USER MOD reduce.3.24.130724 H: found=0, std=0, add=1035, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1035 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 89 LYS NZ :NH3+ -144:sc= -1.07 (180deg=-1.21) USER MOD Set 1.2: A 116 GLN : amide:sc= -4.54! C(o=-5.6!,f=-13!) USER MOD Set 2.1: A 64 MET CE :methyl -173:sc= -7.3! (180deg=-7.81!) USER MOD Set 2.2: A 65 ASN : amide:sc= -8.34! C(o=-16!,f=-27!) USER MOD Set 3.1: A 24 SER OG : rot 14:sc= 2.19 USER MOD Set 3.2: A 73 SER OG : rot -100:sc= 1.01 USER MOD Set 4.1: A 10 HIS : no HE2:sc= 0.701 K(o=4.2,f=-5.5!) USER MOD Set 4.2: A 11 SER OG : rot 149:sc= 1.43 USER MOD Set 4.3: A 18 GLN : amide:sc= 2.06 K(o=4.2,f=-0.99) USER MOD Set 5.1: A 1 MET CE :methyl -123:sc= -0.157 (180deg=-0.508) USER MOD Set 5.2: A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET N :NH3+ -135:sc= 0.215 (180deg=-0.239) USER MOD Single : A 3 SER OG : rot -48:sc= 0.302 USER MOD Single : A 5 HIS : no HE2:sc= -0.0208 K(o=-0.021,f=-0.53) USER MOD Single : A 6 HIS : no HD1:sc= -0.943 K(o=-0.94,f=-1.5) USER MOD Single : A 7 HIS : no HE2:sc= 0.673 K(o=0.67,f=-2.9!) USER MOD Single : A 8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 9 HIS : no HE2:sc= -1.48! C(o=-0.18!,f=-12!) USER MOD Single : A 12 GLN : amide:sc= -0.823 K(o=-0.82,f=0) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 ASN : amide:sc= 1.03 K(o=1,f=-0.15) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 ASN : amide:sc= -0.287 K(o=-0.29,f=-0.94) USER MOD Single : A 23 SER OG : rot 6:sc= 0.975 USER MOD Single : A 25 LYS NZ :NH3+ 176:sc= 0.783 (180deg=0.565) USER MOD Single : A 37 HIS : no HE2:sc= -3.5! C(o=-3.5!,f=-4.1!) USER MOD Single : A 38 CYS SG : rot 156:sc= -12.7! USER MOD Single : A 40 SER OG : rot -30:sc= 0.464 USER MOD Single : A 49 LYS NZ :NH3+ -144:sc= 2.32 (180deg=1.89) USER MOD Single : A 54 GLN : amide:sc= -13.1! C(o=-13!,f=-4.7!) USER MOD Single : A 67 SER OG : rot -35:sc= 0.797 USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc=0.000389 USER MOD Single : A 70 GLN : amide:sc= -6.6! C(o=-6.6!,f=-6.6!) USER MOD Single : A 78 TYR OH : rot -83:sc= 0.806 USER MOD Single : A 79 THR OG1 : rot 98:sc= -1.8 USER MOD Single : A 80 SER OG : rot 92:sc= 1.28 USER MOD Single : A 81 SER OG : rot 50:sc= 0.427 USER MOD Single : A 84 TYR OH : rot 180:sc= -0.216 USER MOD Single : A 86 TYR OH : rot 154:sc= 1.22 USER MOD Single : A 93 THR OG1 : rot -142:sc= 1.26 USER MOD Single : A 100 ASN : amide:sc= -0.0286 K(o=-0.029,f=-0.69) USER MOD Single : A 102 CYS SG : rot -122:sc= 0.0758 USER MOD Single : A 108 GLN : amide:sc= -0.533 K(o=-0.53,f=0) USER MOD Single : A 109 HIS : no HE2:sc= 0.054 K(o=0.054,f=-1.9) USER MOD Single : A 112 HIS : no HD1:sc= -1.01 K(o=-1,f=-1.7) USER MOD Single : A 115 LYS NZ :NH3+ 153:sc= 1.03 (180deg=0.15) USER MOD Single : A 121 LYS NZ :NH3+ -143:sc= 0.948 (180deg=-0.808) USER MOD Single : A 125 GLN : amide:sc= -3.36! C(o=-3.4!,f=-3.1!) USER MOD Single : A 127 GLN : amide:sc= 0.015 K(o=0.015,f=-3.9!) USER MOD Single : A 131 GLN : amide:sc= -0.736 K(o=-0.74,f=0) USER MOD Single : A 132 GLN : amide:sc= 0.188 K(o=0.19,f=-6.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 28.368 -11.627 18.958 1.00 0.00 N ATOM 2 CA MET A 1 26.931 -11.918 18.841 1.00 0.00 C ATOM 3 C MET A 1 26.833 -13.194 18.059 1.00 0.00 C ATOM 4 O MET A 1 27.866 -13.791 17.803 1.00 0.00 O ATOM 5 CB MET A 1 26.200 -10.772 18.110 1.00 0.00 C ATOM 6 CG MET A 1 26.354 -9.411 18.784 1.00 0.00 C ATOM 7 SD MET A 1 25.516 -8.078 17.912 1.00 0.00 S ATOM 8 CE MET A 1 23.790 -8.492 18.176 1.00 0.00 C ATOM 0 H1 MET A 1 28.587 -11.348 19.936 1.00 0.00 H new ATOM 0 H2 MET A 1 28.915 -12.476 18.709 1.00 0.00 H new ATOM 0 H3 MET A 1 28.619 -10.852 18.312 1.00 0.00 H new ATOM 0 HA MET A 1 26.462 -12.014 19.820 1.00 0.00 H new ATOM 0 HB2 MET A 1 26.577 -10.706 17.090 1.00 0.00 H new ATOM 0 HB3 MET A 1 25.140 -11.015 18.043 1.00 0.00 H new ATOM 0 HG2 MET A 1 25.964 -9.471 19.800 1.00 0.00 H new ATOM 0 HG3 MET A 1 27.414 -9.172 18.864 1.00 0.00 H new ATOM 0 HE1 MET A 1 23.289 -8.596 17.213 1.00 0.00 H new ATOM 0 HE2 MET A 1 23.721 -9.432 18.724 1.00 0.00 H new ATOM 0 HE3 MET A 1 23.310 -7.700 18.751 1.00 0.00 H new ATOM 20 N GLY A 2 25.642 -13.617 17.694 1.00 0.00 N ATOM 21 CA GLY A 2 25.516 -14.837 16.925 1.00 0.00 C ATOM 22 C GLY A 2 25.383 -14.517 15.461 1.00 0.00 C ATOM 23 O GLY A 2 26.077 -13.633 14.956 1.00 0.00 O ATOM 0 H GLY A 2 24.764 -13.146 17.911 1.00 0.00 H new ATOM 0 HA2 GLY A 2 26.388 -15.470 17.089 1.00 0.00 H new ATOM 0 HA3 GLY A 2 24.646 -15.400 17.262 1.00 0.00 H new ATOM 27 N SER A 3 24.437 -15.151 14.801 1.00 0.00 N ATOM 28 CA SER A 3 24.168 -14.923 13.381 1.00 0.00 C ATOM 29 C SER A 3 23.310 -13.635 13.225 1.00 0.00 C ATOM 30 O SER A 3 22.449 -13.522 12.360 1.00 0.00 O ATOM 31 CB SER A 3 23.431 -16.159 12.817 1.00 0.00 C ATOM 32 OG SER A 3 23.246 -16.074 11.420 1.00 0.00 O ATOM 0 H SER A 3 23.825 -15.845 15.230 1.00 0.00 H new ATOM 0 HA SER A 3 25.096 -14.783 12.826 1.00 0.00 H new ATOM 0 HB2 SER A 3 23.999 -17.059 13.053 1.00 0.00 H new ATOM 0 HB3 SER A 3 22.462 -16.257 13.306 1.00 0.00 H new ATOM 0 HG SER A 3 22.890 -15.190 11.190 1.00 0.00 H new ATOM 38 N SER A 4 23.645 -12.645 14.016 1.00 0.00 N ATOM 39 CA SER A 4 22.937 -11.398 14.097 1.00 0.00 C ATOM 40 C SER A 4 23.503 -10.393 13.074 1.00 0.00 C ATOM 41 O SER A 4 23.242 -9.187 13.157 1.00 0.00 O ATOM 42 CB SER A 4 23.132 -10.865 15.512 1.00 0.00 C ATOM 43 OG SER A 4 22.917 -11.907 16.478 1.00 0.00 O ATOM 0 H SER A 4 24.448 -12.691 14.643 1.00 0.00 H new ATOM 0 HA SER A 4 21.880 -11.541 13.874 1.00 0.00 H new ATOM 0 HB2 SER A 4 24.140 -10.464 15.620 1.00 0.00 H new ATOM 0 HB3 SER A 4 22.440 -10.043 15.696 1.00 0.00 H new ATOM 0 HG SER A 4 23.048 -11.548 17.381 1.00 0.00 H new ATOM 49 N HIS A 5 24.253 -10.913 12.106 1.00 0.00 N ATOM 50 CA HIS A 5 24.903 -10.111 11.079 1.00 0.00 C ATOM 51 C HIS A 5 23.866 -9.488 10.144 1.00 0.00 C ATOM 52 O HIS A 5 23.424 -10.110 9.179 1.00 0.00 O ATOM 53 CB HIS A 5 25.917 -10.964 10.278 1.00 0.00 C ATOM 54 CG HIS A 5 26.647 -10.216 9.185 1.00 0.00 C ATOM 55 ND1 HIS A 5 26.116 -10.010 7.927 1.00 0.00 N ATOM 56 CD2 HIS A 5 27.871 -9.629 9.169 1.00 0.00 C ATOM 57 CE1 HIS A 5 26.972 -9.338 7.187 1.00 0.00 C ATOM 58 NE2 HIS A 5 28.047 -9.093 7.914 1.00 0.00 N ATOM 0 H HIS A 5 24.427 -11.914 12.014 1.00 0.00 H new ATOM 0 HA HIS A 5 25.448 -9.305 11.571 1.00 0.00 H new ATOM 0 HB2 HIS A 5 26.651 -11.376 10.970 1.00 0.00 H new ATOM 0 HB3 HIS A 5 25.390 -11.808 9.833 1.00 0.00 H new ATOM 0 HD1 HIS A 5 25.198 -10.330 7.618 1.00 0.00 H new ATOM 0 HD2 HIS A 5 28.574 -9.590 9.988 1.00 0.00 H new ATOM 0 HE1 HIS A 5 26.821 -9.038 6.161 1.00 0.00 H new ATOM 67 N HIS A 6 23.490 -8.288 10.452 1.00 0.00 N ATOM 68 CA HIS A 6 22.516 -7.559 9.680 1.00 0.00 C ATOM 69 C HIS A 6 23.172 -6.619 8.668 1.00 0.00 C ATOM 70 O HIS A 6 24.405 -6.637 8.498 1.00 0.00 O ATOM 71 CB HIS A 6 21.552 -6.834 10.600 1.00 0.00 C ATOM 72 CG HIS A 6 20.489 -7.717 11.177 1.00 0.00 C ATOM 73 ND1 HIS A 6 20.378 -8.002 12.516 1.00 0.00 N ATOM 74 CD2 HIS A 6 19.440 -8.324 10.582 1.00 0.00 C ATOM 75 CE1 HIS A 6 19.302 -8.740 12.715 1.00 0.00 C ATOM 76 NE2 HIS A 6 18.709 -8.947 11.557 1.00 0.00 N ATOM 0 H HIS A 6 23.851 -7.774 11.256 1.00 0.00 H new ATOM 0 HA HIS A 6 21.942 -8.276 9.093 1.00 0.00 H new ATOM 0 HB2 HIS A 6 22.115 -6.378 11.415 1.00 0.00 H new ATOM 0 HB3 HIS A 6 21.077 -6.023 10.048 1.00 0.00 H new ATOM 0 HD2 HIS A 6 19.217 -8.319 9.525 1.00 0.00 H new ATOM 0 HE1 HIS A 6 18.963 -9.113 13.670 1.00 0.00 H new ATOM 0 HE2 HIS A 6 17.852 -9.480 11.412 1.00 0.00 H new ATOM 85 N HIS A 7 22.365 -5.789 8.016 1.00 0.00 N ATOM 86 CA HIS A 7 22.833 -4.957 6.915 1.00 0.00 C ATOM 87 C HIS A 7 23.054 -3.518 7.407 1.00 0.00 C ATOM 88 O HIS A 7 23.713 -2.720 6.721 1.00 0.00 O ATOM 89 CB HIS A 7 21.781 -4.975 5.780 1.00 0.00 C ATOM 90 CG HIS A 7 22.262 -4.502 4.417 1.00 0.00 C ATOM 91 ND1 HIS A 7 22.893 -3.293 4.194 1.00 0.00 N ATOM 92 CD2 HIS A 7 22.179 -5.099 3.199 1.00 0.00 C ATOM 93 CE1 HIS A 7 23.169 -3.167 2.907 1.00 0.00 C ATOM 94 NE2 HIS A 7 22.747 -4.247 2.281 1.00 0.00 N ATOM 0 H HIS A 7 21.375 -5.675 8.234 1.00 0.00 H new ATOM 0 HA HIS A 7 23.778 -5.347 6.537 1.00 0.00 H new ATOM 0 HB2 HIS A 7 21.404 -5.993 5.677 1.00 0.00 H new ATOM 0 HB3 HIS A 7 20.939 -4.352 6.082 1.00 0.00 H new ATOM 0 HD1 HIS A 7 23.112 -2.603 4.913 1.00 0.00 H new ATOM 0 HD2 HIS A 7 21.746 -6.066 2.990 1.00 0.00 H new ATOM 0 HE1 HIS A 7 23.658 -2.321 2.446 1.00 0.00 H new ATOM 103 N HIS A 8 22.492 -3.218 8.580 1.00 0.00 N ATOM 104 CA HIS A 8 22.565 -1.915 9.279 1.00 0.00 C ATOM 105 C HIS A 8 21.409 -1.009 8.937 1.00 0.00 C ATOM 106 O HIS A 8 21.457 -0.255 7.977 1.00 0.00 O ATOM 107 CB HIS A 8 23.927 -1.186 9.207 1.00 0.00 C ATOM 108 CG HIS A 8 25.038 -1.922 9.876 1.00 0.00 C ATOM 109 ND1 HIS A 8 26.059 -2.536 9.185 1.00 0.00 N ATOM 110 CD2 HIS A 8 25.296 -2.134 11.189 1.00 0.00 C ATOM 111 CE1 HIS A 8 26.894 -3.095 10.035 1.00 0.00 C ATOM 112 NE2 HIS A 8 26.457 -2.867 11.260 1.00 0.00 N ATOM 0 H HIS A 8 21.945 -3.904 9.101 1.00 0.00 H new ATOM 0 HA HIS A 8 22.474 -2.186 10.331 1.00 0.00 H new ATOM 0 HB2 HIS A 8 24.188 -1.025 8.161 1.00 0.00 H new ATOM 0 HB3 HIS A 8 23.827 -0.202 9.666 1.00 0.00 H new ATOM 0 HD2 HIS A 8 24.701 -1.792 12.023 1.00 0.00 H new ATOM 0 HE1 HIS A 8 27.785 -3.647 9.775 1.00 0.00 H new ATOM 0 HE2 HIS A 8 26.907 -3.183 12.119 1.00 0.00 H new ATOM 121 N HIS A 9 20.343 -1.240 9.689 1.00 0.00 N ATOM 122 CA HIS A 9 19.070 -0.507 9.714 1.00 0.00 C ATOM 123 C HIS A 9 18.650 0.296 8.531 1.00 0.00 C ATOM 124 O HIS A 9 19.052 1.432 8.340 1.00 0.00 O ATOM 125 CB HIS A 9 18.765 0.214 11.021 1.00 0.00 C ATOM 126 CG HIS A 9 18.107 -0.670 12.032 1.00 0.00 C ATOM 127 ND1 HIS A 9 16.738 -0.895 12.060 1.00 0.00 N ATOM 128 CD2 HIS A 9 18.620 -1.384 13.056 1.00 0.00 C ATOM 129 CE1 HIS A 9 16.447 -1.699 13.050 1.00 0.00 C ATOM 130 NE2 HIS A 9 17.573 -2.014 13.677 1.00 0.00 N ATOM 0 H HIS A 9 20.339 -2.010 10.358 1.00 0.00 H new ATOM 0 HA HIS A 9 18.418 -1.377 9.634 1.00 0.00 H new ATOM 0 HB2 HIS A 9 19.692 0.608 11.438 1.00 0.00 H new ATOM 0 HB3 HIS A 9 18.119 1.068 10.817 1.00 0.00 H new ATOM 0 HD1 HIS A 9 16.062 -0.495 11.409 1.00 0.00 H new ATOM 0 HD2 HIS A 9 19.662 -1.447 13.334 1.00 0.00 H new ATOM 0 HE1 HIS A 9 15.459 -2.047 13.312 1.00 0.00 H new ATOM 139 N HIS A 10 17.819 -0.307 7.759 1.00 0.00 N ATOM 140 CA HIS A 10 17.117 0.385 6.723 1.00 0.00 C ATOM 141 C HIS A 10 15.747 0.632 7.259 1.00 0.00 C ATOM 142 O HIS A 10 15.249 1.743 7.310 1.00 0.00 O ATOM 143 CB HIS A 10 16.985 -0.473 5.472 1.00 0.00 C ATOM 144 CG HIS A 10 18.247 -0.732 4.750 1.00 0.00 C ATOM 145 ND1 HIS A 10 18.576 -1.968 4.249 1.00 0.00 N ATOM 146 CD2 HIS A 10 19.215 0.110 4.339 1.00 0.00 C ATOM 147 CE1 HIS A 10 19.677 -1.873 3.560 1.00 0.00 C ATOM 148 NE2 HIS A 10 20.099 -0.623 3.588 1.00 0.00 N ATOM 0 H HIS A 10 17.601 -1.301 7.824 1.00 0.00 H new ATOM 0 HA HIS A 10 17.649 1.297 6.452 1.00 0.00 H new ATOM 0 HB2 HIS A 10 16.543 -1.429 5.752 1.00 0.00 H new ATOM 0 HB3 HIS A 10 16.288 0.013 4.789 1.00 0.00 H new ATOM 0 HD1 HIS A 10 18.042 -2.825 4.394 1.00 0.00 H new ATOM 0 HD2 HIS A 10 19.283 1.165 4.559 1.00 0.00 H new ATOM 0 HE1 HIS A 10 20.167 -2.688 3.047 1.00 0.00 H new ATOM 157 N SER A 11 15.181 -0.434 7.701 1.00 0.00 N ATOM 158 CA SER A 11 13.887 -0.508 8.196 1.00 0.00 C ATOM 159 C SER A 11 13.787 -0.139 9.661 1.00 0.00 C ATOM 160 O SER A 11 14.803 0.048 10.369 1.00 0.00 O ATOM 161 CB SER A 11 13.460 -1.887 7.904 1.00 0.00 C ATOM 162 OG SER A 11 14.573 -2.758 8.102 1.00 0.00 O ATOM 0 H SER A 11 15.661 -1.334 7.720 1.00 0.00 H new ATOM 0 HA SER A 11 13.229 0.222 7.725 1.00 0.00 H new ATOM 0 HB2 SER A 11 12.634 -2.174 8.555 1.00 0.00 H new ATOM 0 HB3 SER A 11 13.098 -1.962 6.879 1.00 0.00 H new ATOM 0 HG SER A 11 14.254 -3.632 8.409 1.00 0.00 H new ATOM 168 N GLN A 12 12.559 -0.061 10.103 1.00 0.00 N ATOM 169 CA GLN A 12 12.186 0.483 11.390 1.00 0.00 C ATOM 170 C GLN A 12 11.371 -0.578 12.088 1.00 0.00 C ATOM 171 O GLN A 12 10.452 -0.327 12.864 1.00 0.00 O ATOM 172 CB GLN A 12 11.360 1.717 11.106 1.00 0.00 C ATOM 173 CG GLN A 12 12.035 2.645 10.081 1.00 0.00 C ATOM 174 CD GLN A 12 11.203 3.849 9.676 1.00 0.00 C ATOM 175 OE1 GLN A 12 11.734 4.890 9.340 1.00 0.00 O ATOM 176 NE2 GLN A 12 9.900 3.714 9.691 1.00 0.00 N ATOM 0 H GLN A 12 11.759 -0.386 9.559 1.00 0.00 H new ATOM 0 HA GLN A 12 13.034 0.752 12.020 1.00 0.00 H new ATOM 0 HB2 GLN A 12 10.380 1.418 10.733 1.00 0.00 H new ATOM 0 HB3 GLN A 12 11.195 2.263 12.035 1.00 0.00 H new ATOM 0 HG2 GLN A 12 12.980 2.996 10.495 1.00 0.00 H new ATOM 0 HG3 GLN A 12 12.273 2.067 9.188 1.00 0.00 H new ATOM 0 HE21 GLN A 12 9.482 2.829 9.978 1.00 0.00 H new ATOM 0 HE22 GLN A 12 9.303 4.494 9.416 1.00 0.00 H new ATOM 185 N ASP A 13 11.782 -1.737 11.784 1.00 0.00 N ATOM 186 CA ASP A 13 11.284 -2.967 12.132 1.00 0.00 C ATOM 187 C ASP A 13 11.982 -3.483 13.410 1.00 0.00 C ATOM 188 O ASP A 13 12.776 -2.746 14.036 1.00 0.00 O ATOM 189 CB ASP A 13 11.675 -3.817 10.941 1.00 0.00 C ATOM 190 CG ASP A 13 13.186 -3.877 10.656 1.00 0.00 C ATOM 191 OD1 ASP A 13 14.004 -3.203 11.349 1.00 0.00 O ATOM 192 OD2 ASP A 13 13.568 -4.545 9.718 1.00 0.00 O ATOM 0 H ASP A 13 12.606 -1.841 11.192 1.00 0.00 H new ATOM 0 HA ASP A 13 10.215 -2.968 12.344 1.00 0.00 H new ATOM 0 HB2 ASP A 13 11.310 -4.831 11.101 1.00 0.00 H new ATOM 0 HB3 ASP A 13 11.168 -3.432 10.056 1.00 0.00 H new ATOM 197 N PRO A 14 11.720 -4.740 13.843 1.00 0.00 N ATOM 198 CA PRO A 14 12.380 -5.298 14.987 1.00 0.00 C ATOM 199 C PRO A 14 13.801 -5.746 14.681 1.00 0.00 C ATOM 200 O PRO A 14 14.064 -6.901 14.360 1.00 0.00 O ATOM 201 CB PRO A 14 11.498 -6.465 15.418 1.00 0.00 C ATOM 202 CG PRO A 14 10.289 -6.397 14.531 1.00 0.00 C ATOM 203 CD PRO A 14 10.749 -5.694 13.292 1.00 0.00 C ATOM 0 HA PRO A 14 12.495 -4.557 15.778 1.00 0.00 H new ATOM 0 HB2 PRO A 14 12.019 -7.415 15.301 1.00 0.00 H new ATOM 0 HB3 PRO A 14 11.220 -6.381 16.469 1.00 0.00 H new ATOM 0 HG2 PRO A 14 9.913 -7.394 14.301 1.00 0.00 H new ATOM 0 HG3 PRO A 14 9.477 -5.853 15.014 1.00 0.00 H new ATOM 0 HD2 PRO A 14 11.206 -6.378 12.577 1.00 0.00 H new ATOM 0 HD3 PRO A 14 9.930 -5.194 12.775 1.00 0.00 H new ATOM 211 N MET A 15 14.676 -4.773 14.745 1.00 0.00 N ATOM 212 CA MET A 15 16.090 -4.887 14.572 1.00 0.00 C ATOM 213 C MET A 15 16.511 -5.594 13.309 1.00 0.00 C ATOM 214 O MET A 15 17.396 -6.461 13.323 1.00 0.00 O ATOM 215 CB MET A 15 16.679 -5.450 15.808 1.00 0.00 C ATOM 216 CG MET A 15 16.715 -4.496 16.915 1.00 0.00 C ATOM 217 SD MET A 15 17.796 -3.077 16.615 1.00 0.00 S ATOM 218 CE MET A 15 17.632 -2.201 18.175 1.00 0.00 C ATOM 0 H MET A 15 14.390 -3.812 14.934 1.00 0.00 H new ATOM 0 HA MET A 15 16.496 -3.887 14.419 1.00 0.00 H new ATOM 0 HB2 MET A 15 16.105 -6.326 16.110 1.00 0.00 H new ATOM 0 HB3 MET A 15 17.693 -5.791 15.597 1.00 0.00 H new ATOM 0 HG2 MET A 15 15.704 -4.137 17.107 1.00 0.00 H new ATOM 0 HG3 MET A 15 17.047 -5.011 17.816 1.00 0.00 H new ATOM 0 HE1 MET A 15 18.241 -1.297 18.151 1.00 0.00 H new ATOM 0 HE2 MET A 15 16.588 -1.931 18.333 1.00 0.00 H new ATOM 0 HE3 MET A 15 17.968 -2.843 18.990 1.00 0.00 H new ATOM 228 N GLU A 16 15.904 -5.151 12.223 1.00 0.00 N ATOM 229 CA GLU A 16 16.169 -5.627 10.866 1.00 0.00 C ATOM 