USER MOD reduce.3.24.130724 H: found=0, std=0, add=1198, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1198 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 117 ASN : amide:sc= -1.57 X(o=-3.7,f=-3.5) USER MOD Set 1.2: A 134 GLN : amide:sc= -2.17 K(o=-3.7,f=-9.2) USER MOD Set 2.1: A 115 ASN : amide:sc= -6.32! C(o=-7.7!,f=-13!) USER MOD Set 2.2: A 131 GLN : amide:sc= -1.39 K(o=-7.7,f=-19!) USER MOD Set 3.1: A 47 HIS :FLIP no HD1:sc= -2.91! F(o=-5.3,f=-3.6!) USER MOD Set 3.2: A 78 ASN : amide:sc= -0.738 K(o=-3.6,f=-5.3!) USER MOD Set 4.1: A 73 ASN : amide:sc= -10.5! C(o=-15!,f=-20!) USER MOD Set 4.2: A 136 MET CE :methyl -136:sc= -4.62! (180deg=-7.17!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 HIS : no HD1:sc= 0 X(o=0,f=-0.19) USER MOD Single : A 3 HIS : no HD1:sc= -0.849 X(o=-0.85,f=-0.72) USER MOD Single : A 4 HIS : no HE2:sc= -0.601 K(o=-0.6,f=-2.5) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 6 HIS : no HD1:sc= -0.105 X(o=-0.1,f=-0.58) USER MOD Single : A 7 HIS : no HD1:sc= -1.03 K(o=-1,f=-2!) USER MOD Single : A 8 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 12 HIS : no HD1:sc= -2.26 K(o=-2.3,f=-4.1!) USER MOD Single : A 13 ASN : amide:sc= -3.3 K(o=-3.3,f=-4.4!) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 HIS :FLIP no HE2:sc= -1.11 F(o=-1.6,f=-1.1) USER MOD Single : A 24 HIS : no HD1:sc= -12.3! C(o=-12!,f=-13!) USER MOD Single : A 27 THR OG1 : rot -173:sc= -3.87! USER MOD Single : A 32 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 43 MET CE :methyl -122:sc= -1.8 (180deg=-7.91!) USER MOD Single : A 48 LYS NZ :NH3+ -117:sc= 0.00186 (180deg=0) USER MOD Single : A 49 SER OG : rot -130:sc= -1.64 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 SER OG : rot 168:sc= -4.55! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0.104 USER MOD Single : A 68 SER OG : rot -116:sc= 0.572 USER MOD Single : A 71 SER OG : rot -160:sc= -0.715 USER MOD Single : A 72 HIS : no HE2:sc= -0.692 K(o=-0.69,f=-1.9!) USER MOD Single : A 76 MET CE :methyl -118:sc= -3.99 (180deg=-7.41!) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot -8:sc= 0.683 USER MOD Single : A 96 TYR OH : rot -49:sc= 0.42 USER MOD Single : A 106 SER OG : rot -95:sc= -0.226 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 110 HIS : no HE2:sc= -1.96 K(o=-2,f=-6.7!) USER MOD Single : A 119 ASN : amide:sc= -3.28! C(o=-3.3!,f=-3.7!) USER MOD Single : A 121 SER OG : rot 39:sc= 0.137 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 TYR OH : rot -57:sc= -1.96! USER MOD Single : A 126 TYR OH : rot 180:sc= -0.343 USER MOD Single : A 128 SER OG : rot 180:sc= -0.0253 USER MOD Single : A 137 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 GLN : amide:sc= -2.68! C(o=-2.7!,f=-3.3!) USER MOD Single : A 144 THR OG1 : rot 180:sc= 0 USER MOD Single : A 150 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 152 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -22.795 -18.456 -17.603 1.00 0.00 N ATOM 2 CA MET A 1 -22.687 -16.977 -17.515 1.00 0.00 C ATOM 3 C MET A 1 -21.724 -16.432 -18.565 1.00 0.00 C ATOM 4 O MET A 1 -20.563 -16.833 -18.624 1.00 0.00 O ATOM 5 CB MET A 1 -22.205 -16.607 -16.111 1.00 0.00 C ATOM 6 CG MET A 1 -22.924 -15.406 -15.517 1.00 0.00 C ATOM 7 SD MET A 1 -21.896 -14.481 -14.362 1.00 0.00 S ATOM 8 CE MET A 1 -22.380 -15.226 -12.807 1.00 0.00 C ATOM 0 H1 MET A 1 -23.456 -18.800 -16.878 1.00 0.00 H new ATOM 0 H2 MET A 1 -23.145 -18.723 -18.545 1.00 0.00 H new ATOM 0 H3 MET A 1 -21.859 -18.882 -17.448 1.00 0.00 H new ATOM 0 HA MET A 1 -23.664 -16.533 -17.705 1.00 0.00 H new ATOM 0 HB2 MET A 1 -22.341 -17.464 -15.452 1.00 0.00 H new ATOM 0 HB3 MET A 1 -21.136 -16.399 -16.146 1.00 0.00 H new ATOM 0 HG2 MET A 1 -23.244 -14.745 -16.322 1.00 0.00 H new ATOM 0 HG3 MET A 1 -23.825 -15.744 -15.005 1.00 0.00 H new ATOM 0 HE1 MET A 1 -21.828 -14.758 -11.992 1.00 0.00 H new ATOM 0 HE2 MET A 1 -23.449 -15.081 -12.651 1.00 0.00 H new ATOM 0 HE3 MET A 1 -22.158 -16.293 -12.830 1.00 0.00 H new ATOM 20 N HIS A 2 -22.216 -15.514 -19.391 1.00 0.00 N ATOM 21 CA HIS A 2 -21.398 -14.914 -20.439 1.00 0.00 C ATOM 22 C HIS A 2 -21.431 -13.391 -20.349 1.00 0.00 C ATOM 23 O HIS A 2 -20.393 -12.733 -20.426 1.00 0.00 O ATOM 24 CB HIS A 2 -21.886 -15.364 -21.817 1.00 0.00 C ATOM 25 CG HIS A 2 -20.816 -15.357 -22.863 1.00 0.00 C ATOM 26 ND1 HIS A 2 -20.112 -14.224 -23.214 1.00 0.00 N ATOM 27 CD2 HIS A 2 -20.327 -16.356 -23.638 1.00 0.00 C ATOM 28 CE1 HIS A 2 -19.239 -14.526 -24.159 1.00 0.00 C ATOM 29 NE2 HIS A 2 -19.348 -15.812 -24.432 1.00 0.00 N ATOM 0 H HIS A 2 -23.176 -15.170 -19.355 1.00 0.00 H new ATOM 0 HA HIS A 2 -20.370 -15.248 -20.298 1.00 0.00 H new ATOM 0 HB2 HIS A 2 -22.297 -16.370 -21.737 1.00 0.00 H new ATOM 0 HB3 HIS A 2 -22.699 -14.712 -22.136 1.00 0.00 H new ATOM 0 HD2 HIS A 2 -20.648 -17.387 -23.632 1.00 0.00 H new ATOM 0 HE1 HIS A 2 -18.553 -13.837 -24.628 1.00 0.00 H new ATOM 0 HE2 HIS A 2 -18.794 -16.320 -25.122 1.00 0.00 H new ATOM 38 N HIS A 3 -22.628 -12.838 -20.186 1.00 0.00 N ATOM 39 CA HIS A 3 -22.795 -11.393 -20.085 1.00 0.00 C ATOM 40 C HIS A 3 -22.384 -10.892 -18.704 1.00 0.00 C ATOM 41 O HIS A 3 -22.981 -11.266 -17.695 1.00 0.00 O ATOM 42 CB HIS A 3 -24.247 -11.006 -20.369 1.00 0.00 C ATOM 43 CG HIS A 3 -25.235 -11.687 -19.473 1.00 0.00 C ATOM 44 ND1 HIS A 3 -25.754 -11.096 -18.341 1.00 0.00 N ATOM 45 CD2 HIS A 3 -25.798 -12.916 -19.547 1.00 0.00 C ATOM 46 CE1 HIS A 3 -26.594 -11.933 -17.756 1.00 0.00 C ATOM 47 NE2 HIS A 3 -26.639 -13.042 -18.468 1.00 0.00 N ATOM 0 H HIS A 3 -23.497 -13.369 -20.121 1.00 0.00 H new ATOM 0 HA HIS A 3 -22.149 -10.925 -20.828 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -24.354 -9.927 -20.261 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -24.483 -11.247 -21.406 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -25.619 -13.658 -20.311 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -27.149 -11.741 -16.849 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -27.207 -13.861 -18.252 1.00 0.00 H new ATOM 56 N HIS A 4 -21.362 -10.046 -18.669 1.00 0.00 N ATOM 57 CA HIS A 4 -20.870 -9.493 -17.412 1.00 0.00 C ATOM 58 C HIS A 4 -20.830 -7.969 -17.466 1.00 0.00 C ATOM 59 O HIS A 4 -19.836 -7.379 -17.887 1.00 0.00 O ATOM 60 CB HIS A 4 -19.475 -10.039 -17.101 1.00 0.00 C ATOM 61 CG HIS A 4 -18.479 -9.792 -18.189 1.00 0.00 C ATOM 62 ND1 HIS A 4 -18.523 -10.433 -19.410 1.00 0.00 N ATOM 63 CD2 HIS A 4 -17.406 -8.967 -18.239 1.00 0.00 C ATOM 64 CE1 HIS A 4 -17.521 -10.014 -20.161 1.00 0.00 C ATOM 65 NE2 HIS A 4 -16.828 -9.123 -19.475 1.00 0.00 N ATOM 0 H HIS A 4 -20.857 -9.727 -19.496 1.00 0.00 H new ATOM 0 HA HIS A 4 -21.556 -9.793 -16.620 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -19.113 -9.584 -16.179 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -19.546 -11.112 -16.921 1.00 0.00 H new ATOM 0 HD1 HIS A 4 -19.221 -11.123 -19.689 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -17.068 -8.309 -17.453 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -17.305 -10.344 -21.166 1.00 0.00 H new ATOM 74 N HIS A 5 -21.918 -7.337 -17.036 1.00 0.00 N ATOM 75 CA HIS A 5 -22.008 -5.882 -17.036 1.00 0.00 C ATOM 76 C HIS A 5 -22.197 -5.349 -15.620 1.00 0.00 C ATOM 77 O HIS A 5 -23.190 -5.650 -14.959 1.00 0.00 O ATOM 78 CB HIS A 5 -23.164 -5.423 -17.928 1.00 0.00 C ATOM 79 CG HIS A 5 -22.757 -4.429 -18.971 1.00 0.00 C ATOM 80 ND1 HIS A 5 -21.959 -4.753 -20.049 1.00 0.00 N ATOM 81 CD2 HIS A 5 -23.041 -3.111 -19.100 1.00 0.00 C ATOM 82 CE1 HIS A 5 -21.769 -3.677 -20.793 1.00 0.00 C ATOM 83 NE2 HIS A 5 -22.416 -2.669 -20.239 1.00 0.00 N ATOM 0 H HIS A 5 -22.750 -7.811 -16.683 1.00 0.00 H new ATOM 0 HA HIS A 5 -21.074 -5.484 -17.431 1.00 0.00 H new ATOM 0 HB2 HIS A 5 -23.602 -6.293 -18.418 1.00 0.00 H new ATOM 0 HB3 HIS A 5 -23.942 -4.984 -17.303 1.00 0.00 H new ATOM 0 HD2 HIS A 5 -23.647 -2.518 -18.431 1.00 0.00 H new ATOM 0 HE1 HIS A 5 -21.184 -3.631 -21.700 1.00 0.00 H new ATOM 0 HE2 HIS A 5 -22.447 -1.715 -20.599 1.00 0.00 H new ATOM 92 N HIS A 6 -21.234 -4.555 -15.158 1.00 0.00 N ATOM 93 CA HIS A 6 -21.294 -3.980 -13.820 1.00 0.00 C ATOM 94 C HIS A 6 -21.243 -2.457 -13.880 1.00 0.00 C ATOM 95 O HIS A 6 -20.343 -1.879 -14.489 1.00 0.00 O ATOM 96 CB HIS A 6 -20.141 -4.507 -12.965 1.00 0.00 C ATOM 97 CG HIS A 6 -18.793 -4.299 -13.582 1.00 0.00 C ATOM 98 ND1 HIS A 6 -18.032 -3.170 -13.364 1.00 0.00 N ATOM 99 CD2 HIS A 6 -18.071 -5.082 -14.416 1.00 0.00 C ATOM 100 CE1 HIS A 6 -16.900 -3.268 -14.038 1.00 0.00 C ATOM 101 NE2 HIS A 6 -16.898 -4.419 -14.684 1.00 0.00 N ATOM 0 H HIS A 6 -20.404 -4.296 -15.691 1.00 0.00 H new ATOM 0 HA HIS A 6 -22.240 -4.276 -13.366 1.00 0.00 H new ATOM 0 HB2 HIS A 6 -20.166 -4.015 -11.993 1.00 0.00 H new ATOM 0 HB3 HIS A 6 -20.289 -5.572 -12.787 1.00 0.00 H new ATOM 0 HD2 HIS A 6 -18.362 -6.049 -14.800 1.00 0.00 H new ATOM 0 HE1 HIS A 6 -16.110 -2.531 -14.057 1.00 0.00 H new ATOM 0 HE2 HIS A 6 -16.148 -4.761 -15.285 1.00 0.00 H new ATOM 110 N HIS A 7 -22.216 -1.811 -13.243 1.00 0.00 N ATOM 111 CA HIS A 7 -22.281 -0.356 -13.225 1.00 0.00 C ATOM 112 C HIS A 7 -22.846 0.147 -11.900 1.00 0.00 C ATOM 113 O HIS A 7 -24.061 0.273 -11.740 1.00 0.00 O ATOM 114 CB HIS A 7 -23.141 0.152 -14.383 1.00 0.00 C ATOM 115 CG HIS A 7 -24.507 -0.459 -14.427 1.00 0.00 C ATOM 116 ND1 HIS A 7 -25.623 0.153 -13.893 1.00 0.00 N ATOM 117 CD2 HIS A 7 -24.937 -1.633 -14.947 1.00 0.00 C ATOM 118 CE1 HIS A 7 -26.679 -0.620 -14.081 1.00 0.00 C ATOM 119 NE2 HIS A 7 -26.290 -1.709 -14.719 1.00 0.00 N ATOM 0 H HIS A 7 -22.969 -2.273 -12.733 1.00 0.00 H new ATOM 0 HA HIS A 7 -21.267 0.029 -13.338 1.00 0.00 H new ATOM 0 HB2 HIS A 7 -23.239 1.235 -14.305 1.00 0.00 H new ATOM 0 HB3 HIS A 7 -22.629 -0.055 -15.323 1.00 0.00 H new ATOM 0 HD2 HIS A 7 -24.330 -2.372 -15.448 1.00 0.00 H new ATOM 0 HE1 HIS A 7 -27.688 -0.399 -13.766 1.00 0.00 H new ATOM 0 HE2 HIS A 7 -26.896 -2.481 -14.997 1.00 0.00 H new ATOM 128 N MET A 8 -21.958 0.430 -10.952 1.00 0.00 N ATOM 129 CA MET A 8 -22.369 0.918 -9.642 1.00 0.00 C ATOM 130 C MET A 8 -21.296 1.818 -9.036 1.00 0.00 C ATOM 131 O MET A 8 -20.174 1.886 -9.537 1.00 0.00 O ATOM 132 CB MET A 8 -22.655 -0.256 -8.703 1.00 0.00 C ATOM 133 CG MET A 8 -24.005 -0.910 -8.946 1.00 0.00 C ATOM 134 SD MET A 8 -24.513 -1.977 -7.583 1.00 0.00 S ATOM 135 CE MET A 8 -23.385 -3.352 -7.792 1.00 0.00 C ATOM 0 H MET A 8 -20.950 0.329 -11.067 1.00 0.00 H new ATOM 0 HA MET A 8 -23.280 1.503 -9.769 1.00 0.00 H new ATOM 0 HB2 MET A 8 -21.871 -1.004 -8.820 1.00 0.00 H new ATOM 0 HB3 MET A 8 -22.610 0.094 -7.672 1.00 0.00 H new ATOM 0 HG2 MET A 8 -24.758 -0.136 -9.097 1.00 0.00 H new ATOM 0 HG3 MET A 8 -23.961 -1.496 -9.864 1.00 0.00 H new ATOM 0 HE1 MET A 8 -23.575 -4.099 -7.021 1.00 0.00 H new ATOM 0 HE2 MET A 8 -23.535 -3.799 -8.775 1.00 0.00 H new ATOM 0 HE3 MET A 8 -22.358 -2.996 -7.708 1.00 0.00 H new ATOM 145 N SER A 9 -21.651 2.510 -7.958 1.00 0.00 N ATOM 146 CA SER A 9 -20.719 3.407 -7.286 1.00 0.00 C ATOM 147 C SER A 9 -19.934 2.668 -6.206 1.00 0.00 C ATOM 148 O SER A 9 -18.704 2.639 -6.229 1.00 0.00 O ATOM 149 CB SER A 9 -21.470 4.587 -6.667 1.00 0.00 C ATOM 150 OG SER A 9 -22.059 5.399 -7.667 1.00 0.00 O ATOM 0 H SER A 9 -22.577 2.467 -7.532 1.00 0.00 H new ATOM 0 HA SER A 9 -20.016 3.782 -8.030 1.00 0.00 H new ATOM 0 HB2 SER A 9 -22.243 4.217 -5.993 1.00 0.00 H new ATOM 0 HB3 SER A 9 -20.783 5.184 -6.067 1.00 0.00 H new ATOM 0 HG SER A 9 -22.534 6.145 -7.245 1.00 0.00 H new ATOM 156 N ASP A 10 -20.654 2.071 -5.262 1.00 0.00 N ATOM 157 CA ASP A 10 -20.025 1.332 -4.173 1.00 0.00 C ATOM 158 C ASP A 10 -19.119 2.242 -3.350 1.00 0.00 C ATOM 159 O ASP A 10 -18.017 2.587 -3.776 1.00 0.00 O ATOM 160 CB ASP A 10 -19.218 0.156 -4.727 1.00 0.00 C ATOM 161 CG ASP A 10 -20.048 -1.107 -4.855 1.00 0.00 C ATOM 162 OD1 ASP A 10 -20.255 -1.787 -3.830 1.00 0.00 O ATOM 163 OD2 ASP A 10 -20.492 -1.414 -5.982 1.00 0.00 O ATOM 0 H ASP A 10 -21.673 2.084 -5.229 1.00 0.00 H new ATOM 0 HA ASP A 10 -20.813 0.950 -3.524 1.00 0.00 H new ATOM 0 HB2 ASP A 10 -18.816 0.423 -5.704 1.00 0.00 H new ATOM 0 HB3 ASP A 10 -18.367 -0.037 -4.074 1.00 0.00 H new ATOM 168 N GLY A 11 -19.591 2.628 -2.170 1.00 0.00 N ATOM 169 CA GLY A 11 -18.812 3.496 -1.308 1.00 0.00 C ATOM 170 C GLY A 11 -18.851 4.944 -1.753 1.00 0.00 C ATOM 171 O GLY A 11 -19.209 5.240 -2.894 1.00 0.00 O ATOM 0 H GLY A 11 -20.500 2.355 -1.795 1.00 0.00 H new ATOM 0 HA2 GLY A 11 -19.189 3.423 -0.288 1.00 0.00 H new ATOM 0 HA3 GLY A 11 -17.778 3.152 -1.291 1.00 0.00 H new ATOM 175 N HIS A 12 -18.483 5.849 -0.854 1.00 0.00 N ATOM 176 CA HIS A 12 -18.479 7.276 -1.161 1.00 0.00 C ATOM 177 C HIS A 12 -17.396 8.001 -0.367 1.00 0.00 C ATOM 178 O HIS A 12 -17.632 8.451 0.753 1.00 0.00 O ATOM 179 CB HIS A 12 -19.847 7.888 -0.853 1.00 0.00 C ATOM 180 CG HIS A 12 -20.972 7.241 -1.600 1.00 0.00 C ATOM 181 ND1 HIS A 12 -21.459 5.987 -1.293 1.00 0.00 N ATOM 182 CD2 HIS A 12 -21.709 7.682 -2.647 1.00 0.00 C ATOM 183 CE1 HIS A 12 -22.445 5.684 -2.118 1.00 0.00 C ATOM 184 NE2 HIS A 12 -22.618 6.695 -2.948 1.00 0.00 N ATOM 0 H HIS A 12 -18.183 5.621 0.094 1.00 0.00 H new ATOM 0 HA HIS A 12 -18.266 7.393 -2.223 1.00 0.00 H new ATOM 0 HB2 HIS A 12 -20.039 7.809 0.217 1.00 0.00 H new ATOM 0 HB3 HIS A 12 -19.824 8.950 -1.095 1.00 0.00 H new ATOM 0 HD2 HIS A 12 -21.603 8.631 -3.151 1.00 0.00 H new ATOM 0 HE1 HIS A 12 -23.013 4.765 -2.114 1.00 0.00 H new ATOM 0 HE2 HIS A 12 -23.314 6.738 -3.693 1.00 0.00 H new ATOM 193 N ASN A 13 -16.208 8.109 -0.956 1.00 0.00 N ATOM 194 CA ASN A 13 -15.090 8.778 -0.302 1.00 0.00 C ATOM 195 C ASN A 13 -14.022 9.179 -1.315 1.00 0.00 C ATOM 196 O ASN A 13 -13.919 10.344 -1.700 1.00 0.00 O ATOM 197 CB ASN A 13 -14.482 7.871 0.769 1.00 0.00 C ATOM 198 CG ASN A 13 -15.293 7.860 2.049 1.00 0.00 C ATOM 199 OD1 ASN A 13 -15.171 8.758 2.883 1.00 0.00 O ATOM 200 ND2 ASN A 13 -16.127 6.839 2.215 1.00 0.00 N ATOM 0 H ASN A 13 -15.996 7.742 -1.884 1.00 0.00 H new ATOM 0 HA ASN A 13 -15.469 9.684 0.171 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -14.408 6.855 0.381 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -13.467 8.203 0.988 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -16.697 6.778 3.059 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -16.197 6.116 1.499 1.00 0.00 H new ATOM 207 N GLY A 14 -13.225 8.205 -1.744 1.00 0.00 N ATOM 208 CA GLY A 14 -12.172 8.470 -2.707 1.00 0.00 C ATOM 209 C GLY A 14 -11.216 7.301 -2.847 1.00 0.00 C ATOM 210 O GLY A 14 -10.795 6.715 -1.849 1.00 0.00 O ATOM 0 H GLY A 14 -13.290 7.233 -1.440 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -12.617 8.692 -3.677 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -11.617 9.357 -2.401 1.00 0.00 H new ATOM 214 N LEU A 15 -10.879 6.954 -4.084 