 70 2.427 1.890 -7.006 1.00 0.00 C ATOM 1013 C ILE A 70 2.105 2.980 -8.024 1.00 0.00 C ATOM 1014 O ILE A 70 2.796 3.995 -8.100 1.00 0.00 O ATOM 1015 CB ILE A 70 2.229 2.455 -5.587 1.00 0.00 C ATOM 1016 CG1 ILE A 70 2.493 1.369 -4.542 1.00 0.00 C ATOM 1017 CG2 ILE A 70 0.824 3.017 -5.431 1.00 0.00 C ATOM 1018 CD1 ILE A 70 2.635 1.906 -3.135 1.00 0.00 C ATOM 0 H ILE A 70 4.510 1.963 -6.785 1.00 0.00 H new ATOM 0 HA ILE A 70 1.750 1.048 -7.151 1.00 0.00 H new ATOM 0 HB ILE A 70 2.942 3.265 -5.431 1.00 0.00 H new ATOM 0 HG12 ILE A 70 1.677 0.647 -4.566 1.00 0.00 H new ATOM 0 HG13 ILE A 70 3.402 0.831 -4.810 1.00 0.00 H new ATOM 0 HG21 ILE A 70 0.700 3.412 -4.423 1.00 0.00 H new ATOM 0 HG22 ILE A 70 0.669 3.816 -6.156 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.094 2.226 -5.603 1.00 0.00 H new ATOM 0 HD11 ILE A 70 2.820 1.081 -2.448 1.00 0.00 H new ATOM 0 HD12 ILE A 70 3.470 2.606 -3.095 1.00 0.00 H new ATOM 0 HD13 ILE A 70 1.717 2.419 -2.847 1.00 0.00 H new ATOM 1030 N ASN A 71 1.051 2.762 -8.802 1.00 0.00 N ATOM 1031 CA ASN A 71 0.636 3.727 -9.815 1.00 0.00 C ATOM 1032 C ASN A 71 1.755 3.973 -10.822 1.00 0.00 C ATOM 1033 O ASN A 71 1.837 5.041 -11.427 1.00 0.00 O ATOM 1034 CB ASN A 71 0.229 5.046 -9.156 1.00 0.00 C ATOM 1035 CG ASN A 71 -0.971 4.889 -8.241 1.00 0.00 C ATOM 1036 OD1 ASN A 71 -1.885 4.116 -8.525 1.00 0.00 O ATOM 1037 ND2 ASN A 71 -0.971 5.625 -7.135 1.00 0.00 N ATOM 0 H ASN A 71 0.468 1.926 -8.751 1.00 0.00 H new ATOM 0 HA ASN A 71 -0.222 3.314 -10.345 1.00 0.00 H new ATOM 0 HB2 ASN A 71 1.070 5.438 -8.584 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -0.000 5.780 -9.929 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -1.751 5.562 -6.481 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -0.191 6.253 -6.940 1.00 0.00 H new ATOM 1044 N GLY A 72 2.616 2.975 -10.998 1.00 0.00 N ATOM 1045 CA GLY A 72 3.718 3.102 -11.933 1.00 0.00 C ATOM 1046 C GLY A 72 4.778 4.073 -11.451 1.00 0.00 C ATOM 1047 O GLY A 72 5.305 4.865 -12.232 1.00 0.00 O ATOM 0 H GLY A 72 2.570 2.081 -10.509 1.00 0.00 H new ATOM 0 HA2 GLY A 72 4.171 2.123 -12.091 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.336 3.436 -12.898 1.00 0.00 H new ATOM 1051 N ARG A 73 5.091 4.013 -10.161 1.00 0.00 N ATOM 1052 CA ARG A 73 6.093 4.895 -9.576 1.00 0.00 C ATOM 1053 C ARG A 73 6.994 4.130 -8.611 1.00 0.00 C ATOM 1054 O ARG A 73 6.626 3.066 -8.114 1.00 0.00 O ATOM 1055 CB ARG A 73 5.416 6.057 -8.845 1.00 0.00 C ATOM 1056 CG ARG A 73 4.895 7.140 -9.775 1.00 0.00 C ATOM 1057 CD ARG A 73 4.662 8.447 -9.033 1.00 0.00 C ATOM 1058 NE ARG A 73 4.256 9.523 -9.933 1.00 0.00 N ATOM 1059 CZ ARG A 73 4.096 10.783 -9.546 1.00 0.00 C ATOM 1060 NH1 ARG A 73 4.306 11.124 -8.283 1.00 0.00 N ATOM 1061 NH2 ARG A 73 3.724 11.706 -10.425 1.00 0.00 N ATOM 0 H ARG A 73 4.665 3.363 -9.501 1.00 0.00 H new ATOM 0 HA ARG A 73 6.708 5.291 -10.384 1.00 0.00 H new ATOM 0 HB2 ARG A 73 4.587 5.669 -8.252 1.00 0.00 H new ATOM 0 HB3 ARG A 73 6.127 6.500 -8.147 1.00 0.00 H new ATOM 0 HG2 ARG A 73 5.609 7.301 -10.583 1.00 0.00 H new ATOM 0 HG3 ARG A 73 3.963 6.810 -10.234 1.00 0.00 H new ATOM 0 HD2 ARG A 73 3.894 8.301 -8.274 1.00 0.00 H new ATOM 0 HD3 ARG A 73 5.575 8.736 -8.512 1.00 0.00 H new ATOM 0 HE ARG A 73 4.086 9.294 -10.912 1.00 0.00 H new ATOM 0 HH11 ARG A 73 4.591 10.418 -7.605 1.00 0.00 H new ATOM 0 HH12 ARG A 73 4.182 12.093 -7.989 1.00 0.00 H new ATOM 0 HH21 ARG A 73 3.561 11.447 -11.398 1.00 0.00 H new ATOM 0 HH22 ARG A 73 3.601 12.674 -10.127 1.00 0.00 H new ATOM 1075 N ASP A 74 8.176 4.680 -8.353 1.00 0.00 N ATOM 1076 CA ASP A 74 9.130 4.050 -7.448 1.00 0.00 C ATOM 1077 C ASP A 74 8.827 4.415 -5.998 1.00 0.00 C ATOM 1078 O ASP A 74 9.062 5.546 -5.571 1.00 0.00 O ATOM 1079 CB ASP A 74 10.557 4.469 -7.805 1.00 0.00 C ATOM 1080 CG ASP A 74 10.749 5.972 -7.752 1.00 0.00 C ATOM 1081 OD1 ASP A 74 10.477 6.640 -8.771 1.00 0.00 O ATOM 1082 OD2 ASP A 74 11.174 6.479 -6.693 1.00 0.00 O ATOM 0 H ASP A 74 8.496 5.560 -8.758 1.00 0.00 H new ATOM 0 HA ASP A 74 9.038 2.969 -7.558 1.00 0.00 H new ATOM 0 HB2 ASP A 74 11.255 3.992 -7.118 1.00 0.00 H new ATOM 0 HB3 ASP A 74 10.799 4.110 -8.805 1.00 0.00 H new ATOM 1087 N ILE A 75 8.304 3.452 -5.247 1.00 0.00 N ATOM 1088 CA ILE A 75 7.969 3.673 -3.846 1.00 0.00 C ATOM 1089 C ILE A 75 8.785 2.762 -2.935 1.00 0.00 C ATOM 1090 O ILE A 75 8.712 2.864 -1.711 1.00 0.00 O ATOM 1091 CB ILE A 75 6.470 3.435 -3.581 1.00 0.00 C ATOM 1092 CG1 ILE A 75 6.087 2.000 -3.945 1.00 0.00 C ATOM 1093 CG2 ILE A 75 5.629 4.430 -4.368 1.00 0.00 C ATOM 1094 CD1 ILE A 75 6.299 1.013 -2.818 1.00 0.00 C ATOM 0 H ILE A 75 8.103 2.511 -5.585 1.00 0.00 H new ATOM 0 HA ILE A 75 8.208 4.713 -3.625 1.00 0.00 H new ATOM 0 HB ILE A 75 6.275 3.584 -2.519 1.00 0.00 H new ATOM 0 HG12 ILE A 75 5.039 1.977 -4.245 1.00 0.00 H new ATOM 0 HG13 ILE A 75 6.672 1.684 -4.808 1.00 0.00 H new ATOM 0 HG21 ILE A 75 4.572 4.250 -4.171 1.00 0.00 H new ATOM 0 HG22 ILE A 75 5.887 5.445 -4.064 1.00 0.00 H new ATOM 0 HG23 ILE A 75 5.825 4.309 -5.433 1.00 0.00 H new ATOM 0 HD11 ILE A 75 6.006 0.016 -3.148 1.00 0.00 H new ATOM 0 HD12 ILE A 75 7.351 1.007 -2.533 1.00 0.00 H new ATOM 0 HD13 ILE A 75 5.692 1.304 -1.960 1.00 0.00 H new ATOM 1106 N ALA A 76 9.564 1.872 -3.542 1.00 0.00 N ATOM 1107 CA ALA A 76 10.397 0.945 -2.786 1.00 0.00 C ATOM 1108 C ALA A 76 11.374 1.695 -1.886 1.00 0.00 C ATOM 1109 O ALA A 76 11.796 1.182 -0.850 1.00 0.00 O ATOM 