230 C GLU A 16 15.599 -6.998 10.610 1.00 0.00 C ATOM 231 O GLU A 16 16.172 -8.038 11.004 1.00 0.00 O ATOM 232 CB GLU A 16 17.634 -5.546 10.469 1.00 0.00 C ATOM 233 CG GLU A 16 18.162 -4.150 10.305 1.00 0.00 C ATOM 234 CD GLU A 16 19.636 -4.144 10.043 1.00 0.00 C ATOM 235 OE1 GLU A 16 20.393 -3.632 10.895 1.00 0.00 O ATOM 236 OE2 GLU A 16 20.081 -4.647 8.986 1.00 0.00 O ATOM 0 H GLU A 16 15.188 -4.425 12.256 1.00 0.00 H new ATOM 0 HA GLU A 16 15.639 -4.931 10.215 1.00 0.00 H new ATOM 0 HB2 GLU A 16 18.230 -6.059 11.224 1.00 0.00 H new ATOM 0 HB3 GLU A 16 17.773 -6.085 9.532 1.00 0.00 H new ATOM 0 HG2 GLU A 16 17.644 -3.659 9.481 1.00 0.00 H new ATOM 0 HG3 GLU A 16 17.950 -3.572 11.205 1.00 0.00 H new ATOM 243 N ASN A 17 14.501 -6.987 9.924 1.00 0.00 N ATOM 244 CA ASN A 17 13.728 -8.171 9.568 1.00 0.00 C ATOM 245 C ASN A 17 14.064 -8.596 8.162 1.00 0.00 C ATOM 246 O ASN A 17 13.563 -9.596 7.650 1.00 0.00 O ATOM 247 CB ASN A 17 12.216 -7.864 9.753 1.00 0.00 C ATOM 248 CG ASN A 17 11.246 -8.955 9.330 1.00 0.00 C ATOM 249 OD1 ASN A 17 10.893 -9.838 10.116 1.00 0.00 O ATOM 250 ND2 ASN A 17 10.770 -8.871 8.108 1.00 0.00 N ATOM 0 H ASN A 17 14.087 -6.123 9.574 1.00 0.00 H new ATOM 0 HA ASN A 17 13.980 -9.006 10.222 1.00 0.00 H new ATOM 0 HB2 ASN A 17 12.040 -7.640 10.805 1.00 0.00 H new ATOM 0 HB3 ASN A 17 11.980 -6.961 9.191 1.00 0.00 H new ATOM 0 HD21 ASN A 17 10.084 -9.551 7.780 1.00 0.00 H new ATOM 0 HD22 ASN A 17 11.087 -8.126 7.487 1.00 0.00 H new ATOM 257 N GLN A 18 15.067 -7.935 7.687 1.00 0.00 N ATOM 258 CA GLN A 18 15.516 -7.901 6.353 1.00 0.00 C ATOM 259 C GLN A 18 15.458 -9.227 5.608 1.00 0.00 C ATOM 260 O GLN A 18 16.377 -10.085 5.681 1.00 0.00 O ATOM 261 CB GLN A 18 16.868 -7.355 6.284 1.00 0.00 C ATOM 262 CG GLN A 18 17.039 -5.933 6.816 1.00 0.00 C ATOM 263 CD GLN A 18 16.776 -4.873 5.765 1.00 0.00 C ATOM 264 OE1 GLN A 18 17.715 -4.415 5.074 1.00 0.00 O ATOM 265 NE2 GLN A 18 15.551 -4.492 5.595 1.00 0.00 N ATOM 0 H GLN A 18 15.643 -7.350 8.292 1.00 0.00 H new ATOM 0 HA GLN A 18 14.806 -7.251 5.841 1.00 0.00 H new ATOM 0 HB2 GLN A 18 17.534 -8.014 6.841 1.00 0.00 H new ATOM 0 HB3 GLN A 18 17.195 -7.376 5.244 1.00 0.00 H new ATOM 0 HG2 GLN A 18 16.361 -5.781 7.656 1.00 0.00 H new ATOM 0 HG3 GLN A 18 18.052 -5.814 7.199 1.00 0.00 H new ATOM 0 HE21 GLN A 18 14.810 -4.885 6.175 1.00 0.00 H new ATOM 0 HE22 GLN A 18 15.327 -3.799 4.881 1.00 0.00 H new ATOM 274 N PRO A 19 14.403 -9.389 4.867 1.00 0.00 N ATOM 275 CA PRO A 19 14.109 -10.557 4.127 1.00 0.00 C ATOM 276 C PRO A 19 14.691 -10.523 2.729 1.00 0.00 C ATOM 277 O PRO A 19 15.108 -9.480 2.203 1.00 0.00 O ATOM 278 CB PRO A 19 12.584 -10.495 3.966 1.00 0.00 C ATOM 279 CG PRO A 19 12.148 -9.202 4.514 1.00 0.00 C ATOM 280 CD PRO A 19 13.385 -8.397 4.681 1.00 0.00 C ATOM 0 HA PRO A 19 14.507 -11.439 4.628 1.00 0.00 H new ATOM 0 HB2 PRO A 19 12.303 -10.584 2.917 1.00 0.00 H new ATOM 0 HB3 PRO A 19 12.106 -11.319 4.495 1.00 0.00 H new ATOM 0 HG2 PRO A 19 11.448 -8.708 3.841 1.00 0.00 H new ATOM 0 HG3 PRO A 19 11.635 -9.334 5.467 1.00 0.00 H new ATOM 0 HD2 PRO A 19 13.583 -7.777 3.806 1.00 0.00 H new ATOM 0 HD3 PRO A 19 13.316 -7.726 5.538 1.00 0.00 H new ATOM 288 N LYS A 20 14.766 -11.669 2.153 1.00 0.00 N ATOM 289 CA LYS A 20 14.990 -11.843 0.812 1.00 0.00 C ATOM 290 C LYS A 20 13.626 -11.765 0.230 1.00 0.00 C ATOM 291 O LYS A 20 12.804 -12.594 0.494 1.00 0.00 O ATOM 292 CB LYS A 20 15.595 -13.187 0.651 1.00 0.00 C ATOM 293 CG LYS A 20 16.724 -13.380 1.645 1.00 0.00 C ATOM 294 CD LYS A 20 17.831 -12.386 1.478 1.00 0.00 C ATOM 295 CE LYS A 20 18.417 -12.053 2.820 1.00 0.00 C ATOM 296 NZ LYS A 20 19.346 -13.099 3.340 1.00 0.00 N ATOM 0 H LYS A 20 14.663 -12.548 2.661 1.00 0.00 H new ATOM 0 HA LYS A 20 15.657 -11.123 0.339 1.00 0.00 H new ATOM 0 HB2 LYS A 20 14.836 -13.955 0.799 1.00 0.00 H new ATOM 0 HB3 LYS A 20 15.972 -13.304 -0.365 1.00 0.00 H new ATOM 0 HG2 LYS A 20 16.326 -13.305 2.657 1.00 0.00 H new ATOM 0 HG3 LYS A 20 17.128 -14.386 1.536 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.602 -12.792 0.824 1.00 0.00 H new ATOM 0 HD3 LYS A 20 17.452 -11.482 1.001 1.00 0.00 H new ATOM 0 HE2 LYS A 20 18.952 -11.106 2.749 1.00 0.00 H new ATOM 0 HE3 LYS A 20 17.607 -11.909 3.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 19.714 -12.806 4.268 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 18.835 -13.999 3.438 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.138 -13.221 2.677 1.00 0.00 H new ATOM 310 N LEU A 21 13.371 -10.670 -0.399 1.00 0.00 N ATOM 311 CA LEU A 21 12.105 -10.278 -0.869 1.00 0.00 C ATOM 312 C LEU A 21 11.406 -11.174 -1.850 1.00 0.00 C ATOM 313 O LEU A 21 10.192 -11.095 -2.020 1.00 0.00 O ATOM 314 CB LEU A 21 12.338 -8.914 -1.300 1.00 0.00 C ATOM 315 CG LEU A 21 12.764 -8.007 -0.236 1.00 0.00 C ATOM 316 CD1 LEU A 21 12.355 -6.724 -0.521 1.00 0.00 C ATOM 317 CD2 LEU A 21 12.256 -8.306 1.000 1.00 0.00 C ATOM 0 H LEU A 21 14.097 -9.985 -0.608 1.00 0.00 H new ATOM 0 HA LEU A 21 11.350 -10.361 -0.087 1.00 0.00 H new ATOM 0 HB2 LEU A 21 13.097 -8.918 -2.082 1.00 0.00 H new ATOM 0 HB3 LEU A 21 11.422 -8.526 -1.746 1.00 0.00 H new ATOM 0 HG LEU A 21 13.848 -8.112 -0.199 1.00 0.00 H new ATOM 0 HD11 LEU A 21 12.676 -6.054 0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 21 12.796 -6.403 -1.465 1.00 0.00 H new ATOM 0 HD13 LEU A 21 11.268 -6.698 -0.601 1.00 0.00 H new ATOM 0 HD21 LEU A 21 12.623 -7.583 1.729 1.00 0.00 H new ATOM 0 HD22 LEU A 21 11.167 -8.266 0.965 1.00 0.00 H new ATOM 0 HD23 LEU A 21 12.573 -9.308 1.291 1.00 0.00 H new ATOM 329 N ASN A 22 12.167 -11.975 -2.493 1.00 0.00 N ATOM 330 CA ASN A 22 11.739 -13.045 -3.358 1.00 0.00 C ATOM 331 C ASN A 22 10.948 -12.540 -4.519 1.00 0.00 C ATOM 332 O ASN A 22 10.193 -13.256 -5.159 1.00 0.00 O ATOM 333 CB ASN A 22 11.010 -14.011 -2.523 1.00 0.00 C ATOM 334 CG ASN A 22 11.870 -14.626 -1.520 1.00 0.00 C ATOM 335 OD1 ASN A 22 13.075 -14.825 -1.717 1.00 0.00 O ATOM 336 ND2 ASN A 22 11.304 -14.897 -0.439 1.00 0.00 N ATOM 0 H ASN A 22 13.183 -11.909 -2.435 1.00 0.00 H new ATOM 0 HA ASN A 22 12.594 -13.542 -3.816 1.00 0.00 H new ATOM 0 HB2 ASN A 22 10.179 -13.508 -2.028 1.00 0.00 H new ATOM 0 HB3 ASN A 22 10.581 -14.787 -3.157 1.00 0.00 H new ATOM 0 HD21 ASN A 22 11.839 -15.301 0.330 1.00 0.00 H new ATOM 0 HD22 ASN A 22 10.307 -14.714 -0.325 1.00 0.00 H new ATOM 343 N SER A 23 11.118 -11.271 -4.731 1.00 0.00 N ATOM 344 CA SER A 23 10.685 -10.544 -5.905 1.00 0.00 C ATOM 345 C SER A 23 9.193 -10.190 -5.985 1.00 0.00 C ATOM 346 O SER A 23 8.756 -9.692 -7.014 1.00 0.00 O ATOM 347 CB SER A 23 11.279 -11.100 -7.255 1.00 0.00 C ATOM 348 OG SER A 23 10.933 -12.452 -7.524 1.00 0.00 O ATOM 0 H SER A 23 11.590 -10.671 -4.054 1.00 0.00 H new ATOM 0 HA SER A 23 11.147 -9.568 -5.753 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.931 -10.476 -8.078 1.00 0.00 H new ATOM 0 HB3 SER A 23 12.365 -11.012 -7.226 1.00 0.00 H new ATOM 0 HG SER A 23 10.297 -12.768 -6.848 1.00 0.00 H new ATOM 354 N SER A 24 8.423 -10.396 -4.901 1.00 0.00 N ATOM 355 CA SER A 24 7.018 -9.918 -4.848 1.00 0.00 C ATOM 356 C SER A 24 6.432 -9.807 -3.419 1.00 0.00 C ATOM 357 O SER A 24 6.572 -8.785 -2.785 1.00 0.00 O ATOM 358 CB SER A 24 6.049 -10.666 -5.813 1.00 0.00 C ATOM 359 OG SER A 24 6.290 -10.353 -7.184 1.00 0.00 O ATOM 0 H SER A 24 8.737 -10.881 -4.061 1.00 0.00 H new ATOM 0 HA SER A 24 7.093 -8.897 -5.223 1.00 0.00 H new ATOM 0 HB2 SER A 24 6.154 -11.741 -5.666 1.00 0.00 H new ATOM 0 HB3 SER A 24 5.020 -10.408 -5.561 1.00 0.00 H new ATOM 0 HG SER A 24 7.158 -9.907 -7.270 1.00 0.00 H new ATOM 365 N LYS A 25 5.860 -10.869 -2.895 1.00 0.00 N ATOM 366 CA LYS A 25 5.131 -10.849 -1.686 1.00 0.00 C ATOM 367 C LYS A 25 5.962 -10.421 -0.538 1.00 0.00 C ATOM 368 O LYS A 25 5.638 -9.483 0.184 1.00 0.00 O ATOM 369 CB LYS A 25 4.711 -12.253 -1.461 1.00 0.00 C ATOM 370 CG LYS A 25 4.330 -12.527 -0.055 1.00 0.00 C ATOM 371 CD LYS A 25 3.007 -13.114 0.081 1.00 0.00 C ATOM 372 CE LYS A 25 2.977 -14.466 -0.562 1.00 0.00 C ATOM 373 NZ LYS A 25 3.948 -15.422 0.057 1.00 0.00 N ATOM 0 H LYS A 25 5.902 -11.792 -3.328 1.00 0.00 H new ATOM 0 HA LYS A 25 4.301 -10.147 -1.760 1.00 0.00 H new ATOM 0 HB2 LYS A 25 3.867 -12.482 -2.111 1.00 0.00 H new ATOM 0 HB3 LYS A 25 5.524 -12.920 -1.747 1.00 0.00 H new ATOM 0 HG2 LYS A 25 5.065 -13.199 0.388 1.00 0.00 H new ATOM 0 HG3 LYS A 25 4.366 -11.596 0.511 1.00 0.00 H new ATOM 0 HD2 LYS A 25 2.744 -13.198 1.136 1.00 0.00 H new ATOM 0 HD3 LYS A 25 2.263 -12.466 -0.382 1.00 0.00 H new ATOM 0 HE2 LYS A 25 1.970 -14.877 -0.487 1.00 0.00 H new ATOM 0 HE3 LYS A 25 3.201 -14.364 -1.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 3.838 -16.360 -0.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 4.918 -15.080 -0.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 3.763 -15.492 1.078 1.00 0.00 H new ATOM 387 N GLU A 26 6.989 -11.143 -0.371 1.00 0.00 N ATOM 388 CA GLU A 26 7.896 -10.964 0.723 1.00 0.00 C ATOM 389 C GLU A 26 8.611 -9.588 0.688 1.00 0.00 C ATOM 390 O GLU A 26 9.323 -9.233 1.609 1.00 0.00 O ATOM 391 CB GLU A 26 8.911 -12.126 0.841 1.00 0.00 C ATOM 392 CG GLU A 26 8.336 -13.526 1.177 1.00 0.00 C ATOM 393 CD GLU A 26 7.347 -14.079 0.152 1.00 0.00 C ATOM 394 OE1 GLU A 26 6.383 -14.787 0.552 1.00 0.00 O ATOM 395 OE2 GLU A 26 7.466 -13.760 -1.051 1.00 0.00 O ATOM 0 H GLU A 26 7.247 -11.903 -1.000 1.00 0.00 H new ATOM 0 HA GLU A 26 7.282 -10.978 1.624 1.00 0.00 H new ATOM 0 HB2 GLU A 26 9.454 -12.199 -0.101 1.00 0.00 H new ATOM 0 HB3 GLU A 26 9.639 -11.864 1.609 1.00 0.00 H new ATOM 0 HG2 GLU A 26 9.164 -14.228 1.277 1.00 0.00 H new ATOM 0 HG3 GLU A 26 7.841 -13.476 2.147 1.00 0.00 H new ATOM 402 N VAL A 27 8.410 -8.822 -0.367 1.00 0.00 N ATOM 403 CA VAL A 27 8.950 -7.489 -0.420 1.00 0.00 C ATOM 404 C VAL A 27 7.984 -6.540 0.140 1.00 0.00 C ATOM 405 O VAL A 27 8.386 -5.501 0.571 1.00 0.00 O ATOM 406 CB VAL A 27 9.438 -7.048 -1.792 1.00 0.00 C ATOM 407 CG1 VAL A 27 9.610 -8.188 -2.642 1.00 0.00 C ATOM 408 CG2 VAL A 27 8.595 -6.045 -2.393 1.00 0.00 C ATOM 0 H VAL A 27 7.879 -9.103 -1.191 1.00 0.00 H new ATOM 0 HA VAL A 27 9.853 -7.503 0.191 1.00 0.00 H new ATOM 0 HB VAL A 27 10.407 -6.567 -1.658 1.00 0.00 H new ATOM 0 HG11 VAL A 27 9.959 -7.862 -3.622 1.00 0.00 H new ATOM 0 HG12 VAL A 27 10.344 -8.863 -2.201 1.00 0.00 H new ATOM 0 HG13 VAL A 27 8.658 -8.708 -2.751 1.00 0.00 H new ATOM 0 HG21 VAL A 27 8.995 -5.771 -3.369 1.00 0.00 H new ATOM 0 HG22 VAL A 27 7.586 -6.441 -2.512 1.00 0.00 H new ATOM 0 HG23 VAL A 27 8.566 -5.163 -1.753 1.00 0.00 H new ATOM 418 N ILE A 28 6.678 -6.906 0.177 1.00 0.00 N ATOM 419 CA ILE A 28 5.739 -6.125 0.886 1.00 0.00 C ATOM 420 C ILE A 28 6.172 -6.125 2.255 1.00 0.00 C ATOM 421 O ILE A 28 6.095 -5.170 2.923 1.00 0.00 O ATOM 422 CB ILE A 28 4.369 -6.757 0.857 1.00 0.00 C ATOM 423 CG1 ILE A 28 3.760 -6.649 -0.487 1.00 0.00 C ATOM 424 CG2 ILE A 28 3.414 -6.224 1.974 1.00 0.00 C ATOM 425 CD1 ILE A 28 3.955 -5.301 -1.110 1.00 0.00 C ATOM 0 H ILE A 28 6.294 -7.732 -0.282 1.00 0.00 H new ATOM 0 HA ILE A 28 5.679 -5.131 0.444 1.00 0.00 H new ATOM 0 HB ILE A 28 4.515 -7.814 1.079 1.00 0.00 H new ATOM 0 HG12 ILE A 28 4.191 -7.410 -1.138 1.00 0.00 H new ATOM 0 HG13 ILE A 28 2.693 -6.859 -0.414 1.00 0.00 H new ATOM 0 HG21 ILE A 28 2.447 -6.721 1.894 1.00 0.00 H new ATOM 0 HG22 ILE A 28 3.848 -6.430 2.952 1.00 0.00 H new ATOM 0 HG23 ILE A 28 3.280 -5.149 1.856 1.00 0.00 H new ATOM 0 HD11 ILE A 28 3.486 -5.284 -2.094 1.00 0.00 H new ATOM 0 HD12 ILE A 28 3.500 -4.539 -0.478 1.00 0.00 H new ATOM 0 HD13 ILE A 28 5.021 -5.098 -1.212 1.00 0.00 H new ATOM 437 N ALA A 29 6.613 -7.244 2.632 1.00 0.00 N ATOM 438 CA ALA A 29 7.146 -7.467 3.885 1.00 0.00 C ATOM 439 C ALA A 29 8.320 -6.562 4.207 1.00 0.00 C ATOM 440 O ALA A 29 8.370 -6.019 5.293 1.00 0.00 O ATOM 441 CB ALA A 29 7.450 -8.863 4.024 1.00 0.00 C ATOM 0 H ALA A 29 6.609 -8.072 2.037 1.00 0.00 H new ATOM 0 HA ALA A 29 6.399 -7.200 4.632 1.00 0.00 H new ATOM 0 HB1 ALA A 29 7.872 -9.047 5.012 1.00 0.00 H new ATOM 0 HB2 ALA A 29 6.538 -9.448 3.904 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.172 -9.156 3.261 1.00 0.00 H new ATOM 447 N PHE A 30 9.223 -6.354 3.257 1.00 0.00 N ATOM 448 CA PHE A 30 10.262 -5.411 3.468 1.00 0.00 C ATOM 449 C PHE A 30 9.660 -4.090 3.514 1.00 0.00 C ATOM 450 O PHE A 30 9.929 -3.330 4.377 1.00 0.00 O ATOM 451 CB PHE A 30 11.229 -5.452 2.364 1.00 0.00 C ATOM 452 CG PHE A 30 11.692 -4.131 1.862 1.00 0.00 C ATOM 453 CD1 PHE A 30 11.311 -3.749 0.606 1.00 0.00 C ATOM 454 CD2 PHE A 30 12.513 -3.267 2.624 1.00 0.00 C ATOM 455 CE1 PHE A 30 11.732 -2.579 0.125 1.00 0.00 C ATOM 456 CE2 PHE A 30 12.909 -2.098 2.114 1.00 0.00 C ATOM 457 CZ PHE A 30 12.526 -1.761 0.873 1.00 0.00 C ATOM 0 H PHE A 30 9.240 -6.828 2.354 1.00 0.00 H new ATOM 0 HA PHE A 30 10.784 -5.643 4.397 1.00 0.00 H new ATOM 0 HB2 PHE A 30 12.100 -6.022 2.689 1.00 0.00 H new ATOM 0 HB3 PHE A 30 10.782 -5.999 1.534 1.00 0.00 H new ATOM 0 HD1 PHE A 30 10.676 -4.388 0.010 1.00 0.00 H new ATOM 0 HD2 PHE A 30 12.820 -3.553 3.619 1.00 0.00 H new ATOM 0 HE1 PHE A 30 11.440 -2.275 -0.870 1.00 0.00 H new ATOM 0 HE2 PHE A 30 13.530 -1.432 2.694 1.00 0.00 H new ATOM 0 HZ PHE A 30 12.854 -0.820 0.457 1.00 0.00 H new ATOM 467 N LEU A 31 8.806 -3.833 2.551 1.00 0.00 N ATOM 468 CA LEU A 31 8.148 -2.595 2.433 1.00 0.00 C ATOM 469 C LEU A 31 7.471 -2.242 3.691 1.00 0.00 C ATOM 470 O LEU A 31 7.418 -1.149 4.052 1.00 0.00 O ATOM 471 CB LEU A 31 7.162 -2.713 1.328 1.00 0.00 C ATOM 472 CG LEU A 31 7.757 -2.663 0.006 1.00 0.00 C ATOM 473 CD1 LEU A 31 6.726 -2.623 -1.025 1.00 0.00 C ATOM 474 CD2 LEU A 31 8.695 -1.522 -0.097 1.00 0.00 C ATOM 0 H LEU A 31 8.559 -4.505 1.824 1.00 0.00 H new ATOM 0 HA LEU A 31 8.868 -1.805 2.219 1.00 0.00 H new ATOM 0 HB2 LEU A 31 6.619 -3.652 1.437 1.00 0.00 H new ATOM 0 HB3 LEU A 31 6.431 -1.909 1.418 1.00 0.00 H new ATOM 0 HG LEU A 31 8.334 -3.574 -0.155 1.00 0.00 H new ATOM 0 HD11 LEU A 31 7.196 -2.586 -2.008 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.105 -3.516 -0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 31 6.106 -1.737 -0.885 1.00 0.00 H new ATOM 0 HD21 LEU A 31 9.132 -1.499 -1.095 1.00 0.00 H new ATOM 0 HD22 LEU A 31 8.157 -0.591 0.085 1.00 0.00 H new ATOM 0 HD23 LEU A 31 9.487 -1.634 0.644 1.00 0.00 H new ATOM 486 N ALA A 32 7.018 -3.208 4.342 1.00 0.00 N ATOM 487 CA ALA A 32 6.299 -3.069 5.557 1.00 0.00 C ATOM 488 C ALA A 32 7.170 -2.928 6.772 1.00 0.00 C ATOM 489 O ALA A 32 6.802 -2.254 7.723 1.00 0.00 O ATOM 490 CB ALA A 32 5.449 -4.228 5.652 1.00 0.00 C ATOM 0 H ALA A 32 7.132 -4.178 4.046 1.00 0.00 H new ATOM 0 HA ALA A 32 5.729 -2.140 5.536 1.00 0.00 H new ATOM 0 HB1 ALA A 32 4.867 -4.178 6.572 1.00 0.00 H new ATOM 0 HB2 ALA A 32 4.774 -4.255 4.797 1.00 0.00 H new ATOM 0 HB3 ALA A 32 6.062 -5.129 5.659 1.00 0.00 H new ATOM 496 N GLU A 33 8.332 -3.521 6.744 1.00 0.00 N ATOM 497 CA GLU A 33 9.216 -3.439 7.861 1.00 0.00 C ATOM 498 C GLU A 33 9.909 -2.094 7.829 1.00 0.00 C ATOM 499 O GLU A 33 10.368 -1.512 8.824 1.00 0.00 O ATOM 500 CB GLU A 33 10.160 -4.571 7.771 1.00 0.00 C ATOM 501 CG GLU A 33 11.196 -4.443 6.734 1.00 0.00 C ATOM 502 CD GLU A 33 12.130 -5.606 6.682 1.00 0.00 C ATOM 503 OE1 GLU A 33 13.355 -5.392 6.730 1.00 0.00 O ATOM 504 OE2 GLU A 33 11.643 -6.744 6.598 1.00 0.00 O ATOM 0 H GLU A 33 8.684 -4.065 5.957 1.00 0.00 H new ATOM 0 HA GLU A 33 8.690 -3.510 8.813 1.00 0.00 H new ATOM 0 HB2 GLU A 33 10.649 -4.693 8.737 1.00 0.00 H new ATOM 0 HB3 GLU A 33 9.592 -5.483 7.584 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.715 -4.329 5.763 1.00 0.00 H new ATOM 0 HG3 GLU A 33 11.769 -3.534 6.914 1.00 0.00 H new ATOM 511 N ARG A 34 9.925 -1.632 6.657 1.00 0.00 N ATOM 512 CA ARG A 34 10.497 -0.450 6.234 1.00 0.00 C ATOM 513 C ARG A 34 9.510 0.688 6.360 1.00 0.00 C ATOM 514 O ARG A 34 9.842 1.747 6.880 1.00 0.00 O ATOM 515 CB ARG A 34 10.897 -0.708 4.810 1.00 0.00 C ATOM 516 CG ARG A 34 11.675 0.311 4.194 1.00 0.00 C ATOM 517 CD ARG A 34 12.891 0.528 4.968 1.00 0.00 C ATOM 518 NE ARG A 34 13.883 1.206 4.232 1.00 0.00 N ATOM 519 CZ ARG A 34 14.284 2.476 4.435 1.00 0.00 C ATOM 520 NH1 ARG A 34 13.620 3.269 5.299 1.00 0.00 N ATOM 521 NH2 ARG A 34 15.341 2.945 3.792 1.00 0.00 N ATOM 0 H ARG A 34 9.485 -2.136 5.887 1.00 0.00 H new ATOM 0 HA ARG A 34 11.358 -0.154 6.834 1.00 0.00 H new ATOM 0 HB2 ARG A 34 11.459 -1.641 4.773 1.00 0.00 H new ATOM 0 HB3 ARG A 34 9.993 -0.857 4.219 1.00 0.00 H new ATOM 0 HG2 ARG A 34 11.927 0.024 3.173 1.00 0.00 H new ATOM 0 HG3 ARG A 34 11.100 1.235 4.133 1.00 0.00 H new ATOM 0 HD2 ARG A 34 12.651 1.102 5.863 1.00 0.00 H new ATOM 0 HD3 ARG A 34 13.283 -0.433 5.301 1.00 0.00 H new ATOM 0 HE ARG A 34 14.338 0.690 3.479 1.00 0.00 H new ATOM 0 HH11 ARG A 34 12.810 2.908 5.803 1.00 0.00 H new ATOM 0 HH12 ARG A 34 13.928 4.230 5.449 1.00 0.00 H new ATOM 0 HH21 ARG A 34 15.851 2.345 3.144 1.00 0.00 H new ATOM 0 HH22 ARG A 34 15.646 3.906 3.945 1.00 0.00 H new ATOM 535 N PHE A 35 8.313 0.472 5.871 1.00 0.00 N ATOM 536 CA PHE A 35 7.249 1.411 5.932 1.00 0.00 C ATOM 537 C PHE A 35 6.057 0.886 6.719 1.00 0.00 C ATOM 538 O PHE A 35 5.042 0.524 6.106 1.00 0.00 O ATOM 539 CB PHE A 35 6.809 1.610 4.532 1.00 0.00 C ATOM 540 CG PHE A 35 7.790 2.229 3.659 1.00 0.00 C ATOM 541 CD1 PHE A 35 8.216 1.539 2.592 1.00 0.00 C ATOM 542 CD2 PHE A 35 8.347 3.463 3.923 1.00 0.00 C ATOM 543 CE1 PHE A 35 9.147 2.008 1.786 1.00 0.00 C ATOM 544 CE2 PHE A 35 9.314 3.972 3.083 1.00 0.00 C ATOM 545 CZ PHE A 35 9.720 3.226 1.997 1.00 0.00 C ATOM 0 H PHE A 35 8.056 -0.398 5.405 1.00 0.00 H new ATOM 0 HA PHE A 35 7.595 2.320 6.424 1.00 0.00 H new ATOM 0 HB2 PHE A 35 6.533 0.642 4.114 1.00 0.00 H new ATOM 0 HB3 PHE A 35 5.909 2.225 4.535 1.00 0.00 H new ATOM 0 HD1 PHE A 35 7.784 0.571 2.387 1.00 0.00 H new ATOM 0 HD2 PHE A 35 8.026 4.029 4.785 1.00 0.00 H new ATOM 0 HE1 PHE A 35 9.462 1.415 0.941 1.00 0.00 H new ATOM 0 HE2 PHE A 35 9.748 4.943 3.273 1.00 0.00 H new ATOM 0 HZ PHE A 35 10.479 3.600 1.326 1.00 0.00 H new ATOM 555 N PRO A 36 6.167 0.783 8.067 1.00 0.00 N ATOM 556 CA PRO A 36 5.055 0.458 8.963 1.00 0.00 C ATOM 557 C PRO A 36 3.689 1.132 8.605 1.00 0.00 C ATOM 558 O PRO A 36 2.631 0.629 8.972 1.00 0.00 O ATOM 559 CB PRO A 36 5.552 1.027 10.302 1.00 0.00 C ATOM 560 CG PRO A 36 7.021 1.221 10.188 1.00 0.00 C ATOM 561 CD PRO A 36 7.419 0.782 8.834 1.00 0.00 C ATOM 0 HA PRO A 36 4.836 -0.609 8.931 1.00 0.00 H new ATOM 0 HB2 PRO A 36 5.057 1.972 10.524 1.00 0.00 H new ATOM 0 HB3 PRO A 36 5.318 0.345 11.119 1.00 0.00 H new ATOM 0 HG2 PRO A 36 7.284 2.267 10.345 1.00 0.00 H new ATOM 0 HG3 PRO A 36 7.545 0.643 10.949 1.00 0.00 H new ATOM 0 HD2 PRO A 36 8.153 1.459 8.397 1.00 0.00 H new ATOM 0 HD3 PRO A 36 7.872 -0.209 8.855 1.00 0.00 H new ATOM 569 N HIS A 37 3.710 2.257 7.876 1.00 0.00 N ATOM 570 CA HIS A 37 2.466 2.952 7.579 1.00 0.00 C ATOM 571 C HIS A 37 1.835 2.297 6.377 1.00 0.00 C ATOM 572 O HIS A 37 0.730 1.794 6.422 1.00 0.00 O ATOM 573 CB HIS A 37 2.667 4.477 7.236 1.00 0.00 C ATOM 574 CG HIS A 37 1.433 5.298 7.400 1.00 0.00 C ATOM 575 ND1 HIS A 37 1.390 6.499 8.083 1.00 0.00 N ATOM 576 CD2 HIS A 37 0.216 5.105 6.912 1.00 0.00 C ATOM 577 CE1 HIS A 37 0.174 7.001 7.996 1.00 0.00 C ATOM 578 NE2 HIS A 37 -0.565 6.174 7.283 1.00 0.00 N ATOM 0 H HIS A 37 4.552 2.689 7.494 1.00 0.00 H new ATOM 0 HA HIS A 37 1.845 2.891 8.473 1.00 0.00 H new ATOM 0 HB2 HIS A 37 3.450 4.884 7.876 1.00 0.00 H new ATOM 0 HB3 HIS A 37 3.017 4.566 6.208 1.00 0.00 H new ATOM 0 HD1 HIS A 37 2.173 6.928 8.575 1.00 0.00 H new ATOM 0 HD2 HIS A 37 -0.106 4.257 6.326 1.00 0.00 H new ATOM 0 HE1 HIS A 37 -0.160 7.930 8.434 1.00 0.00 H new ATOM 587 N CYS A 38 2.572 2.370 5.337 1.00 0.00 N ATOM 588 CA CYS A 38 2.238 1.964 4.011 1.00 0.00 C ATOM 589 C CYS A 38 1.943 0.525 3.904 1.00 0.00 C ATOM 590 O CYS A 38 0.972 0.102 3.291 1.00 0.00 O ATOM 591 CB CYS A 38 3.476 2.289 3.214 1.00 0.00 C ATOM 592 SG CYS A 38 4.205 3.805 3.835 1.00 0.00 S ATOM 0 H CYS A 38 3.517 2.751 5.388 1.00 0.00 H new ATOM 0 HA CYS A 38 1.335 2.467 3.664 1.00 0.00 H new ATOM 0 HB2 CYS A 38 4.193 1.472 3.287 1.00 0.00 H new ATOM 0 HB3 CYS A 38 3.224 2.399 2.159 1.00 0.00 H new ATOM 0 HG CYS A 38 5.470 3.832 3.536 1.00 0.00 H new ATOM 598 N PHE A 39 2.780 -0.217 4.458 1.00 0.00 N ATOM 599 CA PHE A 39 2.750 -1.563 4.268 1.00 0.00 C ATOM 600 C PHE A 39 2.480 -2.327 5.559 1.00 0.00 C ATOM 601 O PHE A 39 2.730 -1.834 6.645 1.00 0.00 O ATOM 602 CB PHE A 39 4.072 -1.806 3.657 1.00 0.00 C ATOM 603 CG PHE A 39 4.243 -1.296 2.329 1.00 0.00 C ATOM 604 CD1 PHE A 39 5.168 -0.367 2.128 1.00 0.00 C ATOM 605 CD2 PHE A 39 3.479 -1.714 1.287 1.00 0.00 C ATOM 606 CE1 PHE A 39 5.368 0.161 0.974 1.00 0.00 C ATOM 607 CE2 PHE A 39 3.666 -1.180 0.055 1.00 0.00 C ATOM 608 CZ PHE A 39 4.621 -0.226 -0.109 1.00 0.00 C ATOM 0 H PHE A 39 3.524 0.112 5.073 1.00 0.00 H new ATOM 0 HA PHE A 39 1.935 -1.920 3.638 1.00 0.00 H new ATOM 0 HB2 PHE A 39 4.835 -1.364 4.298 1.00 0.00 H new ATOM 0 HB3 PHE A 39 4.253 -2.881 3.640 1.00 0.00 H new ATOM 0 HD1 PHE A 39 5.773 -0.044 2.962 1.00 0.00 H new ATOM 0 HD2 PHE A 39 2.724 -2.471 1.440 1.00 0.00 H new ATOM 0 HE1 PHE A 39 6.131 0.916 0.856 1.00 0.00 H new ATOM 0 HE2 PHE A 39 3.067 -1.507 -0.782 1.00 0.00 H new ATOM 0 HZ PHE A 39 4.789 0.220 -1.078 1.00 0.00 H new ATOM 618 N SER A 40 1.886 -3.495 5.398 1.00 0.00 N ATOM 619 CA SER A 40 1.552 -4.389 6.480 1.00 0.00 C ATOM 620 C SER A 40 2.645 -5.316 6.834 1.00 0.00 C ATOM 621 O SER A 40 3.438 -4.993 7.690 1.00 0.00 O ATOM 622 CB SER A 40 0.335 -5.155 6.126 1.00 0.00 C ATOM 623 OG SER A 40 -0.789 -4.308 6.141 1.00 0.00 O ATOM 0 H SER A 40 1.617 -3.854 4.482 1.00 0.00 H new ATOM 0 HA SER A 40 1.376 -3.771 7.361 1.00 0.00 H new ATOM 0 HB2 SER A 40 0.451 -5.601 5.138 1.00 0.00 H new ATOM 0 HB3 SER A 40 0.193 -5.974 6.831 1.00 0.00 H new ATOM 0 HG SER A 40 -0.652 -3.594 6.799 1.00 0.00 H new ATOM 629 N ALA A 41 2.541 -6.560 6.273 1.00 0.00 N ATOM 630 CA ALA A 41 3.460 -7.725 6.386 1.00 0.00 C ATOM 631 C ALA A 41 2.858 -8.557 7.437 1.00 0.00 C ATOM 632 O ALA A 41 2.970 -9.763 7.505 1.00 0.00 O ATOM 633 CB ALA A 41 4.756 -7.272 6.790 1.00 0.00 C ATOM 0 H ALA A 41 1.742 -6.787 5.681 1.00 0.00 H new ATOM 0 HA ALA A 41 3.584 -8.267 5.449 1.00 0.00 H new ATOM 0 HB1 ALA A 41 5.430 -8.125 6.873 1.00 0.00 H new ATOM 0 HB2 ALA A 41 5.144 -6.573 6.049 1.00 0.00 H new ATOM 0 HB3 ALA A 41 4.682 -6.773 7.756 1.00 0.00 H new ATOM 639 N GLU A 42 2.192 -7.800 8.232 1.00 0.00 N ATOM 640 CA GLU A 42 1.329 -8.130 9.228 1.00 0.00 C ATOM 641 C GLU A 42 0.216 -8.850 8.693 1.00 0.00 C ATOM 642 O GLU A 42 -0.263 -9.858 9.195 1.00 0.00 O ATOM 643 CB GLU A 42 0.686 -6.865 9.563 1.00 0.00 C ATOM 644 CG GLU A 42 1.443 -5.710 9.887 1.00 0.00 C ATOM 645 CD GLU A 42 0.525 -4.578 10.329 1.00 0.00 C ATOM 646 OE1 GLU A 42 -0.725 -4.662 10.028 1.00 0.00 O ATOM 647 OE2 GLU A 42 1.000 -3.569 10.821 1.00 0.00 O ATOM 0 H GLU A 42 2.279 -6.787 8.157 1.00 0.00 H new ATOM 0 HA GLU A 42 1.853 -8.674 10.014 1.00 0.00 H new ATOM 0 HB2 GLU A 42 0.050 -6.600 8.718 1.00 0.00 H new ATOM 0 HB3 GLU A 42 0.027 -7.059 10.409 1.00 0.00 H new ATOM 0 HG2 GLU A 42 2.151 -5.943 10.682 1.00 0.00 H new ATOM 0 HG3 GLU A 42 2.027 -5.396 9.022 1.00 0.00 H new ATOM 654 N GLY A 43 -0.209 -8.260 7.672 1.00 0.00 N ATOM 655 CA GLY A 43 -1.432 -8.572 7.161 1.00 0.00 C ATOM 656 C GLY A 43 -1.466 -8.549 5.690 1.00 0.00 C ATOM 657 O GLY A 43 -0.454 -8.238 5.052 1.00 0.00 O ATOM 0 H GLY A 43 0.300 -7.535 7.166 1.00 0.00 H new ATOM 0 HA2 GLY A 43 -1.723 -9.563 7.510 1.00 0.00 H new ATOM 0 HA3 GLY A 43 -2.170 -7.869 7.547 1.00 0.00 H new ATOM 661 N GLU A 44 -2.656 -8.833 5.185 1.00 0.00 N ATOM 662 CA GLU A 44 -3.027 -8.846 3.798 1.00 0.00 C ATOM 663 C GLU A 44 -2.438 -7.627 3.077 1.00 0.00 C ATOM 664 O GLU A 44 -1.601 -7.763 2.188 1.00 0.00 O ATOM 665 CB GLU A 44 -4.550 -8.790 3.757 1.00 0.00 C ATOM 666 CG GLU A 44 -5.210 -9.478 2.601 1.00 0.00 C ATOM 667 CD GLU A 44 -6.708 -9.250 2.614 1.00 0.00 C ATOM 668 OE1 GLU A 44 -7.217 -8.561 1.683 1.00 0.00 O ATOM 669 OE2 GLU A 44 -7.360 -9.657 3.567 1.00 0.00 O ATOM 0 H GLU A 44 -3.440 -9.078 5.789 1.00 0.00 H new ATOM 0 HA GLU A 44 -2.648 -9.739 3.300 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -4.933 -9.227 4.679 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -4.854 -7.743 3.750 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -4.791 -9.107 1.666 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -5.001 -10.547 2.643 1.00 0.00 H new ATOM 676 N ALA A 45 -2.850 -6.435 3.517 1.00 0.00 N ATOM 677 CA ALA A 45 -2.370 -5.198 2.948 1.00 0.00 C ATOM 678 C ALA A 45 -2.790 -4.015 3.791 1.00 0.00 C ATOM 679 O ALA A 45 -3.251 -4.175 4.903 1.00 0.00 O ATOM 680 CB ALA A 45 -2.883 -5.043 1.548 1.00 0.00 C ATOM 0 H ALA A 45 -3.522 -6.313 4.274 1.00 0.00 H new ATOM 0 HA ALA A 45 -1.281 -5.231 2.928 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -2.516 -4.107 1.127 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -2.534 -5.876 0.938 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -3.973 -5.033 1.559 1.00 0.00 H new ATOM 686 N ARG A 46 -2.618 -2.857 3.276 1.00 0.00 N ATOM 687 CA ARG A 46 -2.949 -1.630 3.939 1.00 0.00 C ATOM 688 C ARG A 46 -3.422 -0.754 2.808 1.00 0.00 C ATOM 689 O ARG A 46 -3.019 -1.038 1.668 1.00 0.00 O ATOM 690 CB ARG A 46 -1.651 -1.027 4.535 1.00 0.00 C ATOM 691 CG ARG A 46 -1.842 0.172 5.458 1.00 0.00 C ATOM 692 CD ARG A 46 -1.961 -0.248 6.923 1.00 0.00 C ATOM 693 NE ARG A 46 -0.634 -0.587 7.499 1.00 0.00 N ATOM 694 CZ ARG A 46 -0.385 -1.487 8.484 1.00 0.00 C ATOM 695 NH1 ARG A 46 -1.367 -2.217 9.001 1.00 0.00 N ATOM 696 NH2 ARG A 46 0.841 -1.640 8.954 1.00 0.00 N ATOM 0 H ARG A 46 -2.228 -2.720 2.344 1.00 0.00 H new ATOM 0 HA ARG A 46 -3.679 -1.741 4.741 1.00 0.00 H new ATOM 0 HB2 ARG A 46 -1.130 -1.808 5.088 1.00 0.00 H new ATOM 0 HB3 ARG A 46 -1.000 -0.729 3.713 1.00 0.00 H new ATOM 0 HG2 ARG A 46 -1.001 0.855 5.344 1.00 0.00 H new ATOM 0 HG3 ARG A 46 -2.738 0.718 5.163 1.00 0.00 H new ATOM 0 HD2 ARG A 46 -2.414 0.559 7.499 1.00 0.00 H new ATOM 0 HD3 ARG A 46 -2.625 -1.109 7.004 1.00 0.00 H new ATOM 0 HE ARG A 46 0.172 -0.093 7.115 1.00 0.00 H new ATOM 0 HH11 ARG A 46 -2.321 -2.105 8.658 1.00 0.00 H new ATOM 0 HH12 ARG A 46 -1.167 -2.890 9.741 1.00 0.00 H new ATOM 0 HH21 ARG A 46 1.605 -1.080 8.576 1.00 0.00 H new ATOM 0 HH22 ARG A 46 1.022 -2.318 9.694 1.00 0.00 H new ATOM 710 N PRO A 47 -4.341 0.220 3.019 1.00 0.00 N ATOM 711 CA PRO A 47 -4.648 1.168 1.973 1.00 0.00 C ATOM 712 C PRO A 47 -3.364 1.821 1.486 1.00 0.00 C ATOM 713 O PRO A 47 -2.513 2.232 2.278 1.00 0.00 O ATOM 714 CB PRO A 47 -5.615 2.171 2.613 1.00 0.00 C ATOM 715 CG PRO A 47 -6.232 1.412 3.743 1.00 0.00 C ATOM 716 CD PRO A 47 -5.196 0.410 4.207 1.00 0.00 C ATOM 0 HA PRO A 47 -5.104 0.711 1.095 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -5.091 3.059 2.968 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -6.368 2.508 1.901 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -6.512 2.084 4.554 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -7.142 0.907 3.419 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -4.625 0.787 5.056 1.00 0.00 H new ATOM 0 HD3 PRO A 47 -5.657 -0.526 4.523 1.00 0.00 H new ATOM 724 N LEU A 48 -3.195 1.828 0.208 1.00 0.00 N ATOM 725 CA LEU A 48 -1.998 2.261 -0.389 1.00 0.00 C ATOM 726 C LEU A 48 -2.316 2.955 -1.729 1.00 0.00 C ATOM 727 O LEU A 48 -3.399 2.814 -2.242 1.00 0.00 O ATOM 728 CB LEU A 48 -1.137 0.998 -0.579 1.00 0.00 C ATOM 729 CG LEU A 48 -0.048 1.086 -1.550 1.00 0.00 C ATOM 730 CD1 LEU A 48 1.144 1.593 -0.958 1.00 0.00 C ATOM 731 CD2 LEU A 48 0.285 -0.145 -2.193 1.00 0.00 C ATOM 0 H LEU A 48 -3.906 1.524 -0.457 1.00 0.00 H new ATOM 0 HA LEU A 48 -1.463 2.989 0.221 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -0.710 0.728 0.387 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -1.793 0.180 -0.877 1.00 0.00 H new ATOM 0 HG LEU A 48 -0.439 1.766 -2.307 1.00 0.00 H new ATOM 0 HD11 LEU A 48 1.931 1.644 -1.711 1.00 0.00 H new ATOM 0 HD12 LEU A 48 0.957 2.591 -0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 48 1.458 0.933 -0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 48 1.103 0.021 -2.895 1.00 0.00 H new ATOM 0 HD22 LEU A 48 0.592 -0.875 -1.444 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -0.585 -0.521 -2.732 1.00 0.00 H new ATOM 743 N LYS A 49 -1.376 3.724 -2.248 1.00 0.00 N ATOM 744 CA LYS A 49 -1.465 4.356 -3.489 1.00 0.00 C ATOM 745 C LYS A 49 -0.734 3.412 -4.380 1.00 0.00 C ATOM 746 O LYS A 49 -0.006 2.656 -3.913 1.00 0.00 O ATOM 747 CB LYS A 49 -0.713 5.727 -3.435 1.00 0.00 C ATOM 748 CG LYS A 49 0.720 5.658 -2.933 1.00 0.00 C ATOM 749 CD LYS A 49 1.548 7.008 -2.840 1.00 0.00 C ATOM 750 CE LYS A 49 1.807 7.731 -4.194 1.00 0.00 C ATOM 751 NZ LYS A 49 2.857 8.822 -4.096 1.00 0.00 N ATOM 0 H LYS A 49 -0.497 3.914 -1.766 1.00 0.00 H new ATOM 0 HA LYS A 49 -2.486 4.563 -3.810 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -0.711 6.162 -4.434 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -1.274 6.406 -2.793 1.00 0.00 H new ATOM 0 HG2 LYS A 49 0.704 5.209 -1.940 1.00 0.00 H new ATOM 0 HG3 LYS A 49 1.268 4.976 -3.583 1.00 0.00 H new ATOM 0 HD2 LYS A 49 1.019 7.693 -2.178 1.00 0.00 H new ATOM 0 HD3 LYS A 49 2.509 6.793 -2.374 1.00 0.00 H new ATOM 0 HE2 LYS A 49 2.122 6.997 -4.936 1.00 0.00 H new ATOM 0 HE3 LYS A 49 0.873 8.165 -4.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 2.595 9.612 -4.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 2.916 9.160 -3.