1.00 0.00 N ATOM 215 CA LEU A 15 -9.975 5.836 -4.338 1.00 0.00 C ATOM 216 C LEU A 15 -9.192 6.036 -5.635 1.00 0.00 C ATOM 217 O LEU A 15 -9.264 7.094 -6.260 1.00 0.00 O ATOM 218 CB LEU A 15 -10.769 4.528 -4.402 1.00 0.00 C ATOM 219 CG LEU A 15 -11.154 3.937 -3.044 1.00 0.00 C ATOM 220 CD1 LEU A 15 -12.203 2.851 -3.214 1.00 0.00 C ATOM 221 CD2 LEU A 15 -9.925 3.386 -2.336 1.00 0.00 C ATOM 0 H LEU A 15 -11.215 7.427 -4.923 1.00 0.00 H new ATOM 0 HA LEU A 15 -9.259 5.787 -3.518 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -11.679 4.701 -4.977 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -10.181 3.790 -4.949 1.00 0.00 H new ATOM 0 HG LEU A 15 -11.578 4.731 -2.430 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -12.465 2.442 -2.238 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -13.093 3.274 -3.681 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -11.805 2.057 -3.845 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -10.217 2.970 -1.372 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -9.473 2.605 -2.947 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -9.204 4.189 -2.181 1.00 0.00 H new ATOM 233 N GLY A 16 -8.443 5.005 -6.025 1.00 0.00 N ATOM 234 CA GLY A 16 -7.648 5.059 -7.239 1.00 0.00 C ATOM 235 C GLY A 16 -8.499 5.153 -8.493 1.00 0.00 C ATOM 236 O GLY A 16 -8.494 4.244 -9.322 1.00 0.00 O ATOM 0 H GLY A 16 -8.374 4.125 -5.514 1.00 0.00 H new ATOM 0 HA2 GLY A 16 -6.980 5.919 -7.193 1.00 0.00 H new ATOM 0 HA3 GLY A 16 -7.020 4.170 -7.297 1.00 0.00 H new ATOM 240 N LYS A 17 -9.227 6.256 -8.633 1.00 0.00 N ATOM 241 CA LYS A 17 -10.082 6.465 -9.795 1.00 0.00 C ATOM 242 C LYS A 17 -9.483 7.523 -10.717 1.00 0.00 C ATOM 243 O LYS A 17 -9.966 8.652 -10.784 1.00 0.00 O ATOM 244 CB LYS A 17 -11.487 6.882 -9.356 1.00 0.00 C ATOM 245 CG LYS A 17 -12.428 5.709 -9.133 1.00 0.00 C ATOM 246 CD LYS A 17 -13.852 6.172 -8.870 1.00 0.00 C ATOM 247 CE LYS A 17 -14.305 5.817 -7.463 1.00 0.00 C ATOM 248 NZ LYS A 17 -15.771 5.563 -7.397 1.00 0.00 N ATOM 0 H LYS A 17 -9.242 7.019 -7.956 1.00 0.00 H new ATOM 0 HA LYS A 17 -10.151 5.525 -10.343 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -11.414 7.459 -8.434 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -11.914 7.541 -10.112 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -12.413 5.059 -10.008 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -12.076 5.116 -8.289 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -13.917 7.251 -9.012 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -14.524 5.714 -9.596 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -13.768 4.932 -7.122 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -14.047 6.629 -6.783 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -16.038 5.324 -6.421 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -16.285 6.415 -7.698 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -16.015 4.771 -8.026 1.00 0.00 H new ATOM 262 N GLY A 18 -8.422 7.145 -11.421 1.00 0.00 N ATOM 263 CA GLY A 18 -7.760 8.064 -12.327 1.00 0.00 C ATOM 264 C GLY A 18 -6.392 7.566 -12.747 1.00 0.00 C ATOM 265 O GLY A 18 -5.917 7.881 -13.839 1.00 0.00 O ATOM 0 H GLY A 18 -8.007 6.214 -11.380 1.00 0.00 H new ATOM 0 HA2 GLY A 18 -8.380 8.209 -13.212 1.00 0.00 H new ATOM 0 HA3 GLY A 18 -7.659 9.037 -11.846 1.00 0.00 H new ATOM 269 N PHE A 19 -5.757 6.787 -11.878 1.00 0.00 N ATOM 270 CA PHE A 19 -4.436 6.242 -12.159 1.00 0.00 C ATOM 271 C PHE A 19 -4.522 5.087 -13.147 1.00 0.00 C ATOM 272 O PHE A 19 -3.929 5.133 -14.224 1.00 0.00 O ATOM 273 CB PHE A 19 -3.767 5.774 -10.867 1.00 0.00 C ATOM 274 CG PHE A 19 -3.671 6.849 -9.821 1.00 0.00 C ATOM 275 CD1 PHE A 19 -3.411 8.161 -10.183 1.00 0.00 C ATOM 276 CD2 PHE A 19 -3.843 6.545 -8.482 1.00 0.00 C ATOM 277 CE1 PHE A 19 -3.324 9.151 -9.223 1.00 0.00 C ATOM 278 CE2 PHE A 19 -3.759 7.531 -7.518 1.00 0.00 C ATOM 279 CZ PHE A 19 -3.499 8.836 -7.888 1.00 0.00 C ATOM 0 H PHE A 19 -6.138 6.519 -10.971 1.00 0.00 H new ATOM 0 HA PHE A 19 -3.834 7.033 -12.605 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -4.327 4.932 -10.461 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -2.765 5.410 -11.096 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -3.275 8.412 -11.225 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -4.045 5.526 -8.187 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -3.119 10.170 -9.515 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -3.896 7.282 -6.476 1.00 0.00 H new ATOM 0 HZ PHE A 19 -3.433 9.609 -7.136 1.00 0.00 H new ATOM 289 N GLY A 20 -5.262 4.050 -12.773 1.00 0.00 N ATOM 290 CA GLY A 20 -5.404 2.898 -13.640 1.00 0.00 C ATOM 291 C GLY A 20 -6.826 2.361 -13.662 1.00 0.00 C ATOM 292 O GLY A 20 -7.548 2.530 -14.644 1.00 0.00 O ATOM 0 H GLY A 20 -5.764 3.987 -11.888 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -5.105 3.170 -14.652 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -4.726 2.111 -13.308 1.00 0.00 H new ATOM 296 N ASP A 21 -7.217 1.705 -12.570 1.00 0.00 N ATOM 297 CA ASP A 21 -8.554 1.125 -12.440 1.00 0.00 C ATOM 298 C ASP A 21 -8.702 0.454 -11.065 1.00 0.00 C ATOM 299 O ASP A 21 -8.304 1.028 -10.056 1.00 0.00 O ATOM 300 CB ASP A 21 -8.802 0.124 -13.576 1.00 0.00 C ATOM 301 CG ASP A 21 -10.277 -0.035 -13.893 1.00 0.00 C ATOM 302 OD1 ASP A 21 -11.058 -0.310 -12.959 1.00 0.00 O ATOM 303 OD2 ASP A 21 -10.648 0.117 -15.077 1.00 0.00 O ATOM 0 H ASP A 21 -6.621 1.561 -11.755 1.00 0.00 H new ATOM 0 HA ASP A 21 -9.302 1.915 -12.514 1.00 0.00 H new ATOM 0 HB2 ASP A 21 -8.274 0.455 -14.470 1.00 0.00 H new ATOM 0 HB3 ASP A 21 -8.386 -0.845 -13.301 1.00 0.00 H new ATOM 308 N HIS A 22 -9.261 -0.759 -11.018 1.00 0.00 N ATOM 309 CA HIS A 22 -9.420 -1.470 -9.751 1.00 0.00 C ATOM 310 C HIS A 22 -8.143 -2.235 -9.422 1.00 0.00 C ATOM 311 O HIS A 22 -7.909 -3.324 -9.948 1.00 0.00 O ATOM 312 CB HIS A 22 -10.608 -2.433 -9.821 1.00 0.00 C ATOM 313 CG HIS A 22 -10.462 -3.494 -10.868 1.00 0.00 C ATOM 314 ND1 HIS A 22 -10.554 -3.429 -12.218 1.00 0.00 N flip ATOM 315 CD2 HIS A 22 -10.186 -4.812 -10.570 1.00 0.00 C flip ATOM 316 CE1 HIS A 22 -10.335 -4.695 -12.703 1.00 0.00 C flip ATOM 317 NE2 HIS A 22 -10.116 -5.511 -11.690 1.00 0.00 N flip ATOM 0 H HIS A 22 -9.607 -1.263 -11.835 1.00 0.00 H new ATOM 0 HA HIS A 22 -9.613 -0.742 -8.963 1.00 0.00 H new ATOM 0 HB2 HIS A 22 -10.736 -2.909 -8.849 1.00 0.00 H new ATOM 0 HB3 HIS A 22 -11.516 -1.863 -10.018 1.00 0.00 H new ATOM 0 HD1 HIS A 22 -10.750 -2.595 -12.771 1.00 0.00 H new ATOM 0 HD2 HIS A 22 -10.048 -5.211 -9.576 1.00 0.00 H new ATOM 0 HE1 HIS A 22 -10.341 -4.977 -13.746 1.00 0.00 H new ATOM 326 N ILE A 23 -7.299 -1.645 -8.577 1.00 0.00 N ATOM 327 CA ILE A 23 -6.025 -2.264 -8.220 1.00 0.00 C ATOM 328 C ILE A 23 -5.701 -2.111 -6.720 1.00 0.00 C ATOM 329 O ILE A 23 -6.220 -2.859 -5.876 1.00 0.00 O ATOM 330 CB ILE A 23 -4.894 -1.646 -9.074 1.00 0.00 C ATOM 331 CG1 ILE A 23 -5.190 -1.809 -10.565 1.00 0.00 C ATOM 332 CG2 ILE A 23 -3.549 -2.251 -8.725 1.00 0.00 C ATOM 333 CD1 ILE A 23 -5.479 -0.498 -11.258 1.00 0.00 C ATOM 0 H ILE A 23 -7.473 -0.745 -8.130 1.00 0.00 H new ATOM 0 HA ILE A 23 -6.105 -3.332 -8.424 1.00 0.00 H new ATOM 0 HB ILE A 23 -4.850 -0.581 -8.847 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -4.339 -2.289 -11.048 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -6.044 -2.475 -10.689 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -2.774 -1.796 -9.342 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -3.329 -2.068 -7.673 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -3.575 -3.325 -8.908 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.681 -0.681 -12.313 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.348 -0.027 -10.798 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -4.617 0.162 -11.163 1.00 0.00 H new ATOM 345 N HIS A 24 -4.835 -1.143 -6.394 1.00 0.00 N ATOM 346 CA HIS A 24 -4.439 -0.897 -5.012 1.00 0.00 C ATOM 347 C HIS A 24 -5.441 0.021 -4.312 1.00 0.00 C ATOM 348 O HIS A 24 -5.074 0.804 -3.439 1.00 0.00 O ATOM 349 CB HIS A 24 -3.043 -0.276 -4.951 1.00 0.00 C ATOM 350 CG HIS A 24 -2.114 -0.760 -6.024 1.00 0.00 C ATOM 351 ND1 HIS A 24 -1.416 0.090 -6.856 1.00 0.00 N ATOM 352 CD2 HIS A 24 -1.759 -2.015 -6.390 1.00 0.00 C ATOM 353 CE1 HIS A 24 -0.673 -0.620 -7.685 1.00 0.00 C ATOM 354 NE2 HIS A 24 -0.862 -1.899 -7.423 1.00 0.00 N ATOM 0 H HIS A 24 -4.398 -0.520 -7.073 1.00 0.00 H new ATOM 0 HA HIS A 24 -4.423 -1.857 -4.497 1.00 0.00 H new ATOM 0 HB2 HIS A 24 -3.135 0.808 -5.025 1.00 0.00 H new ATOM 0 HB3 HIS A 24 -2.602 -0.492 -3.978 1.00 0.00 H new ATOM 0 HD2 HIS A 24 -2.115 -2.935 -5.951 1.00 0.00 H new ATOM 0 HE1 HIS A 24 -0.021 -0.221 -8.448 1.00 0.00 H new ATOM 0 HE2 HIS A 24 -0.414 -2.676 -7.909 1.00 0.00 H new ATOM 363 N TRP A 25 -6.706 -0.081 -4.713 1.00 0.00 N ATOM 364 CA TRP A 25 -7.769 0.741 -4.140 1.00 0.00 C ATOM 365 C TRP A 25 -9.123 0.055 -4.228 1.00 0.00 C ATOM 366 O TRP A 25 -10.083 0.507 -3.602 1.00 0.00 O ATOM 367 CB TRP A 25 -7.864 2.075 -4.867 1.00 0.00 C ATOM 368 CG TRP A 25 -7.128 2.084 -6.156 1.00 0.00 C ATOM 369 CD1 TRP A 25 -7.642 1.820 -7.385 1.00 0.00 C ATOM 370 CD2 TRP A 25 -5.741 2.360 -6.343 1.00 0.00 C ATOM 371 NE1 TRP A 25 -6.660 1.924 -8.329 1.00 0.00 N ATOM 372 CE2 TRP A 25 -5.482 2.257 -7.718 1.00 0.00 C ATOM 373 CE3 TRP A 25 -4.694 2.690 -5.483 1.00 0.00 C ATOM 374 CZ2 TRP A 25 -4.218 2.472 -8.255 1.00 0.00 C ATOM 375 CZ3 TRP A 25 -3.440 2.903 -6.014 1.00 0.00 C ATOM 376 CH2 TRP A 25 -3.209 2.795 -7.390 1.00 0.00 C ATOM 0 H TRP A 25 -7.021 -0.728 -5.436 1.00 0.00 H new ATOM 0 HA TRP A 25 -7.514 0.896 -3.092 1.00 0.00 H new ATOM 0 HB2 TRP A 25 -8.913 2.309 -5.051 1.00 0.00 H new ATOM 0 HB3 TRP A 25 -7.470 2.862 -4.224 1.00 0.00 H new ATOM 0 HD1 TRP A 25 -8.672 1.566 -7.586 1.00 0.00 H new ATOM 0 HE1 TRP A 25 -6.785 1.777 -9.331 1.00 0.00 H new ATOM 0 HE3 TRP A 25 -4.863 2.777 -4.420 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 -4.039 2.387 -9.317 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 -2.622 3.158 -5.357 1.00 0.00 H new ATOM 0 HH2 TRP A 25 -2.216 2.970 -7.776 1.00 0.00 H new ATOM 387 N ARG A 26 -9.205 -1.025 -5.010 1.00 0.00 N ATOM 388 CA ARG A 26 -10.460 -1.753 -5.171 1.00 0.00 C ATOM 389 C ARG A 26 -11.332 -1.650 -3.909 1.00 0.00 C ATOM 390 O ARG A 26 -12.532 -1.401 -3.999 1.00 0.00 O ATOM 391 CB ARG A 26 -10.177 -3.224 -5.496 1.00 0.00 C ATOM 392 CG ARG A 26 -11.262 -4.202 -5.056 1.00 0.00 C ATOM 393 CD ARG A 26 -12.629 -3.779 -5.551 1.00 0.00 C ATOM 394 NE ARG A 26 -13.159 -4.701 -6.552 1.00 0.00 N ATOM 395 CZ ARG A 26 -14.454 -4.842 -6.823 1.00 0.00 C ATOM 396 NH1 ARG A 26 -15.358 -4.116 -6.177 1.00 0.00 N ATOM 397 NH2 ARG A 26 -14.848 -5.711 -7.745 1.00 0.00 N ATOM 0 H ARG A 26 -8.421 -1.410 -5.537 1.00 0.00 H new ATOM 0 HA ARG A 26 -11.008 -1.300 -5.997 1.00 0.00 H new ATOM 0 HB2 ARG A 26 -10.036 -3.322 -6.572 1.00 0.00 H new ATOM 0 HB3 ARG A 26 -9.237 -3.511 -5.024 1.00 0.00 H new ATOM 0 HG2 ARG A 26 -11.030 -5.198 -5.434 1.00 0.00 H new ATOM 0 HG3 ARG A 26 -11.273 -4.268 -3.968 1.00 0.00 H new ATOM 0 HD2 ARG A 26 -13.318 -3.724 -4.708 1.00 0.00 H new ATOM 0 HD3 ARG A 26 -12.566 -2.778 -5.978 1.00 0.00 H new ATOM 0 HE ARG A 26 -12.496 -5.272 -7.076 1.00 0.00 H new ATOM 0 HH11 ARG A 26 -15.061 -3.445 -5.468 1.00 0.00 H new ATOM 0 HH12 ARG A 26 -16.349 -4.229 -6.389 1.00 0.00 H new ATOM 0 HH21 ARG A 26 -14.158 -6.271 -8.246 1.00 0.00 H new ATOM 0 HH22 ARG A 26 -15.841 -5.819 -7.953 1.00 0.00 H new ATOM 411 N THR A 27 -10.709 -1.837 -2.732 1.00 0.00 N ATOM 412 CA THR A 27 -11.420 -1.759 -1.451 1.00 0.00 C ATOM 413 C THR A 27 -10.582 -2.360 -0.327 1.00 0.00 C ATOM 414 O THR A 27 -9.849 -3.329 -0.534 1.00 0.00 O ATOM 415 CB THR A 27 -12.775 -2.478 -1.516 1.00 0.00 C ATOM 416 OG1 THR A 27 -12.794 -3.429 -2.567 1.00 0.00 O ATOM 417 CG2 THR A 27 -13.944 -1.540 -1.721 1.00 0.00 C ATOM 0 H THR A 27 -9.714 -2.043 -2.645 1.00 0.00 H new ATOM 0 HA THR A 27 -11.595 -0.703 -1.245 1.00 0.00 H new ATOM 0 HB THR A 27 -12.887 -2.963 -0.546 1.00 0.00 H new ATOM 0 HG1 THR A 27 -13.698 -3.795 -2.661 1.00 0.00 H new ATOM 0 HG21 THR A 27 -14.870 -2.115 -1.757 1.00 0.00 H new ATOM 0 HG22 THR A 27 -13.990 -0.830 -0.895 1.00 0.00 H new ATOM 0 HG23 THR A 27 -13.816 -0.999 -2.658 1.00 0.00 H new ATOM 425 N LEU A 28 -10.700 -1.783 0.864 1.00 0.00 N ATOM 426 CA LEU A 28 -9.958 -2.263 2.026 1.00 0.00 C ATOM 427 C LEU A 28 -10.624 -3.500 2.620 1.00 0.00 C ATOM 428 O LEU A 28 -9.967 -4.512 2.864 1.00 0.00 O ATOM 429 CB LEU A 28 -9.859 -1.159 3.085 1.00 0.00 C ATOM 430 CG LEU A 28 -9.071 -1.528 4.346 1.00 0.00 C ATOM 431 CD1 LEU A 28 -9.920 -2.382 5.277 1.00 0.00 C ATOM 432 CD2 LEU A 28 -7.782 -2.251 3.985 1.00 0.00 C ATOM 0 H LEU A 28 -11.303 -0.982 1.051 1.00 0.00 H new ATOM 0 HA LEU A 28 -8.953 -2.535 1.702 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -9.396 -0.283 2.631 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -10.868 -0.869 3.379 1.00 0.00 H new ATOM 0 HG LEU A 28 -8.810 -0.606 4.866 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -9.343 -2.634 6.167 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -10.812 -1.827 5.568 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -10.214 -3.298 4.764 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -7.239 -2.503 4.896 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -8.018 -3.164 3.438 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -7.164 -1.604 3.362 1.00 0.00 H new ATOM 444 N GLU A 29 -11.930 -3.411 2.851 1.00 0.00 N ATOM 445 CA GLU A 29 -12.684 -4.525 3.417 1.00 0.00 C ATOM 446 C GLU A 29 -12.552 -5.770 2.547 1.00 0.00 C ATOM 447 O GLU A 29 -12.144 -6.830 3.020 1.00 0.00 O ATOM 448 CB GLU A 29 -14.160 -4.146 3.565 1.00 0.00 C ATOM 449 CG GLU A 29 -14.971 -5.158 4.359 1.00 0.00 C ATOM 450 CD GLU A 29 -15.882 -5.993 3.482 1.00 0.00 C ATOM 451 OE1 GLU A 29 -16.588 -5.408 2.633 1.00 0.00 O ATOM 452 OE2 GLU A 29 -15.891 -7.231 3.643 1.00 0.00 O ATOM 0 H GLU A 29 -12.488 -2.580 2.655 1.00 0.00 H new ATOM 0 HA GLU A 29 -12.272 -4.747 4.401 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -14.230 -3.174 4.053 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -14.600 -4.038 2.574 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -14.292 -5.816 4.902 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -15.570 -4.634 5.104 1.00 0.00 H new ATOM 459 N ASP A 30 -12.898 -5.634 1.270 1.00 0.00 N ATOM 460 CA ASP A 30 -12.815 -6.749 0.335 1.00 0.00 C ATOM 461 C ASP A 30 -11.382 -7.259 0.226 1.00 0.00 C ATOM 462 O ASP A 30 -11.149 -8.445 -0.009 1.00 0.00 O ATOM 463 CB ASP A 30 -13.326 -6.324 -1.044 1.00 0.00 C ATOM 464 CG ASP A 30 -14.741 -6.804 -1.308 1.00 0.00 C ATOM 465 OD1 ASP A 30 -14.931 -8.027 -1.472 1.00 0.00 O ATOM 466 OD2 ASP A 30 -15.657 -5.957 -1.348 1.00 0.00 O ATOM 0 H ASP A 30 -13.238 -4.764 0.861 1.00 0.00 H new ATOM 0 HA ASP A 30 -13.441 -7.557 0.713 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -13.293 -5.237 -1.122 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -12.662 -6.719 -1.813 1.00 0.00 H new ATOM 471 N GLY A 31 -10.423 -6.353 0.400 1.00 0.00 N ATOM 472 CA GLY A 31 -9.025 -6.731 0.318 1.00 0.00 C ATOM 473 C GLY A 31 -8.591 -7.610 1.474 1.00 0.00 C ATOM 474 O GLY A 31 -7.753 -8.496 1.308 1.00 0.00 O ATOM 0 H GLY A 31 -10.590 -5.366 0.596 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -8.849 -7.257 -0.620 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -8.410 -5.832 0.299 1.00 0.00 H new ATOM 478 N LYS A 32 -9.162 -7.366 2.648 1.00 0.00 N ATOM 479 CA LYS A 32 -8.829 -8.144 3.836 1.00 0.00 C ATOM 480 C LYS A 32 -9.368 -9.566 3.720 1.00 0.00 C ATOM 481 O LYS A 32 -8.696 -10.527 4.094 1.00 0.00 O ATOM 482 CB LYS A 32 -9.394 -7.473 5.089 1.00 0.00 C ATOM 483 CG LYS A 32 -8.913 -8.103 6.386 1.00 0.00 C ATOM 484 CD LYS A 32 -10.013 -8.127 7.435 1.00 0.00 C ATOM 485 CE LYS A 32 -10.745 -9.460 7.446 1.00 0.00 C ATOM 486 NZ LYS A 32 -11.960 -9.420 8.305 1.00 0.00 N ATOM 0 H LYS A 32 -9.857 -6.636 2.803 1.00 0.00 H new ATOM 0 HA LYS A 32 -7.743 -8.189 3.917 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -9.117 -6.419 5.082 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -10.483 -7.517 5.055 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -8.571 -9.120 6.193 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -8.057 -7.546 6.767 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -9.583 -7.939 8.419 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -10.722 -7.323 7.238 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -11.029 -9.726 6.428 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -10.073 -10.240 7.