1110 CB ALA A 76 11.150 0.021 -3.731 1.00 0.00 C ATOM 0 H ALA A 76 9.635 1.774 -4.555 1.00 0.00 H new ATOM 0 HA ALA A 76 9.746 0.344 -2.151 1.00 0.00 H new ATOM 0 HB1 ALA A 76 11.768 -0.666 -3.153 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.437 -0.548 -4.329 1.00 0.00 H new ATOM 0 HB3 ALA A 76 11.785 0.613 -4.390 1.00 0.00 H new ATOM 1116 N GLU A 77 11.730 2.910 -2.290 1.00 0.00 N ATOM 1117 CA GLU A 77 12.660 3.728 -1.519 1.00 0.00 C ATOM 1118 C GLU A 77 11.953 4.388 -0.338 1.00 0.00 C ATOM 1119 O GLU A 77 12.569 4.665 0.692 1.00 0.00 O ATOM 1120 CB GLU A 77 13.292 4.798 -2.411 1.00 0.00 C ATOM 1121 CG GLU A 77 14.027 5.880 -1.637 1.00 0.00 C ATOM 1122 CD GLU A 77 14.669 6.912 -2.543 1.00 0.00 C ATOM 1123 OE1 GLU A 77 15.563 6.535 -3.330 1.00 0.00 O ATOM 1124 OE2 GLU A 77 14.279 8.095 -2.466 1.00 0.00 O ATOM 0 H GLU A 77 11.390 3.350 -3.145 1.00 0.00 H new ATOM 0 HA GLU A 77 13.444 3.076 -1.134 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.988 4.320 -3.100 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.513 5.262 -3.016 1.00 0.00 H new ATOM 0 HG2 GLU A 77 13.329 6.377 -0.964 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.795 5.419 -1.016 1.00 0.00 H new ATOM 1131 N HIS A 78 10.657 4.637 -0.495 1.00 0.00 N ATOM 1132 CA HIS A 78 9.866 5.263 0.558 1.00 0.00 C ATOM 1133 C HIS A 78 9.720 4.331 1.756 1.00 0.00 C ATOM 1134 O HIS A 78 9.713 3.108 1.608 1.00 0.00 O ATOM 1135 CB HIS A 78 8.485 5.649 0.026 1.00 0.00 C ATOM 1136 CG HIS A 78 8.458 6.981 -0.658 1.00 0.00 C ATOM 1137 ND1 HIS A 78 7.459 7.358 -1.531 1.00 0.00 N ATOM 1138 CD2 HIS A 78 9.313 8.028 -0.593 1.00 0.00 C ATOM 1139 CE1 HIS A 78 7.702 8.579 -1.974 1.00 0.00 C ATOM 1140 NE2 HIS A 78 8.821 9.008 -1.419 1.00 0.00 N ATOM 0 H HIS A 78 10.132 4.415 -1.341 1.00 0.00 H new ATOM 0 HA HIS A 78 10.387 6.163 0.883 1.00 0.00 H new ATOM 0 HB2 HIS A 78 8.147 4.884 -0.673 1.00 0.00 H new ATOM 0 HB3 HIS A 78 7.776 5.660 0.854 1.00 0.00 H new ATOM 0 HD2 HIS A 78 10.215 8.082 -0.001 1.00 0.00 H new ATOM 0 HE1 HIS A 78 7.090 9.132 -2.671 1.00 0.00 H new ATOM 0 HE2 HIS A 78 9.250 9.920 -1.578 1.00 0.00 H new ATOM 1149 N THR A 79 9.605 4.915 2.945 1.00 0.00 N ATOM 1150 CA THR A 79 9.461 4.137 4.169 1.00 0.00 C ATOM 1151 C THR A 79 8.034 3.626 4.331 1.00 0.00 C ATOM 1152 O THR A 79 7.113 4.105 3.669 1.00 0.00 O ATOM 1153 CB THR A 79 9.841 4.967 5.410 1.00 0.00 C ATOM 1154 OG1 THR A 79 8.772 5.855 5.752 1.00 0.00 O ATOM 1155 CG2 THR A 79 11.111 5.767 5.158 1.00 0.00 C ATOM 0 H THR A 79 9.609 5.925 3.086 1.00 0.00 H new ATOM 0 HA THR A 79 10.141 3.289 4.086 1.00 0.00 H new ATOM 0 HB THR A 79 10.021 4.281 6.237 1.00 0.00 H new ATOM 0 HG1 THR A 79 9.021 6.378 6.543 1.00 0.00 H new ATOM 0 HG21 THR A 79 11.360 6.345 6.048 1.00 0.00 H new ATOM 0 HG22 THR A 79 11.930 5.086 4.927 1.00 0.00 H new ATOM 0 HG23 THR A 79 10.954 6.444 4.318 1.00 0.00 H new ATOM 1163 N HIS A 80 7.857 2.650 5.216 1.00 0.00 N ATOM 1164 CA HIS A 80 6.541 2.074 5.467 1.00 0.00 C ATOM 1165 C HIS A 80 5.475 3.164 5.535 1.00 0.00 C ATOM 1166 O HIS A 80 4.481 3.120 4.810 1.00 0.00 O ATOM 1167 CB HIS A 80 6.551 1.272 6.768 1.00 0.00 C ATOM 1168 CG HIS A 80 5.185 0.872 7.236 1.00 0.00 C ATOM 1169 ND1 HIS A 80 4.632 -0.363 6.974 1.00 0.00 N ATOM 1170 CD2 HIS A 80 4.261 1.552 7.954 1.00 0.00 C ATOM 1171 CE1 HIS A 80 3.426 -0.426 7.509 1.00 0.00 C ATOM 1172 NE2 HIS A 80 3.177 0.724 8.110 1.00 0.00 N ATOM 0 H HIS A 80 8.609 2.241 5.771 1.00 0.00 H new ATOM 0 HA HIS A 80 6.300 1.406 4.640 1.00 0.00 H new ATOM 0 HB2 HIS A 80 7.155 0.376 6.628 1.00 0.00 H new ATOM 0 HB3 HIS A 80 7.034 1.863 7.546 1.00 0.00 H new ATOM 0 HD2 HIS A 80 4.358 2.558 8.334 1.00 0.00 H new ATOM 0 HE1 HIS A 80 2.758 -1.273 7.463 1.00 0.00 H new ATOM 0 HE2 HIS A 80 2.319 0.959 8.609 1.00 0.00 H new ATOM 1181 N ASP A 81 5.690 4.141 6.410 1.00 0.00 N ATOM 1182 CA ASP A 81 4.748 5.242 6.572 1.00 0.00 C ATOM 1183 C ASP A 81 4.574 6.006 5.263 1.00 0.00 C ATOM 1184 O ASP A 81 3.453 6.299 4.850 1.00 0.00 O ATOM 1185 CB ASP A 81 5.226 6.192 7.672 1.00 0.00 C ATOM 1186 CG ASP A 81 5.419 5.489 9.001 1.00 0.00 C ATOM 1187 OD1 ASP A 81 4.439 5.393 9.768 1.00 0.00 O ATOM 1188 OD2 ASP A 81 6.550 5.035 9.274 1.00 0.00 O ATOM 0 H ASP A 81 6.508 4.193 7.017 1.00 0.00 H new ATOM 0 HA ASP A 81 3.783 4.823 6.858 1.00 0.00 H new ATOM 0 HB2 ASP A 81 6.166 6.652 7.368 1.00 0.00 H new ATOM 0 HB3 ASP A 81 4.502 6.998 7.792 1.00 0.00 H new ATOM 1193 N GLN A 82 5.691 6.325 4.617 1.00 0.00 N ATOM 1194 CA GLN A 82 5.661 7.056 3.356 1.00 0.00 C ATOM 1195 C GLN A 82 4.801 6.331 2.326 1.00 0.00 C ATOM 1196 O GLN A 82 4.062 6.957 1.567 1.00 0.00 O ATOM 1197 CB GLN A 82 7.080 7.240 2.815 1.00 0.00 C ATOM 1198 CG GLN A 82 7.838 8.382 3.472 1.00 0.00 C ATOM 1199 CD GLN A 82 7.370 9.743 2.996 1.00 0.00 C ATOM 1200 OE1 GLN A 82 6.434 10.320 3.550 1.00 0.00 O ATOM 1201 NE2 GLN A 82 8.022 10.266 1.963 1.00 0.00 N ATOM 0 H GLN A 82 6.627 6.089 4.946 1.00 0.00 H new ATOM 0 HA GLN A 82 5.221 8.036 3.544 1.00 0.00 H new ATOM 0 HB2 GLN A 82 7.638 6.315 2.959 1.00 0.00 H new ATOM 0 HB3 GLN A 82 7.030 7.418 1.741 1.00 0.00 H new ATOM 0 HG2 GLN A 82 7.718 8.318 4.553 1.00 0.00 H new ATOM 0 HG3 GLN A 82 8.902 8.274 3.263 1.00 0.00 H new ATOM 0 HE21 GLN A 82 8.792 9.753 1.534 1.00 0.00 H new ATOM 0 HE22 GLN A 82 7.752 11.180 1.600 1.00 0.00 H new ATOM 1210 N VAL A 83 4.904 5.005 2.305 1.00 0.00 N ATOM 1211 CA VAL A 83 4.135 4.194 1.369 1.00 0.00 