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 3.780 8.442 -4.387 1.00 0.00 H new ATOM 765 N ILE A 50 -0.970 3.383 -5.584 1.00 0.00 N ATOM 766 CA ILE A 50 -0.171 2.544 -6.418 1.00 0.00 C ATOM 767 C ILE A 50 1.092 3.151 -6.981 1.00 0.00 C ATOM 768 O ILE A 50 2.155 2.481 -7.085 1.00 0.00 O ATOM 769 CB ILE A 50 -0.977 1.728 -7.365 1.00 0.00 C ATOM 770 CG1 ILE A 50 -1.181 0.396 -6.645 1.00 0.00 C ATOM 771 CG2 ILE A 50 -0.276 1.627 -8.668 1.00 0.00 C ATOM 772 CD1 ILE A 50 -1.784 -0.687 -7.450 1.00 0.00 C ATOM 0 H ILE A 50 -1.701 3.914 -6.057 1.00 0.00 H new ATOM 0 HA ILE A 50 0.262 1.824 -5.724 1.00 0.00 H new ATOM 0 HB ILE A 50 -1.946 2.158 -7.617 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -0.215 0.053 -6.276 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -1.812 0.569 -5.773 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -0.872 1.028 -9.356 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -0.135 2.625 -9.084 1.00 0.00 H new ATOM 0 HG23 ILE A 50 0.695 1.154 -8.523 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -1.881 -1.584 -6.838 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -2.769 -0.376 -7.798 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -1.147 -0.901 -8.308 1.00 0.00 H new ATOM 784 N GLY A 51 1.012 4.382 -7.277 1.00 0.00 N ATOM 785 CA GLY A 51 2.164 5.108 -7.783 1.00 0.00 C ATOM 786 C GLY A 51 3.270 5.218 -6.763 1.00 0.00 C ATOM 787 O GLY A 51 4.366 5.509 -7.116 1.00 0.00 O ATOM 0 H GLY A 51 0.163 4.940 -7.187 1.00 0.00 H new ATOM 0 HA2 GLY A 51 2.543 4.606 -8.673 1.00 0.00 H new ATOM 0 HA3 GLY A 51 1.854 6.108 -8.088 1.00 0.00 H new ATOM 791 N ILE A 52 2.961 4.921 -5.484 1.00 0.00 N ATOM 792 CA ILE A 52 3.918 4.814 -4.418 1.00 0.00 C ATOM 793 C ILE A 52 5.126 4.029 -4.804 1.00 0.00 C ATOM 794 O ILE A 52 6.146 4.297 -4.336 1.00 0.00 O ATOM 795 CB ILE A 52 3.325 4.024 -3.280 1.00 0.00 C ATOM 796 CG1 ILE A 52 4.389 3.688 -2.401 1.00 0.00 C ATOM 797 CG2 ILE A 52 2.734 2.768 -3.773 1.00 0.00 C ATOM 798 CD1 ILE A 52 4.060 2.720 -1.460 1.00 0.00 C ATOM 0 H ILE A 52 2.003 4.748 -5.179 1.00 0.00 H new ATOM 0 HA ILE A 52 4.181 5.840 -4.160 1.00 0.00 H new ATOM 0 HB ILE A 52 2.551 4.614 -2.788 1.00 0.00 H new ATOM 0 HG12 ILE A 52 5.235 3.335 -2.990 1.00 0.00 H new ATOM 0 HG13 ILE A 52 4.716 4.589 -1.882 1.00 0.00 H new ATOM 0 HG21 ILE A 52 2.311 2.212 -2.936 1.00 0.00 H new ATOM 0 HG22 ILE A 52 1.948 2.994 -4.493 1.00 0.00 H new ATOM 0 HG23 ILE A 52 3.505 2.167 -4.255 1.00 0.00 H new ATOM 0 HD11 ILE A 52 4.924 2.519 -0.827 1.00 0.00 H new ATOM 0 HD12 ILE A 52 3.235 3.077 -0.844 1.00 0.00 H new ATOM 0 HD13 ILE A 52 3.762 1.804 -1.970 1.00 0.00 H new ATOM 810 N PHE A 53 4.957 3.000 -5.559 1.00 0.00 N ATOM 811 CA PHE A 53 5.982 2.130 -5.866 1.00 0.00 C ATOM 812 C PHE A 53 7.212 2.904 -6.268 1.00 0.00 C ATOM 813 O PHE A 53 8.193 2.720 -5.800 1.00 0.00 O ATOM 814 CB PHE A 53 5.524 1.344 -6.985 1.00 0.00 C ATOM 815 CG PHE A 53 6.639 0.727 -7.620 1.00 0.00 C ATOM 816 CD1 PHE A 53 7.187 1.143 -8.833 1.00 0.00 C ATOM 817 CD2 PHE A 53 7.189 -0.199 -6.967 1.00 0.00 C ATOM 818 CE1 PHE A 53 8.304 0.497 -9.311 1.00 0.00 C ATOM 819 CE2 PHE A 53 8.215 -0.815 -7.401 1.00 0.00 C ATOM 820 CZ PHE A 53 8.796 -0.521 -8.571 1.00 0.00 C ATOM 0 H PHE A 53 4.062 2.753 -5.982 1.00 0.00 H new ATOM 0 HA PHE A 53 6.238 1.505 -5.011 1.00 0.00 H new ATOM 0 HB2 PHE A 53 4.819 0.585 -6.646 1.00 0.00 H new ATOM 0 HB3 PHE A 53 4.992 1.978 -7.695 1.00 0.00 H new ATOM 0 HD1 PHE A 53 6.743 1.957 -9.387 1.00 0.00 H new ATOM 0 HD2 PHE A 53 6.777 -0.479 -6.009 1.00 0.00 H new ATOM 0 HE1 PHE A 53 8.769 0.792 -10.240 1.00 0.00 H new ATOM 0 HE2 PHE A 53 8.635 -1.608 -6.800 1.00 0.00 H new ATOM 0 HZ PHE A 53 9.646 -1.090 -8.918 1.00 0.00 H new ATOM 830 N GLN A 54 7.010 3.808 -7.052 1.00 0.00 N ATOM 831 CA GLN A 54 7.974 4.751 -7.530 1.00 0.00 C ATOM 832 C GLN A 54 8.689 5.570 -6.386 1.00 0.00 C ATOM 833 O GLN A 54 9.670 6.266 -6.558 1.00 0.00 O ATOM 834 CB GLN A 54 7.073 5.554 -8.356 1.00 0.00 C ATOM 835 CG GLN A 54 7.358 6.968 -8.515 1.00 0.00 C ATOM 836 CD GLN A 54 6.960 7.784 -7.427 1.00 0.00 C ATOM 837 OE1 GLN A 54 6.794 8.980 -7.585 1.00 0.00 O ATOM 838 NE2 GLN A 54 6.522 7.139 -6.352 1.00 0.00 N ATOM 0 H GLN A 54 6.085 3.970 -7.450 1.00 0.00 H new ATOM 0 HA GLN A 54 8.839 4.328 -8.041 1.00 0.00 H new ATOM 0 HB2 GLN A 54 7.047 5.107 -9.350 1.00 0.00 H new ATOM 0 HB3 GLN A 54 6.070 5.462 -7.939 1.00 0.00 H new ATOM 0 HG2 GLN A 54 8.430 7.092 -8.670 1.00 0.00 H new ATOM 0 HG3 GLN A 54 6.862 7.324 -9.418 1.00 0.00 H new ATOM 0 HE21 GLN A 54 6.682 6.136 -6.259 1.00 0.00 H new ATOM 0 HE22 GLN A 54 6.026 7.647 -5.620 1.00 0.00 H new ATOM 847 N ASP A 55 8.090 5.508 -5.332 1.00 0.00 N ATOM 848 CA ASP A 55 8.360 6.337 -4.174 1.00 0.00 C ATOM 849 C ASP A 55 9.070 5.576 -3.272 1.00 0.00 C ATOM 850 O ASP A 55 9.901 6.032 -2.570 1.00 0.00 O ATOM 851 CB ASP A 55 7.078 6.800 -3.509 1.00 0.00 C ATOM 852 CG ASP A 55 6.661 8.226 -3.595 1.00 0.00 C ATOM 853 OD1 ASP A 55 7.441 9.088 -3.197 1.00 0.00 O ATOM 854 OD2 ASP A 55 5.482 8.449 -3.999 1.00 0.00 O ATOM 0 H ASP A 55 7.328 4.848 -5.177 1.00 0.00 H new ATOM 0 HA ASP A 55 8.916 7.219 -4.491 1.00 0.00 H new ATOM 0 HB2 ASP A 55 6.266 6.201 -3.921 1.00 0.00 H new ATOM 0 HB3 ASP A 55 7.154 6.549 -2.451 1.00 0.00 H new ATOM 859 N LEU A 56 8.652 4.407 -3.248 1.00 0.00 N ATOM 860 CA LEU A 56 9.252 3.394 -2.638 1.00 0.00 C ATOM 861 C LEU A 56 10.510 3.358 -3.169 1.00 0.00 C ATOM 862 O LEU A 56 11.386 3.604 -2.523 1.00 0.00 O ATOM 863 CB LEU A 56 8.491 2.317 -3.126 1.00 0.00 C ATOM 864 CG LEU A 56 8.092 1.177 -2.435 1.00 0.00 C ATOM 865 CD1 LEU A 56 7.637 1.523 -1.172 1.00 0.00 C ATOM 866 CD2 LEU A 56 6.938 0.838 -3.025 1.00 0.00 C ATOM 0 H LEU A 56 7.787 4.131 -3.712 1.00 0.00 H new ATOM 0 HA LEU A 56 9.318 3.420 -1.550 1.00 0.00 H new ATOM 0 HB2 LEU A 56 7.569 2.764 -3.498 1.00 0.00 H new ATOM 0 HB3 LEU A 56 9.039 1.949 -3.993 1.00 0.00 H new ATOM 0 HG LEU A 56 8.901 0.446 -2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 56 7.327 0.625 -0.638 1.00 0.00 H new ATOM 0 HD12 LEU A 56 8.437 2.015 -0.619 1.00 0.00 H new ATOM 0 HD13 LEU A 56 6.789 2.201 -1.264 1.00 0.00 H new ATOM 0 HD21 LEU A 56 6.536 -0.057 -2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 56 6.223 1.655 -2.923 1.00 0.00 H new ATOM 0 HD23 LEU A 56 7.114 0.640 -4.082 1.00 0.00 H new ATOM 878 N VAL A 57 10.555 3.171 -4.412 1.00 0.00 N ATOM 879 CA VAL A 57 11.778 2.907 -5.133 1.00 0.00 C ATOM 880 C VAL A 57 12.822 3.955 -4.963 1.00 0.00 C ATOM 881 O VAL A 57 14.007 3.676 -5.182 1.00 0.00 O ATOM 882 CB VAL A 57 11.517 2.669 -6.542 1.00 0.00 C ATOM 883 CG1 VAL A 57 10.532 1.637 -6.601 1.00 0.00 C ATOM 884 CG2 VAL A 57 11.052 3.878 -7.212 1.00 0.00 C ATOM 0 H VAL A 57 9.727 3.192 -5.008 1.00 0.00 H new ATOM 0 HA VAL A 57 12.186 2.001 -4.686 1.00 0.00 H new ATOM 0 HB VAL A 57 12.430 2.372 -7.059 1.00 0.00 H new ATOM 0 HG11 VAL A 57 10.297 1.417 -7.642 1.00 0.00 H new ATOM 0 HG12 VAL A 57 10.917 0.739 -6.118 1.00 0.00 H new ATOM 0 HG13 VAL A 57 9.629 1.966 -6.087 1.00 0.00 H new ATOM 0 HG21 VAL A 57 10.867 3.662 -8.264 1.00 0.00 H new ATOM 0 HG22 VAL A 57 10.129 4.221 -6.744 1.00 0.00 H new ATOM 0 HG23 VAL A 57 11.812 4.655 -7.129 1.00 0.00 H new ATOM 894 N ASP A 58 12.361 5.165 -4.629 1.00 0.00 N ATOM 895 CA ASP A 58 13.247 6.247 -4.213 1.00 0.00 C ATOM 896 C ASP A 58 14.163 5.741 -3.093 1.00 0.00 C ATOM 897 O ASP A 58 15.380 5.870 -3.089 1.00 0.00 O ATOM 898 CB ASP A 58 12.412 7.242 -3.523 1.00 0.00 C ATOM 899 CG ASP A 58 13.043 8.600 -3.305 1.00 0.00 C ATOM 900 OD1 ASP A 58 13.174 9.363 -4.276 1.00 0.00 O ATOM 901 OD2 ASP A 58 13.357 8.915 -2.133 1.00 0.00 O ATOM 0 H ASP A 58 11.372 5.416 -4.640 1.00 0.00 H new ATOM 0 HA ASP A 58 13.793 6.621 -5.079 1.00 0.00 H new ATOM 0 HB2 ASP A 58 11.495 7.377 -4.096 1.00 0.00 H new ATOM 0 HB3 ASP A 58 12.125 6.837 -2.553 1.00 0.00 H new ATOM 906 N ARG A 59 13.473 5.064 -2.211 1.00 0.00 N ATOM 907 CA ARG A 59 13.853 4.631 -0.961 1.00 0.00 C ATOM 908 C ARG A 59 14.167 3.157 -0.896 1.00 0.00 C ATOM 909 O ARG A 59 15.260 2.762 -0.534 1.00 0.00 O ATOM 910 CB ARG A 59 12.670 4.891 -0.071 1.00 0.00 C ATOM 911 CG ARG A 59 12.365 6.328 0.331 1.00 0.00 C ATOM 912 CD ARG A 59 10.900 6.566 0.042 1.00 0.00 C ATOM 913 NE ARG A 59 10.295 7.768 0.631 1.00 0.00 N ATOM 914 CZ ARG A 59 9.371 8.550 -0.019 1.00 0.00 C ATOM 915 NH1 ARG A 59 9.247 8.467 -1.339 1.00 0.00 N ATOM 916 NH2 ARG A 59 8.628 9.430 0.646 1.00 0.00 N ATOM 0 H ARG A 59 12.513 4.787 -2.415 1.00 0.00 H new ATOM 0 HA ARG A 59 14.765 5.153 -0.670 1.00 0.00 H new ATOM 0 HB2 ARG A 59 11.786 4.491 -0.569 1.00 0.00 H new ATOM 0 HB3 ARG A 59 12.809 4.314 0.843 1.00 0.00 H new ATOM 0 HG2 ARG A 59 12.580 6.487 1.388 1.00 0.00 H new ATOM 0 HG3 ARG A 59 12.987 7.026 -0.230 1.00 0.00 H new ATOM 0 HD2 ARG A 59 10.771 6.616 -1.039 1.00 0.00 H new ATOM 0 HD3 ARG A 59 10.340 5.698 0.390 1.00 0.00 H new ATOM 0 HE ARG A 59 10.576 8.037 1.574 1.00 0.00 H new ATOM 0 HH11 ARG A 59 9.837 7.824 -1.867 1.00 0.00 H new ATOM 0 HH12 ARG A 59 8.562 9.046 -1.824 1.00 0.00 H new ATOM 0 HH21 ARG A 59 8.739 9.533 1.655 1.00 0.00 H new ATOM 0 HH22 ARG A 59 7.947 10.002 0.147 1.00 0.00 H new ATOM 930 N VAL A 60 13.181 2.351 -1.264 1.00 0.00 N ATOM 931 CA VAL A 60 13.165 0.960 -1.001 1.00 0.00 C ATOM 932 C VAL A 60 14.195 0.099 -1.603 1.00 0.00 C ATOM 933 O VAL A 60 14.746 -0.742 -0.962 1.00 0.00 O ATOM 934 CB VAL A 60 11.870 0.434 -1.523 1.00 0.00 C ATOM 935 CG1 VAL A 60 10.859 1.067 -0.921 1.00 0.00 C ATOM 936 CG2 VAL A 60 11.686 0.669 -2.923 1.00 0.00 C ATOM 0 H VAL A 60 12.356 2.678 -1.767 1.00 0.00 H new ATOM 0 HA VAL A 60 13.343 0.909 0.073 1.00 0.00 H new ATOM 0 HB VAL A 60 11.889 -0.639 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL A 60 9.912 0.684 -1.301 1.00 0.00 H new ATOM 0 HG12 VAL A 60 10.913 0.898 0.155 1.00 0.00 H new ATOM 0 HG13 VAL A 60 10.926 2.136 -1.125 1.00 0.00 H new ATOM 0 HG21 VAL A 60 10.725 0.262 -3.237 1.00 0.00 H new ATOM 0 HG22 VAL A 60 11.707 1.741 -3.118 1.00 0.00 H new ATOM 0 HG23 VAL A 60 12.486 0.183 -3.482 1.00 0.00 H new ATOM 946 N ALA A 61 14.354 0.312 -2.831 1.00 0.00 N ATOM 947 CA ALA A 61 14.764 -0.651 -3.705 1.00 0.00 C ATOM 948 C ALA A 61 15.873 -1.563 -3.356 1.00 0.00 C ATOM 949 O ALA A 61 15.723 -2.549 -2.633 1.00 0.00 O ATOM 950 CB ALA A 61 14.779 -0.122 -5.050 1.00 0.00 C ATOM 0 H ALA A 61 14.189 1.219 -3.267 1.00 0.00 H new ATOM 0 HA ALA A 61 13.992 -1.415 -3.615 1.00 0.00 H new ATOM 0 HB1 ALA A 61 15.108 -0.897 -5.742 1.00 0.00 H new ATOM 0 HB2 ALA A 61 13.776 0.207 -5.323 1.00 0.00 H new ATOM 0 HB3 ALA A 61 15.465 0.724 -5.101 1.00 0.00 H new ATOM 956 N GLY A 62 16.922 -1.235 -3.754 1.00 0.00 N ATOM 957 CA GLY A 62 17.997 -2.166 -3.710 1.00 0.00 C ATOM 958 C GLY A 62 18.805 -2.089 -2.481 1.00 0.00 C ATOM 959 O GLY A 62 20.024 -2.185 -2.478 1.00 0.00 O ATOM 0 H GLY A 62 17.146 -0.318 -4.141 1.00 0.00 H new ATOM 0 HA2 GLY A 62 17.595 -3.175 -3.806 1.00 0.00 H new ATOM 0 HA3 GLY A 62 18.645 -1.998 -4.570 1.00 0.00 H new ATOM 963 N GLU A 63 18.086 -1.894 -1.466 1.00 0.00 N ATOM 964 CA GLU A 63 18.528 -1.903 -0.138 1.00 0.00 C ATOM 965 C GLU A 63 18.986 -3.284 0.243 1.00 0.00 C ATOM 966 O GLU A 63 20.116 -3.483 0.755 1.00 0.00 O ATOM 967 CB GLU A 63 17.402 -1.518 0.759 1.00 0.00 C ATOM 968 CG GLU A 63 17.059 -0.049 0.734 1.00 0.00 C ATOM 969 CD GLU A 63 16.377 0.425 1.987 1.00 0.00 C ATOM 970 OE1 GLU A 63 16.978 1.250 2.694 1.00 0.00 O ATOM 971 OE2 GLU A 63 15.280 -0.040 2.331 1.00 0.00 O ATOM 0 H GLU A 63 17.086 -1.707 -1.543 1.00 0.00 H new ATOM 0 HA GLU A 63 19.354 -1.199 -0.037 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.518 -2.090 0.478 1.00 0.00 H new ATOM 0 HB3 GLU A 63 17.654 -1.802 1.781 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.972 0.527 0.586 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.413 0.151 -0.121 1.00 0.00 H new ATOM 978 N MET A 64 18.090 -4.228 0.077 1.00 0.00 N ATOM 979 CA MET A 64 18.417 -5.570 0.295 1.00 0.00 C ATOM 980 C MET A 64 18.598 -6.222 -0.967 1.00 0.00 C ATOM 981 O MET A 64 19.642 -6.780 -1.274 1.00 0.00 O ATOM 982 CB MET A 64 17.400 -6.406 1.047 1.00 0.00 C ATOM 983 CG MET A 64 16.853 -5.923 2.336 1.00 0.00 C ATOM 984 SD MET A 64 15.930 -4.406 2.177 1.00 0.00 S ATOM 985 CE MET A 64 14.683 -4.965 1.036 1.00 0.00 C ATOM 0 H MET A 64 17.126 -4.063 -0.212 1.00 0.00 H new ATOM 0 HA MET A 64 19.311 -5.516 0.917 1.00 0.00 H new ATOM 0 HB2 MET A 64 16.556 -6.569 0.377 1.00 0.00 H new ATOM 0 HB3 MET A 64 17.854 -7.380 1.232 1.00 0.00 H new ATOM 0 HG2 MET A 64 16.208 -6.692 2.761 1.00 0.00 H new ATOM 0 HG3 MET A 64 17.673 -5.771 3.038 1.00 0.00 H new ATOM 0 HE1 MET A 64 14.077 -4.118 0.716 1.00 0.00 H new ATOM 0 HE2 MET A 64 15.161 -5.418 0.168 1.00 0.00 H new ATOM 0 HE3 MET A 64 14.046 -5.702 1.525 1.00 0.00 H new ATOM 995 N ASN A 65 17.550 -6.143 -1.703 1.00 0.00 N ATOM 996 CA ASN A 65 17.391 -6.986 -2.832 1.00 0.00 C ATOM 997 C ASN A 65 16.294 -6.645 -3.888 1.00 0.00 C ATOM 998 O ASN A 65 15.715 -7.548 -4.460 1.00 0.00 O ATOM 999 CB ASN A 65 17.070 -8.297 -2.257 1.00 0.00 C ATOM 1000 CG ASN A 65 15.977 -8.256 -1.312 1.00 0.00 C ATOM 1001 OD1 ASN A 65 15.097 -7.498 -1.434 1.00 0.00 O ATOM 1002 ND2 ASN A 65 16.140 -9.027 -0.289 1.00 0.00 N ATOM 0 H ASN A 65 16.780 -5.494 -1.541 1.00 0.00 H new ATOM 0 HA ASN A 65 18.309 -6.895 -3.412 1.00 0.00 H new ATOM 0 HB2 ASN A 65 16.819 -8.987 -3.062 1.00 0.00 H new ATOM 0 HB3 ASN A 65 17.955 -8.695 -1.761 1.00 0.00 H new ATOM 0 HD21 ASN A 65 15.474 -8.998 0.483 1.00 0.00 H new ATOM 0 HD22 ASN A 65 16.935 -9.665 -0.253 1.00 0.00 H new ATOM 1009 N LEU A 66 16.070 -5.432 -4.153 1.00 0.00 N ATOM 1010 CA LEU A 66 15.023 -4.983 -5.095 1.00 0.00 C ATOM 1011 C LEU A 66 15.562 -4.278 -6.316 1.00 0.00 C ATOM 1012 O LEU A 66 16.202 -3.227 -6.255 1.00 0.00 O ATOM 1013 CB LEU A 66 14.153 -4.017 -4.391 1.00 0.00 C ATOM 1014 CG LEU A 66 13.180 -4.357 -3.347 1.00 0.00 C ATOM 1015 CD1 LEU A 66 12.445 -3.129 -2.988 1.00 0.00 C ATOM 1016 CD2 LEU A 66 12.322 -5.446 -3.802 1.00 0.00 C ATOM 0 H LEU A 66 16.597 -4.666 -3.735 1.00 0.00 H new ATOM 0 HA LEU A 66 14.500 -5.879 -5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 66 14.823 -3.282 -3.945 1.00 0.00 H new ATOM 0 HB3 LEU A 66 13.588 -3.503 -5.169 1.00 0.00 H new ATOM 0 HG LEU A 66 13.669 -4.724 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 66 11.714 -3.356 -2.212 1.00 0.00 H new ATOM 0 HD12 LEU A 66 13.146 -2.380 -2.618 1.00 0.00 H new ATOM 0 HD13 LEU A 66 11.931 -2.742 -3.868 1.00 0.00 H new ATOM 0 HD21 LEU A 66 11.602 -5.693 -3.021 1.00 0.00 H new ATOM 0 HD22 LEU A 66 11.790 -5.138 -4.702 1.00 0.00 H new ATOM 0 HD23 LEU A 66 12.932 -6.322 -4.023 1.00 0.00 H new ATOM 1028 N SER A 67 15.187 -4.819 -7.393 1.00 0.00 N ATOM 1029 CA SER A 67 15.429 -4.316 -8.704 1.00 0.00 C ATOM 1030 C SER A 67 14.156 -3.521 -9.201 1.00 0.00 C ATOM 1031 O SER A 67 13.880 -3.446 -10.391 1.00 0.00 O ATOM 1032 CB SER A 67 15.691 -5.558 -9.553 1.00 0.00 C ATOM 1033 OG SER A 67 15.819 -5.278 -10.933 1.00 0.00 O ATOM 0 H SER A 67 14.661 -5.693 -7.402 1.00 0.00 H new ATOM 0 HA SER A 67 16.269 -3.623 -8.756 1.00 0.00 H new ATOM 0 HB2 SER A 67 16.602 -6.043 -9.202 1.00 0.00 H new ATOM 0 HB3 SER A 67 14.876 -6.267 -9.408 1.00 0.00 H new ATOM 0 HG SER A 67 15.218 -4.543 -11.175 1.00 0.00 H new ATOM 1039 N LYS A 68 13.453 -2.855 -8.244 1.00 0.00 N ATOM 1040 CA LYS A 68 12.148 -2.111 -8.426 1.00 0.00 C ATOM 1041 C LYS A 68 11.033 -2.967 -8.962 1.00 0.00 C ATOM 1042 O LYS A 68 10.012 -3.024 -8.396 1.00 0.00 O ATOM 1043 CB LYS A 68 12.182 -0.799 -9.265 1.00 0.00 C ATOM 1044 CG LYS A 68 13.494 -0.141 -9.525 1.00 0.00 C ATOM 1045 CD LYS A 68 14.138 0.055 -8.247 1.00 0.00 C ATOM 1046 CE LYS A 68 15.659 0.074 -8.360 1.00 0.00 C ATOM 1047 NZ LYS A 68 16.143 1.211 -9.201 1.00 0.00 N ATOM 0 H LYS A 68 13.783 -2.812 -7.280 1.00 0.00 H new ATOM 0 HA LYS A 68 11.957 -1.820 -7.393 1.00 0.00 H new ATOM 0 HB2 LYS A 68 11.725 -1.014 -10.231 1.00 0.00 H new ATOM 0 HB3 LYS A 68 11.543 -0.072 -8.765 1.00 0.00 H new ATOM 0 HG2 LYS A 68 14.112 -0.760 -10.176 1.00 0.00 H new ATOM 0 HG3 LYS A 68 13.351 0.813 -10.034 1.00 0.00 H new ATOM 0 HD2 LYS A 68 13.797 0.994 -7.811 1.00 0.00 H new ATOM 0 HD3 LYS A 68 13.837 -0.741 -7.565 1.00 0.00 H new ATOM 0 HE2 LYS A 68 16.096 0.148 -7.364 1.00 0.00 H new ATOM 0 HE3 LYS A 68 16.003 -0.867 -8.