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -12.430 -10.348 8.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -11.687 -9.191 9.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -12.613 -8.693 7.949 1.00 0.00 H new ATOM 500 N LYS A 33 -10.583 -9.691 3.200 1.00 0.00 N ATOM 501 CA LYS A 33 -11.214 -10.995 3.033 1.00 0.00 C ATOM 502 C LYS A 33 -10.455 -11.842 2.018 1.00 0.00 C ATOM 503 O LYS A 33 -10.196 -13.023 2.250 1.00 0.00 O ATOM 504 CB LYS A 33 -12.668 -10.826 2.588 1.00 0.00 C ATOM 505 CG LYS A 33 -13.435 -12.138 2.505 1.00 0.00 C ATOM 506 CD LYS A 33 -14.390 -12.152 1.321 1.00 0.00 C ATOM 507 CE LYS A 33 -14.179 -13.378 0.446 1.00 0.00 C ATOM 508 NZ LYS A 33 -13.482 -13.038 -0.826 1.00 0.00 N ATOM 0 H LYS A 33 -11.152 -8.905 2.886 1.00 0.00 H new ATOM 0 HA LYS A 33 -11.191 -11.508 3.995 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -13.178 -10.160 3.284 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.687 -10.341 1.612 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.732 -12.966 2.417 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -13.995 -12.292 3.427 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.418 -12.135 1.682 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -14.246 -11.250 0.726 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.596 -14.119 0.993 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.143 -13.834 0.221 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -13.357 -13.900 -1.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -14.051 -12.350 -1.360 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.551 -12.626 -0.612 1.00 0.00 H new ATOM 522 N GLU A 34 -10.099 -11.231 0.893 1.00 0.00 N ATOM 523 CA GLU A 34 -9.367 -11.931 -0.157 1.00 0.00 C ATOM 524 C GLU A 34 -7.937 -12.230 0.279 1.00 0.00 C ATOM 525 O GLU A 34 -7.445 -13.345 0.104 1.00 0.00 O ATOM 526 CB GLU A 34 -9.357 -11.104 -1.442 1.00 0.00 C ATOM 527 CG GLU A 34 -8.645 -11.790 -2.594 1.00 0.00 C ATOM 528 CD GLU A 34 -9.315 -11.534 -3.929 1.00 0.00 C ATOM 529 OE1 GLU A 34 -10.452 -12.013 -4.124 1.00 0.00 O ATOM 530 OE2 GLU A 34 -8.704 -10.855 -4.780 1.00 0.00 O ATOM 0 H GLU A 34 -10.305 -10.254 0.685 1.00 0.00 H new ATOM 0 HA GLU A 34 -9.875 -12.877 -0.346 1.00 0.00 H new ATOM 0 HB2 GLU A 34 -10.385 -10.890 -1.736 1.00 0.00 H new ATOM 0 HB3 GLU A 34 -8.875 -10.146 -1.245 1.00 0.00 H new ATOM 0 HG2 GLU A 34 -7.613 -11.442 -2.637 1.00 0.00 H new ATOM 0 HG3 GLU A 34 -8.612 -12.864 -2.408 1.00 0.00 H new ATOM 537 N ALA A 35 -7.274 -11.226 0.844 1.00 0.00 N ATOM 538 CA ALA A 35 -5.899 -11.383 1.305 1.00 0.00 C ATOM 539 C ALA A 35 -5.774 -12.543 2.288 1.00 0.00 C ATOM 540 O ALA A 35 -4.696 -13.113 2.455 1.00 0.00 O ATOM 541 CB ALA A 35 -5.406 -10.092 1.943 1.00 0.00 C ATOM 0 H ALA A 35 -7.666 -10.296 0.994 1.00 0.00 H new ATOM 0 HA ALA A 35 -5.277 -11.609 0.439 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -4.379 -10.223 2.283 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -5.446 -9.286 1.211 1.00 0.00 H new ATOM 0 HB3 ALA A 35 -6.040 -9.841 2.793 1.00 0.00 H new ATOM 547 N ALA A 36 -6.883 -12.891 2.933 1.00 0.00 N ATOM 548 CA ALA A 36 -6.896 -13.986 3.896 1.00 0.00 C ATOM 549 C ALA A 36 -6.738 -15.332 3.200 1.00 0.00 C ATOM 550 O ALA A 36 -5.870 -16.129 3.557 1.00 0.00 O ATOM 551 CB ALA A 36 -8.183 -13.956 4.706 1.00 0.00 C ATOM 0 H ALA A 36 -7.784 -12.430 2.806 1.00 0.00 H new ATOM 0 HA ALA A 36 -6.050 -13.856 4.571 1.00 0.00 H new ATOM 0 HB1 ALA A 36 -8.182 -14.778 5.422 1.00 0.00 H new ATOM 0 HB2 ALA A 36 -8.254 -13.009 5.241 1.00 0.00 H new ATOM 0 HB3 ALA A 36 -9.037 -14.059 4.036 1.00 0.00 H new ATOM 557 N ALA A 37 -7.584 -15.582 2.207 1.00 0.00 N ATOM 558 CA ALA A 37 -7.542 -16.835 1.461 1.00 0.00 C ATOM 559 C ALA A 37 -6.182 -17.038 0.798 1.00 0.00 C ATOM 560 O ALA A 37 -5.370 -17.839 1.261 1.00 0.00 O ATOM 561 CB ALA A 37 -8.648 -16.863 0.418 1.00 0.00 C ATOM 0 H ALA A 37 -8.308 -14.933 1.899 1.00 0.00 H new ATOM 0 HA ALA A 37 -7.698 -17.653 2.165 1.00 0.00 H new ATOM 0 HB1 ALA A 37 -8.606 -17.803 -0.132 1.00 0.00 H new ATOM 0 HB2 ALA A 37 -9.616 -16.774 0.912 1.00 0.00 H new ATOM 0 HB3 ALA A 37 -8.516 -16.032 -0.274 1.00 0.00 H new ATOM 567 N SER A 38 -5.943 -16.310 -0.288 1.00 0.00 N ATOM 568 CA SER A 38 -4.685 -16.413 -1.018 1.00 0.00 C ATOM 569 C SER A 38 -3.492 -16.157 -0.098 1.00 0.00 C ATOM 570 O SER A 38 -2.413 -16.713 -0.298 1.00 0.00 O ATOM 571 CB SER A 38 -4.665 -15.421 -2.183 1.00 0.00 C ATOM 572 OG SER A 38 -5.029 -16.054 -3.398 1.00 0.00 O ATOM 0 H SER A 38 -6.605 -15.642 -0.682 1.00 0.00 H new ATOM 0 HA SER A 38 -4.606 -17.428 -1.409 1.00 0.00 H new ATOM 0 HB2 SER A 38 -5.351 -14.600 -1.977 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.669 -14.988 -2.279 1.00 0.00 H new ATOM 0 HG SER A 38 -5.010 -15.399 -4.127 1.00 0.00 H new ATOM 578 N GLY A 39 -3.695 -15.312 0.908 1.00 0.00 N ATOM 579 CA GLY A 39 -2.628 -15.000 1.839 1.00 0.00 C ATOM 580 C GLY A 39 -1.608 -14.046 1.250 1.00 0.00 C ATOM 581 O GLY A 39 -0.404 -14.274 1.355 1.00 0.00 O ATOM 0 H GLY A 39 -4.579 -14.838 1.094 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -3.054 -14.561 2.741 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -2.129 -15.922 2.138 1.00 0.00 H new ATOM 585 N LEU A 40 -2.090 -12.974 0.629 1.00 0.00 N ATOM 586 CA LEU A 40 -1.207 -11.985 0.021 1.00 0.00 C ATOM 587 C LEU A 40 -1.219 -10.677 0.813 1.00 0.00 C ATOM 588 O LEU A 40 -2.208 -10.344 1.463 1.00 0.00 O ATOM 589 CB LEU A 40 -1.616 -11.722 -1.431 1.00 0.00 C ATOM 590 CG LEU A 40 -3.099 -11.415 -1.649 1.00 0.00 C ATOM 591 CD1 LEU A 40 -3.460 -10.073 -1.034 1.00 0.00 C ATOM 592 CD2 LEU A 40 -3.432 -11.432 -3.134 1.00 0.00 C ATOM 0 H LEU A 40 -3.084 -12.768 0.534 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.194 -12.387 0.036 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -1.029 -10.885 -1.810 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -1.351 -12.594 -2.029 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.689 -12.187 -1.156 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.518 -9.870 -1.198 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -3.257 -10.097 0.037 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -2.864 -9.288 -1.499 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -4.491 -11.212 -3.272 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -2.835 -10.680 -3.649 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -3.210 -12.417 -3.546 1.00 0.00 H new ATOM 604 N PRO A 41 -0.108 -9.922 0.769 1.00 0.00 N ATOM 605 CA PRO A 41 0.019 -8.647 1.489 1.00 0.00 C ATOM 606 C PRO A 41 -0.935 -7.576 0.974 1.00 0.00 C ATOM 607 O PRO A 41 -1.526 -7.702 -0.101 1.00 0.00 O ATOM 608 CB PRO A 41 1.472 -8.232 1.233 1.00 0.00 C ATOM 609 CG PRO A 41 1.862 -8.951 -0.011 1.00 0.00 C ATOM 610 CD PRO A 41 1.117 -10.254 0.023 1.00 0.00 C ATOM 0 HA PRO A 41 -0.231 -8.759 2.544 1.00 0.00 H new ATOM 0 HB2 PRO A 41 1.559 -7.153 1.109 1.00 0.00 H new ATOM 0 HB3 PRO A 41 2.115 -8.510 2.068 1.00 0.00 H new ATOM 0 HG2 PRO A 41 1.599 -8.372 -0.897 1.00 0.00 H new ATOM 0 HG3 PRO A 41 2.939 -9.116 -0.047 1.00 0.00 H new ATOM 0 HD2 PRO A 41 0.892 -10.615 -0.980 1.00 0.00 H new ATOM 0 HD3 PRO A 41 1.693 -11.034 0.521 1.00 0.00 H new ATOM 618 N LEU A 42 -1.076 -6.510 1.752 1.00 0.00 N ATOM 619 CA LEU A 42 -1.952 -5.413 1.382 1.00 0.00 C ATOM 620 C LEU A 42 -1.156 -4.275 0.756 1.00 0.00 C ATOM 621 O LEU A 42 0.021 -4.071 1.070 1.00 0.00 O ATOM 622 CB LEU A 42 -2.725 -4.910 2.603 1.00 0.00 C ATOM 623 CG LEU A 42 -4.105 -5.538 2.800 1.00 0.00 C ATOM 624 CD1 LEU A 42 -3.975 -7.003 3.187 1.00 0.00 C ATOM 625 CD2 LEU A 42 -4.891 -4.774 3.854 1.00 0.00 C ATOM 0 H LEU A 42 -0.594 -6.385 2.642 1.00 0.00 H new ATOM 0 HA LEU A 42 -2.665 -5.781 0.644 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -2.127 -5.097 3.495 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -2.843 -3.830 2.519 1.00 0.00 H new ATOM 0 HG LEU A 42 -4.648 -5.480 1.857 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -4.967 -7.433 3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -3.451 -7.543 2.398 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -3.414 -7.085 4.118 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -5.871 -5.234 3.982 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -4.351 -4.801 4.801 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -5.015 -3.739 3.536 1.00 0.00 H new ATOM 637 N MET A 43 -1.810 -3.541 -0.133 1.00 0.00 N ATOM 638 CA MET A 43 -1.180 -2.425 -0.816 1.00 0.00 C ATOM 639 C MET A 43 -1.707 -1.099 -0.270 1.00 0.00 C ATOM 640 O MET A 43 -2.657 -0.529 -0.808 1.00 0.00 O ATOM 641 CB MET A 43 -1.430 -2.527 -2.321 1.00 0.00 C ATOM 642 CG MET A 43 -0.533 -1.620 -3.141 1.00 0.00 C ATOM 643 SD MET A 43 1.207 -2.079 -3.032 1.00 0.00 S ATOM 644 CE MET A 43 1.747 -1.045 -1.674 1.00 0.00 C ATOM 0 H MET A 43 -2.782 -3.701 -0.398 1.00 0.00 H new ATOM 0 HA MET A 43 -0.105 -2.462 -0.637 1.00 0.00 H new ATOM 0 HB2 MET A 43 -1.279 -3.559 -2.638 1.00 0.00 H new ATOM 0 HB3 MET A 43 -2.471 -2.279 -2.527 1.00 0.00 H new ATOM 0 HG2 MET A 43 -0.848 -1.651 -4.184 1.00 0.00 H new ATOM 0 HG3 MET A 43 -0.655 -0.591 -2.801 1.00 0.00 H new ATOM 0 HE1 MET A 43 2.563 -0.403 -2.007 1.00 0.00 H new ATOM 0 HE2 MET A 43 0.916 -0.428 -1.334 1.00 0.00 H new ATOM 0 HE3 MET A 43 2.092 -1.673 -0.853 1.00 0.00 H new ATOM 654 N VAL A 44 -1.090 -0.623 0.810 1.00 0.00 N ATOM 655 CA VAL A 44 -1.502 0.625 1.444 1.00 0.00 C ATOM 656 C VAL A 44 -0.946 1.843 0.721 1.00 0.00 C ATOM 657 O VAL A 44 -0.030 2.504 1.211 1.00 0.00 O ATOM 658 CB VAL A 44 -1.059 0.692 2.917 1.00 0.00 C ATOM 659 CG1 VAL A 44 -1.698 1.885 3.614 1.00 0.00 C ATOM 660 CG2 VAL A 44 -1.397 -0.598 3.638 1.00 0.00 C ATOM 0 H VAL A 44 -0.302 -1.085 1.264 1.00 0.00 H new ATOM 0 HA VAL A 44 -2.591 0.638 1.389 1.00 0.00 H new ATOM 0 HB VAL A 44 0.023 0.821 2.944 1.00 0.00 H new ATOM 0 HG11 VAL A 44 -1.373 1.916 4.654 1.00 0.00 H new ATOM 0 HG12 VAL A 44 -1.396 2.804 3.112 1.00 0.00 H new ATOM 0 HG13 VAL A 44 -2.783 1.790 3.576 1.00 0.00 H new ATOM 0 HG21 VAL A 44 -1.075 -0.529 4.677 1.00 0.00 H new ATOM 0 HG22 VAL A 44 -2.474 -0.764 3.602 1.00 0.00 H new ATOM 0 HG23 VAL A 44 -0.885 -1.430 3.154 1.00 0.00 H new ATOM 670 N ILE A 45 -1.520 2.157 -0.430 1.00 0.00 N ATOM 671 CA ILE A 45 -1.089 3.318 -1.188 1.00 0.00 C ATOM 672 C ILE A 45 -1.864 4.544 -0.725 1.00 0.00 C ATOM 673 O ILE A 45 -3.072 4.622 -0.904 1.00 0.00 O ATOM 674 CB ILE A 45 -1.289 3.118 -2.709 1.00 0.00 C ATOM 675 CG1 ILE A 45 -0.245 2.140 -3.249 1.00 0.00 C ATOM 676 CG2 ILE A 45 -1.203 4.446 -3.452 1.00 0.00 C ATOM 677 CD1 ILE A 45 -0.399 1.842 -4.724 1.00 0.00 C ATOM 0 H ILE A 45 -2.280 1.627 -0.856 1.00 0.00 H new ATOM 0 HA ILE A 45 -0.023 3.459 -1.009 1.00 0.00 H new ATOM 0 HB ILE A 45 -2.284 2.704 -2.872 1.00 0.00 H new ATOM 0 HG12 ILE A 45 0.750 2.549 -3.072 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -0.310 1.207 -2.690 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -1.347 4.276 -4.519 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -1.977 5.120 -3.084 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -0.223 4.894 -3.285 1.00 0.00 H new ATOM 0 HD11 ILE A 45 0.375 1.142 -5.036 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -1.380 1.403 -4.906 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -0.304 2.766 -5.294 1.00 0.00 H new ATOM 689 N ILE A 46 -1.172 5.492 -0.115 1.00 0.00 N ATOM 690 CA ILE A 46 -1.821 6.695 0.372 1.00 0.00 C ATOM 691 C ILE A 46 -1.297 7.911 -0.368 1.00 0.00 C ATOM 692 O ILE A 46 -0.115 7.980 -0.704 1.00 0.00 O ATOM 693 CB ILE A 46 -1.616 6.880 1.884 1.00 0.00 C ATOM 694 CG1 ILE A 46 -1.767 5.543 2.605 1.00 0.00 C ATOM 695 CG2 ILE A 46 -2.611 7.884 2.438 1.00 0.00 C ATOM 696 CD1 ILE A 46 -0.805 5.379 3.758 1.00 0.00 C ATOM 0 H ILE A 46 -0.167 5.452 0.053 1.00 0.00 H new ATOM 0 HA ILE A 46 -2.890 6.588 0.187 1.00 0.00 H new ATOM 0 HB ILE A 46 -0.608 7.260 2.050 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -2.788 5.450 2.976 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -1.612 4.733 1.892 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -2.451 8.002 3.510 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -2.472 8.845 1.942 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -3.625 7.527 2.260 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -0.963 4.409 4.229 1.00 0.00 H new ATOM 0 HD12 ILE A 46 0.219 5.441 3.389 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -0.976 6.169 4.489 1.00 0.00 H new ATOM 708 N HIS A 47 -2.181 8.857 -0.647 1.00 0.00 N ATOM 709 CA HIS A 47 -1.776 10.050 -1.380 1.00 0.00 C ATOM 710 C HIS A 47 -2.479 11.305 -0.885 1.00 0.00 C ATOM 711 O HIS A 47 -3.696 11.437 -1.009 1.00 0.00 O ATOM 712 CB HIS A 47 -2.060 9.860 -2.869 1.00 0.00 C ATOM 713 CG HIS A 47 -3.485 9.503 -3.163 1.00 0.00 C ATOM 714 ND1 HIS A 47 -4.295 8.559 -2.625 1.00 0.00 N flip ATOM 715 CD2 HIS A 47 -4.241 10.154 -4.116 1.00 0.00 C flip ATOM 716 CE1 HIS A 47 -5.509 8.657 -3.257 1.00 0.00 C flip ATOM 717 NE2 HIS A 47 -5.452 9.626 -4.151 1.00 0.00 N flip ATOM 0 H HIS A 47 -3.166 8.826 -0.384 1.00 0.00 H new ATOM 0 HA HIS A 47 -0.708 10.186 -1.211 1.00 0.00 H new ATOM 0 HB2 HIS A 47 -1.806 10.778 -3.399 1.00 0.00 H new ATOM 0 HB3 HIS A 47 -1.409 9.077 -3.258 1.00 0.00 H new ATOM 0 HD2 HIS A 47 -3.897 10.968 -4.737 1.00 0.00 H new ATOM 0 HE1 HIS A 47 -6.372 8.040 -3.055 1.00 0.00 H new ATOM 0 HE2 HIS A 47 -6.213 9.918 -4.764 1.00 0.00 H new ATOM 726 N LYS A 48 -1.700 12.238 -0.345 1.00 0.00 N ATOM 727 CA LYS A 48 -2.265 13.501 0.141 1.00 0.00 C ATOM 728 C LYS A 48 -1.518 14.702 -0.436 1.00 0.00 C ATOM 729 O LYS A 48 -0.365 14.590 -0.850 1.00 0.00 O ATOM 730 CB LYS A 48 -2.251 13.557 1.669 1.00 0.00 C ATOM 731 CG LYS A 48 -3.627 13.795 2.274 1.00 0.00 C ATOM 732 CD LYS A 48 -3.870 12.915 3.488 1.00 0.00 C ATOM 733 CE LYS A 48 -2.954 13.288 4.641 1.00 0.00 C ATOM 734 NZ LYS A 48 -3.430 14.506 5.356 1.00 0.00 N ATOM 0 H LYS A 48 -0.690 12.150 -0.232 1.00 0.00 H new ATOM 0 HA LYS A 48 -3.300 13.546 -0.199 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -1.848 12.621 2.057 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -1.578 14.352 1.991 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -3.722 14.843 2.560 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -4.393 13.599 1.524 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.909 13.008 3.803 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.711 11.871 3.219 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -2.895 12.455 5.342 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -1.946 13.459 4.