C ATOM 1212 C VAL A 83 2.643 4.268 1.673 1.00 0.00 C ATOM 1213 O VAL A 83 1.869 4.837 0.903 1.00 0.00 O ATOM 1214 CB VAL A 83 4.583 2.720 1.405 1.00 0.00 C ATOM 1215 CG1 VAL A 83 3.535 1.828 0.757 1.00 0.00 C ATOM 1216 CG2 VAL A 83 5.931 2.557 0.720 1.00 0.00 C ATOM 0 H VAL A 83 5.512 4.471 2.925 1.00 0.00 H new ATOM 0 HA VAL A 83 4.320 4.599 0.374 1.00 0.00 H new ATOM 0 HB VAL A 83 4.691 2.416 2.446 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.868 0.791 0.792 1.00 0.00 H new ATOM 0 HG12 VAL A 83 2.592 1.924 1.295 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.393 2.129 -0.281 1.00 0.00 H new ATOM 0 HG21 VAL A 83 6.232 1.510 0.754 1.00 0.00 H new ATOM 0 HG22 VAL A 83 5.852 2.878 -0.319 1.00 0.00 H new ATOM 0 HG23 VAL A 83 6.676 3.166 1.233 1.00 0.00 H new ATOM 1226 N VAL A 84 2.246 3.690 2.802 1.00 0.00 N ATOM 1227 CA VAL A 84 0.846 3.692 3.210 1.00 0.00 C ATOM 1228 C VAL A 84 0.170 5.010 2.850 1.00 0.00 C ATOM 1229 O VAL A 84 -0.893 5.025 2.228 1.00 0.00 O ATOM 1230 CB VAL A 84 0.703 3.451 4.725 1.00 0.00 C ATOM 1231 CG1 VAL A 84 -0.694 3.825 5.195 1.00 0.00 C ATOM 1232 CG2 VAL A 84 1.019 2.003 5.066 1.00 0.00 C ATOM 0 H VAL A 84 2.874 3.215 3.450 1.00 0.00 H new ATOM 0 HA VAL A 84 0.358 2.879 2.672 1.00 0.00 H new ATOM 0 HB VAL A 84 1.418 4.087 5.246 1.00 0.00 H new ATOM 0 HG11 VAL A 84 -0.777 3.648 6.267 1.00 0.00 H new ATOM 0 HG12 VAL A 84 -0.878 4.879 4.986 1.00 0.00 H new ATOM 0 HG13 VAL A 84 -1.430 3.217 4.669 1.00 0.00 H new ATOM 0 HG21 VAL A 84 0.913 1.851 6.140 1.00 0.00 H new ATOM 0 HG22 VAL A 84 0.329 1.346 4.536 1.00 0.00 H new ATOM 0 HG23 VAL A 84 2.041 1.773 4.766 1.00 0.00 H new ATOM 1242 N LEU A 85 0.793 6.115 3.244 1.00 0.00 N ATOM 1243 CA LEU A 85 0.253 7.440 2.962 1.00 0.00 C ATOM 1244 C LEU A 85 0.225 7.709 1.461 1.00 0.00 C ATOM 1245 O LEU A 85 -0.710 8.322 0.947 1.00 0.00 O ATOM 1246 CB LEU A 85 1.084 8.512 3.669 1.00 0.00 C ATOM 1247 CG LEU A 85 0.667 8.849 5.101 1.00 0.00 C ATOM 1248 CD1 LEU A 85 1.049 7.722 6.047 1.00 0.00 C ATOM 1249 CD2 LEU A 85 1.300 10.159 5.546 1.00 0.00 C ATOM 0 H LEU A 85 1.673 6.120 3.760 1.00 0.00 H new ATOM 0 HA LEU A 85 -0.770 7.476 3.337 1.00 0.00 H new ATOM 0 HB2 LEU A 85 2.124 8.187 3.682 1.00 0.00 H new ATOM 0 HB3 LEU A 85 1.043 9.425 3.075 1.00 0.00 H new ATOM 0 HG LEU A 85 -0.417 8.965 5.126 1.00 0.00 H new ATOM 0 HD11 LEU A 85 0.744 7.980 7.061 1.00 0.00 H new ATOM 0 HD12 LEU A 85 0.548 6.804 5.740 1.00 0.00 H new ATOM 0 HD13 LEU A 85 2.128 7.574 6.019 1.00 0.00 H new ATOM 0 HD21 LEU A 85 0.992 10.383 6.567 1.00 0.00 H new ATOM 0 HD22 LEU A 85 2.386 10.071 5.505 1.00 0.00 H new ATOM 0 HD23 LEU A 85 0.976 10.963 4.885 1.00 0.00 H new ATOM 1261 N PHE A 86 1.255 7.243 0.763 1.00 0.00 N ATOM 1262 CA PHE A 86 1.349 7.432 -0.680 1.00 0.00 C ATOM 1263 C PHE A 86 0.055 7.009 -1.369 1.00 0.00 C ATOM 1264 O PHE A 86 -0.419 7.679 -2.287 1.00 0.00 O ATOM 1265 CB PHE A 86 2.525 6.633 -1.245 1.00 0.00 C ATOM 1266 CG PHE A 86 2.785 6.897 -2.701 1.00 0.00 C ATOM 1267 CD1 PHE A 86 3.135 8.165 -3.137 1.00 0.00 C ATOM 1268 CD2 PHE A 86 2.679 5.878 -3.633 1.00 0.00 C ATOM 1269 CE1 PHE A 86 3.375 8.412 -4.476 1.00 0.00 C ATOM 1270 CE2 PHE A 86 2.918 6.118 -4.973 1.00 0.00 C ATOM 1271 CZ PHE A 86 3.265 7.387 -5.395 1.00 0.00 C ATOM 0 H PHE A 86 2.037 6.732 1.173 1.00 0.00 H new ATOM 0 HA PHE A 86 1.513 8.492 -0.872 1.00 0.00 H new ATOM 0 HB2 PHE A 86 3.423 6.871 -0.675 1.00 0.00 H new ATOM 0 HB3 PHE A 86 2.332 5.569 -1.106 1.00 0.00 H new ATOM 0 HD1 PHE A 86 3.221 8.970 -2.422 1.00 0.00 H new ATOM 0 HD2 PHE A 86 2.406 4.884 -3.309 1.00 0.00 H new ATOM 0 HE1 PHE A 86 3.648 9.405 -4.803 1.00 0.00 H new ATOM 0 HE2 PHE A 86 2.834 5.314 -5.690 1.00 0.00 H new ATOM 0 HZ PHE A 86 3.450 7.577 -6.442 1.00 0.00 H new ATOM 1281 N ILE A 87 -0.511 5.894 -0.920 1.00 0.00 N ATOM 1282 CA ILE A 87 -1.749 5.382 -1.492 1.00 0.00 C ATOM 1283 C ILE A 87 -2.899 6.362 -1.282 1.00 0.00 C ATOM 1284 O ILE A 87 -3.517 6.825 -2.240 1.00 0.00 O ATOM 1285 CB ILE A 87 -2.132 4.021 -0.880 1.00 0.00 C ATOM 1286 CG1 ILE A 87 -0.986 3.022 -1.048 1.00 0.00 C ATOM 1287 CG2 ILE A 87 -3.404 3.490 -1.523 1.00 0.00 C ATOM 1288 CD1 ILE A 87 -1.068 1.843 -0.103 1.00 0.00 C ATOM 0 H ILE A 87 -0.131 5.328 -0.161 1.00 0.00 H new ATOM 0 HA ILE A 87 -1.573 5.255 -2.560 1.00 0.00 H new ATOM 0 HB ILE A 87 -2.317 4.157 0.185 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -0.982 2.655 -2.074 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -0.039 3.538 -0.891 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -3.661 2.528 -1.080 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -4.218 4.196 -1.356 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -3.246 3.365 -2.594 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -0.224 1.176 -0.279 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -1.041 2.199 0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -1.999 1.303 -0.275 1.00 0.00 H new ATOM 1300 N LYS A 88 -3.178 6.676 -0.021 1.00 0.00 N ATOM 1301 CA LYS A 88 -4.251 7.604 0.317 1.00 0.00 C ATOM 1302 C LYS A 88 -4.112 8.904 -0.468 1.00 0.00 C ATOM 1303 O LYS A 88 -5.097 9.442 -0.975 1.00 0.00 O ATOM 1304 CB LYS A 88 -4.243 7.899 1.818 1.00 0.00 C ATOM 1305 CG LYS A 88 -5.090 6.935 2.632 1.00 0.00 C ATOM 1306 CD LYS A 88 -4.320 5.671 2.976 1.00 0.00 C ATOM 1307 CE LYS A 88 -3.500 5.846 4.245 1.00 0.00 C ATOM 1308 NZ LYS A 88 -4.346 6.253 5.401 1.00 0.00 N ATOM 0 H LYS A 88 -2.676 6.301 0.784 1.00 0.00 H new ATOM 0 HA LYS A 88 -5.199 7.138 0.050 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -3.216 7.863 2.181 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -4.604 8.914 1.982 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -5.418 7.423 3.550 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -5.987 6.674 2.071 1.00 0.00 H new ATOM 0 HD2 LYS A 88 -5.017 4.842 3.103 1.00 0.00 H new ATOM 0 HD3 LYS A 88 -3.661 5.409 2.149 1.00 0.00 H new ATOM 0 HE2 LYS A 88 -2.990 4.912 4.479 1.00 0.00 H new ATOM 0 HE3 LYS A 88 -2.728 6.597 4.078 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 -4.086 5.691 6.236 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 -4.196 7.262 5.