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 17.181 1.187 -9.252 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 15.747 1.127 -10.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 15.838 2.111 -8.778 1.00 0.00 H new ATOM 1061 N THR A 69 11.226 -3.681 -9.996 1.00 0.00 N ATOM 1062 CA THR A 69 10.151 -4.317 -10.629 1.00 0.00 C ATOM 1063 C THR A 69 9.688 -5.511 -9.850 1.00 0.00 C ATOM 1064 O THR A 69 8.533 -5.913 -9.888 1.00 0.00 O ATOM 1065 CB THR A 69 10.555 -4.721 -11.967 1.00 0.00 C ATOM 1066 OG1 THR A 69 11.640 -5.664 -11.857 1.00 0.00 O ATOM 1067 CG2 THR A 69 11.013 -3.541 -12.746 1.00 0.00 C ATOM 0 H THR A 69 12.136 -3.841 -10.428 1.00 0.00 H new ATOM 0 HA THR A 69 9.318 -3.616 -10.688 1.00 0.00 H new ATOM 0 HB THR A 69 9.706 -5.174 -12.479 1.00 0.00 H new ATOM 0 HG1 THR A 69 11.921 -5.946 -12.753 1.00 0.00 H new ATOM 0 HG21 THR A 69 11.312 -3.858 -13.745 1.00 0.00 H new ATOM 0 HG22 THR A 69 10.201 -2.818 -12.823 1.00 0.00 H new ATOM 0 HG23 THR A 69 11.862 -3.080 -12.242 1.00 0.00 H new ATOM 1075 N GLN A 70 10.574 -5.997 -9.098 1.00 0.00 N ATOM 1076 CA GLN A 70 10.307 -7.078 -8.207 1.00 0.00 C ATOM 1077 C GLN A 70 9.638 -6.528 -6.916 1.00 0.00 C ATOM 1078 O GLN A 70 9.372 -7.223 -5.967 1.00 0.00 O ATOM 1079 CB GLN A 70 11.586 -7.754 -7.899 1.00 0.00 C ATOM 1080 CG GLN A 70 12.506 -6.880 -7.282 1.00 0.00 C ATOM 1081 CD GLN A 70 13.530 -7.589 -6.644 1.00 0.00 C ATOM 1082 OE1 GLN A 70 14.571 -7.849 -7.194 1.00 0.00 O ATOM 1083 NE2 GLN A 70 13.223 -7.945 -5.468 1.00 0.00 N ATOM 0 H GLN A 70 11.536 -5.660 -9.068 1.00 0.00 H new ATOM 0 HA GLN A 70 9.625 -7.797 -8.661 1.00 0.00 H new ATOM 0 HB2 GLN A 70 11.399 -8.605 -7.245 1.00 0.00 H new ATOM 0 HB3 GLN A 70 12.019 -8.148 -8.818 1.00 0.00 H new ATOM 0 HG2 GLN A 70 12.934 -6.212 -8.029 1.00 0.00 H new ATOM 0 HG3 GLN A 70 11.986 -6.255 -6.556 1.00 0.00 H new ATOM 0 HE21 GLN A 70 12.319 -7.683 -5.075 1.00 0.00 H new ATOM 0 HE22 GLN A 70 13.880 -8.494 -4.913 1.00 0.00 H new ATOM 1092 N LEU A 71 9.473 -5.256 -6.906 1.00 0.00 N ATOM 1093 CA LEU A 71 8.818 -4.529 -5.874 1.00 0.00 C ATOM 1094 C LEU A 71 7.496 -4.032 -6.424 1.00 0.00 C ATOM 1095 O LEU A 71 6.511 -4.035 -5.743 1.00 0.00 O ATOM 1096 CB LEU A 71 9.758 -3.363 -5.531 1.00 0.00 C ATOM 1097 CG LEU A 71 9.582 -2.529 -4.327 1.00 0.00 C ATOM 1098 CD1 LEU A 71 9.778 -1.089 -4.617 1.00 0.00 C ATOM 1099 CD2 LEU A 71 8.356 -2.767 -3.675 1.00 0.00 C ATOM 0 H LEU A 71 9.810 -4.657 -7.660 1.00 0.00 H new ATOM 0 HA LEU A 71 8.612 -5.122 -4.983 1.00 0.00 H new ATOM 0 HB2 LEU A 71 10.764 -3.779 -5.477 1.00 0.00 H new ATOM 0 HB3 LEU A 71 9.739 -2.686 -6.385 1.00 0.00 H new ATOM 0 HG LEU A 71 10.366 -2.830 -3.632 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.639 -0.512 -3.703 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.787 -0.929 -4.998 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.053 -0.766 -5.364 1.00 0.00 H new ATOM 0 HD21 LEU A 71 8.281 -2.126 -2.797 1.00 0.00 H new ATOM 0 HD22 LEU A 71 7.533 -2.548 -4.356 1.00 0.00 H new ATOM 0 HD23 LEU A 71 8.304 -3.811 -3.368 1.00 0.00 H new ATOM 1111 N ARG A 72 7.463 -3.651 -7.673 1.00 0.00 N ATOM 1112 CA ARG A 72 6.226 -3.098 -8.238 1.00 0.00 C ATOM 1113 C ARG A 72 5.180 -4.157 -8.276 1.00 0.00 C ATOM 1114 O ARG A 72 4.015 -3.911 -8.266 1.00 0.00 O ATOM 1115 CB ARG A 72 6.492 -2.508 -9.649 1.00 0.00 C ATOM 1116 CG ARG A 72 7.009 -3.512 -10.610 1.00 0.00 C ATOM 1117 CD ARG A 72 5.932 -4.356 -11.246 1.00 0.00 C ATOM 1118 NE ARG A 72 5.196 -3.667 -12.318 1.00 0.00 N ATOM 1119 CZ ARG A 72 4.371 -4.289 -13.198 1.00 0.00 C ATOM 1120 NH1 ARG A 72 4.132 -5.608 -13.087 1.00 0.00 N ATOM 1121 NH2 ARG A 72 3.798 -3.591 -14.189 1.00 0.00 N ATOM 0 H ARG A 72 8.250 -3.704 -8.319 1.00 0.00 H new ATOM 0 HA ARG A 72 5.868 -2.285 -7.607 1.00 0.00 H new ATOM 0 HB2 ARG A 72 5.567 -2.083 -10.039 1.00 0.00 H new ATOM 0 HB3 ARG A 72 7.208 -1.691 -9.566 1.00 0.00 H new ATOM 0 HG2 ARG A 72 7.566 -2.998 -11.394 1.00 0.00 H new ATOM 0 HG3 ARG A 72 7.713 -4.165 -10.095 1.00 0.00 H new ATOM 0 HD2 ARG A 72 6.384 -5.261 -11.652 1.00 0.00 H new ATOM 0 HD3 ARG A 72 5.227 -4.669 -10.476 1.00 0.00 H new ATOM 0 HE ARG A 72 5.313 -2.658 -12.405 1.00 0.00 H new ATOM 0 HH11 ARG A 72 4.571 -6.145 -12.339 1.00 0.00 H new ATOM 0 HH12 ARG A 72 3.511 -6.071 -13.751 1.00 0.00 H new ATOM 0 HH21 ARG A 72 3.982 -2.592 -14.282 1.00 0.00 H new ATOM 0 HH22 ARG A 72 3.178 -4.059 -14.850 1.00 0.00 H new ATOM 1135 N SER A 73 5.659 -5.320 -8.305 1.00 0.00 N ATOM 1136 CA SER A 73 4.923 -6.470 -8.434 1.00 0.00 C ATOM 1137 C SER A 73 4.376 -6.883 -7.128 1.00 0.00 C ATOM 1138 O SER A 73 3.370 -7.541 -7.034 1.00 0.00 O ATOM 1139 CB SER A 73 5.842 -7.395 -9.039 1.00 0.00 C ATOM 1140 OG SER A 73 5.340 -8.686 -9.248 1.00 0.00 O ATOM 0 H SER A 73 6.661 -5.498 -8.232 1.00 0.00 H new ATOM 0 HA SER A 73 4.031 -6.376 -9.053 1.00 0.00 H new ATOM 0 HB2 SER A 73 6.163 -6.988 -9.998 1.00 0.00 H new ATOM 0 HB3 SER A 73 6.729 -7.465 -8.409 1.00 0.00 H new ATOM 0 HG SER A 73 5.662 -9.281 -8.539 1.00 0.00 H new ATOM 1146 N ALA A 74 4.971 -6.343 -6.137 1.00 0.00 N ATOM 1147 CA ALA A 74 4.527 -6.521 -4.767 1.00 0.00 C ATOM 1148 C ALA A 74 3.402 -5.598 -4.537 1.00 0.00 C ATOM 1149 O ALA A 74 2.462 -5.845 -3.784 1.00 0.00 O ATOM 1150 CB ALA A 74 5.666 -6.215 -3.844 1.00 0.00 C ATOM 0 H ALA A 74 5.796 -5.751 -6.231 1.00 0.00 H new ATOM 0 HA ALA A 74 4.202 -7.545 -4.583 1.00 0.00 H new ATOM 0 HB1 ALA A 74 5.343 -6.346 -2.811 1.00 0.00 H new ATOM 0 HB2 ALA A 74 6.495 -6.891 -4.053 1.00 0.00 H new ATOM 0 HB3 ALA A 74 5.990 -5.185 -3.995 1.00 0.00 H new ATOM 1156 N LEU A 75 3.432 -4.649 -5.321 1.00 0.00 N ATOM 1157 CA LEU A 75 2.672 -3.528 -5.209 1.00 0.00 C ATOM 1158 C LEU A 75 1.510 -3.508 -6.181 1.00 0.00 C ATOM 1159 O LEU A 75 0.853 -2.498 -6.357 1.00 0.00 O ATOM 1160 CB LEU A 75 3.699 -2.536 -5.387 1.00 0.00 C ATOM 1161 CG LEU A 75 4.049 -1.729 -4.234 1.00 0.00 C ATOM 1162 CD1 LEU A 75 5.397 -1.400 -4.382 1.00 0.00 C ATOM 1163 CD2 LEU A 75 3.337 -0.451 -4.190 1.00 0.00 C ATOM 0 H LEU A 75 4.046 -4.633 -6.135 1.00 0.00 H new ATOM 0 HA LEU A 75 2.118 -3.394 -4.280 1.00 0.00 H new ATOM 0 HB2 LEU A 75 4.601 -3.042 -5.731 1.00 0.00 H new ATOM 0 HB3 LEU A 75 3.385 -1.865 -6.186 1.00 0.00 H new ATOM 0 HG LEU A 75 3.804 -2.298 -3.337 1.00 0.00 H new ATOM 0 HD11 LEU A 75 5.717 -0.789 -3.538 1.00 0.00 H new ATOM 0 HD12 LEU A 75 5.993 -2.312 -4.416 1.00 0.00 H new ATOM 0 HD13 LEU A 75 5.536 -0.841 -5.307 1.00 0.00 H new ATOM 0 HD21 LEU A 75 3.643 0.106 -3.304 1.00 0.00 H new ATOM 0 HD22 LEU A 75 3.574 0.128 -5.082 1.00 0.00 H new ATOM 0 HD23 LEU A 75 2.263 -0.634 -4.151 1.00 0.00 H new ATOM 1175 N ARG A 76 1.359 -4.611 -6.889 1.00 0.00 N ATOM 1176 CA ARG A 76 0.140 -4.993 -7.589 1.00 0.00 C ATOM 1177 C ARG A 76 -0.402 -6.227 -6.882 1.00 0.00 C ATOM 1178 O ARG A 76 -1.569 -6.548 -6.954 1.00 0.00 O ATOM 1179 CB ARG A 76 0.336 -5.352 -9.073 1.00 0.00 C ATOM 1180 CG ARG A 76 0.410 -4.189 -10.058 1.00 0.00 C ATOM 1181 CD ARG A 76 1.611 -3.355 -9.800 1.00 0.00 C ATOM 1182 NE ARG A 76 1.401 -2.214 -8.918 1.00 0.00 N ATOM 1183 CZ ARG A 76 2.093 -1.070 -8.924 1.00 0.00 C ATOM 1184 NH1 ARG A 76 2.738 -0.671 -10.023 1.00 0.00 N ATOM 1185 NH2 ARG A 76 2.079 -0.300 -7.837 1.00 0.00 N ATOM 0 H ARG A 76 2.109 -5.294 -6.999 1.00 0.00 H new ATOM 0 HA ARG A 76 -0.529 -4.133 -7.568 1.00 0.00 H new ATOM 0 HB2 ARG A 76 1.254 -5.933 -9.164 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -0.484 -6.003 -9.376 1.00 0.00 H new ATOM 0 HG2 ARG A 76 0.440 -4.572 -11.078 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -0.488 -3.577 -9.973 1.00 0.00 H new ATOM 0 HD2 ARG A 76 2.387 -3.988 -9.369 1.00 0.00 H new ATOM 0 HD3 ARG A 76 1.991 -2.990 -10.754 1.00 0.00 H new ATOM 0 HE ARG A 76 0.653 -2.296 -8.229 1.00 0.00 H new ATOM 0 HH11 ARG A 76 2.706 -1.241 -10.868 1.00 0.00 H new ATOM 0 HH12 ARG A 76 3.263 0.203 -10.017 1.00 0.00 H new ATOM 0 HH21 ARG A 76 1.546 -0.586 -7.016 1.00 0.00 H new ATOM 0 HH22 ARG A 76 2.602 0.576 -7.826 1.00 0.00 H new ATOM 1199 N LEU A 77 0.497 -6.882 -6.168 1.00 0.00 N ATOM 1200 CA LEU A 77 0.242 -8.126 -5.471 1.00 0.00 C ATOM 1201 C LEU A 77 -0.640 -7.908 -4.311 1.00 0.00 C ATOM 1202 O LEU A 77 -1.797 -8.297 -4.296 1.00 0.00 O ATOM 1203 CB LEU A 77 1.547 -8.650 -4.929 1.00 0.00 C ATOM 1204 CG LEU A 77 1.560 -9.940 -4.244 1.00 0.00 C ATOM 1205 CD1 LEU A 77 2.694 -10.694 -4.759 1.00 0.00 C ATOM 1206 CD2 LEU A 77 1.876 -9.661 -2.853 1.00 0.00 C ATOM 0 H LEU A 77 1.455 -6.550 -6.055 1.00 0.00 H new ATOM 0 HA LEU A 77 -0.224 -8.819 -6.171 1.00 0.00 H new ATOM 0 HB2 LEU A 77 2.248 -8.712 -5.761 1.00 0.00 H new ATOM 0 HB3 LEU A 77 1.939 -7.905 -4.236 1.00 0.00 H new ATOM 0 HG LEU A 77 0.617 -10.472 -4.372 1.00 0.00 H new ATOM 0 HD11 LEU A 77 2.737 -11.667 -4.269 1.00 0.00 H new ATOM 0 HD12 LEU A 77 2.580 -10.834 -5.834 1.00 0.00 H new ATOM 0 HD13 LEU A 77 3.615 -10.147 -4.560 1.00 0.00 H new ATOM 0 HD21 LEU A 77 1.899 -10.595 -2.291 1.00 0.00 H new ATOM 0 HD22 LEU A 77 2.850 -9.176 -2.791 1.00 0.00 H new ATOM 0 HD23 LEU A 77 1.116 -9.003 -2.432 1.00 0.00 H new ATOM 1218 N TYR A 78 -0.090 -7.214 -3.343 1.00 0.00 N ATOM 1219 CA TYR A 78 -0.747 -7.053 -2.106 1.00 0.00 C ATOM 1220 C TYR A 78 -1.808 -5.989 -2.275 1.00 0.00 C ATOM 1221 O TYR A 78 -2.646 -5.786 -1.456 1.00 0.00 O ATOM 1222 CB TYR A 78 0.270 -6.778 -0.953 1.00 0.00 C ATOM 1223 CG TYR A 78 0.410 -5.392 -0.518 1.00 0.00 C ATOM 1224 CD1 TYR A 78 0.634 -4.411 -1.409 1.00 0.00 C ATOM 1225 CD2 TYR A 78 0.265 -5.076 0.788 1.00 0.00 C ATOM 1226 CE1 TYR A 78 0.686 -3.142 -1.034 1.00 0.00 C ATOM 1227 CE2 TYR A 78 0.340 -3.799 1.205 1.00 0.00 C ATOM 1228 CZ TYR A 78 0.540 -2.821 0.299 1.00 0.00 C ATOM 1229 OH TYR A 78 0.529 -1.519 0.702 1.00 0.00 O ATOM 0 H TYR A 78 0.819 -6.756 -3.408 1.00 0.00 H new ATOM 0 HA TYR A 78 -1.247 -7.974 -1.804 1.00 0.00 H new ATOM 0 HB2 TYR A 78 -0.023 -7.377 -0.091 1.00 0.00 H new ATOM 0 HB3 TYR A 78 1.249 -7.135 -1.271 1.00 0.00 H new ATOM 0 HD1 TYR A 78 0.774 -4.662 -2.450 1.00 0.00 H new ATOM 0 HD2 TYR A 78 0.086 -5.861 1.508 1.00 0.00 H new ATOM 0 HE1 TYR A 78 0.842 -2.364 -1.767 1.00 0.00 H new ATOM 0 HE2 TYR A 78 0.241 -3.560 2.254 1.00 0.00 H new ATOM 0 HH TYR A 78 1.450 -1.199 0.798 1.00 0.00 H new ATOM 1239 N THR A 79 -1.745 -5.318 -3.404 1.00 0.00 N ATOM 1240 CA THR A 79 -2.728 -4.279 -3.708 1.00 0.00 C ATOM 1241 C THR A 79 -3.973 -4.878 -4.327 1.00 0.00 C ATOM 1242 O THR A 79 -4.958 -4.202 -4.562 1.00 0.00 O ATOM 1243 CB THR A 79 -2.147 -3.224 -4.602 1.00 0.00 C ATOM 1244 OG1 THR A 79 -1.850 -3.766 -5.871 1.00 0.00 O ATOM 1245 CG2 THR A 79 -0.900 -2.764 -3.967 1.00 0.00 C ATOM 0 H THR A 79 -1.037 -5.463 -4.124 1.00 0.00 H new ATOM 0 HA THR A 79 -3.008 -3.804 -2.768 1.00 0.00 H new ATOM 0 HB THR A 79 -2.854 -2.406 -4.737 1.00 0.00 H new ATOM 0 HG1 THR A 79 -2.579 -3.561 -6.493 1.00 0.00 H new ATOM 0 HG21 THR A 79 -0.440 -1.993 -4.585 1.00 0.00 H new ATOM 0 HG22 THR A 79 -1.123 -2.355 -2.982 1.00 0.00 H new ATOM 0 HG23 THR A 79 -0.213 -3.604 -3.864 1.00 0.00 H new ATOM 1253 N SER A 80 -3.893 -6.151 -4.615 1.00 0.00 N ATOM 1254 CA SER A 80 -5.032 -6.906 -5.038 1.00 0.00 C ATOM 1255 C SER A 80 -5.719 -7.461 -3.798 1.00 0.00 C ATOM 1256 O SER A 80 -6.710 -8.184 -3.884 1.00 0.00 O ATOM 1257 CB SER A 80 -4.629 -8.026 -6.003 1.00 0.00 C ATOM 1258 OG SER A 80 -4.044 -7.491 -7.184 1.00 0.00 O ATOM 0 H SER A 80 -3.029 -6.691 -4.561 1.00 0.00 H new ATOM 0 HA SER A 80 -5.722 -6.262 -5.583 1.00 0.00 H new ATOM 0 HB2 SER A 80 -3.923 -8.697 -5.514 1.00 0.00 H new ATOM 0 HB3 SER A 80 -5.505 -8.620 -6.263 1.00 0.00 H new ATOM 0 HG SER A 80 -3.072 -7.440 -7.073 1.00 0.00 H new ATOM 1264 N SER A 81 -5.169 -7.118 -2.622 1.00 0.00 N ATOM 1265 CA SER A 81 -5.800 -7.449 -1.411 1.00 0.00 C ATOM 1266 C SER A 81 -6.958 -6.546 -1.237 1.00 0.00 C ATOM 1267 O SER A 81 -6.986 -5.456 -1.762 1.00 0.00 O ATOM 1268 CB SER A 81 -4.823 -7.310 -0.260 1.00 0.00 C ATOM 1269 OG SER A 81 -5.426 -6.888 0.952 1.00 0.00 O ATOM 0 H SER A 81 -4.289 -6.613 -2.523 1.00 0.00 H new ATOM 0 HA SER A 81 -6.142 -8.484 -1.428 1.00 0.00 H new ATOM 0 HB2 SER A 81 -4.330 -8.268 -0.096 1.00 0.00 H new ATOM 0 HB3 SER A 81 -4.048 -6.596 -0.538 1.00 0.00 H new ATOM 0 HG SER A 81 -6.212 -7.443 1.137 1.00 0.00 H new ATOM 1275 N TRP A 82 -7.856 -6.981 -0.478 1.00 0.00 N ATOM 1276 CA TRP A 82 -9.071 -6.260 -0.219 1.00 0.00 C ATOM 1277 C TRP A 82 -8.792 -5.330 0.828 1.00 0.00 C ATOM 1278 O TRP A 82 -9.123 -4.185 0.723 1.00 0.00 O ATOM 1279 CB TRP A 82 -10.174 -7.174 0.225 1.00 0.00 C ATOM 1280 CG TRP A 82 -11.473 -6.711 -0.092 1.00 0.00 C ATOM 1281 CD1 TRP A 82 -11.811 -6.011 -1.142 1.00 0.00 C ATOM 1282 CD2 TRP A 82 -12.619 -6.956 0.600 1.00 0.00 C ATOM 1283 NE1 TRP A 82 -13.103 -5.769 -1.152 1.00 0.00 N ATOM 1284 CE2 TRP A 82 -13.637 -6.343 -0.091 1.00 0.00 C ATOM 1285 CE3 TRP A 82 -12.898 -7.618 1.737 1.00 0.00 C ATOM 1286 CZ2 TRP A 82 -14.897 -6.364 0.319 1.00 0.00 C ATOM 1287 CZ3 TRP A 82 -14.165 -7.637 2.137 1.00 0.00 C ATOM 1288 CH2 TRP A 82 -15.156 -7.000 1.425 1.00 0.00 C ATOM 0 H TRP A 82 -7.794 -7.874 0.011 1.00 0.00 H new ATOM 0 HA TRP A 82 -9.400 -5.765 -1.133 1.00 0.00 H new ATOM 0 HB2 TRP A 82 -10.027 -8.152 -0.233 1.00 0.00 H new ATOM 0 HB3 TRP A 82 -10.103 -7.314 1.304 1.00 0.00 H new ATOM 0 HD1 TRP A 82 -11.120 -5.676 -1.901 1.00 0.00 H new ATOM 0 HE1 TRP A 82 -13.606 -5.231 -1.858 1.00 0.00 H new ATOM 0 HE3 TRP A 82 -12.123 -8.114 2.302 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 -15.678 -5.873 -0.242 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 -14.424 -8.165 3.043 1.00 0.00 H new ATOM 0 HH2 TRP A 82 -16.171 -7.028 1.792 1.00 0.00 H new ATOM 1299 N ARG A 83 -8.163 -5.831 1.829 1.00 0.00 N ATOM 1300 CA ARG A 83 -7.740 -5.054 2.980 1.00 0.00 C ATOM 1301 C ARG A 83 -6.880 -3.867 2.601 1.00 0.00 C ATOM 1302 O ARG A 83 -6.761 -2.886 3.347 1.00 0.00 O ATOM 1303 CB ARG A 83 -7.192 -5.934 4.082 1.00 0.00 C ATOM 1304 CG ARG A 83 -6.090 -5.316 4.915 1.00 0.00 C ATOM 1305 CD ARG A 83 -5.679 -6.147 6.139 1.00 0.00 C ATOM 1306 NE ARG A 83 -4.421 -5.603 6.718 1.00 0.00 N ATOM 1307 CZ ARG A 83 -3.870 -5.840 7.925 1.00 0.00 C ATOM 1308 NH1 ARG A 83 -4.501 -6.590 8.830 1.00 0.00 N ATOM 1309 NH2 ARG A 83 -2.661 -5.305 8.205 1.00 0.00 N ATOM 0 H ARG A 83 -7.913 -6.818 1.890 1.00 0.00 H new ATOM 0 HA ARG A 83 -8.626 -4.593 3.417 1.00 0.00 H new ATOM 0 HB2 ARG A 83 -8.012 -6.213 4.744 1.00 0.00 H new ATOM 0 HB3 ARG A 83 -6.815 -6.854 3.636 1.00 0.00 H new ATOM 0 HG2 ARG A 83 -5.215 -5.165 4.283 1.00 0.00 H new ATOM 0 HG3 ARG A 83 -6.414 -4.331 5.252 1.00 0.00 H new ATOM 0 HD2 ARG A 83 -6.472 -6.128 6.886 1.00 0.00 H new ATOM 0 HD3 ARG A 83 -5.537 -7.189 5.852 1.00 0.00 H new ATOM 0 HE ARG A 83 -3.903 -4.961 6.118 1.00 0.00 H new ATOM 0 HH11 ARG A 83 -5.413 -6.993 8.613 1.00 0.00 H new ATOM 0 HH12 ARG A 83 -4.072 -6.761 9.739 1.00 0.00 H new ATOM 0 HH21 ARG A 83 -2.182 -4.734 7.509 1.00 0.00 H new ATOM 0 HH22 ARG A 83 -2.227 -5.473 9.113 1.00 0.00 H new ATOM 1323 N TYR A 84 -6.324 -3.970 1.447 1.00 0.00 N ATOM 1324 CA TYR A 84 -5.719 -2.875 0.785 1.00 0.00 C ATOM 1325 C TYR A 84 -6.799 -1.802 0.568 1.00 0.00 C ATOM 1326 O TYR A 84 -6.815 -0.792 1.232 1.00 0.00 O ATOM 1327 CB TYR A 84 -5.156 -3.380 -0.540 1.00 0.00 C ATOM 1328 CG TYR A 84 -4.761 -2.324 -1.540 1.00 0.00 C ATOM 1329 CD1 TYR A 84 -3.514 -1.652 -1.569 1.00 0.00 C ATOM 1330 CD2 TYR A 84 -5.677 -2.011 -2.494 1.00 0.00 C ATOM 1331 CE1 TYR A 84 -3.282 -0.732 -2.540 1.00 0.00 C ATOM 1332 CE2 TYR A 84 -5.433 -1.088 -3.456 1.00 0.00 C ATOM 1333 CZ TYR A 84 -4.231 -0.447 -3.483 1.00 0.00 C ATOM 1334 OH TYR A 84 -3.962 0.480 -4.467 1.00 0.00 O ATOM 0 H TYR A 84 -6.277 -4.844 0.924 1.00 0.00 H new ATOM 0 HA TYR A 84 -4.905 -2.440 1.365 1.00 0.00 H new ATOM 0 HB2 TYR A 84 -4.282 -3.996 -0.328 1.00 0.00 H new ATOM 0 HB3 TYR A 84 -5.899 -4.029 -1.003 1.00 0.00 H new ATOM 0 HD1 TYR A 84 -2.758 -1.869 -0.829 1.00 0.00 H new ATOM 0 HD2 TYR A 84 -6.632 -2.515 -2.485 1.00 0.00 H new ATOM 0 HE1 TYR A 84 -2.333 -0.217 -2.568 1.00 0.00 H new ATOM 0 HE2 TYR A 84 -6.186 -0.862 -4.196 1.00 0.00 H new ATOM 0 HH TYR A 84 -4.740 0.565 -5.057 1.00 0.00 H new ATOM 1344 N LEU A 85 -7.780 -2.123 -0.246 1.00 0.00 N ATOM 1345 CA LEU A 85 -8.798 -1.167 -0.664 1.00 0.00 C ATOM 1346 C LEU A 85 -9.894 -0.832 0.265 1.00 0.00 C ATOM 1347 O LEU A 85 -10.839 -0.157 -0.126 1.00 0.00 O ATOM 1348 CB LEU A 85 -9.354 -1.315 -2.029 1.00 0.00 C ATOM 1349 CG LEU A 85 -10.006 -2.577 -2.554 1.00 0.00 C ATOM 1350 CD1 LEU A 85 -9.054 -3.638 -2.687 1.00 0.00 C ATOM 1351 CD2 LEU A 85 -11.065 -3.008 -1.653 1.00 0.00 C ATOM 0 H LEU A 85 -7.900 -3.056 -0.641 1.00 0.00 H new ATOM 0 HA LEU A 85 -8.120 -0.314 -0.656 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -10.094 -0.523 -2.142 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.537 -1.089 -2.715 1.00 0.00 H new ATOM 0 HG LEU A 85 -10.420 -2.348 -3.536 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.554 -4.530 -3.066 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.270 -3.338 -3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -8.613 -3.855 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -11.526 -3.916 -2.041 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.645 -3.207 -0.667 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -11.818 -2.224 -1.575 1.00 0.00 H new ATOM 1363 N TYR A 86 -9.769 -1.218 1.457 1.00 0.00 N ATOM 1364 CA TYR A 86 -10.667 -0.883 2.512 1.00 0.00 C ATOM 1365 C TYR A 86 -10.753 0.638 2.696 1.00 0.00 C ATOM 1366 O TYR A 86 -11.609 1.167 3.404 1.00 0.00 O ATOM 1367 CB TYR A 86 -10.145 -1.502 3.711 1.00 0.00 C ATOM 1368 CG TYR A 86 -10.616 -2.850 3.992 1.00 0.00 C ATOM 1369 CD1 TYR A 86 -11.040 -3.237 5.245 1.00 0.00 C ATOM 1370 CD2 TYR A 86 -10.667 -3.739 2.994 1.00 0.00 C ATOM 1371 CE1 TYR A 86 -11.506 -4.504 5.460 1.00 0.00 C ATOM 1372 CE2 TYR A 86 -11.109 -4.972 3.167 1.00 0.00 C ATOM 1373 CZ TYR A 86 -11.545 -5.382 4.410 1.00 0.00 C ATOM 1374 OH TYR A 86 -12.017 -6.654 4.608 1.00 0.00 O ATOM 0 H TYR A 86 -8.998 -1.812 1.762 1.00 0.00 H new ATOM 0 HA TYR A 86 -11.673 -1.236 2.288 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -9.058 -1.526 3.639 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -10.394 -0.867 4.561 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -11.004 -2.534 6.064 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -10.335 -3.438 2.011 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -11.838 -4.807 6.442 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -11.129 -5.660 2.334 1.00 0.00 H new ATOM 0 HH TYR A 86 -12.370 -7.007 3.765 1.00 0.00 H new ATOM 1384 N GLY A 87 -9.817 1.280 2.062 1.00 0.00 N ATOM 1385 CA GLY A 87 -9.720 2.671 1.949 1.00 0.00 C ATOM 1386 C GLY A 87 -8.707 3.008 1.007 1.00 0.00 C ATOM 1387 O GLY A 87 -7.741 3.488 1.358 1.00 0.00 O ATOM 0 H GLY A 87 -9.058 0.794 1.584 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -10.677 3.087 1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -9.487 3.109 2.920 1.00 0.00 H new ATOM 1391 N VAL A 88 -8.949 2.737 -0.245 1.00 0.00 N ATOM 1392 CA VAL A 88 -8.058 3.094 -1.301 1.00 0.00 C ATOM 1393 C VAL A 88 -8.870 3.481 -2.526 1.00 0.00 C ATOM 1394 O VAL A 88 -9.845 2.812 -2.855 1.00 0.00 O ATOM 1395 CB VAL A 88 -7.212 1.934 -1.801 1.00 0.00 C ATOM 1396 CG1 VAL A 88 -6.249 2.415 -2.877 1.00 0.00 C ATOM 1397 CG2 VAL A 88 -6.469 1.369 -0.714 1.00 0.00 C ATOM 0 H VAL A 88 -9.789 2.252 -0.561 1.00 0.00 H new ATOM 0 HA VAL A 88 -7.430 3.884 -0.889 1.00 0.00 H new ATOM 0 HB VAL A 88 -7.871 1.175 -2.223 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -5.648 1.576 -3.228 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -6.814 2.831 -3.711 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -5.595 3.182 -2.463 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -5.865 0.538 -1.079 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -5.818 2.130 -0.284 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -7.158 1.008 0.049 1.00 0.00 H new ATOM 1407 N LYS A 89 -8.512 4.571 -3.088 1.00 0.00 N ATOM 1408 CA LYS A 89 -8.851 5.025 -4.447 1.00 0.00 C ATOM 1409 C LYS A 89 -8.368 6.441 -4.601 1.00 0.00 C ATOM 1410 O LYS A 89 -7.644 6.728 -5.520 1.00 0.00 O ATOM 1411 CB LYS A 89 -10.318 4.761 -4.953 1.00 0.00 C ATOM 1412 CG LYS A 89 -10.634 5.401 -6.308 1.00 0.00 C ATOM 1413 CD LYS A 89 -11.899 4.843 -7.001 1.00 0.00 C ATOM 1414 CE LYS A 89 -13.173 4.898 -6.147 1.00 0.00 C ATOM 1415 NZ LYS A 89 -13.262 3.775 -5.175 1.00 0.00 N ATOM 0 H LYS A 89 -7.926 5.248 -2.599 1.00 0.00 H new ATOM 0 HA LYS A 89 -8.320 4.376 -5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -10.479 3.685 -5.024 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -11.021 5.140 -4.211 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -10.755 6.475 -6.169 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -9.780 5.260 -6.970 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -12.070 5.402 -7.921 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -11.714 3.808 -7.287 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -13.203 5.844 -5.606 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -14.045 4.877 -6.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -14.254 3.476 -5.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -12.691 2.975 -5.515 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -12.904 4.087 -4.250 1.00 0.00 H new ATOM 1429 N PRO A 90 -8.786 7.356 -3.705 1.00 0.00 N ATOM 1430 CA PRO A 90 -8.115 8.629 -3.552 1.00 0.00 C ATOM 1431 C PRO A 90 -7.007 8.467 -2.505 1.00 0.00 C ATOM 1432 O PRO A 90 -6.419 7.374 -2.362 1.00 0.00 O ATOM 1433 CB PRO A 90 -9.217 9.524 -2.984 1.00 0.00 C ATOM 1434 CG PRO A 90 -10.458 8.711 -2.996 1.00 0.00 C ATOM 1435 CD PRO A 90 -9.987 7.317 -2.883 1.00 0.00 C ATOM 0 HA PRO A 90 -7.669 9.015 -4.468 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -8.973 9.847 -1.972 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -9.336 10.425 -3.586 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -11.115 8.977 -2.167 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -11.025 8.865 -3.914 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -9.771 7.038 -1.852 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -10.720 6.603 -3.259 1.00 0.00 H new ATOM 1443 N GLY A 91 -6.819 9.524 -1.660 1.00 0.00 N ATOM 1444 CA GLY A 91 -5.824 9.606 -0.609 1.00 0.00 C ATOM 1445 C GLY A 91 -6.069 8.700 0.558 1.00 0.00 C ATOM 1446 O GLY A 91 -5.603 8.827 1.660 1.00 0.00 O ATOM 0 H GLY A 91 -7.394 10.365 -1.716 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -4.847 9.373 -1.033 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -5.779 10.634 -0.250 1.00 0.00 H new ATOM 1450 N ALA A 92 -6.800 7.830 0.232 1.00 0.00 N ATOM 1451 CA ALA A 92 -7.281 6.724 0.983 1.00 0.00 C ATOM 1452 C ALA A 92 -6.187 5.892 1.418 1.00 0.00 C ATOM 1453 O ALA A 92 -6.214 5.340 2.500 1.00 0.00 O ATOM 1454 CB ALA A 92 -8.203 6.032 0.095 1.00 0.00 C ATOM 0 H ALA A 92 -7.177 7.812 -0.716 1.00 0.00 H new ATOM 0 HA ALA A 92 -7.789 7.024 1.900 1.00 0.00 H new ATOM 0 HB1 ALA A 92 -8.617 5.163 0.606 1.00 0.00 H new ATOM 0 HB2 ALA A 92 -9.011 6.706 -0.187 1.00 0.00 H new ATOM 0 HB3 ALA A 92 -7.672 5.708 -0.800 1.00 0.00 H new ATOM 1460 N THR A 93 -5.251 5.849 0.580 1.00 0.00 N ATOM 1461 CA THR A 93 -3.990 5.282 0.795 1.00 0.00 C ATOM 1462 C THR A 93 -3.452 5.632 2.175 1.00 0.00 C ATOM 1463 O THR A 93 -2.961 4.797 2.888 1.00 0.00 O ATOM 1464 CB THR A 93 -3.042 5.876 -0.237 1.00 0.00 C ATOM 1465 OG1 THR A 93 -1.693 5.639 0.079 1.00 0.00 O ATOM 1466 CG2 THR A 93 -3.310 7.328 -0.432 1.00 0.00 C ATOM 0 H THR A 93 -5.348 6.241 -0.357 1.00 0.00 H new ATOM 0 HA THR A 93 -4.069 4.198 0.716 1.00 0.00 H new ATOM 0 HB THR A 93 -3.234 5.367 -1.182 1.00 0.00 H new ATOM 0 HG1 THR A 93 -1.160 6.430 -0.148 1.00 0.00 H new ATOM 0 HG21 THR A 93 -2.620 7.729 -1.174 1.00 0.00 H new ATOM 0 HG22 THR A 93 -4.334 7.466 -0.778 1.00 0.00 H new ATOM 0 HG23 THR A 93 -3.172 7.854 0.513 1.00 0.00 H new ATOM 1474 N ARG A 94 -3.595 6.893 2.527 1.00 0.00 N ATOM 1475 CA ARG A 94 -3.022 7.456 3.681 1.00 0.00 C ATOM 1476 C ARG A 94 -1.506 7.337 3.697 1.00 0.00 C ATOM 1477 O ARG A 94 -0.906 7.548 4.740 1.00 0.00 O ATOM 1478 CB ARG A 94 -3.536 6.861 4.957 1.00 0.00 C ATOM 1479 CG ARG A 94 -4.810 7.452 5.573 1.00 0.00 C ATOM 1480 CD ARG A 94 -6.106 6.887 4.991 1.00 0.00 C ATOM 1481 NE ARG A 94 -7.270 7.357 5.763 1.00 0.00 N ATOM 1482 CZ ARG A 94 -8.540 7.124 5.471 1.00 0.00 C ATOM 1483 NH1 ARG A 94 -8.860 6.370 4.402 1.00 0.00 N ATOM 1484 NH2 ARG A 94 -9.485 7.605 6.275 1.00 0.00 N ATOM 0 H ARG A 94 -4.139 7.560 1.980 1.00 0.00 H new ATOM 0 HA ARG A 94 -3.317 8.504 3.632 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -3.713 5.800 4.782 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -2.743 6.933 5.701 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -4.798 7.272 6.648 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -4.802 8.533 5.431 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -6.207 7.192 3.949 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -6.071 5.798 5.002 1.00 0.00 H new ATOM 0 HE ARG A 94 -7.080 7.912 6.598 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -8.123 5.977 3.816 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -9.839 6.191 4.179 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -9.226 8.144 7.101 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -10.469 7.435 6.065 1.00 0.00 H new ATOM 1498 N VAL A 95 -0.862 6.933 2.573 1.00 0.00 N ATOM 1499 CA VAL A 95 0.557 6.790 2.536 1.00 0.00 C ATOM 1500 C VAL A 95 1.182 7.199 1.216 1.00 0.00 C ATOM 1501 O VAL A 95 0.604 7.160 0.148 1.00 0.00 O ATOM 1502 CB VAL A 95 1.090 5.426 2.928 1.00 0.00 C ATOM 1503 CG1 VAL A 95 0.092 4.728 3.722 1.00 0.00 C ATOM 1504 CG2 VAL A 95 1.522 4.658 1.733 1.00 0.00 C ATOM 0 H VAL A 95 -1.332 6.708 1.696 1.00 0.00 H new ATOM 0 HA VAL A 95 0.863 7.492 3.312 1.00 0.00 H new ATOM 0 HB VAL A 95 1.981 5.542 3.545 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.473 3.747 4.005 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -0.127 5.305 4.620 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -0.820 4.608 3.137 1.00 0.00 H new ATOM 0 HG21 VAL A 95 1.900 3.684 2.044 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.674 4.521 1.062 1.00 0.00 H new ATOM 0 HG23 VAL A 95 2.310 5.204 1.215 1.00 0.00 H new ATOM 1514 N ASP A 96 2.296 7.683 1.418 1.00 0.00 N ATOM 1515 CA ASP A 96 3.252 8.127 0.423 1.00 0.00 C ATOM 1516 C ASP A 96 4.592 7.810 1.049 1.00 0.00 C ATOM 1517 O ASP A 96 5.527 8.561 1.031 1.00 0.00 O ATOM 1518 CB ASP A 96 3.025 9.610 0.303 1.00 0.00 C ATOM 1519 CG ASP A 96 3.675 10.285 -0.827 1.00 0.00 C ATOM 1520 OD1 ASP A 96 3.183 10.105 -1.939 1.00 0.00 O ATOM 1521 OD2 ASP A 96 4.584 11.072 -0.588 1.00 0.00 O ATOM 0 H ASP A 96 2.649 7.815 2.366 1.00 0.00 H new ATOM 0 HA ASP A 96 3.179 7.673 -0.565 1.00 0.00 H new ATOM 0 HB2 ASP A 96 1.952 9.786 0.233 1.00 0.00 H new ATOM 0 HB3 ASP A 96 3.366 10.083 1.224 1.00 0.00 H new ATOM 1526 N LEU A 97 4.613 6.622 1.603 1.00 0.00 N ATOM 1527 CA LEU A 97 5.624 6.039 2.381 1.00 0.00 C ATOM 1528 C LEU A 97 6.086 6.726 3.650 1.00 0.00 C ATOM 1529 O LEU A 97 6.569 6.083 4.573 1.00 0.00 O ATOM 1530 CB LEU A 97 6.572 5.325 1.601 1.00 0.00 C ATOM 1531 CG LEU A 97 5.996 4.622 0.496 1.00 0.00 C ATOM 1532 CD1 LEU A 97 6.934 4.689 -0.655 1.00 0.00 C ATOM 1533 CD2 LEU A 97 5.936 3.297 0.871 1.00 0.00 C ATOM 0 H LEU A 97 3.822 5.988 1.493 1.00 0.00 H new ATOM 0 HA LEU A 97 5.095 5.268 2.941 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.320 6.023 1.226 1.00 0.00 H new ATOM 0 HB3 LEU A 97 7.093 4.613 2.241 1.00 0.00 H new ATOM 0 HG LEU A 97 5.024 5.039 0.231 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.506 4.156 -1.504 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.102 5.731 -0.927 1.00 0.00 H new ATOM 0 HD13 LEU A 97 7.883 4.229 -0.379 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.502 2.709 0.062 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.941 2.934 1.085 1.00 0.00 H new ATOM 0 HD23 LEU A 97 5.317 3.199 1.763 1.00 0.00 H new ATOM 1545 N ASP A 98 5.826 7.991 3.707 1.00 0.00 N ATOM 1546 CA ASP A 98 5.952 8.809 4.859 1.00 0.00 C ATOM 1547 C ASP A 98 4.626 8.672 5.556 1.00 0.00 C ATOM 1548 O ASP A 98 4.485 8.770 6.770 1.00 0.00 O ATOM 1549 CB ASP A 98 6.196 10.259 4.404 1.00 0.00 C ATOM 1550 CG ASP A 98 7.658 10.549 4.075 1.00 0.00 C ATOM 1551 OD1 ASP A 98 8.227 9.869 3.179 1.00 0.00 O ATOM 1552 OD2 ASP A 98 8.229 11.464 4.675 1.00 0.00 O ATOM 0 H ASP A 98 5.498 8.511 2.893 1.00 0.00 H new ATOM 0 HA ASP A 98 6.777 8.530 5.514 1.00 0.00 H new ATOM 0 HB2 ASP A 98 5.585 10.465 3.525 1.00 0.00 H new ATOM 0 HB3 ASP A 98 5.865 10.940 5.189 1.00 0.00 H new ATOM 1557 N GLY A 99 3.648 8.323 4.733 1.00 0.00 N ATOM 1558 CA GLY A 99 2.341 8.077 5.191 1.00 0.00 C ATOM 1559 C GLY A 99 1.404 9.309 5.056 1.00 0.00 C ATOM 1560 O GLY A 99 0.648 9.628 5.960 1.00 0.00 O ATOM 0 H GLY A 99 3.768 8.209 3.726 1.00 0.00 H new ATOM 0 HA2 GLY A 99 1.917 7.243 4.631 1.00 0.00 H new ATOM 0 HA3 GLY A 99 2.381 7.771 6.237 1.00 0.00 H new ATOM 1564 N ASN A 100 1.502 9.956 3.906 1.00 0.00 N ATOM 1565 CA ASN A 100 0.674 11.053 3.405 1.00 0.00 C ATOM 1566 C ASN A 100 -0.294 10.378 2.536 1.00 0.00 C ATOM 1567 O ASN A 100 0.058 9.474 2.009 1.00 0.00 O ATOM 1568 CB ASN A 100 1.586 11.840 2.516 1.00 0.00 C ATOM 1569 CG ASN A 100 2.402 12.826 3.144 1.00 0.00 C ATOM 1570 OD1 ASN A 100 2.045 13.433 4.137 1.00 0.00 O ATOM 1571 ND2 ASN A 100 3.515 13.001 2.585 1.00 0.00 N ATOM 0 H ASN A 100 2.228 9.707 3.234 1.00 0.00 H new ATOM 0 HA ASN A 100 0.208 11.674 4.170 1.00 0.00 H new ATOM 0 HB2 ASN A 100 2.239 11.140 1.994 1.00 0.00 H new ATOM 0 HB3 ASN A 100 0.978 12.334 1.758 1.00 0.00 H new ATOM 0 HD21 ASN A 100 4.174 13.682 2.963 1.00 0.00 H new ATOM 0 HD22 ASN A 100 3.759 12.462 1.754 1.00 0.00 H new ATOM 1578 N PRO A 101 -1.478 10.831 2.309 1.00 0.00 N ATOM 1579 CA PRO A 101 -2.524 10.082 1.573 1.00 0.00 C ATOM 1580 C PRO A 101 -2.280 10.151 0.123 1.00 0.00 C ATOM 1581 O PRO A 101 -3.062 10.690 -0.609 1.00 0.00 O ATOM 1582 CB PRO A 101 -3.740 10.915 1.941 1.00 0.00 C ATOM 1583 CG PRO A 101 -3.271 11.704 3.112 1.00 0.00 C ATOM 1584 CD PRO A 101 -1.972 12.094 2.637 1.00 0.00 C ATOM 0 HA PRO A 101 -2.593 9.020 1.811 1.00 0.00 H new ATOM 0 HB2 PRO A 101 -4.050 11.560 1.119 1.00 0.00 H new ATOM 0 HB3 PRO A 101 -4.595 10.289 2.194 1.00 0.00 H new ATOM 0 