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -2.722 15.262 5.263 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -4.330 14.822 4.942 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -3.571 14.285 6.362 1.00 0.00 H new ATOM 748 N SER A 49 -2.193 15.853 -0.463 1.00 0.00 N ATOM 749 CA SER A 49 -1.603 17.081 -0.993 1.00 0.00 C ATOM 750 C SER A 49 -1.315 16.943 -2.485 1.00 0.00 C ATOM 751 O SER A 49 -1.705 15.956 -3.107 1.00 0.00 O ATOM 752 CB SER A 49 -0.316 17.423 -0.240 1.00 0.00 C ATOM 753 OG SER A 49 -0.560 18.377 0.781 1.00 0.00 O ATOM 0 H SER A 49 -3.149 15.959 -0.124 1.00 0.00 H new ATOM 0 HA SER A 49 -2.320 17.890 -0.852 1.00 0.00 H new ATOM 0 HB2 SER A 49 0.105 16.517 0.197 1.00 0.00 H new ATOM 0 HB3 SER A 49 0.424 17.814 -0.938 1.00 0.00 H new ATOM 0 HG SER A 49 0.089 19.108 0.708 1.00 0.00 H new ATOM 759 N TRP A 50 -0.628 17.933 -3.053 1.00 0.00 N ATOM 760 CA TRP A 50 -0.289 17.908 -4.473 1.00 0.00 C ATOM 761 C TRP A 50 0.714 16.793 -4.757 1.00 0.00 C ATOM 762 O TRP A 50 1.871 17.046 -5.087 1.00 0.00 O ATOM 763 CB TRP A 50 0.283 19.257 -4.920 1.00 0.00 C ATOM 764 CG TRP A 50 1.282 19.832 -3.962 1.00 0.00 C ATOM 765 CD1 TRP A 50 2.608 19.520 -3.873 1.00 0.00 C ATOM 766 CD2 TRP A 50 1.033 20.822 -2.958 1.00 0.00 C ATOM 767 NE1 TRP A 50 3.199 20.255 -2.874 1.00 0.00 N ATOM 768 CE2 TRP A 50 2.253 21.062 -2.296 1.00 0.00 C ATOM 769 CE3 TRP A 50 -0.103 21.530 -2.554 1.00 0.00 C ATOM 770 CZ2 TRP A 50 2.367 21.979 -1.255 1.00 0.00 C ATOM 771 CZ3 TRP A 50 0.012 22.439 -1.520 1.00 0.00 C ATOM 772 CH2 TRP A 50 1.239 22.656 -0.880 1.00 0.00 C ATOM 0 H TRP A 50 -0.297 18.758 -2.553 1.00 0.00 H new ATOM 0 HA TRP A 50 -1.201 17.717 -5.038 1.00 0.00 H new ATOM 0 HB2 TRP A 50 0.755 19.137 -5.895 1.00 0.00 H new ATOM 0 HB3 TRP A 50 -0.536 19.965 -5.047 1.00 0.00 H new ATOM 0 HD1 TRP A 50 3.118 18.801 -4.497 1.00 0.00 H new ATOM 0 HE1 TRP A 50 4.182 20.208 -2.606 1.00 0.00 H new ATOM 0 HE3 TRP A 50 -1.053 21.369 -3.041 1.00 0.00 H new ATOM 0 HZ2 TRP A 50 3.312 22.150 -0.761 1.00 0.00 H new ATOM 0 HZ3 TRP A 50 -0.859 22.992 -1.200 1.00 0.00 H new ATOM 0 HH2 TRP A 50 1.296 23.373 -0.074 1.00 0.00 H new ATOM 783 N CYS A 51 0.255 15.557 -4.607 1.00 0.00 N ATOM 784 CA CYS A 51 1.094 14.387 -4.825 1.00 0.00 C ATOM 785 C CYS A 51 1.444 14.211 -6.300 1.00 0.00 C ATOM 786 O CYS A 51 0.614 13.760 -7.089 1.00 0.00 O ATOM 787 CB CYS A 51 0.374 13.132 -4.324 1.00 0.00 C ATOM 788 SG CYS A 51 -1.327 12.949 -4.958 1.00 0.00 S ATOM 0 H CYS A 51 -0.703 15.339 -4.333 1.00 0.00 H new ATOM 0 HA CYS A 51 2.020 14.536 -4.270 1.00 0.00 H new ATOM 0 HB2 CYS A 51 0.954 12.254 -4.610 1.00 0.00 H new ATOM 0 HB3 CYS A 51 0.344 13.153 -3.235 1.00 0.00 H new ATOM 793 N GLY A 52 2.681 14.540 -6.669 1.00 0.00 N ATOM 794 CA GLY A 52 3.099 14.374 -8.051 1.00 0.00 C ATOM 795 C GLY A 52 2.990 12.927 -8.477 1.00 0.00 C ATOM 796 O GLY A 52 2.758 12.629 -9.647 1.00 0.00 O ATOM 0 H GLY A 52 3.394 14.914 -6.043 1.00 0.00 H new ATOM 0 HA2 GLY A 52 2.481 14.996 -8.699 1.00 0.00 H new ATOM 0 HA3 GLY A 52 4.128 14.715 -8.168 1.00 0.00 H new ATOM 800 N ALA A 53 3.139 12.027 -7.508 1.00 0.00 N ATOM 801 CA ALA A 53 3.034 10.601 -7.768 1.00 0.00 C ATOM 802 C ALA A 53 1.656 10.260 -8.297 1.00 0.00 C ATOM 803 O ALA A 53 1.442 9.184 -8.846 1.00 0.00 O ATOM 804 CB ALA A 53 3.341 9.806 -6.507 1.00 0.00 C ATOM 0 H ALA A 53 3.333 12.265 -6.535 1.00 0.00 H new ATOM 0 HA ALA A 53 3.768 10.331 -8.528 1.00 0.00 H new ATOM 0 HB1 ALA A 53 3.258 8.740 -6.720 1.00 0.00 H new ATOM 0 HB2 ALA A 53 4.354 10.031 -6.172 1.00 0.00 H new ATOM 0 HB3 ALA A 53 2.632 10.076 -5.725 1.00 0.00 H new ATOM 810 N CYS A 54 0.722 11.186 -8.146 1.00 0.00 N ATOM 811 CA CYS A 54 -0.623 10.978 -8.631 1.00 0.00 C ATOM 812 C CYS A 54 -0.780 11.589 -10.021 1.00 0.00 C ATOM 813 O CYS A 54 -1.601 11.141 -10.822 1.00 0.00 O ATOM 814 CB CYS A 54 -1.635 11.580 -7.658 1.00 0.00 C ATOM 815 SG CYS A 54 -1.312 11.158 -5.914 1.00 0.00 S ATOM 0 H CYS A 54 0.875 12.086 -7.691 1.00 0.00 H new ATOM 0 HA CYS A 54 -0.812 9.907 -8.702 1.00 0.00 H new ATOM 0 HB2 CYS A 54 -1.631 12.664 -7.767 1.00 0.00 H new ATOM 0 HB3 CYS A 54 -2.634 11.236 -7.927 1.00 0.00 H new ATOM 820 N LYS A 55 0.029 12.608 -10.303 1.00 0.00 N ATOM 821 CA LYS A 55 0.000 13.276 -11.597 1.00 0.00 C ATOM 822 C LYS A 55 0.682 12.416 -12.655 1.00 0.00 C ATOM 823 O LYS A 55 0.145 12.212 -13.744 1.00 0.00 O ATOM 824 CB LYS A 55 0.692 14.638 -11.505 1.00 0.00 C ATOM 825 CG LYS A 55 0.061 15.704 -12.388 1.00 0.00 C ATOM 826 CD LYS A 55 1.073 16.311 -13.351 1.00 0.00 C ATOM 827 CE LYS A 55 1.318 17.782 -13.053 1.00 0.00 C ATOM 828 NZ LYS A 55 1.407 18.594 -14.299 1.00 0.00 N ATOM 0 H LYS A 55 0.713 12.988 -9.649 1.00 0.00 H new ATOM 0 HA LYS A 55 -1.040 13.426 -11.885 1.00 0.00 H new ATOM 0 HB2 LYS A 55 0.671 14.977 -10.469 1.00 0.00 H new ATOM 0 HB3 LYS A 55 1.740 14.523 -11.782 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -0.762 15.267 -12.953 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -0.363 16.490 -11.763 1.00 0.00 H new ATOM 0 HD2 LYS A 55 2.013 15.764 -13.284 1.00 0.00 H new ATOM 0 HD3 LYS A 55 0.713 16.202 -14.374 1.00 0.00 H new ATOM 0 HE2 LYS A 55 0.512 18.165 -12.427 1.00 0.00 H new ATOM 0 HE3 LYS A 55 2.241 17.888 -12.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 1.574 19.590 -14.053 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 2.192 18.246 -14.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 0.516 18.514 -14.830 1.00 0.00 H new ATOM 842 N ALA A 56 1.864 11.904 -12.323 1.00 0.00 N ATOM 843 CA ALA A 56 2.618 11.057 -13.241 1.00 0.00 C ATOM 844 C ALA A 56 2.025 9.657 -13.322 1.00 0.00 C ATOM 845 O ALA A 56 2.370 8.892 -14.216 1.00 0.00 O ATOM 846 CB ALA A 56 4.078 10.989 -12.820 1.00 0.00 C ATOM 0 H ALA A 56 2.320 12.061 -11.424 1.00 0.00 H new ATOM 0 HA ALA A 56 2.556 11.503 -14.233 1.00 0.00 H new ATOM 0 HB1 ALA A 56 4.628 10.354 -13.514 1.00 0.00 H new ATOM 0 HB2 ALA A 56 4.506 11.991 -12.829 1.00 0.00 H new ATOM 0 HB3 ALA A 56 4.148 10.573 -11.815 1.00 0.00 H new ATOM 852 N LEU A 57 1.148 9.319 -12.380 1.00 0.00 N ATOM 853 CA LEU A 57 0.532 7.998 -12.354 1.00 0.00 C ATOM 854 C LEU A 57 -0.753 7.945 -13.181 1.00 0.00 C ATOM 855 O LEU A 57 -1.148 6.886 -13.654 1.00 0.00 O ATOM 856 CB LEU A 57 0.237 7.583 -10.908 1.00 0.00 C ATOM 857 CG LEU A 57 1.385 6.881 -10.171 1.00 0.00 C ATOM 858 CD1 LEU A 57 1.415 5.402 -10.510 1.00 0.00 C ATOM 859 CD2 LEU A 57 2.723 7.530 -10.502 1.00 0.00 C ATOM 0 H LEU A 57 0.850 9.940 -11.628 1.00 0.00 H new ATOM 0 HA LEU A 57 1.241 7.300 -12.800 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.043 8.473 -10.344 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.629 6.921 -10.909 1.00 0.00 H new ATOM 0 HG LEU A 57 1.211 6.987 -9.100 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.236 4.923 -9.977 1.00 0.00 H new ATOM 0 HD12 LEU A 57 0.473 4.942 -10.213 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.558 5.278 -11.583 1.00 0.00 H new ATOM 0 HD21 LEU A 57 3.520 7.014 -9.967 1.00 0.00 H new ATOM 0 HD22 LEU A 57 2.904 7.464 -11.575 1.00 0.00 H new ATOM 0 HD23 LEU A 57 2.704 8.578 -10.201 1.00 0.00 H new ATOM 871 N LYS A 58 -1.422 9.079 -13.348 1.00 0.00 N ATOM 872 CA LYS A 58 -2.668 9.103 -14.113 1.00 0.00 C ATOM 873 C LYS A 58 -2.479 8.541 -15.530 1.00 0.00 C ATOM 874 O LYS A 58 -3.016 7.480 -15.861 1.00 0.00 O ATOM 875 CB LYS A 58 -3.240 10.522 -14.174 1.00 0.00 C ATOM 876 CG LYS A 58 -4.610 10.649 -13.526 1.00 0.00 C ATOM 877 CD LYS A 58 -4.940 12.094 -13.189 1.00 0.00 C ATOM 878 CE LYS A 58 -4.926 12.974 -14.427 1.00 0.00 C ATOM 879 NZ LYS A 58 -6.176 12.833 -15.223 1.00 0.00 N ATOM 0 H LYS A 58 -1.131 9.982 -12.972 1.00 0.00 H new ATOM 0 HA LYS A 58 -3.379 8.460 -13.594 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.549 11.206 -13.682 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -3.309 10.834 -15.216 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -5.369 10.250 -14.198 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -4.640 10.047 -12.618 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -5.922 12.143 -12.718 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -4.219 12.473 -12.464 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -4.800 14.015 -14.131 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -4.069 12.713 -15.048 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -6.127 13.450 -16.059 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -6.284 11.845 -15.528 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -6.992 13.106 -14.639 1.00 0.00 H new ATOM 893 N PRO A 59 -1.708 9.237 -16.384 1.00 0.00 N ATOM 894 CA PRO A 59 -1.461 8.800 -17.763 1.00 0.00 C ATOM 895 C PRO A 59 -0.507 7.618 -17.842 1.00 0.00 C ATOM 896 O PRO A 59 -0.483 6.892 -18.837 1.00 0.00 O ATOM 897 CB PRO A 59 -0.834 10.031 -18.412 1.00 0.00 C ATOM 898 CG PRO A 59 -0.149 10.729 -17.290 1.00 0.00 C ATOM 899 CD PRO A 59 -1.004 10.497 -16.074 1.00 0.00 C ATOM 0 HA PRO A 59 -2.374 8.456 -18.249 1.00 0.00 H new ATOM 0 HB2 PRO A 59 -0.130 9.752 -19.196 1.00 0.00 H new ATOM 0 HB3 PRO A 59 -1.590 10.666 -18.873 1.00 0.00 H new ATOM 0 HG2 PRO A 59 0.856 10.335 -17.141 1.00 0.00 H new ATOM 0 HG3 PRO A 59 -0.046 11.794 -17.498 1.00 0.00 H new ATOM 0 HD2 PRO A 59 -0.401 10.408 -15.170 1.00 0.00 H new ATOM 0 HD3 PRO A 59 -1.703 11.318 -15.912 1.00 0.00 H new ATOM 907 N LYS A 60 0.281 7.428 -16.793 1.00 0.00 N ATOM 908 CA LYS A 60 1.235 6.333 -16.748 1.00 0.00 C ATOM 909 C LYS A 60 0.586 5.082 -16.187 1.00 0.00 C ATOM 910 O LYS A 60 0.462 4.068 -16.872 1.00 0.00 O ATOM 911 CB LYS A 60 2.435 6.709 -15.885 1.00 0.00 C ATOM 912 CG LYS A 60 3.157 5.507 -15.302 1.00 0.00 C ATOM 913 CD LYS A 60 3.834 4.690 -16.388 1.00 0.00 C ATOM 914 CE LYS A 60 4.964 5.472 -17.037 1.00 0.00 C ATOM 915 NZ LYS A 60 4.902 5.405 -18.523 1.00 0.00 N ATOM 0 H LYS A 60 0.277 8.019 -15.962 1.00 0.00 H new ATOM 0 HA LYS A 60 1.570 6.136 -17.766 1.00 0.00 H new ATOM 0 HB2 LYS A 60 3.136 7.290 -16.484 1.00 0.00 H new ATOM 0 HB3 LYS A 60 2.101 7.353 -15.071 1.00 0.00 H new ATOM 0 HG2 LYS A 60 3.901 5.842 -14.579 1.00 0.00 H new ATOM 0 HG3 LYS A 60 2.447 4.881 -14.762 1.00 0.00 H new ATOM 0 HD2 LYS A 60 4.225 3.766 -15.962 1.00 0.00 H new ATOM 0 HD3 LYS A 60 3.102 4.407 -17.144 1.00 0.00 H new ATOM 0 HE2 LYS A 60 4.915 6.513 -16.718 1.00 0.00 H new ATOM 0 HE3 LYS A 60 5.921 5.078 -16.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 5.689 5.951 -18.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 4.974 4.414 -18.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 3.999 5.804 -18.851 1.00 0.00 H new ATOM 929 N PHE A 61 0.174 5.164 -14.923 1.00 0.00 N ATOM 930 CA PHE A 61 -0.456 4.044 -14.259 1.00 0.00 C ATOM 931 C PHE A 61 -1.617 3.529 -15.089 1.00 0.00 C ATOM 932 O PHE A 61 -2.029 2.386 -14.935 1.00 0.00 O ATOM 933 CB PHE A 61 -0.905 4.428 -12.858 1.00 0.00 C ATOM 934 CG PHE A 61 -1.162 3.242 -11.974 1.00 0.00 C ATOM 935 CD1 PHE A 61 -0.146 2.700 -11.202 1.00 0.00 C ATOM 936 CD2 PHE A 61 -2.418 2.666 -11.919 1.00 0.00 C ATOM 937 CE1 PHE A 61 -0.382 1.604 -10.394 1.00 0.00 C ATOM 938 CE2 PHE A 61 -2.659 1.570 -11.115 1.00 0.00 C ATOM 939 CZ PHE A 61 -1.640 1.038 -10.351 1.00 0.00 C ATOM 0 H PHE A 61 0.269 5.999 -14.345 1.00 0.00 H new ATOM 0 HA PHE A 61 0.274 3.241 -14.160 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -0.143 5.057 -12.399 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -1.814 5.026 -12.926 1.00 0.00 H new ATOM 0 HD1 PHE A 61 0.840 3.139 -11.232 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.220 3.079 -12.512 1.00 0.00 H new ATOM 0 HE1 PHE A 61 0.417 1.191 -9.797 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -3.644 1.129 -11.084 1.00 0.00 H new ATOM 0 HZ PHE A 61 -1.827 0.181 -9.721 1.00 0.00 H new ATOM 949 N ALA A 62 -2.108 4.352 -16.019 1.00 0.00 N ATOM 950 CA ALA A 62 -3.165 3.908 -16.909 1.00 0.00 C ATOM 951 C ALA A 62 -2.720 2.603 -17.586 1.00 0.00 C ATOM 952 O ALA A 62 -3.540 1.800 -18.034 1.00 0.00 O ATOM 953 CB ALA A 62 -3.470 4.989 -17.937 1.00 0.00 C ATOM 0 H ALA A 62 -1.793 5.311 -16.168 1.00 0.00 H new ATOM 0 HA ALA A 62 -4.080 3.722 -16.347 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -4.264 4.647 -18.600 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -3.790 5.897 -17.426 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -2.574 5.198 -18.522 1.00 0.00 H new ATOM 959 N GLU A 63 -1.395 2.402 -17.612 1.00 0.00 N ATOM 960 CA GLU A 63 -0.765 1.210 -18.176 1.00 0.00 C ATOM 961 C GLU A 63 -0.939 0.023 -17.237 1.00 0.00 C ATOM 962 O GLU A 63 -0.720 -1.128 -17.621 1.00 0.00 O ATOM 963 CB GLU A 63 0.725 1.477 -18.415 1.00 0.00 C ATOM 964 CG GLU A 63 1.312 0.663 -19.557 1.00 0.00 C ATOM 965 CD GLU A 63 1.661 -0.753 -19.141 1.00 0.00 C ATOM 966 OE1 GLU A 63 2.688 -0.934 -18.455 1.00 0.00 O ATOM 967 OE2 GLU A 63 0.908 -1.681 -19.505 1.00 0.00 O ATOM 0 H GLU A 63 -0.726 3.074 -17.236 1.00 0.00 H new ATOM 0 HA GLU A 63 -1.244 0.973 -19.126 1.00 0.00 H