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 -5.347 6.090 5.173 1.00 0.00 H new ATOM 1322 N ALA A 89 -2.885 9.404 -0.566 1.00 0.00 N ATOM 1323 CA ALA A 89 -2.618 10.639 -1.292 1.00 0.00 C ATOM 1324 C ALA A 89 -3.327 10.646 -2.642 1.00 0.00 C ATOM 1325 O ALA A 89 -4.067 11.577 -2.960 1.00 0.00 O ATOM 1326 CB ALA A 89 -1.120 10.828 -1.480 1.00 0.00 C ATOM 0 H ALA A 89 -2.059 8.972 -0.151 1.00 0.00 H new ATOM 0 HA ALA A 89 -3.007 11.469 -0.702 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.936 11.754 -2.024 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -0.634 10.876 -0.505 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -0.716 9.989 -2.046 1.00 0.00 H new ATOM 1332 N SER A 90 -3.096 9.602 -3.432 1.00 0.00 N ATOM 1333 CA SER A 90 -3.710 9.491 -4.750 1.00 0.00 C ATOM 1334 C SER A 90 -5.188 9.866 -4.695 1.00 0.00 C ATOM 1335 O SER A 90 -5.660 10.693 -5.476 1.00 0.00 O ATOM 1336 CB SER A 90 -3.553 8.069 -5.291 1.00 0.00 C ATOM 1337 OG SER A 90 -3.913 8.001 -6.660 1.00 0.00 O ATOM 0 H SER A 90 -2.489 8.822 -3.182 1.00 0.00 H new ATOM 0 HA SER A 90 -3.202 10.185 -5.419 1.00 0.00 H new ATOM 0 HB2 SER A 90 -2.521 7.741 -5.167 1.00 0.00 H new ATOM 0 HB3 SER A 90 -4.176 7.386 -4.714 1.00 0.00 H new ATOM 0 HG SER A 90 -3.802 7.082 -6.982 1.00 0.00 H new ATOM 1343 N CYS A 91 -5.913 9.251 -3.766 1.00 0.00 N ATOM 1344 CA CYS A 91 -7.338 9.519 -3.608 1.00 0.00 C ATOM 1345 C CYS A 91 -7.626 11.013 -3.713 1.00 0.00 C ATOM 1346 O CYS A 91 -8.458 11.439 -4.514 1.00 0.00 O ATOM 1347 CB CYS A 91 -7.832 8.985 -2.263 1.00 0.00 C ATOM 1348 SG CYS A 91 -9.578 8.515 -2.251 1.00 0.00 S ATOM 0 H CYS A 91 -5.538 8.564 -3.112 1.00 0.00 H new ATOM 0 HA CYS A 91 -7.870 9.008 -4.411 1.00 0.00 H new ATOM 0 HB2 CYS A 91 -7.232 8.118 -1.986 1.00 0.00 H new ATOM 0 HB3 CYS A 91 -7.666 9.745 -1.500 1.00 0.00 H new ATOM 0 HG CYS A 91 -9.901 8.074 -1.071 1.00 0.00 H new ATOM 1354 N GLU A 92 -6.934 11.802 -2.898 1.00 0.00 N ATOM 1355 CA GLU A 92 -7.118 13.249 -2.899 1.00 0.00 C ATOM 1356 C GLU A 92 -7.403 13.761 -4.308 1.00 0.00 C ATOM 1357 O GLU A 92 -8.435 14.385 -4.555 1.00 0.00 O ATOM 1358 CB GLU A 92 -5.876 13.943 -2.334 1.00 0.00 C ATOM 1359 CG GLU A 92 -6.139 15.359 -1.850 1.00 0.00 C ATOM 1360 CD GLU A 92 -4.872 16.073 -1.419 1.00 0.00 C ATOM 1361 OE1 GLU A 92 -3.781 15.675 -1.878 1.00 0.00 O ATOM 1362 OE2 GLU A 92 -4.972 17.029 -0.622 1.00 0.00 O ATOM 0 H GLU A 92 -6.242 11.465 -2.229 1.00 0.00 H new ATOM 0 HA GLU A 92 -7.975 13.481 -2.267 1.00 0.00 H new ATOM 0 HB2 GLU A 92 -5.484 13.352 -1.506 1.00 0.00 H new ATOM 0 HB3 GLU A 92 -5.103 13.968 -3.102 1.00 0.00 H new ATOM 0 HG2 GLU A 92 -6.619 15.928 -2.646 1.00 0.00 H new ATOM 0 HG3 GLU A 92 -6.837 15.329 -1.014 1.00 0.00 H new ATOM 1369 N ARG A 93 -6.482 13.492 -5.227 1.00 0.00 N ATOM 1370 CA ARG A 93 -6.633 13.926 -6.610 1.00 0.00 C ATOM 1371 C ARG A 93 -7.343 12.860 -7.440 1.00 0.00 C ATOM 1372 O ARG A 93 -7.278 11.671 -7.129 1.00 0.00 O ATOM 1373 CB ARG A 93 -5.265 14.237 -7.222 1.00 0.00 C ATOM 1374 CG ARG A 93 -4.407 13.004 -7.453 1.00 0.00 C ATOM 1375 CD ARG A 93 -3.072 13.365 -8.084 1.00 0.00 C ATOM 1376 NE ARG A 93 -3.146 13.398 -9.542 1.00 0.00 N ATOM 1377 CZ ARG A 93 -2.187 13.893 -10.316 1.00 0.00 C ATOM 1378 NH1 ARG A 93 -1.086 14.395 -9.774 1.00 0.00 N ATOM 1379 NH2 ARG A 93 -2.328 13.888 -11.636 1.00 0.00 N ATOM 0 H ARG A 93 -5.623 12.975 -5.039 1.00 0.00 H new ATOM 0 HA ARG A 93 -7.240 14.831 -6.616 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -5.410 14.752 -8.172 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -4.730 14.924 -6.566 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -4.237 12.495 -6.504 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -4.939 12.305 -8.099 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -2.749 14.338 -7.716 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -2.318 12.641 -7.776 1.00 0.00 H new ATOM 0 HE ARG A 93 -3.980 13.020 -9.991 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -0.974 14.402 -8.760 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -0.351 14.774 -10.371 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -3.174 13.504 -12.057 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -1.591 14.269 -12.229 1.00 0.00 H new ATOM 1393 N HIS A 94 -8.020 13.295 -8.498 1.00 0.00 N ATOM 1394 CA HIS A 94 -8.743 12.379 -9.373 1.00 0.00 C ATOM 1395 C HIS A 94 -8.067 12.284 -10.737 1.00 0.00 C ATOM 1396 O HIS A 94 -8.395 13.035 -11.657 1.00 0.00 O ATOM 1397 CB HIS A 94 -10.193 12.836 -9.539 1.00 0.00 C ATOM 1398 CG HIS A 94 -10.928 12.980 -8.242 1.00 0.00 C ATOM 1399 ND1 HIS A 94 -11.528 11.920 -7.596 1.00 0.00 N ATOM 1400 CD2 HIS A 94 -11.156 