HG2 PRO A 101 -3.913 12.559 3.324 1.00 0.00 H new ATOM 0 HG3 PRO A 101 -3.221 11.109 4.024 1.00 0.00 H new ATOM 0 HD2 PRO A 101 -2.020 12.764 1.779 1.00 0.00 H new ATOM 0 HD3 PRO A 101 -1.376 12.595 3.400 1.00 0.00 H new ATOM 1592 N CYS A 102 -1.132 9.603 -0.278 1.00 0.00 N ATOM 1593 CA CYS A 102 -0.478 9.925 -1.567 1.00 0.00 C ATOM 1594 C CYS A 102 -0.255 11.475 -1.654 1.00 0.00 C ATOM 1595 O CYS A 102 0.228 12.037 -2.618 1.00 0.00 O ATOM 1596 CB CYS A 102 -1.189 9.215 -2.790 1.00 0.00 C ATOM 1597 SG CYS A 102 -1.233 10.035 -4.389 1.00 0.00 S ATOM 0 H CYS A 102 -0.620 8.919 0.278 1.00 0.00 H new ATOM 0 HA CYS A 102 0.522 9.495 -1.624 1.00 0.00 H new ATOM 0 HB2 CYS A 102 -0.705 8.249 -2.932 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -2.220 9.016 -2.497 1.00 0.00 H new ATOM 0 HG CYS A 102 -2.468 10.176 -4.770 1.00 0.00 H new ATOM 1603 N GLY A 103 -0.597 12.102 -0.504 1.00 0.00 N ATOM 1604 CA GLY A 103 -0.573 13.534 -0.252 1.00 0.00 C ATOM 1605 C GLY A 103 -1.685 14.209 -0.972 1.00 0.00 C ATOM 1606 O GLY A 103 -1.802 15.424 -1.031 1.00 0.00 O ATOM 0 H GLY A 103 -0.914 11.577 0.311 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -0.658 13.722 0.818 1.00 0.00 H new ATOM 0 HA3 GLY A 103 0.382 13.950 -0.574 1.00 0.00 H new ATOM 1610 N GLU A 104 -2.479 13.373 -1.462 1.00 0.00 N ATOM 1611 CA GLU A 104 -3.570 13.623 -2.293 1.00 0.00 C ATOM 1612 C GLU A 104 -4.815 14.020 -1.515 1.00 0.00 C ATOM 1613 O GLU A 104 -5.527 14.951 -1.903 1.00 0.00 O ATOM 1614 CB GLU A 104 -3.757 12.343 -3.097 1.00 0.00 C ATOM 1615 CG GLU A 104 -5.080 11.707 -3.045 1.00 0.00 C ATOM 1616 CD GLU A 104 -5.180 10.623 -4.063 1.00 0.00 C ATOM 1617 OE1 GLU A 104 -4.273 9.757 -4.100 1.00 0.00 O ATOM 1618 OE2 GLU A 104 -6.188 10.588 -4.769 1.00 0.00 O ATOM 0 H GLU A 104 -2.373 12.377 -1.272 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.391 14.477 -2.946 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -3.528 12.562 -4.140 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -3.019 11.617 -2.754 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -5.254 11.297 -2.050 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -5.855 12.452 -3.222 1.00 0.00 H new ATOM 1625 N LEU A 105 -5.099 13.343 -0.415 1.00 0.00 N ATOM 1626 CA LEU A 105 -6.283 13.639 0.236 1.00 0.00 C ATOM 1627 C LEU A 105 -6.078 13.876 1.742 1.00 0.00 C ATOM 1628 O LEU A 105 -5.005 13.782 2.248 1.00 0.00 O ATOM 1629 CB LEU A 105 -7.334 12.544 -0.140 1.00 0.00 C ATOM 1630 CG LEU A 105 -8.789 12.928 0.076 1.00 0.00 C ATOM 1631 CD1 LEU A 105 -9.710 12.171 -0.795 1.00 0.00 C ATOM 1632 CD2 LEU A 105 -9.102 12.624 1.407 1.00 0.00 C ATOM 0 H LEU A 105 -4.522 12.614 0.006 1.00 0.00 H new ATOM 0 HA LEU A 105 -6.682 14.596 -0.101 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -7.198 12.281 -1.189 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.123 11.648 0.443 1.00 0.00 H new ATOM 0 HG LEU A 105 -8.907 13.986 -0.159 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -10.736 12.484 -0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -9.464 12.364 -1.839 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -9.611 11.105 -0.590 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -10.142 12.885 1.605 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.956 11.558 1.581 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -8.452 13.192 2.072 1.00 0.00 H new ATOM 1644 N ASP A 106 -7.108 14.350 2.331 1.00 0.00 N ATOM 1645 CA ASP A 106 -7.414 14.445 3.744 1.00 0.00 C ATOM 1646 C ASP A 106 -7.745 12.979 4.157 1.00 0.00 C ATOM 1647 O ASP A 106 -7.135 12.030 3.641 1.00 0.00 O ATOM 1648 CB ASP A 106 -8.679 15.409 3.707 1.00 0.00 C ATOM 1649 CG ASP A 106 -9.731 15.307 4.749 1.00 0.00 C ATOM 1650 OD1 ASP A 106 -9.437 15.290 5.909 1.00 0.00 O ATOM 1651 OD2 ASP A 106 -10.902 15.170 4.340 1.00 0.00 O ATOM 0 H ASP A 106 -7.871 14.738 1.776 1.00 0.00 H new ATOM 0 HA ASP A 106 -6.662 14.823 4.437 1.00 0.00 H new ATOM 0 HB2 ASP A 106 -8.305 16.433 3.726 1.00 0.00 H new ATOM 0 HB3 ASP A 106 -9.166 15.265 2.742 1.00 0.00 H new ATOM 1656 N GLU A 107 -8.639 12.785 5.007 1.00 0.00 N ATOM 1657 CA GLU A 107 -9.127 11.462 5.259 1.00 0.00 C ATOM 1658 C GLU A 107 -10.621 11.406 5.441 1.00 0.00 C ATOM 1659 O GLU A 107 -11.210 10.335 5.520 1.00 0.00 O ATOM 1660 CB GLU A 107 -8.389 10.827 6.334 1.00 0.00 C ATOM 1661 CG GLU A 107 -9.014 10.943 7.666 1.00 0.00 C ATOM 1662 CD GLU A 107 -8.297 10.031 8.613 1.00 0.00 C ATOM 1663 OE1 GLU A 107 -7.611 10.504 9.511 1.00 0.00 O ATOM 1664 OE2 GLU A 107 -8.391 8.780 8.381 1.00 0.00 O ATOM 0 H GLU A 107 -9.075 13.519 5.566 1.00 0.00 H new ATOM 0 HA GLU A 107 -8.940 10.874 4.360 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -8.266 9.770 6.097 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -7.391 11.262 6.377 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -8.961 11.973 8.020 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -10.070 10.678 7.612 1.00 0.00 H new ATOM 1671 N GLN A 108 -11.220 12.533 5.333 1.00 0.00 N ATOM 1672 CA GLN A 108 -12.606 12.693 5.403 1.00 0.00 C ATOM 1673 C GLN A 108 -13.066 12.771 4.020 1.00 0.00 C ATOM 1674 O GLN A 108 -14.226 13.061 3.695 1.00 0.00 O ATOM 1675 CB GLN A 108 -12.974 13.878 6.225 1.00 0.00 C ATOM 1676 CG GLN A 108 -14.419 13.873 6.600 1.00 0.00 C ATOM 1677 CD GLN A 108 -14.760 14.857 7.705 1.00 0.00 C ATOM 1678 OE1 GLN A 108 -15.684 14.654 8.475 1.00 0.00 O ATOM 1679 NE2 GLN A 108 -13.998 15.922 7.808 1.00 0.00 N ATOM 0 H GLN A 108 -10.721 13.410 5.186 1.00 0.00 H new ATOM 0 HA GLN A 108 -13.093 11.859 5.908 1.00 0.00 H new ATOM 0 HB2 GLN A 108 -12.365 13.895 7.129 1.00 0.00 H new ATOM 0 HB3 GLN A 108 -12.747 14.788 5.670 1.00 0.00 H new ATOM 0 HG2 GLN A 108 -15.016 14.107 5.719 1.00 0.00 H new ATOM 0 HG3 GLN A 108 -14.700 12.869 6.918 1.00 0.00 H new ATOM 0 HE21 GLN A 108 -13.232 16.067 7.150 1.00 0.00 H new ATOM 0 HE22 GLN A 108 -14.172 16.604 8.546 1.00 0.00 H new ATOM 1688 N HIS A 109 -12.148 12.484 3.130 1.00 0.00 N ATOM 1689 CA HIS A 109 -12.558 12.336 1.819 1.00 0.00 C ATOM 1690 C HIS A 109 -12.187 11.014 1.342 1.00 0.00 C ATOM 1691 O HIS A 109 -12.815 10.450 0.462 1.00 0.00 O ATOM 1692 CB HIS A 109 -12.099 13.414 0.964 1.00 0.00 C ATOM 1693 CG HIS A 109 -12.373 14.848 1.436 1.00 0.00 C ATOM 1694 ND1 HIS A 109 -13.519 15.236 2.101 1.00 0.00 N ATOM 1695 CD2 HIS A 109 -11.594 15.956 1.380 1.00 0.00 C ATOM 1696 CE1 HIS A 109 -13.433 16.507 2.426 1.00 0.00 C ATOM 1697 NE2 HIS A 109 -12.273 16.973 2.006 1.00 0.00 N ATOM 0 H HIS A 109 -11.152 12.358 3.312 1.00 0.00 H new ATOM 0 HA HIS A 109 -13.645 12.410 1.780 1.00 0.00 H new ATOM 0 HB2 HIS A 109 -11.023 13.303 0.828 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -12.559 13.287 -0.016 1.00 0.00 H new ATOM 0 HD1 HIS A 109 -14.312 14.629 2.309 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -10.617 16.026 0.926 1.00 0.00 H new ATOM 0 HE1 HIS A 109 -14.187 17.075 2.950 1.00 0.00 H new ATOM 1706 N VAL A 110 -11.242 10.472 1.987 1.00 0.00 N ATOM 1707 CA VAL A 110 -10.925 9.132 1.743 1.00 0.00 C ATOM 1708 C VAL A 110 -11.635 8.291 2.719 1.00 0.00 C ATOM 1709 O VAL A 110 -11.388 7.125 2.940 1.00 0.00 O ATOM 1710 CB VAL A 110 -9.519 8.847 1.662 1.00 0.00 C ATOM 1711 CG1 VAL A 110 -9.137 9.459 0.429 1.00 0.00 C ATOM 1712 CG2 VAL A 110 -8.778 9.453 2.761 1.00 0.00 C ATOM 0 H VAL A 110 -10.670 10.937 2.692 1.00 0.00 H new ATOM 0 HA VAL A 110 -11.271 8.890 0.738 1.00 0.00 H new ATOM 0 HB VAL A 110 -9.311 7.778 1.716 1.00 0.00 H new ATOM 0 HG11 VAL A 110 -8.071 9.304 0.261 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -9.702 9.013 -0.389 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -9.345 10.528 0.473 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -7.719 9.213 2.662 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -8.909 10.535 2.735 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -9.151 9.065 3.709 1.00 0.00 H new ATOM 1722 N GLU A 111 -12.497 8.983 3.270 1.00 0.00 N ATOM 1723 CA GLU A 111 -13.541 8.595 4.082 1.00 0.00 C ATOM 1724 C GLU A 111 -14.458 7.796 3.267 1.00 0.00 C ATOM 1725 O GLU A 111 -14.922 6.746 3.652 1.00 0.00 O ATOM 1726 CB GLU A 111 -14.197 9.864 4.613 1.00 0.00 C ATOM 1727 CG GLU A 111 -15.479 9.625 5.339 1.00 0.00 C ATOM 1728 CD GLU A 111 -16.723 9.742 4.411 1.00 0.00 C ATOM 1729 OE1 GLU A 111 -17.210 8.709 3.882 1.00 0.00 O ATOM 1730 OE2 GLU A 111 -17.172 10.865 4.121 1.00 0.00 O ATOM 0 H GLU A 111 -12.492 9.996 3.147 1.00 0.00 H new ATOM 0 HA GLU A 111 -13.222 7.990 4.931 1.00 0.00 H new ATOM 0 HB2 GLU A 111 -13.500 10.368 5.283 1.00 0.00 H new ATOM 0 HB3 GLU A 111 -14.384 10.541 3.779 1.00 0.00 H new ATOM 0 HG2 GLU A 111 -15.458 8.632 5.789 1.00 0.00 H new ATOM 0 HG3 GLU A 111 -15.570 10.343 6.154 1.00 0.00 H new ATOM 1737 N HIS A 112 -14.634 8.261 2.074 1.00 0.00 N ATOM 1738 CA HIS A 112 -15.499 7.621 1.141 1.00 0.00 C ATOM 1739 C HIS A 112 -14.835 6.433 0.579 1.00 0.00 C ATOM 1740 O HIS A 112 -15.452 5.581 -0.004 1.00 0.00 O ATOM 1741 CB HIS A 112 -15.876 8.570 0.058 1.00 0.00 C ATOM 1742 CG HIS A 112 -16.610 9.805 0.536 1.00 0.00 C ATOM 1743 ND1 HIS A 112 -17.944 10.047 0.302 1.00 0.00 N ATOM 1744 CD2 HIS A 112 -16.179 10.831 1.296 1.00 0.00 C ATOM 1745 CE1 HIS A 112 -18.293 11.168 0.923 1.00 0.00 C ATOM 1746 NE2 HIS A 112 -17.237 11.655 1.540 1.00 0.00 N ATOM 0 H HIS A 112 -14.178 9.101 1.718 1.00 0.00 H new ATOM 0 HA HIS A 112 -16.408 7.305 1.654 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -14.973 8.880 -0.468 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -16.502 8.047 -0.665 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -15.169 10.975 1.651 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -19.280 11.607 0.922 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -17.214 12.504 2.104 1.00 0.00 H new ATOM 1755 N ALA A 113 -13.600 6.398 0.756 1.00 0.00 N ATOM 1756 CA ALA A 113 -12.833 5.361 0.340 1.00 0.00 C ATOM 1757 C ALA A 113 -12.760 4.338 1.385 1.00 0.00 C ATOM 1758 O ALA A 113 -12.690 3.153 1.120 1.00 0.00 O ATOM 1759 CB ALA A 113 -11.550 5.869 0.057 1.00 0.00 C ATOM 0 H ALA A 113 -13.077 7.139 1.223 1.00 0.00 H new ATOM 0 HA ALA A 113 -13.261 4.898 -0.549 1.00 0.00 H new ATOM 0 HB1 ALA A 113 -10.904 5.059 -0.282 1.00 0.00 H new ATOM 0 HB2 ALA A 113 -11.622 6.626 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 113 -11.129 6.316 0.957 1.00 0.00 H new ATOM 1765 N ARG A 114 -12.813 4.823 2.569 1.00 0.00 N ATOM 1766 CA ARG A 114 -12.822 4.035 3.711 1.00 0.00 C ATOM 1767 C ARG A 114 -14.150 3.288 3.674 1.00 0.00 C ATOM 1768 O ARG A 114 -14.265 2.145 4.116 1.00 0.00 O ATOM 1769 CB ARG A 114 -12.716 4.950 4.971 1.00 0.00 C ATOM 1770 CG ARG A 114 -12.123 4.323 6.268 1.00 0.00 C ATOM 1771 CD ARG A 114 -13.160 3.687 7.225 1.00 0.00 C ATOM 1772 NE ARG A 114 -13.817 2.506 6.681 1.00 0.00 N ATOM 1773 CZ ARG A 114 -14.732 1.743 7.303 1.00 0.00 C ATOM 1774 NH1 ARG A 114 -15.088 1.980 8.564 1.00 0.00 N ATOM 1775 NH2 ARG A 114 -15.286 0.744 6.643 1.00 0.00 N ATOM 0 H ARG A 114 -12.853 5.824 2.761 1.00 0.00 H new ATOM 0 HA ARG A 114 -11.985 3.338 3.753 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -12.108 5.816 4.708 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -13.715 5.320 5.203 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -11.398 3.560 5.985 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -11.578 5.096 6.810 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -12.663 3.418 8.157 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -13.917 4.431 7.471 1.00 0.00 H new ATOM 0 HE ARG A 114 -13.557 2.231 5.734 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -14.664 2.753 9.077 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -15.785 1.388 9.017 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -15.018 0.561 5.676 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -15.982 0.155 7.100 1.00 0.00 H new ATOM 1789 N LYS A 115 -15.134 3.908 3.027 1.00 0.00 N ATOM 1790 CA LYS A 115 -16.378 3.429 3.051 1.00 0.00 C ATOM 1791 C LYS A 115 -16.645 2.668 1.824 1.00 0.00 C ATOM 1792 O LYS A 115 -17.504 1.868 1.833 1.00 0.00 O ATOM 1793 CB LYS A 115 -17.350 4.547 3.235 1.00 0.00 C ATOM 1794 CG LYS A 115 -18.012 5.070 1.984 1.00 0.00 C ATOM 1795 CD LYS A 115 -19.468 5.330 2.257 1.00 0.00 C ATOM 1796 CE LYS A 115 -19.626 6.175 3.522 1.00 0.00 C ATOM 1797 NZ LYS A 115 -19.450 7.624 3.308 1.00 0.00 N ATOM 0 H LYS A 115 -15.016 4.764 2.484 1.00 0.00 H new ATOM 0 HA LYS A 115 -16.494 2.748 3.894 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -18.129 4.214 3.921 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -16.832 5.375 3.719 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -17.523 5.988 1.658 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -17.906 4.347 1.175 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -19.918 5.845 1.408 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -19.998 4.385 2.374 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -20.616 5.999 3.942 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -18.901 5.838 4.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -19.990 8.149 4.025 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -18.442 7.867 3.