new ATOM 0 HB2 GLU A 63 0.867 2.537 -18.625 1.00 0.00 H new ATOM 0 HB3 GLU A 63 1.277 1.256 -17.501 1.00 0.00 H new ATOM 0 HG2 GLU A 63 0.598 0.631 -20.380 1.00 0.00 H new ATOM 0 HG3 GLU A 63 2.207 1.160 -19.930 1.00 0.00 H new ATOM 974 N SER A 64 -1.340 0.316 -16.008 1.00 0.00 N ATOM 975 CA SER A 64 -1.560 -0.697 -14.994 1.00 0.00 C ATOM 976 C SER A 64 -2.582 -1.738 -15.439 1.00 0.00 C ATOM 977 O SER A 64 -2.932 -2.623 -14.662 1.00 0.00 O ATOM 978 CB SER A 64 -2.033 -0.039 -13.706 1.00 0.00 C ATOM 979 OG SER A 64 -0.976 0.658 -13.070 1.00 0.00 O ATOM 0 H SER A 64 -1.522 1.267 -15.688 1.00 0.00 H new ATOM 0 HA SER A 64 -0.612 -1.210 -14.829 1.00 0.00 H new ATOM 0 HB2 SER A 64 -2.848 0.651 -13.925 1.00 0.00 H new ATOM 0 HB3 SER A 64 -2.430 -0.797 -13.031 1.00 0.00 H new ATOM 0 HG SER A 64 -1.339 1.222 -12.356 1.00 0.00 H new ATOM 985 N THR A 65 -3.053 -1.655 -16.685 1.00 0.00 N ATOM 986 CA THR A 65 -4.007 -2.631 -17.189 1.00 0.00 C ATOM 987 C THR A 65 -3.510 -4.024 -16.843 1.00 0.00 C ATOM 988 O THR A 65 -4.284 -4.904 -16.464 1.00 0.00 O ATOM 989 CB THR A 65 -4.181 -2.488 -18.699 1.00 0.00 C ATOM 990 OG1 THR A 65 -3.813 -1.190 -19.126 1.00 0.00 O ATOM 991 CG2 THR A 65 -5.597 -2.740 -19.159 1.00 0.00 C ATOM 0 H THR A 65 -2.790 -0.930 -17.352 1.00 0.00 H new ATOM 0 HA THR A 65 -4.979 -2.460 -16.725 1.00 0.00 H new ATOM 0 HB THR A 65 -3.532 -3.244 -19.140 1.00 0.00 H new ATOM 0 HG1 THR A 65 -3.930 -1.119 -20.096 1.00 0.00 H new ATOM 0 HG21 THR A 65 -5.654 -2.623 -20.241 1.00 0.00 H new ATOM 0 HG22 THR A 65 -5.893 -3.753 -18.888 1.00 0.00 H new ATOM 0 HG23 THR A 65 -6.267 -2.026 -18.681 1.00 0.00 H new ATOM 999 N GLU A 66 -2.193 -4.195 -16.927 1.00 0.00 N ATOM 1000 CA GLU A 66 -1.573 -5.457 -16.574 1.00 0.00 C ATOM 1001 C GLU A 66 -1.460 -5.539 -15.065 1.00 0.00 C ATOM 1002 O GLU A 66 -1.580 -6.614 -14.478 1.00 0.00 O ATOM 1003 CB GLU A 66 -0.191 -5.603 -17.214 1.00 0.00 C ATOM 1004 CG GLU A 66 0.007 -6.937 -17.910 1.00 0.00 C ATOM 1005 CD GLU A 66 1.412 -7.481 -17.742 1.00 0.00 C ATOM 1006 OE1 GLU A 66 1.784 -7.822 -16.599 1.00 0.00 O ATOM 1007 OE2 GLU A 66 2.141 -7.563 -18.752 1.00 0.00 O ATOM 0 H GLU A 66 -1.541 -3.474 -17.236 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.194 -6.270 -16.951 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.045 -4.799 -17.935 1.00 0.00 H new ATOM 0 HB3 GLU A 66 0.573 -5.485 -16.445 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.707 -7.659 -17.514 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -0.210 -6.824 -18.972 1.00 0.00 H new ATOM 1014 N ILE A 67 -1.261 -4.382 -14.433 1.00 0.00 N ATOM 1015 CA ILE A 67 -1.175 -4.336 -12.985 1.00 0.00 C ATOM 1016 C ILE A 67 -2.533 -4.669 -12.374 1.00 0.00 C ATOM 1017 O ILE A 67 -2.631 -4.974 -11.186 1.00 0.00 O ATOM 1018 CB ILE A 67 -0.698 -2.962 -12.478 1.00 0.00 C ATOM 1019 CG1 ILE A 67 0.625 -2.580 -13.142 1.00 0.00 C ATOM 1020 CG2 ILE A 67 -0.552 -2.973 -10.963 1.00 0.00 C ATOM 1021 CD1 ILE A 67 1.060 -1.161 -12.849 1.00 0.00 C ATOM 0 H ILE A 67 -1.158 -3.480 -14.898 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.437 -5.077 -12.676 1.00 0.00 H new ATOM 0 HB ILE A 67 -1.447 -2.216 -12.744 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.402 -3.266 -12.806 1.00 0.00 H new ATOM 0 HG13 ILE A 67 0.531 -2.707 -14.220 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -0.214 -1.994 -10.623 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -1.515 -3.204 -10.506 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.177 -3.729 -10.673 1.00 0.00 H new ATOM 0 HD11 ILE A 67 2.006 -0.959 -13.352 1.00 0.00 H new ATOM 0 HD12 ILE A 67 0.302 -0.466 -13.210 1.00 0.00 H new ATOM 0 HD13 ILE A 67 1.186 -1.034 -11.774 1.00 0.00 H new ATOM 1033 N SER A 68 -3.579 -4.629 -13.203 1.00 0.00 N ATOM 1034 CA SER A 68 -4.921 -4.952 -12.743 1.00 0.00 C ATOM 1035 C SER A 68 -4.999 -6.432 -12.395 1.00 0.00 C ATOM 1036 O SER A 68 -5.750 -6.837 -11.505 1.00 0.00 O ATOM 1037 CB SER A 68 -5.956 -4.607 -13.816 1.00 0.00 C ATOM 1038 OG SER A 68 -6.015 -5.614 -14.811 1.00 0.00 O ATOM 0 H SER A 68 -3.518 -4.377 -14.190 1.00 0.00 H new ATOM 0 HA SER A 68 -5.140 -4.361 -11.854 1.00 0.00 H new ATOM 0 HB2 SER A 68 -6.937 -4.489 -13.355 1.00 0.00 H new ATOM 0 HB3 SER A 68 -5.703 -3.652 -14.276 1.00 0.00 H new ATOM 0 HG SER A 68 -5.739 -5.239 -15.673 1.00 0.00 H new ATOM 1044 N GLU A 69 -4.203 -7.233 -13.097 1.00 0.00 N ATOM 1045 CA GLU A 69 -4.158 -8.669 -12.864 1.00 0.00 C ATOM 1046 C GLU A 69 -3.027 -9.011 -11.903 1.00 0.00 C ATOM 1047 O GLU A 69 -3.154 -9.908 -11.069 1.00 0.00 O ATOM 1048 CB GLU A 69 -3.976 -9.422 -14.185 1.00 0.00 C ATOM 1049 CG GLU A 69 -4.842 -8.889 -15.315 1.00 0.00 C ATOM 1050 CD GLU A 69 -6.309 -8.816 -14.942 1.00 0.00 C ATOM 1051 OE1 GLU A 69 -6.664 -7.975 -14.090 1.00 0.00 O ATOM 1052 OE2 GLU A 69 -7.104 -9.600 -15.503 1.00 0.00 O ATOM 0 H GLU A 69 -3.578 -6.908 -13.835 1.00 0.00 H new ATOM 0 HA GLU A 69 -5.104 -8.977 -12.418 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.929 -9.366 -14.484 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -4.207 -10.476 -14.028 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -4.493 -7.896 -15.597 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -4.725 -9.529 -16.190 1.00 0.00 H new ATOM 1059 N LEU A 70 -1.924 -8.275 -12.017 1.00 0.00 N ATOM 1060 CA LEU A 70 -0.771 -8.483 -11.148 1.00 0.00 C ATOM 1061 C LEU A 70 -1.175 -8.334 -9.689 1.00 0.00 C ATOM 1062 O LEU A 70 -0.573 -8.932 -8.804 1.00 0.00 O ATOM 1063 CB LEU A 70 0.330 -7.472 -11.476 1.00 0.00 C ATOM 1064 CG LEU A 70 1.607 -8.068 -12.057 1.00 0.00 C ATOM 1065 CD1 LEU A 70 1.391 -8.423 -13.515 1.00 0.00 C ATOM 1066 CD2 LEU A 70 2.772 -7.100 -11.899 1.00 0.00 C ATOM 0 H LEU A 70 -1.805 -7.530 -12.703 1.00 0.00 H new ATOM 0 HA LEU A 70 -0.394 -9.492 -11.315 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -0.067 -6.744 -12.184 1.00 0.00 H new ATOM 0 HB3 LEU A 70 0.583 -6.927 -10.567 1.00 0.00 H new ATOM 0 HG LEU A 70 1.854 -8.978 -11.510 1.00 0.00 H new ATOM 0 HD11 LEU A 70 2.307 -8.849 -13.925 1.00 0.00 H new ATOM 0 HD12 LEU A 70 0.584 -9.151 -13.596 1.00 0.00 H new ATOM 0 HD13 LEU A 70 1.127 -7.525 -14.073 1.00 0.00 H new ATOM 0 HD21 LEU A 70 3.674 -7.544 -12.320 1.00 0.00 H new ATOM 0 HD22 LEU A 70 2.547 -6.171 -12.423 1.00 0.00 H new ATOM 0 HD23 LEU A 70 2.930 -6.891 -10.841 1.00 0.00 H new ATOM 1078 N SER A 71 -2.203 -7.524 -9.454 1.00 0.00 N ATOM 1079 CA SER A 71 -2.699 -7.263 -8.104 1.00 0.00 C ATOM 1080 C SER A 71 -2.805 -8.532 -7.261 1.00 0.00 C ATOM 1081 O SER A 71 -2.848 -8.457 -6.037 1.00 0.00 O ATOM 1082 CB SER A 71 -4.066 -6.594 -8.164 1.00 0.00 C ATOM 1083 OG SER A 71 -3.996 -5.244 -7.740 1.00 0.00 O ATOM 0 H SER A 71 -2.714 -7.032 -10.188 1.00 0.00 H new ATOM 0 HA SER A 71 -1.973 -6.603 -7.629 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.451 -6.638 -9.183 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.769 -7.140 -7.534 1.00 0.00 H new ATOM 0 HG SER A 71 -4.890 -4.935 -7.484 1.00 0.00 H new ATOM 1089 N HIS A 72 -2.824 -9.693 -7.901 1.00 0.00 N ATOM 1090 CA HIS A 72 -2.900 -10.956 -7.175 1.00 0.00 C ATOM 1091 C HIS A 72 -1.750 -11.056 -6.175 1.00 0.00 C ATOM 1092 O HIS A 72 -1.761 -11.894 -5.275 1.00 0.00 O ATOM 1093 CB HIS A 72 -2.862 -12.137 -8.147 1.00 0.00 C ATOM 1094 CG HIS A 72 -4.123 -12.295 -8.939 1.00 0.00 C ATOM 1095 ND1 HIS A 72 -4.154 -12.281 -10.319 1.00 0.00 N ATOM 1096 CD2 HIS A 72 -5.403 -12.473 -8.538 1.00 0.00 C ATOM 1097 CE1 HIS A 72 -5.399 -12.442 -10.731 1.00 0.00 C ATOM 1098 NE2 HIS A 72 -6.177 -12.561 -9.670 1.00 0.00 N ATOM 0 H HIS A 72 -2.788 -9.788 -8.916 1.00 0.00 H new ATOM 0 HA HIS A 72 -3.844 -10.988 -6.631 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -2.025 -12.007 -8.833 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -2.676 -13.053 -7.587 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -3.342 -12.165 -10.926 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -5.752 -12.534 -7.518 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.725 -12.471 -11.760 1.00 0.00 H new ATOM 1107 N ASN A 73 -0.761 -10.181 -6.346 1.00 0.00 N ATOM 1108 CA ASN A 73 0.403 -10.150 -5.468 1.00 0.00 C ATOM 1109 C ASN A 73 0.029 -9.597 -4.090 1.00 0.00 C ATOM 1110 O ASN A 73 0.489 -10.092 -3.064 1.00 0.00 O ATOM 1111 CB ASN A 73 1.530 -9.313 -6.093 1.00 0.00 C ATOM 1112 CG ASN A 73 1.034 -8.131 -6.909 1.00 0.00 C ATOM 1113 OD1 ASN A 73 0.213 -7.346 -6.441 1.00 0.00 O ATOM 1114 ND2 ASN A 73 1.529 -7.999 -8.142 1.00 0.00 N ATOM 0 H ASN A 73 -0.744 -9.482 -7.089 1.00 0.00 H new ATOM 0 HA ASN A 73 0.760 -11.172 -5.342 1.00 0.00 H new ATOM 0 HB2 ASN A 73 2.182 -8.947 -5.299 1.00 0.00 H new ATOM 0 HB3 ASN A 73 2.136 -9.955 -6.732 1.00 0.00 H new ATOM 0 HD21 ASN A 73 1.227 -7.224 -8.733 1.00 0.00 H new ATOM 0 HD22 ASN A 73 2.209 -8.673 -8.493 1.00 0.00 H new ATOM 1121 N PHE A 74 -0.816 -8.570 -4.087 1.00 0.00 N ATOM 1122 CA PHE A 74 -1.287 -7.931 -2.861 1.00 0.00 C ATOM 1123 C PHE A 74 -2.735 -7.495 -3.067 1.00 0.00 C ATOM 1124 O PHE A 74 -3.430 -8.082 -3.894 1.00 0.00 O ATOM 1125 CB PHE A 74 -0.394 -6.738 -2.518 1.00 0.00 C ATOM 1126 CG PHE A 74 0.219 -6.084 -3.719 1.00 0.00 C ATOM 1127 CD1 PHE A 74 -0.559 -5.359 -4.605 1.00 0.00 C ATOM 1128 CD2 PHE A 74 1.575 -6.210 -3.966 1.00 0.00 C ATOM 1129 CE1 PHE A 74 0.007 -4.766 -5.718 1.00 0.00 C ATOM 1130 CE2 PHE A 74 2.146 -5.624 -5.077 1.00 0.00 C ATOM 1131 CZ PHE A 74 1.362 -4.903 -5.955 1.00 0.00 C ATOM 0 H PHE A 74 -1.195 -8.155 -4.938 1.00 0.00 H new ATOM 0 HA PHE A 74 -1.240 -8.630 -2.026 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -0.982 -6.000 -1.973 1.00 0.00 H new ATOM 0 HB3 PHE A 74 0.401 -7.070 -1.850 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -1.619 -5.256 -4.425 1.00 0.00 H new ATOM 0 HD2 PHE A 74 2.193 -6.773 -3.282 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -0.607 -4.197 -6.400 1.00 0.00 H new ATOM 0 HE2 PHE A 74 3.205 -5.729 -5.259 1.00 0.00 H new ATOM 0 HZ PHE A 74 1.807 -4.446 -6.827 1.00 0.00 H new ATOM 1141 N VAL A 75 -3.218 -6.482 -2.348 1.00 0.00 N ATOM 1142 CA VAL A 75 -4.602 -6.069 -2.563 1.00 0.00 C ATOM 1143 C VAL A 75 -4.907 -4.602 -2.258 1.00 0.00 C ATOM 1144 O VAL A 75 -4.372 -3.987 -1.337 1.00 0.00 O ATOM 1145 CB VAL A 75 -5.606 -6.950 -1.791 1.00 0.00 C ATOM 1146 CG1 VAL A 75 -5.487 -6.723 -0.292 1.00 0.00 C ATOM 1147 CG2 VAL A 75 -7.030 -6.672 -2.276 1.00 0.00 C ATOM 0 H VAL A 75 -2.701 -5.955 -1.645 1.00 0.00 H new ATOM 0 HA VAL A 75 -4.726 -6.203 -3.638 1.00 0.00 H new ATOM 0 HB VAL A 75 -5.372 -7.997 -1.986 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -6.205 -7.355 0.230 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -4.478 -6.974 0.035 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -5.693 -5.677 -0.065 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -7.731 -7.299 -1.725 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -7.273 -5.623 -2.109 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -7.102 -6.896 -3.340 1.00 0.00 H new ATOM 1157 N MET A 76 -5.814 -4.100 -3.082 1.00 0.00 N ATOM 1158 CA MET A 76 -6.350 -2.751 -3.067 1.00 0.00 C ATOM 1159 C MET A 76 -6.582 -2.126 -1.692 1.00 0.00 C ATOM 1160 O MET A 76 -7.622 -2.367 -1.069 1.00 0.00 O ATOM 1161 CB MET A 76 -7.708 -2.846 -3.730 1.00 0.00 C ATOM 1162 CG MET A 76 -8.470 -4.124 -3.354 1.00 0.00 C ATOM 1163 SD MET A 76 -8.408 -5.406 -4.642 1.00 0.00 S ATOM 1164 CE MET A 76 -9.508 -6.639 -3.950 1.00 0.00 C ATOM 0 H MET A 76 -6.221 -4.664 -3.828 1.00 0.00 H new ATOM 0 HA MET A 76 -5.611 -2.117 -3.558 1.00 0.00 H new ATOM 0 HB2 MET A 76 -8.305 -1.978 -3.450 1.00 0.00 H new ATOM 0 HB3 MET A 76 -7.581 -2.810 -4.812 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.055 -4.527 -2.430 1.00 0.00 H new ATOM 0 HG3 MET A 76 -9.511 -3.872 -3.153 1.00 0.00 H new ATOM 0 HE1 MET A 76 -8.955 -7.561 -3.772 1.00 0.00 H new ATOM 0 HE2 MET A 76 -9.917 -6.274 -3.008 1.00 0.00 H new ATOM 0 HE3 MET A 76 -10.322 -6.833 -4.648 1.00 0.00 H new ATOM 1174 N VAL A 77 -5.655 -1.256 -1.272 1.00 0.00 N ATOM 1175 CA VAL A 77 -5.797 -0.533 -0.008 1.00 0.00 C ATOM 1176 C VAL A 77 -5.350 0.924 -0.148 1.00 0.00 C ATOM 1177 O VAL A 77 -4.369 1.346 0.462 1.00 0.00 O ATOM 1178 CB VAL A 77 -5.000 -1.189 1.134 1.00 0.00 C ATOM 1179 CG1 VAL A 77 -5.231 -0.446 2.441 1.00 0.00 C ATOM 1180 CG2 VAL A 77 -5.382 -2.648 1.278 1.00 0.00 C ATOM 0 H VAL A 77 -4.803 -1.038 -1.789 1.00 0.00 H new ATOM 0 HA VAL A 77 -6.857 -0.570 0.242 1.00 0.00 H new ATOM 0 HB VAL A 77 -3.939 -1.133 0.890 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -4.660 -0.924 3.237 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -4.907 0.589 2.333 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.292 -0.470 2.691 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -4.809 -3.096 2.090 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.446 -2.725 1.500 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.166 -3.174 0.348 1.00 0.00 H new ATOM 1190 N ASN A 78 -6.077 1.688 -0.955 1.00 0.00 N ATOM 1191 CA ASN A 78 -5.758 3.092 -1.177 1.00 0.00 C ATOM 1192 C ASN A 78 -6.373 3.986 -0.111 1.00 0.00 C ATOM 1193 O ASN A 78 -7.572 4.264 -0.134 1.00 0.00 O ATOM 1194 CB ASN A 78 -6.263 3.527 -2.544 1.00 0.00 C ATOM 1195 CG ASN A 78 -5.791 4.912 -2.953 1.00 0.00 C ATOM 1196 OD1 ASN A 78 -6.531 5.664 -3.588 1.00 0.00 O ATOM 1197 ND2 ASN A 78 -4.560 5.260 -2.598 1.00 0.00 N ATOM 0 H ASN A 78 -6.894 1.357 -1.468 1.00 0.00 H new ATOM 0 HA ASN A 78 -4.674 3.194 -1.125 1.00 0.00 H new ATOM 0 HB2 ASN A 78 -5.934 2.805 -3.291 1.00 0.00 H new ATOM 0 HB3 ASN A 78 -7.353 3.509 -2.542 1.00 0.00 H new ATOM 0 HD21 ASN A 78 -4.197 6.179 -2.851 1.00 0.00 H new ATOM 0 HD22 ASN A 78 -3.978 4.609 -2.072 1.00 0.00 H new ATOM 1204 N LEU A 79 -5.545 4.447 0.811 1.00 0.00 N ATOM 1205 CA LEU A 79 -6.006 5.330 1.875 1.00 0.00 C ATOM 1206 C LEU A 79 -5.774 6.796 1.487 1.00 0.00 C ATOM 1207 O LEU A 79 -4.775 7.136 0.843 1.00 0.00 O ATOM 1208 CB LEU A 79 -5.303 4.976 3.192 1.00 0.00 C ATOM 1209 CG LEU A 79 -5.168 6.113 4.209 1.00 0.00 C ATOM 1210 CD1 LEU A 79 -6.537 6.525 4.733 1.00 0.00 C ATOM 1211 CD2 LEU A 79 -4.260 5.696 5.359 1.00 0.00 C ATOM 0 H LEU A 79 -4.550 4.226 0.846 1.00 0.00 H new ATOM 0 HA LEU A 79 -7.078 5.192 2.019 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -5.847 4.157 3.663 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -4.305 4.603 2.959 1.00 0.00 H new ATOM 0 HG LEU A 79 -4.718 6.971 3.709 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -6.422 7.334 5.455 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -7.157 6.864 3.903 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -7.013 5.672 5.217 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -4.176 6.516 6.072 