14.068 -7.470 1.00 0.00 C ATOM 1401 CE1 HIS A 94 -12.096 12.350 -6.483 1.00 0.00 C ATOM 1402 NE2 HIS A 94 -11.884 13.650 -6.383 1.00 0.00 N ATOM 0 H HIS A 94 -8.083 14.276 -8.770 1.00 0.00 H new ATOM 0 HA HIS A 94 -8.732 11.391 -8.913 1.00 0.00 H new ATOM 0 HB2 HIS A 94 -10.206 13.792 -10.063 1.00 0.00 H new ATOM 0 HB3 HIS A 94 -10.721 12.120 -10.169 1.00 0.00 H new ATOM 0 HD2 HIS A 94 -10.827 15.077 -7.671 1.00 0.00 H new ATOM 0 HE1 HIS A 94 -12.641 11.742 -5.776 1.00 0.00 H new ATOM 0 HE2 HIS A 94 -12.208 14.247 -5.622 1.00 0.00 H new ATOM 1411 N SER A 95 -7.122 11.358 -10.861 1.00 0.00 N ATOM 1412 CA SER A 95 -6.396 11.169 -12.112 1.00 0.00 C ATOM 1413 C SER A 95 -7.096 10.141 -12.996 1.00 0.00 C ATOM 1414 O SER A 95 -7.416 10.415 -14.152 1.00 0.00 O ATOM 1415 CB SER A 95 -4.960 10.722 -11.831 1.00 0.00 C ATOM 1416 OG SER A 95 -4.228 10.573 -13.034 1.00 0.00 O ATOM 0 H SER A 95 -6.841 10.727 -10.111 1.00 0.00 H new ATOM 0 HA SER A 95 -6.376 12.123 -12.639 1.00 0.00 H new ATOM 0 HB2 SER A 95 -4.467 11.453 -11.190 1.00 0.00 H new ATOM 0 HB3 SER A 95 -4.970 9.777 -11.288 1.00 0.00 H new ATOM 0 HG SER A 95 -3.313 10.288 -12.827 1.00 0.00 H new ATOM 1422 N GLY A 96 -7.331 8.955 -12.442 1.00 0.00 N ATOM 1423 CA GLY A 96 -7.992 7.904 -13.192 1.00 0.00 C ATOM 1424 C GLY A 96 -8.463 6.767 -12.307 1.00 0.00 C ATOM 1425 O GLY A 96 -9.561 6.818 -11.753 1.00 0.00 O ATOM 0 H GLY A 96 -7.075 8.704 -11.487 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -8.846 8.324 -13.724 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -7.307 7.514 -13.945 1.00 0.00 H new ATOM 1429 N GLU A 97 -7.631 5.739 -12.174 1.00 0.00 N ATOM 1430 CA GLU A 97 -7.971 4.584 -11.351 1.00 0.00 C ATOM 1431 C GLU A 97 -6.789 4.171 -10.478 1.00 0.00 C ATOM 1432 O GLU A 97 -5.661 4.617 -10.690 1.00 0.00 O ATOM 1433 CB GLU A 97 -8.402 3.410 -12.233 1.00 0.00 C ATOM 1434 CG GLU A 97 -9.689 3.666 -13.000 1.00 0.00 C ATOM 1435 CD GLU A 97 -9.493 4.607 -14.172 1.00 0.00 C ATOM 1436 OE1 GLU A 97 -8.579 4.357 -14.986 1.00 0.00 O ATOM 1437 OE2 GLU A 97 -10.251 5.593 -14.276 1.00 0.00 O ATOM 0 H GLU A 97 -6.718 5.682 -12.625 1.00 0.00 H new ATOM 0 HA GLU A 97 -8.800 4.865 -10.701 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -7.605 3.187 -12.942 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -8.530 2.526 -11.609 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -10.086 2.718 -13.363 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -10.434 4.085 -12.323 1.00 0.00 H new ATOM 1444 N LEU A 98 -7.057 3.317 -9.497 1.00 0.00 N ATOM 1445 CA LEU A 98 -6.016 2.843 -8.590 1.00 0.00 C ATOM 1446 C LEU A 98 -5.305 1.624 -9.168 1.00 0.00 C ATOM 1447 O LEU A 98 -5.862 0.527 -9.204 1.00 0.00 O ATOM 1448 CB LEU A 98 -6.619 2.498 -7.227 1.00 0.00 C ATOM 1449 CG LEU A 98 -5.657 2.538 -6.039 1.00 0.00 C ATOM 1450 CD1 LEU A 98 -4.472 1.616 -6.279 1.00 0.00 C ATOM 1451 CD2 LEU A 98 -5.184 3.962 -5.784 1.00 0.00 C ATOM 0 H LEU A 98 -7.985 2.938 -9.309 1.00 0.00 H new ATOM 0 HA LEU A 98 -5.285 3.642 -8.465 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -7.438 3.189 -7.029 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -7.051 1.499 -7.285 1.00 0.00 H new ATOM 0 HG LEU A 98 -6.189 2.188 -5.154 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -3.799 1.658 -5.423 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -4.827 0.594 -6.411 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -3.939 1.934 -7.175 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -4.500 3.972 -4.935 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -4.670 4.339 -6.668 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -6.043 4.597 -5.566 1.00 0.00 H new ATOM 1463 N MET A 99 -4.070 1.824 -9.617 1.00 0.00 N ATOM 1464 CA MET A 99 -3.281 0.740 -10.190 1.00 0.00 C ATOM 1465 C MET A 99 -2.114 0.376 -9.277 1.00 0.00 C ATOM 1466 O MET A 99 -1.493 1.248 -8.669 1.00 0.00 O ATOM 1467 CB MET A 99 -2.758 1.136 -11.572 1.00 0.00 C ATOM 1468 CG MET A 99 -3.830 1.138 -12.650 1.00 0.00 C ATOM 1469 SD MET A 99 -3.222 1.751 -14.233 1.00 0.00 S ATOM 1470 CE MET A 99 -4.140 0.717 -15.371 1.00 0.00 C ATOM 0 H MET A 99 -3.595 2.726 -9.595 1.00 0.00 H new ATOM 0 HA MET A 99 -3.927 -0.132 -10.290 1.00 0.00 H new ATOM 0 HB2 MET A 99 -2.313 2.129 -11.512 1.00 0.00 H new ATOM 0 HB3 MET A 99 -1.964 0.448 -11.862 1.00 0.00 H new ATOM 0 HG2 MET A 99 -4.212 0.125 -12.779 1.00 0.00 H new ATOM 0 HG3 MET A 99 -4.667 1.755 -12.323 1.00 0.00 H new ATOM 0 HE1 MET A 99 -3.899 1.001 -16.396 1.00 0.00 H new ATOM 0 HE2 MET A 99 -3.872 -0.327 -15.211 1.00 0.00 H new ATOM 0 HE3 MET A 99 -5.209 0.847 -15.200 1.00 0.00 H new ATOM 1480 N LEU A 100 -1.821 -0.917 -9.185 1.00 0.00 N ATOM 1481 CA LEU A 100 -0.729 -1.397 -8.346 1.00 0.00 C ATOM 1482 C LEU A 100 0.013 -2.546 -9.022 1.00 0.00 C ATOM 1483 O LEU A 100 -0.557 -3.611 -9.261 1.00 0.00 O ATOM 1484 CB LEU A 100 -1.265 -1.850 -6.987 1.00 0.00 C ATOM 1485 CG LEU A 100 -2.166 -0.854 -6.255 1.00 0.00 C ATOM 1486 CD1 LEU A 100 -3.091 -1.581 -5.291 1.00 0.00 C ATOM 1487 CD2 LEU A 100 -1.329 0.180 -5.517 1.00 0.00 C ATOM 0 H LEU A 100 -2.325 -1.652 -9.682 1.00 0.00 H new ATOM 0 HA LEU A 100 -0.029 -0.575 -8.198 1.00 0.00 H new ATOM 0 HB2 LEU A 100 -1.821 -2.777 -7.129 1.00 0.00 H new ATOM 0 HB3 LEU A 100 -0.417 -2.083 -6.343 1.00 0.00 H new ATOM 0 HG LEU A 100 -2.778 -0.336 -6.993 1.00 0.00 H new ATOM 0 HD11 LEU A 100 -3.725 -0.857 -4.779 1.00 0.00 