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -19.794 7.879 2.360 1.00 0.00 H new ATOM 1811 N GLN A 116 -15.883 2.898 0.741 1.00 0.00 N ATOM 1812 CA GLN A 116 -16.142 2.126 -0.442 1.00 0.00 C ATOM 1813 C GLN A 116 -15.941 0.607 -0.258 1.00 0.00 C ATOM 1814 O GLN A 116 -16.389 -0.213 -1.041 1.00 0.00 O ATOM 1815 CB GLN A 116 -15.553 2.725 -1.697 1.00 0.00 C ATOM 1816 CG GLN A 116 -14.104 2.980 -1.554 1.00 0.00 C ATOM 1817 CD GLN A 116 -13.226 1.879 -2.127 1.00 0.00 C ATOM 1818 OE1 GLN A 116 -12.811 1.972 -3.277 1.00 0.00 O ATOM 1819 NE2 GLN A 116 -13.055 0.811 -1.427 1.00 0.00 N ATOM 0 H GLN A 116 -15.126 3.579 0.677 1.00 0.00 H new ATOM 0 HA GLN A 116 -17.216 2.203 -0.614 1.00 0.00 H new ATOM 0 HB2 GLN A 116 -15.723 2.050 -2.536 1.00 0.00 H new ATOM 0 HB3 GLN A 116 -16.065 3.658 -1.930 1.00 0.00 H new ATOM 0 HG2 GLN A 116 -13.860 3.920 -2.048 1.00 0.00 H new ATOM 0 HG3 GLN A 116 -13.870 3.105 -0.497 1.00 0.00 H new ATOM 0 HE21 GLN A 116 -13.412 0.764 -0.473 1.00 0.00 H new ATOM 0 HE22 GLN A 116 -12.563 0.012 -1.827 1.00 0.00 H new ATOM 1828 N LEU A 117 -15.235 0.267 0.768 1.00 0.00 N ATOM 1829 CA LEU A 117 -15.063 -0.988 1.195 1.00 0.00 C ATOM 1830 C LEU A 117 -15.974 -1.410 2.244 1.00 0.00 C ATOM 1831 O LEU A 117 -16.093 -2.550 2.494 1.00 0.00 O ATOM 1832 CB LEU A 117 -13.701 -1.137 1.447 1.00 0.00 C ATOM 1833 CG LEU A 117 -13.186 -2.210 0.597 1.00 0.00 C ATOM 1834 CD1 LEU A 117 -13.241 -3.499 1.297 1.00 0.00 C ATOM 1835 CD2 LEU A 117 -13.889 -2.285 -0.818 1.00 0.00 C ATOM 0 H LEU A 117 -14.744 0.952 1.342 1.00 0.00 H new ATOM 0 HA LEU A 117 -15.355 -1.702 0.425 1.00 0.00 H new ATOM 0 HB2 LEU A 117 -13.174 -0.205 1.242 1.00 0.00 H new ATOM 0 HB3 LEU A 117 -13.534 -1.373 2.498 1.00 0.00 H new ATOM 0 HG LEU A 117 -12.143 -1.970 0.392 1.00 0.00 H new ATOM 0 HD11 LEU A 117 -12.853 -4.283 0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 117 -12.637 -3.447 2.203 1.00 0.00 H new ATOM 0 HD13 LEU A 117 -14.274 -3.725 1.562 1.00 0.00 H new ATOM 0 HD21 LEU A 117 -13.458 -3.103 -1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 117 -14.957 -2.458 -0.685 1.00 0.00 H new ATOM 0 HD23 LEU A 117 -13.737 -1.346 -1.350 1.00 0.00 H new ATOM 1847 N GLU A 118 -16.753 -0.494 2.723 1.00 0.00 N ATOM 1848 CA GLU A 118 -17.819 -0.769 3.593 1.00 0.00 C ATOM 1849 C GLU A 118 -19.043 -0.837 2.700 1.00 0.00 C ATOM 1850 O GLU A 118 -20.140 -0.949 3.140 1.00 0.00 O ATOM 1851 CB GLU A 118 -17.954 0.291 4.701 1.00 0.00 C ATOM 1852 CG GLU A 118 -18.821 -0.104 5.908 1.00 0.00 C ATOM 1853 CD GLU A 118 -18.188 -1.205 6.728 1.00 0.00 C ATOM 1854 OE1 GLU A 118 -17.148 -0.941 7.395 1.00 0.00 O ATOM 1855 OE2 GLU A 118 -18.654 -2.370 6.686 1.00 0.00 O ATOM 0 H GLU A 118 -16.649 0.497 2.503 1.00 0.00 H new ATOM 0 HA GLU A 118 -17.669 -1.702 4.136 1.00 0.00 H new ATOM 0 HB2 GLU A 118 -16.956 0.541 5.061 1.00 0.00 H new ATOM 0 HB3 GLU A 118 -18.370 1.197 4.261 1.00 0.00 H new ATOM 0 HG2 GLU A 118 -18.983 0.770 6.539 1.00 0.00 H new ATOM 0 HG3 GLU A 118 -19.801 -0.430 5.559 1.00 0.00 H new ATOM 1862 N GLU A 119 -18.758 -0.801 1.416 1.00 0.00 N ATOM 1863 CA GLU A 119 -19.705 -0.958 0.396 1.00 0.00 C ATOM 1864 C GLU A 119 -19.539 -2.340 -0.053 1.00 0.00 C ATOM 1865 O GLU A 119 -20.482 -3.084 -0.234 1.00 0.00 O ATOM 1866 CB GLU A 119 -19.419 -0.046 -0.775 1.00 0.00 C ATOM 1867 CG GLU A 119 -19.447 1.375 -0.416 1.00 0.00 C ATOM 1868 CD GLU A 119 -20.793 1.896 0.060 1.00 0.00 C ATOM 1869 OE1 GLU A 119 -21.782 1.754 -0.684 1.00 0.00 O ATOM 1870 OE2 GLU A 119 -20.837 2.515 1.154 1.00 0.00 O ATOM 0 H GLU A 119 -17.811 -0.654 1.066 1.00 0.00 H new ATOM 0 HA GLU A 119 -20.706 -0.723 0.758 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -18.441 -0.291 -1.189 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -20.152 -0.231 -1.560 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -18.710 1.550 0.368 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -19.135 1.958 -1.282 1.00 0.00 H new ATOM 1877 N ALA A 120 -18.258 -2.720 -0.208 1.00 0.00 N ATOM 1878 CA ALA A 120 -17.951 -4.008 -0.599 1.00 0.00 C ATOM 1879 C ALA A 120 -18.276 -4.996 0.442 1.00 0.00 C ATOM 1880 O ALA A 120 -18.970 -5.897 0.195 1.00 0.00 O ATOM 1881 CB ALA A 120 -16.591 -4.061 -1.094 1.00 0.00 C ATOM 0 H ALA A 120 -17.452 -2.113 -0.055 1.00 0.00 H new ATOM 0 HA ALA A 120 -18.589 -4.297 -1.434 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -16.355 -5.080 -1.401 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -16.488 -3.392 -1.948 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -15.905 -3.751 -0.306 1.00 0.00 H new ATOM 1887 N LYS A 121 -17.842 -4.739 1.591 1.00 0.00 N ATOM 1888 CA LYS A 121 -18.064 -5.502 2.774 1.00 0.00 C ATOM 1889 C LYS A 121 -19.447 -5.749 3.044 1.00 0.00 C ATOM 1890 O LYS A 121 -19.869 -6.868 3.182 1.00 0.00 O ATOM 1891 CB LYS A 121 -17.432 -4.765 3.854 1.00 0.00 C ATOM 1892 CG LYS A 121 -16.080 -5.144 4.025 1.00 0.00 C ATOM 1893 CD LYS A 121 -15.275 -4.203 4.852 1.00 0.00 C ATOM 1894 CE LYS A 121 -16.073 -3.431 5.852 1.00 0.00 C ATOM 1895 NZ LYS A 121 -16.695 -4.209 6.951 1.00 0.00 N ATOM 0 H LYS A 121 -17.265 -3.917 1.769 1.00 0.00 H new ATOM 0 HA LYS A 121 -17.634 -6.497 2.657 1.00 0.00 H new ATOM 0 HB2 LYS A 121 -17.487 -3.696 3.646 1.00 0.00 H new ATOM 0 HB3 LYS A 121 -17.978 -4.938 4.781 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -16.048 -6.131 4.486 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -15.614 -5.235 3.044 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -14.503 -4.767 5.376 1.00 0.00 H new ATOM 0 HD3 LYS A 121 -14.764 -3.502 4.192 1.00 0.00 H new ATOM 0 HE2 LYS A 121 -15.424 -2.675 6.295 1.00 0.00 H new ATOM 0 HE3 LYS A 121 -16.863 -2.901 5.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -17.628 -3.808 7.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -16.806 -5.200 6.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -16.088 -4.165 7.794 1.00 0.00 H new ATOM 1909 N ALA A 122 -20.102 -4.730 3.131 1.00 0.00 N ATOM 1910 CA ALA A 122 -21.478 -4.685 3.297 1.00 0.00 C ATOM 1911 C ALA A 122 -22.260 -5.330 2.155 1.00 0.00 C ATOM 1912 O ALA A 122 -23.452 -5.546 2.270 1.00 0.00 O ATOM 1913 CB ALA A 122 -21.847 -3.315 3.408 1.00 0.00 C ATOM 0 H ALA A 122 -19.677 -3.804 3.087 1.00 0.00 H new ATOM 0 HA ALA A 122 -21.728 -5.259 4.189 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -22.926 -3.238 3.540 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -21.344 -2.871 4.267 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -21.554 -2.785 2.502 1.00 0.00 H new ATOM 1919 N ARG A 123 -21.586 -5.618 1.048 1.00 0.00 N ATOM 1920 CA ARG A 123 -22.213 -6.243 -0.046 1.00 0.00 C ATOM 1921 C ARG A 123 -22.004 -7.696 0.078 1.00 0.00 C ATOM 1922 O ARG A 123 -22.765 -8.520 -0.414 1.00 0.00 O ATOM 1923 CB ARG A 123 -21.606 -5.736 -1.337 1.00 0.00 C ATOM 1924 CG ARG A 123 -20.926 -6.805 -2.170 1.00 0.00 C ATOM 1925 CD ARG A 123 -19.912 -6.231 -3.103 1.00 0.00 C ATOM 1926 NE ARG A 123 -19.361 -7.257 -4.019 1.00 0.00 N ATOM 1927 CZ ARG A 123 -18.204 -7.935 -3.836 1.00 0.00 C ATOM 1928 NH1 ARG A 123 -17.433 -7.689 -2.797 1.00 0.00 N ATOM 1929 NH2 ARG A 123 -17.816 -8.866 -4.700 1.00 0.00 N ATOM 0 H ARG A 123 -20.596 -5.415 0.911 1.00 0.00 H new ATOM 0 HA ARG A 123 -23.280 -6.019 -0.056 1.00 0.00 H new ATOM 0 HB2 ARG A 123 -22.390 -5.270 -1.935 1.00 0.00 H new ATOM 0 HB3 ARG A 123 -20.879 -4.958 -1.102 1.00 0.00 H new ATOM 0 HG2 ARG A 123 -20.443 -7.526 -1.510 1.00 0.00 H new ATOM 0 HG3 ARG A 123 -21.677 -7.350 -2.742 1.00 0.00 H new ATOM 0 HD2 ARG A 123 -20.367 -5.431 -3.686 1.00 0.00 H new ATOM 0 HD3 ARG A 123 -19.101 -5.785 -2.528 1.00 0.00 H new ATOM 0 HE ARG A 123 -19.899 -7.470 -4.859 1.00 0.00 H new ATOM 0 HH11 ARG A 123 -17.705 -6.979 -2.117 1.00 0.00 H new ATOM 0 HH12 ARG A 123 -16.564 -8.208 -2.673 1.00 0.00 H new ATOM 0 HH21 ARG A 123 -18.392 -9.078 -5.514 1.00 0.00 H new ATOM 0 HH22 ARG A 123 -16.942 -9.369 -4.549 1.00 0.00 H new ATOM 1943 N VAL A 124 -20.959 -7.976 0.747 1.00 0.00 N ATOM 1944 CA VAL A 124 -20.458 -9.296 0.824 1.00 0.00 C ATOM 1945 C VAL A 124 -21.188 -9.977 1.845 1.00 0.00 C ATOM 1946 O VAL A 124 -21.872 -10.952 1.619 1.00 0.00 O ATOM 1947 CB VAL A 124 -18.994 -9.297 1.149 1.00 0.00 C ATOM 1948 CG1 VAL A 124 -18.498 -10.661 1.342 1.00 0.00 C ATOM 1949 CG2 VAL A 124 -18.217 -8.611 0.121 1.00 0.00 C ATOM 0 H VAL A 124 -20.415 -7.288 1.267 1.00 0.00 H new ATOM 0 HA VAL A 124 -20.579 -9.796 -0.137 1.00 0.00 H new ATOM 0 HB VAL A 124 -18.869 -8.751 2.084 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -17.434 -10.631 1.576 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -19.038 -11.132 2.164 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -18.653 -11.237 0.430 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -17.161 -8.631 0.389 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -18.358 -9.112 -0.837 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -18.552 -7.577 0.042 1.00 0.00 H new ATOM 1959 N GLN A 125 -21.061 -9.316 2.913 1.00 0.00 N ATOM 1960 CA GLN A 125 -21.649 -9.401 4.167 1.00 0.00 C ATOM 1961 C GLN A 125 -22.188 -10.754 4.698 1.00 0.00 C ATOM 1962 O GLN A 125 -21.970 -11.098 5.852 1.00 0.00 O ATOM 1963 CB GLN A 125 -22.581 -8.323 4.059 1.00 0.00 C ATOM 1964 CG GLN A 125 -23.854 -8.496 3.222 1.00 0.00 C ATOM 1965 CD GLN A 125 -25.022 -9.159 3.940 1.00 0.00 C ATOM 1966 OE1 GLN A 125 -25.848 -9.810 3.331 1.00 0.00 O ATOM 1967 NE2 GLN A 125 -25.102 -8.990 5.239 1.00 0.00 N ATOM 0 H GLN A 125 -20.398 -8.541 2.915 1.00 0.00 H new ATOM 0 HA GLN A 125 -20.919 -9.329 4.973 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -22.890 -8.058 5.070 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -22.041 -7.466 3.656 1.00 0.00 H new ATOM 0 HG2 GLN A 125 -24.174 -7.515 2.872 1.00 0.00 H new ATOM 0 HG3 GLN A 125 -23.610 -9.086 2.338 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -24.395 -8.439 5.726 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -25.871 -9.410 5.762 1.00 0.00 H new ATOM 1976 N ALA A 126 -22.852 -11.455 3.872 1.00 0.00 N ATOM 1977 CA ALA A 126 -23.443 -12.633 4.121 1.00 0.00 C ATOM 1978 C ALA A 126 -22.507 -13.798 3.830 1.00 0.00 C ATOM 1979 O ALA A 126 -21.975 -14.440 4.732 1.00 0.00 O ATOM 1980 CB ALA A 126 -24.665 -12.687 3.291 1.00 0.00 C ATOM 0 H ALA A 126 -22.989 -11.153 2.907 1.00 0.00 H new ATOM 0 HA ALA A 126 -23.700 -12.719 5.177 1.00 0.00 H new ATOM 0 HB1 ALA A 126 -25.180 -13.632 3.462 1.00 0.00 H new ATOM 0 HB2 ALA A 126 -25.324 -11.861 3.559 1.00 0.00 H new ATOM 0 HB3 ALA A 126 -24.394 -12.607 2.238 1.00 0.00 H new ATOM 1986 N GLN A 127 -22.307 -14.065 2.558 1.00 0.00 N ATOM 1987 CA GLN A 127 -21.494 -15.009 2.103 1.00 0.00 C ATOM 1988 C GLN A 127 -20.195 -14.425 1.646 1.00 0.00 C ATOM 1989 O GLN A 127 -20.168 -13.471 0.895 1.00 0.00 O ATOM 1990 CB GLN A 127 -22.189 -15.610 0.946 1.00 0.00 C ATOM 1991 CG GLN A 127 -22.636 -16.997 1.175 1.00 0.00 C ATOM 1992 CD GLN A 127 -21.497 -17.941 1.565 1.00 0.00 C ATOM 1993 OE1 GLN A 127 -20.340 -17.752 1.176 1.00 0.00 O ATOM 1994 NE2 GLN A 127 -21.811 -18.952 2.333 1.00 0.00 N ATOM 0 H GLN A 127 -22.776 -13.551 1.812 1.00 0.00 H new ATOM 0 HA GLN A 127 -21.269 -15.736 2.883 1.00 0.00 H new ATOM 0 HB2 GLN A 127 -23.054 -14.996 0.695 1.00 0.00 H new ATOM 0 HB3 GLN A 127 -21.523 -15.591 0.084 1.00 0.00 H new ATOM 0 HG2 GLN A 127 -23.390 -17.004 1.962 1.00 0.00 H new ATOM 0 HG3 GLN A 127 -23.116 -17.371 0.271 1.00 0.00 H new ATOM 0 HE21 GLN A 127 -22.776 -19.081 2.638 1.00 0.00 H new ATOM 0 HE22 GLN A 127 -21.091 -19.612 2.627 1.00 0.00 H new ATOM 2003 N ARG A 128 -19.128 -14.991 2.135 1.00 0.00 N ATOM 2004 CA ARG A 128 -17.835 -14.690 1.695 1.00 0.00 C ATOM 2005 C ARG A 128 -17.613 -14.942 0.218 1.00 0.00 C ATOM 2006 O ARG A 128 -16.705 -14.379 -0.374 1.00 0.00 O ATOM 2007 CB ARG A 128 -16.800 -15.415 2.477 1.00 0.00 C ATOM 2008 CG ARG A 128 -16.322 -14.685 3.707 1.00 0.00 C ATOM 2009 CD ARG A 128 -15.544 -13.462 3.308 1.00 0.00 C ATOM 2010 NE ARG A 128 -14.452 -13.780 2.355 1.00 0.00 N ATOM 2011 CZ ARG A 128 -14.240 -13.158 1.164 1.00 0.00 C ATOM 2012 NH1 ARG A 128 -14.980 -12.122 0.799 1.00 0.00 N ATOM 2013 NH2 ARG A 128 -13.302 -13.601 0.354 1.00 0.00 N ATOM 0 H ARG A 128 -19.157 -15.694 2.873 1.00 0.00 H new ATOM 0 HA ARG A 128 -17.734 -13.617 1.861 1.00 0.00 H new ATOM 0 HB2 ARG A 128 -17.201 -16.383 2.777 1.00 0.00 H new ATOM 0 HB3 ARG A 128 -15.945 -15.611 1.830 1.00 0.00 H new ATOM 0 HG2 ARG A 128 -17.174 -14.399 4.324 1.00 0.00 H new ATOM 0 HG3 ARG A 128 -15.697 -15.343 4.311 1.00 0.00 H new ATOM 0 HD2 ARG A 128 -16.219 -12.735 2.856 1.00 0.00 H new ATOM 0 HD3 ARG A 128 -15.123 -12.995 4.198 1.00 0.00 H new ATOM 0 HE ARG A 128 -13.807 -14.527 2.614 1.00 0.00 H new ATOM 0 HH11 ARG A 128 -15.719 -11.782 1.414 1.00 0.00 H new ATOM 0 HH12 ARG A 128 -14.811 -11.665 -0.097 1.00 0.00 H new ATOM 0 HH21 ARG A 128 -12.737 -14.408 0.620 1.00 0.00 H new ATOM 0 HH22 ARG A 128 -13.140 -13.138 -0.540 1.00 0.00 H new ATOM 2027 N ALA A 129 -18.371 -15.854 -0.325 1.00 0.00 N ATOM 2028 CA ALA A 129 -18.308 -16.184 -1.695 1.00 0.00 C ATOM 2029 C ALA A 129 -18.524 -15.000 -2.621 1.00 0.00 C ATOM 2030 O ALA A 129 -19.638 -14.517 -2.795 1.00 0.00 O ATOM 2031 CB ALA A 129 -19.238 -17.266 -2.020 1.00 0.00 C ATOM 0 H ALA A 129 -19.061 -16.393 0.198 1.00 0.00 H new ATOM 0 HA ALA A 129 -17.287 -16.524 -1.868 1.00 0.00 H new ATOM 0 HB1 ALA A 129 -19.168 -17.499 -3.082 1.00 0.00 H new ATOM 0 HB2 ALA A 129 -18.985 -18.151 -1.437 1.00 0.00 H new ATOM 0 HB3 ALA A 129 -20.255 -16.955 -1.783 1.00 0.00 H new ATOM 2037 N GLU A 130 -17.439 -14.592 -3.216 1.00 0.00 N ATOM 2038 CA GLU A 130 -17.345 -13.493 -4.136 1.00 0.00 C ATOM 2039 C GLU A 130 -15.946 -13.468 -4.702 1.00 0.00 C ATOM 2040 O GLU A 130 -15.745 -13.628 -5.897 1.00 0.00 O ATOM 2041 CB GLU A 130 -17.859 -12.120 -3.560 1.00 0.00 C ATOM 2042 CG GLU A 130 -17.267 -11.629 -2.218 1.00 0.00 C ATOM 2043 CD GLU A 130 -15.942 -10.901 -2.322 1.00 0.00 C ATOM 2044 OE1 GLU A 130 -14.950 -11.389 -1.738 1.00 0.00 O ATOM 2045 OE2 GLU A 130 -15.885 -9.833 -2.984 1.00 0.00 O ATOM 0 H GLU A 130 -16.539 -15.047 -3.062 1.00 0.00 H new ATOM 0 HA GLU A 130 -18.042 -13.653 -4.958 1.00 0.00 H new ATOM 0 HB2 GLU A 130 -17.670 -11.352 -4.310 1.00 0.00 H new ATOM 0 HB3 GLU A 130 -18.940 -12.191 -3.442 1.00 0.00 H new ATOM 0 HG2 GLU A 130 -17.990 -10.967 -1.742 1.00 0.00 H new ATOM 0 HG3 GLU A 130 -17.140 -12.489 -1.560 1.00 0.00 H new ATOM 2052 N GLN A 131 -14.996 -13.326 -3.839 1.00 0.00 N ATOM 2053 CA GLN A 131 -13.623 -13.483 -4.184 1.00 0.00 C ATOM 2054 C GLN A 131 -13.075 -14.519 -3.240 1.00 0.00 C ATOM 2055 O GLN A 131 -12.508 -14.211 -2.194 1.00 0.00 O ATOM 2056 CB GLN A 131 -12.847 -12.159 -4.117 1.00 0.00 C ATOM 2057 CG GLN A 131 -11.393 -12.270 -4.559 1.00 0.00 C ATOM 2058 CD GLN A 131 -10.657 -10.940 -4.557 1.00 0.00 C ATOM 2059 OE1 GLN A 131 -9.749 -10.733 -5.341 1.00 0.00 O ATOM 2060 NE2 GLN A 131 -11.040 -10.035 -3.688 1.00 0.00 N ATOM 0 H GLN A 131 -15.155 -13.094 -2.859 1.00 0.00 H new ATOM 0 HA GLN A 131 -13.516 -13.805 -5.220 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -13.351 -11.422 -4.743 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -12.878 -11.783 -3.094 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -10.873 -12.965 -3.900 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -11.358 -12.695 -5.562 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -11.804 -10.238 -3.044 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -10.574 -9.128 -3.657 1.00 0.00 H new ATOM 2069 N GLN A 132 -13.364 -15.743 -3.572 1.00 0.00 N ATOM 2070 CA GLN A 132 -13.048 -16.872 -2.777 1.00 0.00 C ATOM 2071 C GLN A 132 -12.241 -17.881 -3.538 1.00 0.00 C ATOM 2072 O GLN A 132 -12.026 -17.732 -4.745 1.00 0.00 O ATOM 2073 CB GLN A 132 -14.305 -17.536 -2.264 1.00 0.00 C ATOM 2074 CG GLN A 132 -14.788 -17.056 -0.915 1.00 0.00 C ATOM 2075 CD GLN A 132 -13.743 -17.251 0.176 1.00 0.00 C ATOM 2076 OE1 GLN A 132 -12.964 -16.349 0.490 1.00 0.00 O ATOM 2077 NE2 GLN A 132 -13.667 -18.442 0.706 1.00 0.00 N ATOM 0 H GLN A 132 -13.845 -15.981 -4.439 1.00 0.00 H new ATOM 0 HA GLN A 132 -12.454 -16.509 -1.938 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -15.101 -17.380 -2.992 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -14.131 -18.610 -2.207 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -15.050 -16.000 -0.980 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -15.697 -17.593 -0.645 1.00 0.00 H new ATOM 0 HE21 GLN A 132 -14.326 -19.168 0.426 1.00 0.00 H new ATOM 0 HE22 GLN A 132 -12.948 -18.646 1.400 1.00 0.00 H new ATOM 2086 N ALA A 133 -11.836 -18.892 -2.831 1.00 0.00 N ATOM 2087 CA ALA A 133 -11.099 -19.994 -3.312 1.00 0.00 C ATOM 2088 C ALA A 133 -11.464 -21.094 -2.372 1.00 0.00 C ATOM 2089 O ALA A 133 -11.745 -22.205 -2.815 1.00 0.00 O ATOM 2090 CB ALA A 133 -9.607 -19.714 -3.256 1.00 0.00 C ATOM 2091 OXT ALA A 133 -11.623 -20.751 -1.163 1.00 0.00 O ATOM 0 H ALA A 133 -12.032 -18.962 -1.832 1.00 0.00 H new ATOM 0 HA ALA A 133 -11.321 -20.230 -4.353 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -9.060 -20.579 -3.632 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -9.377 -18.844 -3.871 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -9.312 -19.519 -2.225 1.00 0.00 H new TER 2097 ALA A 133