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -4.682 4.824 5.858 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -3.272 5.449 4.971 1.00 0.00 H new ATOM 1223 N GLU A 80 -6.710 7.660 1.865 1.00 0.00 N ATOM 1224 CA GLU A 80 -6.610 9.079 1.542 1.00 0.00 C ATOM 1225 C GLU A 80 -6.927 9.948 2.755 1.00 0.00 C ATOM 1226 O GLU A 80 -7.079 9.449 3.869 1.00 0.00 O ATOM 1227 CB GLU A 80 -7.560 9.424 0.393 1.00 0.00 C ATOM 1228 CG GLU A 80 -6.938 10.329 -0.660 1.00 0.00 C ATOM 1229 CD GLU A 80 -7.974 11.141 -1.412 1.00 0.00 C ATOM 1230 OE1 GLU A 80 -8.473 10.654 -2.449 1.00 0.00 O ATOM 1231 OE2 GLU A 80 -8.287 12.264 -0.965 1.00 0.00 O ATOM 0 H GLU A 80 -7.544 7.404 2.394 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.583 9.282 1.238 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -7.892 8.501 -0.083 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -8.447 9.910 0.799 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.229 11.004 -0.181 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -6.372 9.723 -1.368 1.00 0.00 H new ATOM 1238 N ASP A 81 -7.026 11.254 2.526 1.00 0.00 N ATOM 1239 CA ASP A 81 -7.325 12.200 3.594 1.00 0.00 C ATOM 1240 C ASP A 81 -8.679 11.900 4.230 1.00 0.00 C ATOM 1241 O ASP A 81 -8.917 12.234 5.391 1.00 0.00 O ATOM 1242 CB ASP A 81 -7.309 13.631 3.053 1.00 0.00 C ATOM 1243 CG ASP A 81 -7.084 14.661 4.142 1.00 0.00 C ATOM 1244 OD1 ASP A 81 -7.674 14.510 5.233 1.00 0.00 O ATOM 1245 OD2 ASP A 81 -6.317 15.618 3.905 1.00 0.00 O ATOM 0 H ASP A 81 -6.903 11.681 1.608 1.00 0.00 H new ATOM 0 HA ASP A 81 -6.556 12.097 4.360 1.00 0.00 H new ATOM 0 HB2 ASP A 81 -6.524 13.723 2.302 1.00 0.00 H new ATOM 0 HB3 ASP A 81 -8.255 13.837 2.552 1.00 0.00 H new ATOM 1250 N GLU A 82 -9.564 11.267 3.464 1.00 0.00 N ATOM 1251 CA GLU A 82 -10.895 10.920 3.957 1.00 0.00 C ATOM 1252 C GLU A 82 -10.814 10.207 5.304 1.00 0.00 C ATOM 1253 O GLU A 82 -11.735 10.288 6.117 1.00 0.00 O ATOM 1254 CB GLU A 82 -11.621 10.034 2.941 1.00 0.00 C ATOM 1255 CG GLU A 82 -12.354 10.819 1.864 1.00 0.00 C ATOM 1256 CD GLU A 82 -13.664 11.400 2.355 1.00 0.00 C ATOM 1257 OE1 GLU A 82 -13.629 12.278 3.242 1.00 0.00 O ATOM 1258 OE2 GLU A 82 -14.726 10.976 1.852 1.00 0.00 O ATOM 0 H GLU A 82 -9.384 10.984 2.501 1.00 0.00 H new ATOM 0 HA GLU A 82 -11.455 11.845 4.092 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.897 9.371 2.467 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -12.335 9.401 3.468 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -11.713 11.626 1.509 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -12.547 10.167 1.012 1.00 0.00 H new ATOM 1265 N GLU A 83 -9.704 9.513 5.534 1.00 0.00 N ATOM 1266 CA GLU A 83 -9.498 8.789 6.783 1.00 0.00 C ATOM 1267 C GLU A 83 -8.159 9.163 7.409 1.00 0.00 C ATOM 1268 O GLU A 83 -7.171 8.445 7.261 1.00 0.00 O ATOM 1269 CB GLU A 83 -9.559 7.281 6.541 1.00 0.00 C ATOM 1270 CG GLU A 83 -10.228 6.510 7.667 1.00 0.00 C ATOM 1271 CD GLU A 83 -11.708 6.818 7.783 1.00 0.00 C ATOM 1272 OE1 GLU A 83 -12.050 7.927 8.243 1.00 0.00 O ATOM 1273 OE2 GLU A 83 -12.526 5.948 7.414 1.00 0.00 O ATOM 0 H GLU A 83 -8.933 9.437 4.871 1.00 0.00 H new ATOM 0 HA GLU A 83 -10.294 9.069 7.473 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -10.098 7.092 5.613 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -8.546 6.902 6.404 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -10.095 5.441 7.500 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -9.736 6.749 8.609 1.00 0.00 H new ATOM 1280 N GLU A 84 -8.132 10.294 8.109 1.00 0.00 N ATOM 1281 CA GLU A 84 -6.914 10.768 8.759 1.00 0.00 C ATOM 1282 C GLU A 84 -6.281 9.671 9.614 1.00 0.00 C ATOM 1283 O GLU A 84 -6.782 9.347 10.692 1.00 0.00 O ATOM 1284 CB GLU A 84 -7.221 11.990 9.627 1.00 0.00 C ATOM 1285 CG GLU A 84 -6.118 13.036 9.615 1.00 0.00 C ATOM 1286 CD GLU A 84 -5.002 12.718 10.590 1.00 0.00 C ATOM 1287 OE1 GLU A 84 -4.306 11.704 10.386 1.00 0.00 O ATOM 1288 OE2 GLU A 84 -4.827 13.485 11.562 1.00 0.00 O ATOM 0 H GLU A 84 -8.942 10.900 8.241 1.00 0.00 H new ATOM 0 HA GLU A 84 -6.204 11.047 7.980 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -8.148 12.447 9.281 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -7.390 11.664 10.653 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -5.706 13.112 8.609 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -6.543 14.009 9.860 1.00 0.00 H new ATOM 1295 N PRO A 85 -5.166 9.078 9.147 1.00 0.00 N ATOM 1296 CA PRO A 85 -4.473 8.013 9.880 1.00 0.00 C ATOM 1297 C PRO A 85 -4.098 8.439 11.295 1.00 0.00 C ATOM 1298 O PRO A 85 -4.348 9.575 11.699 1.00 0.00 O ATOM 1299 CB PRO A 85 -3.214 7.762 9.048 1.00 0.00 C ATOM 1300 CG PRO A 85 -3.563 8.235 7.679 1.00 0.00 C ATOM 1301 CD PRO A 85 -4.495 9.396 7.874 1.00 0.00 C ATOM 0 HA PRO A 85 -5.100 7.129 10.001 1.00 0.00 H new ATOM 0 HB2 PRO A 85 -2.359 8.307 9.449 1.00 0.00 H new ATOM 0 HB3 PRO A 85 -2.946 6.706 9.045 1.00 0.00 H new ATOM 0 HG2 PRO A 85 -2.671 8.537 7.130 1.00 0.00 H new ATOM 0 HG3 PRO A 85 -4.040 7.443 7.101 1.00 0.00 H new ATOM 0 HD2 PRO A 85 -3.955 10.341 7.928 1.00 0.00 H new ATOM 0 HD3 PRO A 85 -5.208 9.483 7.054 1.00 0.00 H new ATOM 1309 N LYS A 86 -3.495 7.521 12.044 1.00 0.00 N ATOM 1310 CA LYS A 86 -3.085 7.805 13.413 1.00 0.00 C ATOM 1311 C LYS A 86 -1.817 7.039 13.773 1.00 0.00 C ATOM 1312 O LYS A 86 -1.673 6.545 14.892 1.00 0.00 O ATOM 1313 CB LYS A 86 -4.207 7.445 14.389 1.00 0.00 C ATOM 1314 CG LYS A 86 -4.670 6.001 14.278 1.00 0.00 C ATOM 1315 CD LYS A 86 -5.258 5.501 15.589 1.00 0.00 C ATOM 1316 CE LYS A 86 -6.633 4.882 15.386 1.00 0.00 C ATOM 1317 NZ LYS A 86 -6.783 3.603 16.131 1.00 0.00 N ATOM 0 H LYS A 86 -3.280 6.576 11.726 1.00 0.00 H new ATOM 0 HA LYS A 86 -2.876 8.872 13.488 1.00 0.00 H new ATOM 0 HB2 LYS A 86 -3.865 7.631 15.407 1.00 0.00 H new ATOM 0 HB3 LYS A 86 -5.056 8.105 14.212 1.00 0.00 H new ATOM 0 HG2 LYS A 86 -5.416 5.917 13.488 1.00 0.00 H new ATOM 0 HG3 LYS A 86 -3.829 5.369 13.991 1.00 0.00 H new ATOM 0 HD2 LYS A 86 -4.588 4.764 16.031 1.00 0.00 H new ATOM 0 HD3 LYS A 86 -5.331 6.329 16.295 1.00 0.00 H new ATOM 0 HE2 LYS A 86 -7.399 5.585 15.714 1.00 0.00 H new ATOM 0 HE3 LYS A 86 -6.797 4.704 14.323 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 -7.733 3.214 15.966 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 -6.069 2.923 15.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 -6.652 3.776 17.148 1.00 0.00 H new ATOM 1331 N ASP A 87 -0.895 6.942 12.819 1.00 0.00 N ATOM 1332 CA ASP A 87 0.360 6.236 13.042 1.00 0.00 C ATOM 1333 C ASP A 87 1.272 6.330 11.820 1.00 0.00 C ATOM 1334 O ASP A 87 0.999 7.079 10.882 1.00 0.00 O ATOM 1335 CB ASP A 87 0.091 4.768 13.384 1.00 0.00 C ATOM 1336 CG ASP A 87 0.675 4.373 14.726 1.00 0.00 C ATOM 1337 OD1 ASP A 87 1.867 4.001 14.769 1.00 0.00 O ATOM 1338 OD2 ASP A 87 -0.059 4.435 15.734 1.00 0.00 O ATOM 0 H ASP A 87 -0.994 7.343 11.886 1.00 0.00 H new ATOM 0 HA ASP A 87 0.867 6.711 13.882 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -0.984 4.590 13.392 1.00 0.00 H new ATOM 0 HB3 ASP A 87 0.513 4.133 12.605 1.00 0.00 H new ATOM 1343 N GLU A 88 2.357 5.564 11.844 1.00 0.00 N ATOM 1344 CA GLU A 88 3.323 5.546 10.749 1.00 0.00 C ATOM 1345 C GLU A 88 2.714 4.983 9.463 1.00 0.00 C ATOM 1346 O GLU A 88 3.287 5.121 8.384 1.00 0.00 O ATOM 1347 CB GLU A 88 4.547 4.725 11.153 1.00 0.00 C ATOM 1348 CG GLU A 88 5.784 5.565 11.402 1.00 0.00 C ATOM 1349 CD GLU A 88 5.748 6.271 12.744 1.00 0.00 C ATOM 1350 OE1 GLU A 88 4.863 7.131 12.938 1.00 0.00 O ATOM 1351 OE2 GLU A 88 6.604 5.964 13.599 1.00 0.00 O ATOM 0 H GLU A 88 2.592 4.941 12.617 1.00 0.00 H new ATOM 0 HA GLU A 88 3.621 6.575 10.549 1.00 0.00 H new ATOM 0 HB2 GLU A 88 4.314 4.160 12.055 1.00 0.00 H new ATOM 0 HB3 GLU A 88 4.762 3.999 10.369 1.00 0.00 H new ATOM 0 HG2 GLU A 88 6.667 4.928 11.354 1.00 0.00 H new ATOM 0 HG3 GLU A 88 5.882 6.306 10.608 1.00 0.00 H new ATOM 1358 N ASP A 89 1.558 4.337 9.589 1.00 0.00 N ATOM 1359 CA ASP A 89 0.870 3.736 8.446 1.00 0.00 C ATOM 1360 C ASP A 89 0.746 4.691 7.250 1.00 0.00 C ATOM 1361 O ASP A 89 0.405 4.256 6.151 1.00 0.00 O ATOM 1362 CB ASP A 89 -0.515 3.238 8.863 1.00 0.00 C ATOM 1363 CG ASP A 89 -0.454 1.917 9.609 1.00 0.00 C ATOM 1364 OD1 ASP A 89 -0.295 1.944 10.848 1.00 0.00 O ATOM 1365 OD2 ASP A 89 -0.563 0.853 8.956 1.00 0.00 O ATOM 0 H ASP A 89 1.073 4.215 10.478 1.00 0.00 H new ATOM 0 HA ASP A 89 1.483 2.896 8.119 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -0.993 3.987 9.494 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -1.139 3.123 7.977 1.00 0.00 H new ATOM 1370 N PHE A 90 0.992 5.987 7.453 1.00 0.00 N ATOM 1371 CA PHE A 90 0.875 6.951 6.359 1.00 0.00 C ATOM 1372 C PHE A 90 2.242 7.376 5.807 1.00 0.00 C ATOM 1373 O PHE A 90 2.368 7.681 4.616 1.00 0.00 O ATOM 1374 CB PHE A 90 0.078 8.178 6.805 1.00 0.00 C ATOM 1375 CG PHE A 90 0.796 9.042 7.799 1.00 0.00 C ATOM 1376 CD1 PHE A 90 1.842 9.855 7.399 1.00 0.00 C ATOM 1377 CD2 PHE A 90 0.426 9.040 9.131 1.00 0.00 C ATOM 1378 CE1 PHE A 90 2.504 10.651 8.310 1.00 0.00 C ATOM 1379 CE2 PHE A 90 1.084 9.834 10.048 1.00 0.00 C ATOM 1380 CZ PHE A 90 2.126 10.641 9.637 1.00 0.00 C ATOM 0 H PHE A 90 1.269 6.388 8.349 1.00 0.00 H new ATOM 0 HA PHE A 90 0.340 6.452 5.551 1.00 0.00 H new ATOM 0 HB2 PHE A 90 -0.168 8.777 5.928 1.00 0.00 H new ATOM 0 HB3 PHE A 90 -0.865 7.848 7.240 1.00 0.00 H new ATOM 0 HD1 PHE A 90 2.143 9.866 6.362 1.00 0.00 H new ATOM 0 HD2 PHE A 90 -0.388 8.410 9.458 1.00 0.00 H new ATOM 0 HE1 PHE A 90 3.318 11.282 7.985 1.00 0.00 H new ATOM 0 HE2 PHE A 90 0.784 9.824 11.086 1.00 0.00 H new ATOM 0 HZ PHE A 90 2.644 11.263 10.352 1.00 0.00 H new ATOM 1390 N SER A 91 3.262 7.399 6.666 1.00 0.00 N ATOM 1391 CA SER A 91 4.603 7.792 6.235 1.00 0.00 C ATOM 1392 C SER A 91 5.677 7.369 7.241 1.00 0.00 C ATOM 1393 O SER A 91 6.163 8.185 8.023 1.00 0.00 O ATOM 1394 CB SER A 91 4.671 9.304 6.014 1.00 0.00 C ATOM 1395 OG SER A 91 3.843 9.699 4.935 1.00 0.00 O ATOM 0 H SER A 91 3.187 7.153 7.653 1.00 0.00 H new ATOM 0 HA SER A 91 4.802 7.276 5.296 1.00 0.00 H new ATOM 0 HB2 SER A 91 4.362 9.822 6.922 1.00 0.00 H new ATOM 0 HB3 SER A 91 5.701 9.599 5.813 1.00 0.00 H new ATOM 0 HG SER A 91 3.504 8.903 4.474 1.00 0.00 H new ATOM 1401 N PRO A 92 6.063 6.082 7.227 1.00 0.00 N ATOM 1402 CA PRO A 92 7.077 5.535 8.119 1.00 0.00 C ATOM 1403 C PRO A 92 8.483 5.626 7.531 1.00 0.00 C ATOM 1404 O PRO A 92 9.028 4.634 7.047 1.00 0.00 O ATOM 1405 CB PRO A 92 6.658 4.065 8.265 1.00 0.00 C ATOM 1406 CG PRO A 92 5.666 3.793 7.167 1.00 0.00 C ATOM 1407 CD PRO A 92 5.543 5.049 6.338 1.00 0.00 C ATOM 0 HA PRO A 92 7.127 6.081 9.061 1.00 0.00 H new ATOM 0 HB2 PRO A 92 7.521 3.405 8.180 1.00 0.00 H new ATOM 0 HB3 PRO A 92 6.213 3.884 9.243 1.00 0.00 H new ATOM 0 HG2 PRO A 92 5.998 2.958 6.550 1.00 0.00 H new ATOM 0 HG3 PRO A 92 4.699 3.515 7.586 1.00 0.00 H new ATOM 0 HD2 PRO A 92 6.121 4.982 5.416 1.00 0.00 H new ATOM 0 HD3 PRO A 92 4.509 5.245 6.053 1.00 0.00 H new ATOM 1415 N ASP A 93 9.071 6.818 7.575 1.00 0.00 N ATOM 1416 CA ASP A 93 10.417 7.024 7.047 1.00 0.00 C ATOM 1417 C ASP A 93 10.845 8.483 7.193 1.00 0.00 C ATOM 1418 O ASP A 93 11.531 8.844 8.149 1.00 0.00 O ATOM 1419 CB ASP A 93 10.484 6.596 5.577 1.00 0.00 C ATOM 1420 CG ASP A 93 11.237 5.292 5.391 1.00 0.00 C ATOM 1421 OD1 ASP A 93 12.297 5.122 6.029 1.00 0.00 O ATOM 1422 OD2 ASP A 93 10.767 4.442 4.607 1.00 0.00 O ATOM 0 H ASP A 93 8.639 7.654 7.969 1.00 0.00 H new ATOM 0 HA ASP A 93 11.106 6.408 7.625 1.00 0.00 H new ATOM 0 HB2 ASP A 93 9.472 6.488 5.186 1.00 0.00 H new ATOM 0 HB3 ASP A 93 10.969 7.379 4.994 1.00 0.00 H new ATOM 1427 N GLY A 94 10.436 9.318 6.243 1.00 0.00 N ATOM 1428 CA GLY A 94 10.788 10.724 6.291 1.00 0.00 C ATOM 1429 C GLY A 94 9.675 11.575 6.866 1.00 0.00 C ATOM 1430 O GLY A 94 9.308 11.427 8.031 1.00 0.00 O ATOM 0 H GLY A 94 9.867 9.045 5.441 1.00 0.00 H new ATOM 0 HA2 GLY A 94 11.688 10.851 6.893 1.00 0.00 H new ATOM 0 HA3 GLY A 94 11.026 11.071 5.286 1.00 0.00 H new ATOM 1434 N GLY A 95 9.133 12.464 6.044 1.00 0.00 N ATOM 1435 CA GLY A 95 8.057 13.327 6.492 1.00 0.00 C ATOM 1436 C GLY A 95 7.223 13.856 5.343 1.00 0.00 C ATOM 1437 O GLY A 95 7.139 15.068 5.135 1.00 0.00 O ATOM 0 H GLY A 95 9.419 12.603 5.075 1.00 0.00 H new ATOM 0 HA2 GLY A 95 7.415 12.776 7.179 1.00 0.00 H new ATOM 0 HA3 GLY A 95 8.475 14.165 7.049 1.00 0.00 H new ATOM 1441 N TYR A 96 6.595 12.950 4.598 1.00 0.00 N ATOM 1442 CA TYR A 96 5.756 13.345 3.472 1.00 0.00 C ATOM 1443 C TYR A 96 4.281 13.249 3.847 1.00 0.00 C ATOM 1444 O TYR A 96 3.945 13.007 5.007 1.00 0.00 O ATOM 1445 CB TYR A 96 6.045 12.493 2.229 1.00 0.00 C ATOM 1446 CG TYR A 96 6.702 11.157 2.512 1.00 0.00 C ATOM 1447 CD1 TYR A 96 8.020 11.081 2.948 1.00 0.00 C ATOM 1448 CD2 TYR A 96 6.006 9.972 2.326 1.00 0.00 C ATOM 1449 CE1 TYR A 96 8.621 9.860 3.189 1.00 0.00 C ATOM 1450 CE2 TYR A 96 6.598 8.748 2.566 1.00 0.00 C ATOM 1451 CZ TYR A 96 7.905 8.697 2.996 1.00 0.00 C ATOM 1452 OH TYR A 96 8.500 7.479 3.235 1.00 0.00 O ATOM 0 H TYR A 96 6.651 11.943 4.753 1.00 0.00 H new ATOM 0 HA TYR A 96 5.993 14.381 3.230 1.00 0.00 H new ATOM 0 HB2 TYR A 96 5.108 12.316 1.701 1.00 0.00 H new ATOM 0 HB3 TYR A 96 6.687 13.062 1.557 1.00 0.00 H new ATOM 0 HD1 TYR A 96 8.583 11.990 3.101 1.00 0.00 H new ATOM 0 HD2 TYR A 96 4.981 10.007 1.987 1.00 0.00 H new ATOM 0 HE1 TYR A 96 9.646 9.817 3.527 1.00 0.00 H new ATOM 0 HE2 TYR A 96 6.039 7.836 2.417 1.00 0.00 H new ATOM 0 HH TYR A 96 9.373 7.449 2.792 1.00 0.00 H new ATOM 1462 N ILE A 97 3.399 13.456 2.872 1.00 0.00 N ATOM 1463 CA ILE A 97 1.966 13.406 3.134 1.00 0.00 C ATOM 1464 C ILE A 97 1.152 13.085 1.844 1.00 0.00 C ATOM 1465 O ILE A 97 0.457 14.038 1.494 1.00 0.00 O ATOM 1466 CB ILE A 97 1.482 14.749 3.697 1.00 0.00 C ATOM 1467 CG1 ILE A 97 1.980 15.884 2.806 1.00 0.00 C ATOM 1468 CG2 ILE A 97 1.971 14.931 5.123 1.00 0.00 C ATOM 1469 CD1 ILE A 97 0.953 16.966 2.571 1.00 0.00 C ATOM 0 H ILE A 97 3.649 13.658 1.904 1.00 0.00 H new ATOM 0 HA ILE A 97 1.801 12.609 3.859 1.00 0.00 H new ATOM 0 HB ILE A 97 0.392 14.762 3.710 1.00 0.00 H new ATOM 0 HG12 ILE A 97 2.866 16.328 3.260 1.00 0.00 H new ATOM 0 HG13 ILE A 97 2.287 15.472 1.845 1.00 0.00 H new ATOM 0 HG21 ILE A 97 1.620 15.888 5.509 1.00 0.00 H new ATOM 0 HG22 ILE A 97 1.584 14.125 5.746 1.00 0.00 H new ATOM 0 HG23 ILE A 97 3.061 14.911 5.139 1.00 0.00 H new ATOM 0 HD11 ILE A 97 1.378 17.738 1.930 1.00 0.00 H new ATOM 0 HD12 ILE A 97 0.075 16.536 2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 97 0.663 17.406 3.525 1.00 0.00 H new ATOM 1481 N PRO A 98 0.520 11.880 1.893 1.00 0.00 N ATOM 1482 CA PRO A 98 0.863 10.457 2.222 1.00 0.00 C ATOM 1483 C PRO A 98 1.421 9.755 0.995 1.00 0.00 C ATOM 1484 O PRO A 98 1.167 10.190 -0.134 1.00 0.00 O