H new ATOM 0 HD12 LEU A 100 -3.715 -2.282 -5.845 1.00 0.00 H new ATOM 0 HD13 LEU A 100 -2.497 -2.126 -4.557 1.00 0.00 H new ATOM 0 HD21 LEU A 100 -1.987 0.880 -5.002 1.00 0.00 H new ATOM 0 HD22 LEU A 100 -0.691 -0.321 -4.789 1.00 0.00 H new ATOM 0 HD23 LEU A 100 -0.709 0.723 -6.231 1.00 0.00 H new ATOM 1499 N LEU A 101 1.287 -2.323 -9.325 1.00 0.00 N ATOM 1500 CA LEU A 101 2.108 -3.341 -9.971 1.00 0.00 C ATOM 1501 C LEU A 101 2.618 -4.356 -8.954 1.00 0.00 C ATOM 1502 O LEU A 101 3.593 -4.105 -8.245 1.00 0.00 O ATOM 1503 CB LEU A 101 3.289 -2.689 -10.693 1.00 0.00 C ATOM 1504 CG LEU A 101 3.988 -3.547 -11.748 1.00 0.00 C ATOM 1505 CD1 LEU A 101 2.987 -4.042 -12.781 1.00 0.00 C ATOM 1506 CD2 LEU A 101 5.105 -2.762 -12.419 1.00 0.00 C ATOM 0 H LEU A 101 1.774 -1.447 -9.134 1.00 0.00 H new ATOM 0 HA LEU A 101 1.488 -3.864 -10.699 1.00 0.00 H new ATOM 0 HB2 LEU A 101 2.937 -1.775 -11.172 1.00 0.00 H new ATOM 0 HB3 LEU A 101 4.027 -2.394 -9.947 1.00 0.00 H new ATOM 0 HG LEU A 101 4.427 -4.413 -11.252 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.502 -4.651 -13.524 1.00 0.00 H new ATOM 0 HD12 LEU A 101 2.222 -4.641 -12.288 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.519 -3.189 -13.272 1.00 0.00 H new ATOM 0 HD21 LEU A 101 5.591 -3.388 -13.167 1.00 0.00 H new ATOM 0 HD22 LEU A 101 4.689 -1.877 -12.901 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.836 -2.457 -11.670 1.00 0.00 H new ATOM 1518 N VAL A 102 1.953 -5.505 -8.888 1.00 0.00 N ATOM 1519 CA VAL A 102 2.340 -6.561 -7.960 1.00 0.00 C ATOM 1520 C VAL A 102 2.950 -7.746 -8.699 1.00 0.00 C ATOM 1521 O VAL A 102 2.936 -7.798 -9.929 1.00 0.00 O ATOM 1522 CB VAL A 102 1.136 -7.050 -7.133 1.00 0.00 C ATOM 1523 CG1 VAL A 102 0.355 -5.869 -6.576 1.00 0.00 C ATOM 1524 CG2 VAL A 102 0.239 -7.944 -7.975 1.00 0.00 C ATOM 0 H VAL A 102 1.143 -5.728 -9.467 1.00 0.00 H new ATOM 0 HA VAL A 102 3.084 -6.134 -7.288 1.00 0.00 H new ATOM 0 HB VAL A 102 1.509 -7.636 -6.293 1.00 0.00 H new ATOM 0 HG11 VAL A 102 -0.492 -6.234 -5.995 1.00 0.00 H new ATOM 0 HG12 VAL A 102 1.005 -5.273 -5.935 1.00 0.00 H new ATOM 0 HG13 VAL A 102 -0.008 -5.253 -7.398 1.00 0.00 H new ATOM 0 HG21 VAL A 102 -0.606 -8.280 -7.375 1.00 0.00 H new ATOM 0 HG22 VAL A 102 -0.127 -7.385 -8.836 1.00 0.00 H new ATOM 0 HG23 VAL A 102 0.807 -8.809 -8.319 1.00 0.00 H new ATOM 1534 N ARG A 103 3.484 -8.698 -7.941 1.00 0.00 N ATOM 1535 CA ARG A 103 4.100 -9.884 -8.524 1.00 0.00 C ATOM 1536 C ARG A 103 3.164 -11.085 -8.430 1.00 0.00 C ATOM 1537 O ARG A 103 2.489 -11.300 -7.423 1.00 0.00 O ATOM 1538 CB ARG A 103 5.421 -10.197 -7.819 1.00 0.00 C ATOM 1539 CG ARG A 103 6.390 -11.001 -8.670 1.00 0.00 C ATOM 1540 CD ARG A 103 7.778 -11.038 -8.050 1.00 0.00 C ATOM 1541 NE ARG A 103 8.547 -12.196 -8.499 1.00 0.00 N ATOM 1542 CZ ARG A 103 8.371 -13.424 -8.024 1.00 0.00 C ATOM 1543 NH1 ARG A 103 7.457 -13.653 -7.091 1.00 0.00 N ATOM 1544 NH2 ARG A 103 9.110 -14.426 -8.482 1.00 0.00 N ATOM 0 H ARG A 103 3.503 -8.671 -6.922 1.00 0.00 H new ATOM 0 HA ARG A 103 4.297 -9.680 -9.577 1.00 0.00 H new ATOM 0 HB2 ARG A 103 5.898 -9.261 -7.527 1.00 0.00 H new ATOM 0 HB3 ARG A 103 5.212 -10.748 -6.902 1.00 0.00 H new ATOM 0 HG2 ARG A 103 6.016 -12.018 -8.787 1.00 0.00 H new ATOM 0 HG3 ARG A 103 6.447 -10.566 -9.668 1.00 0.00 H new ATOM 0 HD2 ARG A 103 8.314 -10.125 -8.307 1.00 0.00 H new ATOM 0 HD3 ARG A 103 7.689 -11.061 -6.964 1.00 0.00 H new ATOM 0 HE ARG A 103 9.258 -12.054 -9.216 1.00 0.00 H new ATOM 0 HH11 ARG A 103 6.887 -12.885 -6.736 1.00 0.00 H new ATOM 0 HH12 ARG A 103 7.324 -14.597 -6.728 1.00 0.00 H new ATOM 0 HH21 ARG A 103 9.814 -14.254 -9.200 1.00 0.00 H new ATOM 0 HH22 ARG A 103 8.974 -15.369 -8.117 1.00 0.00 H new ATOM 1558 N PRO A 104 3.121 -11.887 -9.504 1.00 0.00 N ATOM 1559 CA PRO A 104 2.271 -13.080 -9.568 1.00 0.00 C ATOM 1560 C PRO A 104 2.756 -14.187 -8.639 1.00 0.00 C ATOM 1561 O PRO A 104 3.954 -14.453 -8.547 1.00 0.00 O ATOM 1562 CB PRO A 104 2.386 -13.520 -11.030 1.00 0.00 C ATOM 1563 CG PRO A 104 3.699 -12.982 -11.485 1.00 0.00 C ATOM 1564 CD PRO A 104 3.899 -11.692 -10.739 1.00 0.00 C ATOM 0 HA PRO A 104 1.249 -12.870 -9.251 1.00 0.00 H new ATOM 0 HB2 PRO A 104 2.350 -14.606 -11.121 1.00 0.00 H new ATOM 0 HB3 PRO A 104 1.566 -13.123 -11.629 1.00 0.00 H new ATOM 0 HG2 PRO A 104 4.504 -13.685 -11.271 1.00 0.00 H new ATOM 0 HG3 PRO A 104 3.700 -12.814 -12.562 1.00 0.00 H new ATOM 0 HD2 PRO A 104 4.952 -11.511 -10.526 1.00 0.00 H new ATOM 0 HD3 PRO A 104 3.538 -10.837 -11.311 1.00 0.00 H new ATOM 1572 N ASN A 105 1.817 -14.830 -7.951 1.00 0.00 N ATOM 1573 CA ASN A 105 2.150 -15.909 -7.029 1.00 0.00 C ATOM 1574 C ASN A 105 1.516 -17.223 -7.477 1.00 0.00 C ATOM 1575 O ASN A 105 0.539 -17.685 -6.889 1.00 0.00 O ATOM 1576 CB ASN A 105 1.682 -15.561 -5.614 1.00 0.00 C ATOM 1577 CG ASN A 105 2.281 -16.478 -4.565 1.00 0.00 C ATOM 1578 OD1 ASN A 105 1.591 -17.327 -4.000 1.00 0.00 O ATOM 1579 ND2 ASN A 105 3.571 -16.310 -4.299 1.00 0.00 N ATOM 0 H ASN A 105 0.820 -14.622 -8.015 1.00 0.00 H new ATOM 0 HA ASN A 105 3.233 -16.031 -7.027 1.00 0.00 H new ATOM 0 HB2 ASN A 105 1.953 -14.530 -5.388 1.00 0.00 H new ATOM 0 HB3 ASN A 105 0.595 -15.623 -5.568 1.00 0.00 H new ATOM 0 HD21 ASN A 105 4.029 -16.897 -3.602 1.00 0.00 H new ATOM 0 HD22 ASN A 105 4.104 -15.594 -4.792 1.00 0.00 H new ATOM 1586 N ALA A 106 2.081 -17.819 -8.522 1.00 0.00 N ATOM 1587 CA ALA A 106 1.573 -19.081 -9.048 1.00 