ATOM 1485 CB PRO A 98 -0.458 9.827 2.622 1.00 0.00 C ATOM 1486 CG PRO A 98 -0.914 10.853 3.517 1.00 0.00 C ATOM 1487 CD PRO A 98 0.216 11.826 3.397 1.00 0.00 C ATOM 0 HA PRO A 98 1.616 10.384 3.007 1.00 0.00 H new ATOM 0 HB2 PRO A 98 -1.128 9.674 1.776 1.00 0.00 H new ATOM 0 HB3 PRO A 98 -0.336 8.861 3.111 1.00 0.00 H new ATOM 0 HG2 PRO A 98 -1.867 11.282 3.208 1.00 0.00 H new ATOM 0 HG3 PRO A 98 -1.044 10.489 4.536 1.00 0.00 H new ATOM 0 HD2 PRO A 98 -0.063 12.807 3.781 1.00 0.00 H new ATOM 0 HD3 PRO A 98 1.085 11.497 3.966 1.00 0.00 H new ATOM 1495 N ARG A 99 2.200 8.693 1.220 1.00 0.00 N ATOM 1496 CA ARG A 99 2.831 7.946 0.133 1.00 0.00 C ATOM 1497 C ARG A 99 2.400 6.476 0.118 1.00 0.00 C ATOM 1498 O ARG A 99 1.462 6.084 0.814 1.00 0.00 O ATOM 1499 CB ARG A 99 4.346 8.039 0.272 1.00 0.00 C ATOM 1500 CG ARG A 99 4.991 9.044 -0.669 1.00 0.00 C ATOM 1501 CD ARG A 99 4.478 10.460 -0.450 1.00 0.00 C ATOM 1502 NE ARG A 99 4.534 11.254 -1.677 1.00 0.00 N ATOM 1503 CZ ARG A 99 3.533 11.358 -2.551 1.00 0.00 C ATOM 1504 NH1 ARG A 99 2.386 10.726 -2.341 1.00 0.00 N ATOM 1505 NH2 ARG A 99 3.683 12.100 -3.640 1.00 0.00 N ATOM 0 H ARG A 99 2.408 8.331 2.151 1.00 0.00 H new ATOM 0 HA ARG A 99 2.510 8.389 -0.810 1.00 0.00 H new ATOM 0 HB2 ARG A 99 4.591 8.309 1.299 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.779 7.055 0.089 1.00 0.00 H new ATOM 0 HG2 ARG A 99 6.072 9.027 -0.528 1.00 0.00 H new ATOM 0 HG3 ARG A 99 4.799 8.747 -1.700 1.00 0.00 H new ATOM 0 HD2 ARG A 99 3.451 10.422 -0.088 1.00 0.00 H new ATOM 0 HD3 ARG A 99 5.071 10.946 0.325 1.00 0.00 H new ATOM 0 HE ARG A 99 5.396 11.762 -1.877 1.00 0.00 H new ATOM 0 HH11 ARG A 99 2.264 10.154 -1.505 1.00 0.00 H new ATOM 0 HH12 ARG A 99 1.626 10.812 -3.015 1.00 0.00 H new ATOM 0 HH21 ARG A 99 4.562 12.589 -3.807 1.00 0.00 H new ATOM 0 HH22 ARG A 99 2.919 12.182 -4.311 1.00 0.00 H new ATOM 1519 N ILE A 100 3.098 5.672 -0.688 1.00 0.00 N ATOM 1520 CA ILE A 100 2.799 4.243 -0.809 1.00 0.00 C ATOM 1521 C ILE A 100 3.514 3.438 0.272 1.00 0.00 C ATOM 1522 O ILE A 100 4.685 3.677 0.551 1.00 0.00 O ATOM 1523 CB ILE A 100 3.205 3.700 -2.197 1.00 0.00 C ATOM 1524 CG1 ILE A 100 2.390 4.386 -3.295 1.00 0.00 C ATOM 1525 CG2 ILE A 100 3.022 2.190 -2.263 1.00 0.00 C ATOM 1526 CD1 ILE A 100 2.909 5.756 -3.670 1.00 0.00 C ATOM 0 H ILE A 100 3.876 5.987 -1.268 1.00 0.00 H new ATOM 0 HA ILE A 100 1.722 4.132 -0.685 1.00 0.00 H new ATOM 0 HB ILE A 100 4.261 3.921 -2.355 1.00 0.00 H new ATOM 0 HG12 ILE A 100 2.387 3.753 -4.182 1.00 0.00 H new ATOM 0 HG13 ILE A 100 1.355 4.477 -2.964 1.00 0.00 H new ATOM 0 HG21 ILE A 100 3.314 1.831 -3.250 1.00 0.00 H new ATOM 0 HG22 ILE A 100 3.644 1.715 -1.505 1.00 0.00 H new ATOM 0 HG23 ILE A 100 1.976 1.942 -2.082 1.00 0.00 H new ATOM 0 HD11 ILE A 100 2.282 6.181 -4.454 1.00 0.00 H new ATOM 0 HD12 ILE A 100 2.886 6.406 -2.795 1.00 0.00 H new ATOM 0 HD13 ILE A 100 3.934 5.670 -4.032 1.00 0.00 H new ATOM 1538 N LEU A 101 2.798 2.496 0.886 1.00 0.00 N ATOM 1539 CA LEU A 101 3.364 1.668 1.953 1.00 0.00 C ATOM 1540 C LEU A 101 3.004 0.194 1.785 1.00 0.00 C ATOM 1541 O LEU A 101 1.839 -0.143 1.578 1.00 0.00 O ATOM 1542 CB LEU A 101 2.819 2.120 3.310 1.00 0.00 C ATOM 1543 CG LEU A 101 3.494 3.329 3.948 1.00 0.00 C ATOM 1544 CD1 LEU A 101 3.486 4.508 2.997 1.00 0.00 C ATOM 1545 CD2 LEU A 101 2.787 3.688 5.242 1.00 0.00 C ATOM 0 H LEU A 101 1.825 2.287 0.663 1.00 0.00 H new ATOM 0 HA LEU A 101 4.447 1.784 1.900 1.00 0.00 H new ATOM 0 HB2 LEU A 101 1.759 2.344 3.194 1.00 0.00 H new ATOM 0 HB3 LEU A 101 2.894 1.282 4.003 1.00 0.00 H new ATOM 0 HG LEU A 101 4.531 3.077 4.168 1.00 0.00 H new ATOM 0 HD11 LEU A 101 3.972 5.361 3.471 1.00 0.00 H new ATOM 0 HD12 LEU A 101 4.023 4.244 2.086 1.00 0.00 H new ATOM 0 HD13 LEU A 101 2.457 4.769 2.749 1.00 0.00 H new ATOM 0 HD21 LEU A 101 3.273 4.553 5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 101 1.744 3.926 5.033 1.00 0.00 H new ATOM 0 HD23 LEU A 101 2.836 2.844 5.930 1.00 0.00 H new ATOM 1557 N PHE A 102 3.991 -0.691 1.929 1.00 0.00 N ATOM 1558 CA PHE A 102 3.725 -2.118 1.846 1.00 0.00 C ATOM 1559 C PHE A 102 3.570 -2.680 3.260 1.00 0.00 C ATOM 1560 O PHE A 102 4.323 -2.311 4.174 1.00 0.00 O ATOM 1561 CB PHE A 102 4.846 -2.837 1.096 1.00 0.00 C ATOM 1562 CG PHE A 102 4.752 -2.703 -0.397 1.00 0.00 C ATOM 1563 CD1 PHE A 102 5.183 -1.548 -1.030 1.00 0.00 C ATOM 1564 CD2 PHE A 102 4.233 -3.732 -1.167 1.00 0.00 C ATOM 1565 CE1 PHE A 102 5.099 -1.421 -2.403 1.00 0.00 C ATOM 1566 CE2 PHE A 102 4.145 -3.610 -2.541 1.00 0.00 C ATOM 1567 CZ PHE A 102 4.579 -2.453 -3.160 1.00 0.00 C ATOM 0 H PHE A 102 4.966 -0.445 2.101 1.00 0.00 H new ATOM 0 HA PHE A 102 2.802 -2.281 1.290 1.00 0.00 H new ATOM 0 HB2 PHE A 102 5.806 -2.442 1.428 1.00 0.00 H new ATOM 0 HB3 PHE A 102 4.828 -3.895 1.359 1.00 0.00 H new ATOM 0 HD1 PHE A 102 5.589 -0.738 -0.443 1.00 0.00 H new ATOM 0 HD2 PHE A 102 3.894 -4.639 -0.688 1.00 0.00 H new ATOM 0 HE1 PHE A 102 5.439 -0.516 -2.884 1.00 0.00 H new ATOM 0 HE2 PHE A 102 3.737 -4.418 -3.130 1.00 0.00 H new ATOM 0 HZ PHE A 102 4.512 -2.356 -4.234 1.00 0.00 H new ATOM 1577 N LEU A 103 2.576 -3.539 3.464 1.00 0.00 N ATOM 1578 CA LEU A 103 2.343 -4.090 4.795 1.00 0.00 C ATOM 1579 C LEU A 103 1.897 -5.548 4.760 1.00 0.00 C ATOM 1580 O LEU A 103 1.648 -6.114 3.695 1.00 0.00 O ATOM 1581 CB LEU A 103 1.308 -3.239 5.529 1.00 0.00 C ATOM 1582 CG LEU A 103 -0.147 -3.503 5.155 1.00 0.00 C ATOM 1583 CD1 LEU A 103 -1.069 -2.530 5.867 1.00 0.00 C ATOM 1584 CD2 LEU A 103 -0.325 -3.405 3.651 1.00 0.00 C ATOM 0 H LEU A 103 1.932 -3.863 2.743 1.00 0.00 H new ATOM 0 HA LEU A 103 3.293 -4.065 5.328 1.00 0.00 H new ATOM 0 HB2 LEU A 103 1.424 -3.402 6.601 1.00 0.00 H new ATOM 0 HB3 LEU A 103 1.528 -2.188 5.340 1.00 0.00 H new ATOM 0 HG LEU A 103 -0.410 -4.512 5.473 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -2.102 -2.736 5.586 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -0.956 -2.645 6.945 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -0.812 -1.510 5.582 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -1.367 -3.595 3.395 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -0.045 -2.406 3.316 1.00 0.00 H new ATOM 0 HD23 LEU A 103 0.310 -4.143 3.161 1.00 0.00 H new ATOM 1596 N ASP A 104 1.802 -6.144 5.948 1.00 0.00 N ATOM 1597 CA ASP A 104 1.388 -7.536 6.083 1.00 0.00 C ATOM 1598 C ASP A 104 -0.128 -7.672 5.972 1.00 0.00 C ATOM 1599 O ASP A 104 -0.871 -6.755 6.339 1.00 0.00 O ATOM 1600 CB ASP A 104 1.864 -8.103 7.421 1.00 0.00 C ATOM 1601 CG ASP A 104 3.236 -8.743 7.322 1.00 0.00 C ATOM 1602 OD1 ASP A 104 4.240 -8.024 7.501 1.00 0.00 O ATOM 1603 OD2 ASP A 104 3.302 -9.963 7.066 1.00 0.00 O ATOM 0 H ASP A 104 2.008 -5.680 6.833 1.00 0.00 H new ATOM 0 HA ASP A 104 1.844 -8.102 5.271 1.00 0.00 H new ATOM 0 HB2 ASP A 104 1.891 -7.304 8.162 1.00 0.00 H new ATOM 0 HB3 ASP A 104 1.146 -8.842 7.775 1.00 0.00 H new ATOM 1608 N PRO A 105 -0.601 -8.829 5.463 1.00 0.00 N ATOM 1609 CA PRO A 105 -2.033 -9.107 5.294 1.00 0.00 C ATOM 1610 C PRO A 105 -2.803 -9.022 6.606 1.00 0.00 C ATOM 1611 O PRO A 105 -2.858 -9.985 7.369 1.00 0.00 O ATOM 1612 CB PRO A 105 -2.073 -10.538 4.743 1.00 0.00 C ATOM 1613 CG PRO A 105 -0.730 -11.115 5.044 1.00 0.00 C ATOM 1614 CD PRO A 105 0.230 -9.961 5.019 1.00 0.00 C ATOM 0 HA PRO A 105 -2.505 -8.376 4.638 1.00 0.00 H new ATOM 0 HB2 PRO A 105 -2.865 -11.119 5.215 1.00 0.00 H new ATOM 0 HB3 PRO A 105 -2.271 -10.541 3.671 1.00 0.00 H new ATOM 0 HG2 PRO A 105 -0.725 -11.606 6.017 1.00 0.00 H new ATOM 0 HG3 PRO A 105 -0.454 -11.868 4.306 1.00 0.00 H new ATOM 0 HD2 PRO A 105 1.077 -10.126 5.685 1.00 0.00 H new ATOM 0 HD3 PRO A 105 0.637 -9.796 4.021 1.00 0.00 H new ATOM 1622 N SER A 106 -3.396 -7.857 6.848 1.00 0.00 N ATOM 1623 CA SER A 106 -4.175 -7.603 8.060 1.00 0.00 C ATOM 1624 C SER A 106 -4.246 -6.105 8.330 1.00 0.00 C ATOM 1625 O SER A 106 -5.190 -5.616 8.947 1.00 0.00 O ATOM 1626 CB SER A 106 -3.561 -8.311 9.274 1.00 0.00 C ATOM 1627 OG SER A 106 -2.146 -8.319 9.198 1.00 0.00 O ATOM 0 H SER A 106 -3.351 -7.061 6.211 1.00 0.00 H new ATOM 0 HA SER A 106 -5.179 -7.997 7.901 1.00 0.00 H new ATOM 0 HB2 SER A 106 -3.876 -7.810 10.189 1.00 0.00 H new ATOM 0 HB3 SER A 106 -3.931 -9.335 9.328 1.00 0.00 H new ATOM 0 HG SER A 106 -1.844 -9.164 8.804 1.00 0.00 H new ATOM 1633 N GLY A 107 -3.230 -5.384 7.863 1.00 0.00 N ATOM 1634 CA GLY A 107 -3.180 -3.952 8.061 1.00 0.00 C ATOM 1635 C GLY A 107 -2.058 -3.552 8.995 1.00 0.00 C ATOM 1636 O GLY A 107 -2.253 -2.737 9.895 1.00 0.00 O ATOM 0 H GLY A 107 -2.439 -5.772 7.349 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -3.046 -3.457 7.099 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -4.131 -3.608 8.467 1.00 0.00 H new ATOM 1640 N LYS A 108 -0.878 -4.137 8.789 1.00 0.00 N ATOM 1641 CA LYS A 108 0.271 -3.835 9.640 1.00 0.00 C ATOM 1642 C LYS A 108 1.433 -3.243 8.845 1.00 0.00 C ATOM 1643 O LYS A 108 2.417 -3.929 8.564 1.00 0.00 O ATOM 1644 CB LYS A 108 0.730 -5.096 10.374 1.00 0.00 C ATOM 1645 CG LYS A 108 0.020 -5.314 11.701 1.00 0.00 C ATOM 1646 CD LYS A 108 1.002 -5.350 12.862 1.00 0.00 C ATOM 1647 CE LYS A 108 0.292 -5.600 14.184 1.00 0.00 C ATOM 1648 NZ LYS A 108 1.080 -6.493 15.077 1.00 0.00 N ATOM 0 H LYS A 108 -0.694 -4.815 8.049 1.00 0.00 H new ATOM 0 HA LYS A 108 -0.049 -3.086 10.365 1.00 0.00 H new ATOM 0 HB2 LYS A 108 0.562 -5.962 9.734 1.00 0.00 H new ATOM 0 HB3 LYS A 108 1.804 -5.034 10.551 1.00 0.00 H new ATOM 0 HG2 LYS A 108 -0.705 -4.516 11.862 1.00 0.00 H new ATOM 0 HG3 LYS A 108 -0.538 -6.250 11.666 1.00 0.00 H new ATOM 0 HD2 LYS A 108 1.741 -6.133 12.691 1.00 0.00 H new ATOM 0 HD3 LYS A 108 1.544 -4.405 12.911 1.00 0.00 H new ATOM 0 HE2 LYS A 108 0.115 -4.649 14.686 1.00 0.00 H new ATOM 0 HE3 LYS A 108 -0.684 -6.047 13.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 108 0.562 -6.639 15.967 1.00 0.00 H new ATOM 0 HZ2 LYS A 108 1.228 -7.410 14.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 108 2.001 -6.055 15.280 1.00 0.00 H new ATOM 1662 N VAL A 109 1.320 -1.961 8.496 1.00 0.00 N ATOM 1663 CA VAL A 109 2.361 -1.264 7.753 1.00 0.00 C ATOM 1664 C VAL A 109 3.694 -1.356 8.471 1.00 0.00 C ATOM 1665 O VAL A 109 3.790 -1.100 9.670 1.00 0.00 O ATOM 1666 CB VAL A 109 1.978 0.216 7.553 1.00 0.00 C ATOM 1667 CG1 VAL A 109 3.208 1.074 7.329 1.00 0.00 C ATOM 1668 CG2 VAL A 109 0.996 0.366 6.402 1.00 0.00 C ATOM 0 H VAL A 109 0.510 -1.384 8.720 1.00 0.00 H new ATOM 0 HA VAL A 109 2.457 -1.744 6.779 1.00 0.00 H new ATOM 0 HB VAL A 109 1.491 0.563 8.464 1.00 0.00 H new ATOM 0 HG11 VAL A 109 2.907 2.112 7.191 1.00 0.00 H new ATOM 0 HG12 VAL A 109 3.866 0.999 8.194 1.00 0.00 H new ATOM 0 HG13 VAL A 109 3.736 0.728 6.440 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.739 1.418 6.278 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.451 -0.007 5.484 1.00 0.00 H new ATOM 0 HG23 VAL A 109 0.093 -0.205 6.617 1.00 0.00 H new ATOM 1678 N HIS A 110 4.723 -1.711 7.718 1.00 0.00 N ATOM 1679 CA HIS A 110 6.057 -1.824 8.276 1.00 0.00 C ATOM 1680 C HIS A 110 7.060 -1.122 7.374 1.00 0.00 C ATOM 1681 O HIS A 110 7.012 -1.271 6.152 1.00 0.00 O ATOM 1682 CB HIS A 110 6.447 -3.294 8.452 1.00 0.00 C ATOM 1683 CG HIS A 110 6.054 -4.163 7.298 1.00 0.00 C ATOM 1684 ND1 HIS A 110 6.538 -3.981 6.019 1.00 0.00 N ATOM 1685 CD2 HIS A 110 5.216 -5.225 7.232 1.00 0.00 C ATOM 1686 CE1 HIS A 110 6.016 -4.891 5.218 1.00 0.00 C ATOM 1687 NE2 HIS A 110 5.211 -5.659 5.929 1.00 0.00 N ATOM 0 H HIS A 110 4.659 -1.925 6.723 1.00 0.00 H new ATOM 0 HA HIS A 110 6.063 -1.346 9.256 1.00 0.00 H new ATOM 0 HB2 HIS A 110 7.526 -3.360 8.594 1.00 0.00 H new ATOM 0 HB3 HIS A 110 5.982 -3.678 9.360 1.00 0.00 H new ATOM 0 HD1 HIS A 110 7.197 -3.256 5.736 1.00 0.00 H new ATOM 0 HD2 HIS A 110 4.656 -5.651 8.051 1.00 0.00 H new ATOM 0 HE1 HIS A 110 6.214 -4.990 4.161 1.00 0.00 H new ATOM 1696 N PRO A 111 7.992 -0.351 7.952 1.00 0.00 N ATOM 1697 CA PRO A 111 9.007 0.358 7.175 1.00 0.00 C ATOM 1698 C PRO A 111 10.023 -0.608 6.578 1.00 0.00 C ATOM 1699 O PRO A 111 11.221 -0.330 6.557 1.00 0.00 O ATOM 1700 CB PRO A 111 9.676 1.268 8.207 1.00 0.00 C ATOM 1701 CG PRO A 111 9.463 0.580 9.511 1.00 0.00 C ATOM 1702 CD PRO A 111 8.136 -0.119 9.401 1.00 0.00 C ATOM 0 HA PRO A 111 8.582 0.901 6.331 1.00 0.00 H new ATOM 0 HB2 PRO A 111 10.738 1.394 7.995 1.00 0.00 H new ATOM 0 HB3 PRO A 111 9.230 2.263 8.206 1.00 0.00 H new ATOM 0 HG2 PRO A 111 10.263 -0.132 9.711 1.00 0.00 H new ATOM 0 HG3 PRO A 111 9.460 1.295 10.333 1.00 0.00 H new ATOM 0 HD2 PRO A 111 8.127 -1.054 9.961 1.00 0.00 H new ATOM 0 HD3 PRO A 111 7.325 0.495 9.792 1.00 0.00 H new ATOM 1710 N GLU A 112 9.534 -1.751 6.102 1.00 0.00 N ATOM 1711 CA GLU A 112 10.404 -2.764 5.515 1.00 0.00 C ATOM 1712 C GLU A 112 10.323 -2.745 3.995 1.00 0.00 C ATOM 1713 O GLU A 112 11.333 -2.573 3.311 1.00 0.00 O ATOM 1714 CB GLU A 112 10.027 -4.152 6.036 1.00 0.00 C ATOM 1715 CG GLU A 112 10.541 -4.439 7.439 1.00 0.00 C ATOM 1716 CD GLU A 112 11.947 -5.007 7.442 1.00 0.00 C ATOM 1717 OE1 GLU A 112 12.108 -6.194 7.091 1.00 0.00 O ATOM 1718 OE2 GLU A 112 12.887 -4.264 7.796 1.00 0.00 O ATOM 0 H GLU A 112 8.544 -1.997 6.112 1.00 0.00 H new ATOM 0 HA GLU A 112 11.429 -2.535 5.807 1.00 0.00 H new ATOM 0 HB2 GLU A 112 8.941 -4.250 6.029 1.00 0.00 H new ATOM 0 HB3 GLU A 112 10.420 -4.906 5.353 1.00 0.00 H new ATOM 0 HG2 GLU A 112 10.524 -3.519 8.023 1.00 0.00 H new ATOM 0 HG3 GLU A 112 9.869 -5.142 7.931 1.00 0.00 H new ATOM 1725 N ILE A 113 9.117 -2.927 3.469 1.00 0.00 N ATOM 1726 CA ILE A 113 8.910 -2.936 2.029 1.00 0.00 C ATOM 1727 C ILE A 113 8.530 -1.548 1.516 1.00 0.00 C ATOM 1728 O ILE A 113 7.371 -1.125 1.605 1.00 0.00 O ATOM 1729 CB ILE A 113 7.827 -3.958 1.625 1.00 0.00 C ATOM 1730 CG1 ILE A 113 8.226 -5.361 2.086 1.00 0.00 C ATOM 1731 CG2 ILE A 113 7.601 -3.938 0.119 1.00 0.00 C ATOM 1732 CD1 ILE A 113 9.541 -5.836 1.506 1.00 0.00 C ATOM 0 H ILE A 113 8.270 -3.070 4.019 1.00 0.00 H new ATOM 0 HA ILE A 113 9.854 -3.231 1.571 1.00 0.00 H new ATOM 0 HB ILE A 113 6.893 -3.681 2.113 1.00 0.00 H new ATOM 0 HG12 ILE A 113 8.293 -5.372 3.174 1.00 0.00 H new ATOM 0 HG13 ILE A 113 7.440 -6.063 1.808 1.00 0.00 H new ATOM 0 HG21 ILE A 113 6.834 -4.666 -0.143 1.00 0.00 H new ATOM 0 HG22 ILE A 113 7.277 -2.943 -0.187 1.00 0.00 H new ATOM 0 HG23 ILE A 113 8.530 -4.190 -0.392 1.00 0.00 H new ATOM 0 HD11 ILE A 113 9.761 -6.838 1.876 1.00 0.00 H new ATOM 0 HD12 ILE A 113 9.472 -5.857 0.418 1.00 0.00 H new ATOM 0 HD13 ILE A 113 10.338 -5.155 1.806 1.00 0.00 H new ATOM 1744 N ILE A 114 9.526 -0.848 0.977 1.00 0.00 N ATOM 1745 CA ILE A 114 9.338 0.490 0.435 1.00 0.00 C ATOM 1746 C ILE A 114 9.653 0.513 -1.060 1.00 0.00 C ATOM 1747 O ILE A 114 9.767 -0.534 -1.696 1.00 0.00 O ATOM 1748 CB ILE A 