0.00 C ATOM 1588 C ALA A 106 1.440 -20.122 -7.942 1.00 0.00 C ATOM 1589 O ALA A 106 2.408 -20.434 -7.248 1.00 0.00 O ATOM 1590 CB ALA A 106 2.483 -19.595 -10.153 1.00 0.00 C ATOM 0 H ALA A 106 2.890 -17.449 -9.021 1.00 0.00 H new ATOM 0 HA ALA A 106 0.581 -18.902 -9.463 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.093 -20.537 -10.537 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.524 -18.864 -10.960 1.00 0.00 H new ATOM 0 HB3 ALA A 106 3.485 -19.753 -9.755 1.00 0.00 H new ATOM 1596 N VAL A 107 0.234 -20.658 -7.782 1.00 0.00 N ATOM 1597 CA VAL A 107 -0.026 -21.665 -6.760 1.00 0.00 C ATOM 1598 C VAL A 107 -1.390 -22.315 -6.964 1.00 0.00 C ATOM 1599 O VAL A 107 -2.365 -21.643 -7.303 1.00 0.00 O ATOM 1600 CB VAL A 107 0.036 -21.058 -5.346 1.00 0.00 C ATOM 1601 CG1 VAL A 107 -1.087 -20.052 -5.146 1.00 0.00 C ATOM 1602 CG2 VAL A 107 -0.027 -22.155 -4.293 1.00 0.00 C ATOM 0 H VAL A 107 -0.578 -20.412 -8.347 1.00 0.00 H new ATOM 0 HA VAL A 107 0.752 -22.423 -6.856 1.00 0.00 H new ATOM 0 HB VAL A 107 0.985 -20.533 -5.236 1.00 0.00 H new ATOM 0 HG11 VAL A 107 -1.026 -19.634 -4.141 1.00 0.00 H new ATOM 0 HG12 VAL A 107 -0.992 -19.251 -5.879 1.00 0.00 H new ATOM 0 HG13 VAL A 107 -2.048 -20.549 -5.275 1.00 0.00 H new ATOM 0 HG21 VAL A 107 0.018 -21.709 -3.300 1.00 0.00 H new ATOM 0 HG22 VAL A 107 -0.960 -22.709 -4.400 1.00 0.00 H new ATOM 0 HG23 VAL A 107 0.815 -22.834 -4.424 1.00 0.00 H new ATOM 1612 N TYR A 108 -1.452 -23.625 -6.753 1.00 0.00 N ATOM 1613 CA TYR A 108 -2.697 -24.367 -6.915 1.00 0.00 C ATOM 1614 C TYR A 108 -2.781 -25.515 -5.914 1.00 0.00 C ATOM 1615 O TYR A 108 -1.761 -26.054 -5.484 1.00 0.00 O ATOM 1616 CB TYR A 108 -2.810 -24.909 -8.341 1.00 0.00 C ATOM 1617 CG TYR A 108 -3.719 -26.111 -8.462 1.00 0.00 C ATOM 1618 CD1 TYR A 108 -3.228 -27.399 -8.281 1.00 0.00 C ATOM 1619 CD2 TYR A 108 -5.068 -25.960 -8.757 1.00 0.00 C ATOM 1620 CE1 TYR A 108 -4.055 -28.500 -8.390 1.00 0.00 C ATOM 1621 CE2 TYR A 108 -5.902 -27.055 -8.867 1.00 0.00 C ATOM 1622 CZ TYR A 108 -5.391 -28.323 -8.683 1.00 0.00 C ATOM 1623 OH TYR A 108 -6.219 -29.417 -8.793 1.00 0.00 O ATOM 0 H TYR A 108 -0.655 -24.195 -6.469 1.00 0.00 H new ATOM 0 HA TYR A 108 -3.525 -23.684 -6.727 1.00 0.00 H new ATOM 0 HB2 TYR A 108 -3.179 -24.118 -8.993 1.00 0.00 H new ATOM 0 HB3 TYR A 108 -1.816 -25.178 -8.698 1.00 0.00 H new ATOM 0 HD1 TYR A 108 -2.182 -27.541 -8.051 1.00 0.00 H new ATOM 0 HD2 TYR A 108 -5.472 -24.969 -8.903 1.00 0.00 H new ATOM 0 HE1 TYR A 108 -3.658 -29.494 -8.247 1.00 0.00 H new ATOM 0 HE2 TYR A 108 -6.949 -26.919 -9.096 1.00 0.00 H new ATOM 0 HH TYR A 108 -7.129 -29.119 -9.002 1.00 0.00 H new ATOM 1633 N ASP A 109 -4.004 -25.884 -5.549 1.00 0.00 N ATOM 1634 CA ASP A 109 -4.223 -26.969 -4.600 1.00 0.00 C ATOM 1635 C ASP A 109 -5.633 -27.535 -4.738 1.00 0.00 C ATOM 1636 O ASP A 109 -6.469 -26.979 -5.451 1.00 0.00 O ATOM 1637 CB ASP A 109 -3.996 -26.478 -3.169 1.00 0.00 C ATOM 1638 CG ASP A 109 -4.685 -25.156 -2.894 1.00 0.00 C ATOM 1639 OD1 ASP A 109 -5.906 -25.061 -3.138 1.00 0.00 O ATOM 1640 OD2 ASP A 109 -4.003 -24.216 -2.434 1.00 0.00 O ATOM 0 H ASP A 109 -4.858 -25.448 -5.896 1.00 0.00 H new ATOM 0 HA ASP A 109 -3.508 -27.762 -4.822 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -4.363 -27.228 -2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -2.926 -26.371 -2.990 1.00 0.00 H new ATOM 1645 N VAL A 110 -5.890 -28.644 -4.052 1.00 0.00 N ATOM 1646 CA VAL A 110 -7.199 -29.285 -4.098 1.00 0.00 C ATOM 1647 C VAL A 110 -8.281 -28.366 -3.543 1.00 0.00 C ATOM 1648 O VAL A 110 -8.153 -27.833 -2.441 1.00 0.00 O ATOM 1649 CB VAL A 110 -7.205 -30.605 -3.305 1.00 0.00 C ATOM 1650 CG1 VAL A 110 -8.585 -31.244 -3.342 1.00 0.00 C ATOM 1651 CG2 VAL A 110 -6.152 -31.559 -3.849 1.00 0.00 C ATOM 0 H VAL A 110 -5.209 -29.117 -3.458 1.00 0.00 H new ATOM 0 HA VAL A 110 -7.411 -29.498 -5.146 1.00 0.00 H new ATOM 0 HB VAL A 110 -6.960 -30.385 -2.266 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.570 -32.176 -2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -9.313 -30.563 -2.901 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -8.862 -31.451 -4.376 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -6.171 -32.486 -3.277 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -6.363 -31.775 -4.896 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -5.167 -31.100 -3.764 1.00 0.00 H new ATOM 1661 N VAL A 111 -9.349 -28.185 -4.315 1.00 0.00 N ATOM 1662 CA VAL A 111 -10.456 -27.332 -3.900 1.00 0.00 C ATOM 1663 C VAL A 111 -11.566 -28.149 -3.248 1.00 0.00 C ATOM 1664 O VAL A 111 -12.467 -28.640 -3.926 1.00 0.00 O ATOM 1665 CB VAL A 111 -11.040 -26.551 -5.092 1.00 0.00 C ATOM 1666 CG1 VAL A 111 -12.219 -25.700 -4.647 1.00 0.00 C ATOM 1667 CG2 VAL A 111 -9.967 -25.692 -5.743 1.00 0.00 C ATOM 0 H VAL A 111 -9.470 -28.618 -5.231 1.00 0.00 H new ATOM 0 HA VAL A 111 -10.055 -26.625 -3.173 1.00 0.00 H new ATOM 0 HB VAL A 111 -11.399 -27.266 -5.832 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -12.618 -25.156 -5.503 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -12.995 -26.343 -4.231 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -11.890 -24.991 -3.887 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -10.397 -25.147 -6.583 1.00 0.00 H new ATOM 0 HG22 VAL A 111 -9.576 -24.983 -5.013 1.00 0.00 H new ATOM 0 HG23 VAL A 111 -9.158 -26.329 -6.100 1.00 0.00 H new ATOM 1677 N GLU A 112 -11.493 -28.289 -1.928 1.00 0.00 N ATOM 1678 CA GLU A 112 -12.493 -29.048 -1.185 1.00 0.00 C ATOM 1679 C GLU A 112 -12.617 -28.529 0.244 1.00 0.00 C ATOM 1680 O GLU A 112 -11.769 -27.773 0.717 1.00 0.00 O ATOM 1681 CB GLU A 112 -12.130 -30.534 -1.170 1.00 0.00 C ATOM 1682 CG GLU A 112 -10.781 -30.825 -0.534 1.00 0.00 C ATOM 1683 CD GLU A 112 -10.806 -30.683 0.976 1.00 0.00 C ATOM 1684 OE1 GLU A 112 -11.509 -31.478 1.635 1.00 0.00 O ATOM 1685 OE2 GLU A 112 -10.124 -29.777 1.498 1.00 0.00 O ATOM 0 H GLU A 112 -10.753 -27.888 -1.352 1.00 0.00 H new ATOM 0 HA GLU A 112 -13.454 -28.921 -1.684 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -12.902 -31.083 -0.631 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -12.128 -30.909 -2.193 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -10.471 -31.837 -0.795 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -10.035 -30.146 -0.947 1.00 0.00 H new ATOM 1692 N GLU A 113 -13.681 -28.941 0.926 1.00 0.00 N ATOM 1693 CA GLU A 113 -13.918 -28.517 2.301 1.00 0.00 C ATOM 1694 C GLU A 113 -14.961 -29.405 2.973 1.00 0.00 C ATOM 1695 O GLU A 113 -16.147 -29.340 2.651 1.00 0.00 O ATOM 1696 CB GLU A 113 -14.376 -27.057 2.337 1.00 0.00 C ATOM 1697 CG GLU A 113 -14.343 -26.442 3.726 1.00 0.00 C ATOM 1698 CD GLU A 113 -12.963 -26.491 4.353 1.00 0.00 C ATOM 1699 OE1 GLU A 113 -12.045 -25.834 3.819 1.00 0.00 O ATOM 1700 OE2 GLU A 113 -12.802 -27.185 5.378 1.00 0.00 O ATOM 0 H GLU A 113 -14.392 -29.568 0.549 1.00 0.00 H new ATOM 0 HA GLU A 113 -12.980 -28.610 2.849 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -13.741 -26.470 1.674 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -15.391 -26.994 1.945 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -14.675 -25.405 3.668 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -15.049 -26.968 4.369 1.00 0.00 H new ATOM 1707 N SER A 114 -14.509 -30.234 3.909 1.00 0.00 N ATOM 1708 CA SER A 114 -15.402 -31.139 4.623 1.00 0.00 C ATOM 1709 C SER A 114 -16.384 -30.359 5.493 1.00 0.00 C ATOM 1710 O SER A 114 -16.221 -29.159 5.709 1.00 0.00 O ATOM 1711 CB SER A 114 -14.594 -32.107 5.490 1.00 0.00 C ATOM 1712 OG SER A 114 -15.422 -33.126 6.023 1.00 0.00 O ATOM 0 H SER A 114 -13.531 -30.297 4.190 1.00 0.00 H new ATOM 0 HA SER A 114 -15.968 -31.708 3.886 1.00 0.00 H new ATOM 0 HB2 SER A 114 -13.798 -32.555 4.895 1.00 0.00 H new ATOM 0 HB3 SER A 114 -14.116 -31.560 6.303 1.00 0.00 H new ATOM 0 HG SER A 114 -14.882 -33.733 6.572 1.00 0.00 H new ATOM 1718 N GLY A 115 -17.404 -31.052 5.989 1.00 0.00 N ATOM 1719 CA GLY A 115 -18.398 -30.410 6.829 1.00 0.00 C ATOM 1720 C GLY A 115 -18.833 -31.286 7.987 1.00 0.00 C ATOM 1721 O GLY A 115 -19.834 -31.998 7.912 1.00 0.00 O ATOM 0 H GLY A 115 -17.560 -32.046 5.824 1.00 0.00 H new ATOM 0 HA2 GLY A 115 -17.992 -29.476 7.217 1.00 0.00 H new ATOM 0 HA3 GLY A 115 -19.268 -30.153 6.225 1.00 0.00 H new ATOM 1725 N PRO A 116 -18.068 -31.242 9.087 1.00 0.00 N ATOM 1726 CA PRO A 116 -18.359 -32.033 10.287 1.00 0.00 C ATOM 1727 C PRO A 116 -19.606 -31.543 11.015 1.00 0.00 C ATOM 1728 O PRO A 116 -20.369 -32.339 11.563 1.00 0.00 O ATOM 1729 CB PRO A 116 -17.117 -31.828 11.157 1.00 0.00 C ATOM 1730 CG PRO A 116 -16.556 -30.521 10.715 1.00 0.00 C ATOM 1731 CD PRO A 116 -16.859 -30.415 9.246 1.00 0.00 C ATOM 0 HA PRO A 116 -18.561 -33.077 10.048 1.00 0.00 H new ATOM 0 HB2 PRO A 116 -17.374 -31.811 12.216 1.00 0.00 H new ATOM 0 HB3 PRO A 116 -16.398 -32.635 11.017 1.00 0.00 H new ATOM 0 HG2 PRO A 116 -17.007 -29.696 11.267 1.00 0.00 H new ATOM 0 HG3 PRO A 116 -15.482 -30.476 10.896 1.00 0.00 H new ATOM 0 HD2 PRO A 116 -17.036 -29.382 8.946 1.00 0.00 H new ATOM 0 HD3 PRO A 116 -16.035 -30.787 8.638 1.00 0.00 H new ATOM 1739 N SER A 117 -19.807 -30.229 11.017 1.00 0.00 N ATOM 1740 CA SER A 117 -20.961 -29.634 11.681 1.00 0.00 C ATOM 1741 C SER A 117 -21.102 -30.164 13.105 1.00 0.00 C ATOM 1742 O SER A 117 -22.166 -30.642 13.499 1.00 0.00 O ATOM 1743 CB SER A 117 -22.238 -29.922 10.889 1.00 0.00 C ATOM 1744 OG SER A 117 -23.362 -29.304 11.490 1.00 0.00 O ATOM 0 H SER A 117 -19.186 -29.557 10.567 1.00 0.00 H new ATOM 0 HA SER A 117 -20.806 -28.556 11.726 1.00 0.00 H new ATOM 0 HB2 SER A 117 -22.124 -29.561 9.867 1.00 0.00 H new ATOM 0 HB3 SER A 117 -22.399 -30.999 10.831 1.00 0.00 H new ATOM 0 HG SER A 117 -23.435 -29.595 12.423 1.00 0.00 H new ATOM 1750 N SER A 118 -20.020 -30.077 13.872 1.00 0.00 N ATOM 1751 CA SER A 118 -20.020 -30.551 15.251 1.00 0.00 C ATOM 1752 C SER A 118 -20.387 -32.031 15.316 1.00 0.00 C ATOM 1753 O SER A 118 -21.251 -32.435 16.093 1.00 0.00 O ATOM 1754 CB SER A 118 -21.001 -29.734 16.094 1.00 0.00 C ATOM 1755 OG SER A 118 -20.567 -28.391 16.221 1.00 0.00 O ATOM 0 H SER A 118 -19.132 -29.683 13.562 1.00 0.00 H new ATOM 0 HA SER A 118 -19.015 -30.425 15.653 1.00 0.00 H new ATOM 0 HB2 SER A 118 -21.989 -29.758 15.634 1.00 0.00 H new ATOM 0 HB3 SER A 118 -21.098 -30.183 17.082 1.00 0.00 H new ATOM 0 HG SER A 118 -21.211 -27.889 16.762 1.00 0.00 H new ATOM 1761 N GLY A 119 -19.721 -32.836 14.493 1.00 0.00 N ATOM 1762 CA GLY A 119 -19.990 -34.262 14.472 1.00 0.00 C ATOM 1763 C GLY A 119 -19.961 -34.837 13.070 1.00 0.00 C ATOM 1764 O GLY A 119 -20.205 -36.028 12.875 1.00 0.00 O ATOM 0 H GLY A 119 -19.000 -32.526 13.841 1.00 0.00 H new ATOM 0 HA2 GLY A 119 -19.252 -34.777 15.088 1.00 0.00 H new ATOM 0 HA3 GLY A 119 -20.966 -34.451 14.919 1.00 0.00 H new TER 1768 GLY A 119