114 10.244 1.516 1.153 1.00 0.00 C ATOM 1749 CG1 ILE A 114 11.725 1.248 0.840 1.00 0.00 C ATOM 1750 CG2 ILE A 114 9.991 1.501 2.657 1.00 0.00 C ATOM 1751 CD1 ILE A 114 12.332 0.102 1.626 1.00 0.00 C ATOM 0 H ILE A 114 10.483 -1.194 0.905 1.00 0.00 H new ATOM 0 HA ILE A 114 8.295 0.762 0.595 1.00 0.00 H new ATOM 0 HB ILE A 114 9.996 2.510 0.780 1.00 0.00 H new ATOM 0 HG12 ILE A 114 11.827 1.037 -0.225 1.00 0.00 H new ATOM 0 HG13 ILE A 114 12.296 2.154 1.041 1.00 0.00 H new ATOM 0 HG21 ILE A 114 10.639 2.231 3.142 1.00 0.00 H new ATOM 0 HG22 ILE A 114 8.949 1.754 2.853 1.00 0.00 H new ATOM 0 HG23 ILE A 114 10.204 0.508 3.052 1.00 0.00 H new ATOM 0 HD11 ILE A 114 13.378 -0.019 1.344 1.00 0.00 H new ATOM 0 HD12 ILE A 114 12.266 0.317 2.693 1.00 0.00 H new ATOM 0 HD13 ILE A 114 11.789 -0.817 1.407 1.00 0.00 H new ATOM 1763 N ASN A 115 9.814 1.712 -1.609 1.00 0.00 N ATOM 1764 CA ASN A 115 10.141 1.872 -3.017 1.00 0.00 C ATOM 1765 C ASN A 115 11.615 2.240 -3.168 1.00 0.00 C ATOM 1766 O ASN A 115 11.969 3.418 -3.212 1.00 0.00 O ATOM 1767 CB ASN A 115 9.255 2.945 -3.649 1.00 0.00 C ATOM 1768 CG ASN A 115 9.720 3.346 -5.036 1.00 0.00 C ATOM 1769 OD1 ASN A 115 10.375 2.569 -5.732 1.00 0.00 O ATOM 1770 ND2 ASN A 115 9.382 4.564 -5.446 1.00 0.00 N ATOM 0 H ASN A 115 9.722 2.589 -1.096 1.00 0.00 H new ATOM 0 HA ASN A 115 9.959 0.929 -3.533 1.00 0.00 H new ATOM 0 HB2 ASN A 115 8.231 2.577 -3.706 1.00 0.00 H new ATOM 0 HB3 ASN A 115 9.242 3.825 -3.006 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.666 4.888 -6.370 1.00 0.00 H new ATOM 0 HD22 ASN A 115 8.838 5.175 -4.836 1.00 0.00 H new ATOM 1777 N GLU A 116 12.466 1.224 -3.228 1.00 0.00 N ATOM 1778 CA GLU A 116 13.906 1.428 -3.357 1.00 0.00 C ATOM 1779 C GLU A 116 14.235 2.394 -4.493 1.00 0.00 C ATOM 1780 O GLU A 116 15.252 3.088 -4.454 1.00 0.00 O ATOM 1781 CB GLU A 116 14.611 0.092 -3.585 1.00 0.00 C ATOM 1782 CG GLU A 116 15.001 -0.611 -2.296 1.00 0.00 C ATOM 1783 CD GLU A 116 16.132 0.091 -1.570 1.00 0.00 C ATOM 1784 OE1 GLU A 116 17.306 -0.162 -1.912 1.00 0.00 O ATOM 1785 OE2 GLU A 116 15.843 0.896 -0.659 1.00 0.00 O ATOM 0 H GLU A 116 12.183 0.245 -3.189 1.00 0.00 H new ATOM 0 HA GLU A 116 14.264 1.869 -2.427 1.00 0.00 H new ATOM 0 HB2 GLU A 116 13.958 -0.561 -4.163 1.00 0.00 H new ATOM 0 HB3 GLU A 116 15.506 0.259 -4.184 1.00 0.00 H new ATOM 0 HG2 GLU A 116 14.132 -0.668 -1.640 1.00 0.00 H new ATOM 0 HG3 GLU A 116 15.298 -1.635 -2.520 1.00 0.00 H new ATOM 1792 N ASN A 117 13.372 2.435 -5.502 1.00 0.00 N ATOM 1793 CA ASN A 117 13.581 3.319 -6.643 1.00 0.00 C ATOM 1794 C ASN A 117 13.329 4.777 -6.261 1.00 0.00 C ATOM 1795 O ASN A 117 13.743 5.691 -6.974 1.00 0.00 O ATOM 1796 CB ASN A 117 12.666 2.917 -7.803 1.00 0.00 C ATOM 1797 CG ASN A 117 13.352 1.985 -8.780 1.00 0.00 C ATOM 1798 OD1 ASN A 117 13.348 2.222 -9.989 1.00 0.00 O ATOM 1799 ND2 ASN A 117 13.948 0.917 -8.263 1.00 0.00 N ATOM 0 H ASN A 117 12.525 1.869 -5.553 1.00 0.00 H new ATOM 0 HA ASN A 117 14.620 3.221 -6.958 1.00 0.00 H new ATOM 0 HB2 ASN A 117 11.773 2.432 -7.408 1.00 0.00 H new ATOM 0 HB3 ASN A 117 12.336 3.812 -8.329 1.00 0.00 H new ATOM 0 HD21 ASN A 117 14.427 0.255 -8.873 1.00 0.00 H new ATOM 0 HD22 ASN A 117 13.927 0.759 -7.256 1.00 0.00 H new ATOM 1806 N GLY A 118 12.652 4.990 -5.136 1.00 0.00 N ATOM 1807 CA GLY A 118 12.366 6.343 -4.691 1.00 0.00 C ATOM 1808 C GLY A 118 13.627 7.139 -4.412 1.00 0.00 C ATOM 1809 O GLY A 118 14.355 7.504 -5.334 1.00 0.00 O ATOM 0 H GLY A 118 12.297 4.253 -4.527 1.00 0.00 H new ATOM 0 HA2 GLY A 118 11.777 6.856 -5.451 1.00 0.00 H new ATOM 0 HA3 GLY A 118 11.757 6.304 -3.788 1.00 0.00 H new ATOM 1813 N ASN A 119 13.884 7.406 -3.135 1.00 0.00 N ATOM 1814 CA ASN A 119 15.065 8.161 -2.734 1.00 0.00 C ATOM 1815 C ASN A 119 15.767 7.480 -1.560 1.00 0.00 C ATOM 1816 O ASN A 119 15.262 6.500 -1.013 1.00 0.00 O ATOM 1817 CB ASN A 119 14.674 9.593 -2.360 1.00 0.00 C ATOM 1818 CG ASN A 119 15.446 10.628 -3.157 1.00 0.00 C ATOM 1819 OD1 ASN A 119 15.739 10.432 -4.336 1.00 0.00 O ATOM 1820 ND2 ASN A 119 15.781 11.740 -2.511 1.00 0.00 N ATOM 0 H ASN A 119 13.290 7.110 -2.361 1.00 0.00 H new ATOM 0 HA ASN A 119 15.757 8.193 -3.576 1.00 0.00 H new ATOM 0 HB2 ASN A 119 13.606 9.731 -2.528 1.00 0.00 H new ATOM 0 HB3 ASN A 119 14.852 9.750 -1.296 1.00 0.00 H new ATOM 0 HD21 ASN A 119 16.302 12.473 -2.993 1.00 0.00 H new ATOM 0 HD22 ASN A 119 15.517 11.861 -1.533 1.00 0.00 H new ATOM 1827 N PRO A 120 16.948 7.987 -1.162 1.00 0.00 N ATOM 1828 CA PRO A 120 17.732 7.422 -0.057 1.00 0.00 C ATOM 1829 C PRO A 120 17.141 7.718 1.323 1.00 0.00 C ATOM 1830 O PRO A 120 17.794 7.488 2.342 1.00 0.00 O ATOM 1831 CB PRO A 120 19.108 8.100 -0.195 1.00 0.00 C ATOM 1832 CG PRO A 120 19.071 8.843 -1.491 1.00 0.00 C ATOM 1833 CD PRO A 120 17.627 9.140 -1.764 1.00 0.00 C ATOM 0 HA PRO A 120 17.761 6.334 -0.121 1.00 0.00 H new ATOM 0 HB2 PRO A 120 19.295 8.777 0.638 1.00 0.00 H new ATOM 0 HB3 PRO A 120 19.909 7.361 -0.191 1.00 0.00 H new ATOM 0 HG2 PRO A 120 19.652 9.763 -1.429 1.00 0.00 H new ATOM 0 HG3 PRO A 120 19.504 8.246 -2.294 1.00 0.00 H new ATOM 0 HD2 PRO A 120 17.313 10.079 -1.309 1.00 0.00 H new ATOM 0 HD3 PRO A 120 17.424 9.219 -2.832 1.00 0.00 H new ATOM 1841 N SER A 121 15.912 8.221 1.361 1.00 0.00 N ATOM 1842 CA SER A 121 15.257 8.533 2.626 1.00 0.00 C ATOM 1843 C SER A 121 13.755 8.519 2.430 1.00 0.00 C ATOM 1844 O SER A 121 13.001 8.000 3.253 1.00 0.00 O ATOM 1845 CB SER A 121 15.706 9.902 3.138 1.00 0.00 C ATOM 1846 OG SER A 121 16.747 9.775 4.092 1.00 0.00 O ATOM 0 H SER A 121 15.351 8.421 0.533 1.00 0.00 H new ATOM 0 HA SER A 121 15.535 7.782 3.366 1.00 0.00 H new ATOM 0 HB2 SER A 121 16.048 10.512 2.302 1.00 0.00 H new ATOM 0 HB3 SER A 121 14.859 10.421 3.587 1.00 0.00 H new ATOM 0 HG SER A 121 17.357 9.059 3.817 1.00 0.00 H new ATOM 1852 N TYR A 122 13.340 9.091 1.314 1.00 0.00 N ATOM 1853 CA TYR A 122 11.942 9.160 0.950 1.00 0.00 C ATOM 1854 C TYR A 122 11.353 7.760 0.803 1.00 0.00 C ATOM 1855 O TYR A 122 10.258 7.481 1.293 1.00 0.00 O ATOM 1856 CB TYR A 122 11.817 9.936 -0.356 1.00 0.00 C ATOM 1857 CG TYR A 122 11.273 11.336 -0.178 1.00 0.00 C ATOM 1858 CD1 TYR A 122 9.955 11.553 0.195 1.00 0.00 C ATOM 1859 CD2 TYR A 122 12.090 12.440 -0.377 1.00 0.00 C ATOM 1860 CE1 TYR A 122 9.463 12.834 0.360 1.00 0.00 C ATOM 1861 CE2 TYR A 122 11.608 13.723 -0.213 1.00 0.00 C ATOM 1862 CZ TYR A 122 10.294 13.915 0.155 1.00 0.00 C ATOM 1863 OH TYR A 122 9.808 15.193 0.319 1.00 0.00 O ATOM 0 H TYR A 122 13.967 9.521 0.635 1.00 0.00 H new ATOM 0 HA TYR A 122 11.384 9.670 1.735 1.00 0.00 H new ATOM 0 HB2 TYR A 122 12.797 9.993 -0.830 1.00 0.00 H new ATOM 0 HB3 TYR A 122 11.166 9.386 -1.035 1.00 0.00 H new ATOM 0 HD1 TYR A 122 9.303 10.708 0.359 1.00 0.00 H new ATOM 0 HD2 TYR A 122 13.120 12.293 -0.665 1.00 0.00 H new ATOM 0 HE1 TYR A 122 8.433 12.987 0.648 1.00 0.00 H new ATOM 0 HE2 TYR A 122 12.257 14.571 -0.372 1.00 0.00 H new ATOM 0 HH TYR A 122 10.521 15.840 0.138 1.00 0.00 H new ATOM 1873 N LYS A 123 12.097 6.886 0.132 1.00 0.00 N ATOM 1874 CA LYS A 123 11.672 5.504 -0.079 1.00 0.00 C ATOM 1875 C LYS A 123 10.247 5.419 -0.637 1.00 0.00 C ATOM 1876 O LYS A 123 10.049 5.377 -1.850 1.00 0.00 O ATOM 1877 CB LYS A 123 11.770 4.715 1.232 1.00 0.00 C ATOM 1878 CG LYS A 123 13.192 4.482 1.726 1.00 0.00 C ATOM 1879 CD LYS A 123 14.049 3.769 0.690 1.00 0.00 C ATOM 1880 CE LYS A 123 15.453 4.345 0.638 1.00 0.00 C ATOM 1881 NZ LYS A 123 16.380 3.636 1.562 1.00 0.00 N ATOM 0 H LYS A 123 13.003 7.111 -0.278 1.00 0.00 H new ATOM 0 HA LYS A 123 12.342 5.066 -0.819 1.00 0.00 H new ATOM 0 HB2 LYS A 123 11.214 5.247 2.004 1.00 0.00 H new ATOM 0 HB3 LYS A 123 11.283 3.749 1.097 1.00 0.00 H new ATOM 0 HG2 LYS A 123 13.649 5.439 1.977 1.00 0.00 H new ATOM 0 HG3 LYS A 123 13.165 3.891 2.642 1.00 0.00 H new ATOM 0 HD2 LYS A 123 14.099 2.706 0.927 1.00 0.00 H new ATOM 0 HD3 LYS A 123 13.583 3.855 -0.291 1.00 0.00 H new ATOM 0 HE2 LYS A 123 15.835 4.278 -0.381 1.00 0.00 H new ATOM 0 HE3 LYS A 123 15.421 5.403 0.898 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 17.327 4.060 1.496 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 16.030 3.721 2.538 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 16.431 2.631 1.299 1.00 0.00 H new ATOM 1895 N TYR A 124 9.264 5.378 0.260 1.00 0.00 N ATOM 1896 CA TYR A 124 7.855 5.271 -0.116 1.00 0.00 C ATOM 1897 C TYR A 124 7.429 6.297 -1.171 1.00 0.00 C ATOM 1898 O TYR A 124 6.346 6.173 -1.752 1.00 0.00 O ATOM 1899 CB TYR A 124 6.986 5.412 1.130 1.00 0.00 C ATOM 1900 CG TYR A 124 7.096 4.230 2.066 1.00 0.00 C ATOM 1901 CD1 TYR A 124 6.931 2.935 1.598 1.00 0.00 C ATOM 1902 CD2 TYR A 124 7.363 4.408 3.417 1.00 0.00 C ATOM 1903 CE1 TYR A 124 7.026 1.851 2.443 1.00 0.00 C ATOM 1904 CE2 TYR A 124 7.460 3.325 4.273 1.00 0.00 C ATOM 1905 CZ TYR A 124 7.290 2.050 3.780 1.00 0.00 C ATOM 1906 OH TYR A 124 7.382 0.969 4.625 1.00 0.00 O ATOM 0 H TYR A 124 9.421 5.418 1.267 1.00 0.00 H new ATOM 0 HA TYR A 124 7.719 4.289 -0.569 1.00 0.00 H new ATOM 0 HB2 TYR A 124 7.271 6.319 1.664 1.00 0.00 H new ATOM 0 HB3 TYR A 124 5.946 5.534 0.828 1.00 0.00 H new ATOM 0 HD1 TYR A 124 6.724 2.773 0.550 1.00 0.00 H new ATOM 0 HD2 TYR A 124 7.497 5.407 3.806 1.00 0.00 H new ATOM 0 HE1 TYR A 124 6.894 0.850 2.059 1.00 0.00 H new ATOM 0 HE2 TYR A 124 7.668 3.479 5.322 1.00 0.00 H new ATOM 0 HH TYR A 124 6.554 0.447 4.580 1.00 0.00 H new ATOM 1916 N PHE A 125 8.260 7.309 -1.420 1.00 0.00 N ATOM 1917 CA PHE A 125 7.926 8.327 -2.411 1.00 0.00 C ATOM 1918 C PHE A 125 7.951 7.750 -3.819 1.00 0.00 C ATOM 1919 O PHE A 125 9.009 7.398 -4.339 1.00 0.00 O ATOM 1920 CB PHE A 125 8.892 9.510 -2.330 1.00 0.00 C ATOM 1921 CG PHE A 125 8.555 10.621 -3.288 1.00 0.00 C ATOM 1922 CD1 PHE A 125 8.790 10.483 -4.650 1.00 0.00 C ATOM 1923 CD2 PHE A 125 7.996 11.803 -2.828 1.00 0.00 C ATOM 1924 CE1 PHE A 125 8.474 11.498 -5.528 1.00 0.00 C ATOM 1925 CE2 PHE A 125 7.680 12.823 -3.705 1.00 0.00 C ATOM 1926 CZ PHE A 125 7.920 12.670 -5.057 1.00 0.00 C ATOM 0 H PHE A 125 9.158 7.444 -0.955 1.00 0.00 H new ATOM 0 HA PHE A 125 6.917 8.676 -2.189 1.00 0.00 H new ATOM 0 HB2 PHE A 125 8.890 9.903 -1.313 1.00 0.00 H new ATOM 0 HB3 PHE A 125 9.904 9.159 -2.533 1.00 0.00 H new ATOM 0 HD1 PHE A 125 9.226 9.569 -5.026 1.00 0.00 H new ATOM 0 HD2 PHE A 125 7.805 11.928 -1.772 1.00 0.00 H new ATOM 0 HE1 PHE A 125 8.660 11.375 -6.585 1.00 0.00 H new ATOM 0 HE2 PHE A 125 7.246 13.739 -3.334 1.00 0.00 H new ATOM 0 HZ PHE A 125 7.674 13.467 -5.744 1.00 0.00 H new ATOM 1936 N TYR A 126 6.780 7.672 -4.440 1.00 0.00 N ATOM 1937 CA TYR A 126 6.670 7.158 -5.796 1.00 0.00 C ATOM 1938 C TYR A 126 6.453 8.309 -6.770 1.00 0.00 C ATOM 1939 O TYR A 126 6.163 9.431 -6.356 1.00 0.00 O ATOM 1940 CB TYR A 126 5.523 6.152 -5.899 1.00 0.00 C ATOM 1941 CG TYR A 126 5.982 4.711 -5.850 1.00 0.00 C ATOM 1942 CD1 TYR A 126 6.910 4.227 -6.762 1.00 0.00 C ATOM 1943 CD2 TYR A 126 5.488 3.837 -4.891 1.00 0.00 C ATOM 1944 CE1 TYR A 126 7.331 2.911 -6.721 1.00 0.00 C ATOM 1945 CE2 TYR A 126 5.905 2.520 -4.843 1.00 0.00 C ATOM 1946 CZ TYR A 126 6.827 2.062 -5.760 1.00 0.00 C ATOM 1947 OH TYR A 126 7.245 0.752 -5.716 1.00 0.00 O ATOM 0 H TYR A 126 5.894 7.959 -4.024 1.00 0.00 H new ATOM 0 HA TYR A 126 7.597 6.646 -6.052 1.00 0.00 H new ATOM 0 HB2 TYR A 126 4.820 6.329 -5.085 1.00 0.00 H new ATOM 0 HB3 TYR A 126 4.983 6.322 -6.830 1.00 0.00 H new ATOM 0 HD1 TYR A 126 7.309 4.889 -7.516 1.00 0.00 H new ATOM 0 HD2 TYR A 126 4.766 4.192 -4.171 1.00 0.00 H new ATOM 0 HE1 TYR A 126 8.052 2.550 -7.439 1.00 0.00 H new ATOM 0 HE2 TYR A 126 5.510 1.853 -4.091 1.00 0.00 H new ATOM 0 HH TYR A 126 6.794 0.289 -4.979 1.00 0.00 H new ATOM 1957 N VAL A 127 6.605 8.037 -8.058 1.00 0.00 N ATOM 1958 CA VAL A 127 6.431 9.072 -9.064 1.00 0.00 C ATOM 1959 C VAL A 127 6.506 8.495 -10.479 1.00 0.00 C ATOM 1960 O VAL A 127 7.197 9.030 -11.345 1.00 0.00 O ATOM 1961 CB VAL A 127 7.484 10.188 -8.877 1.00 0.00 C ATOM 1962 CG1 VAL A 127 8.853 9.755 -9.381 1.00 0.00 C ATOM 1963 CG2 VAL A 127 7.038 11.474 -9.549 1.00 0.00 C ATOM 0 H VAL A 127 6.846 7.117 -8.428 1.00 0.00 H new ATOM 0 HA VAL A 127 5.438 9.501 -8.933 1.00 0.00 H new ATOM 0 HB VAL A 127 7.574 10.378 -7.808 1.00 0.00 H new ATOM 0 HG11 VAL A 127 9.568 10.565 -9.233 1.00 0.00 H new ATOM 0 HG12 VAL A 127 9.182 8.875 -8.829 1.00 0.00 H new ATOM 0 HG13 VAL A 127 8.791 9.515 -10.442 1.00 0.00 H new ATOM 0 HG21 VAL A 127 7.796 12.243 -9.403 1.00 0.00 H new ATOM 0 HG22 VAL A 127 6.901 11.298 -10.616 1.00 0.00 H new ATOM 0 HG23 VAL A 127 6.096 11.805 -9.112 1.00 0.00 H new ATOM 1973 N SER A 128 5.774 7.399 -10.695 1.00 0.00 N ATOM 1974 CA SER A 128 5.725 6.715 -11.994 1.00 0.00 C ATOM 1975 C SER A 128 5.355 5.244 -11.813 1.00 0.00 C ATOM 1976 O SER A 128 6.118 4.475 -11.230 1.00 0.00 O ATOM 1977 CB SER A 128 7.069 6.815 -12.727 1.00 0.00 C ATOM 1978 OG SER A 128 7.166 5.837 -13.750 1.00 0.00 O ATOM 0 H SER A 128 5.199 6.960 -9.977 1.00 0.00 H new ATOM 0 HA SER A 128 4.962 7.209 -12.595 1.00 0.00 H new ATOM 0 HB2 SER A 128 7.178 7.810 -13.159 1.00 0.00 H new ATOM 0 HB3 SER A 128 7.885 6.685 -12.016 1.00 0.00 H new ATOM 0 HG SER A 128 8.031 5.922 -14.203 1.00 0.00 H new ATOM 1984 N ALA A 129 4.187 4.859 -12.322 1.00 0.00 N ATOM 1985 CA ALA A 129 3.720 3.476 -12.220 1.00 0.00 C ATOM 1986 C ALA A 129 4.816 2.485 -12.610 1.00 0.00 C ATOM 1987 O ALA A 129 4.812 1.339 -12.166 1.00 0.00 O ATOM 1988 CB ALA A 129 2.492 3.262 -13.088 1.00 0.00 C ATOM 0 H ALA A 129 3.546 5.484 -12.810 1.00 0.00 H new ATOM 0 HA ALA A 129 3.455 3.295 -11.178 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.159 2.228 -12.999 1.00 0.00 H new ATOM 0 HB2 ALA A 129 1.694 3.929 -12.761 1.00 0.00 H new ATOM 0 HB3 ALA A 129 2.740 3.475 -14.128 1.00 0.00 H new ATOM 1994 N GLU A 130 5.749 2.929 -13.443 1.00 0.00 N ATOM 1995 CA GLU A 130 6.844 2.073 -13.887 1.00 0.00 C ATOM 1996 C GLU A 130 7.556 1.431 -12.696 1.00 0.00 C ATOM 1997 O GLU A 130 7.501 0.215 -12.499 1.00 0.00 O ATOM 1998 CB GLU A 130 7.844 2.877 -14.720 1.00 0.00 C ATOM 1999 CG GLU A 130 8.482 2.076 -15.842 1.00 0.00 C ATOM 2000 CD GLU A 130 9.794 2.675 -16.311 1.00 0.00 C ATOM 2001 OE1 GLU A 130 10.788 2.592 -15.560 1.00 0.00 O ATOM 2002 OE2 GLU A 130 9.827 3.226 -17.432 1.00 0.00 O ATOM 0 H GLU A 130 5.770 3.875 -13.825 1.00 0.00 H new ATOM 0 HA GLU A 130 6.421 1.280 -14.504 1.00 0.00 H new ATOM 0 HB2 GLU A 130 7.337 3.743 -15.146 1.00 0.00 H new ATOM 0 HB3 GLU A 130 8.628 3.257 -14.065 1.00 0.00 H new ATOM 0 HG2 GLU A 130 8.654 1.055 -15.502 1.00 0.00 H new ATOM 0 HG3 GLU A 130 7.791 2.021 -16.683 1.00 0.00 H new ATOM 2009 N GLN A 131 8.227 2.247 -11.898 1.00 0.00 N ATOM 2010 CA GLN A 131 8.942 1.730 -10.742 1.00 0.00 C ATOM 2011 C GLN A 131 8.014 0.956 -9.815 1.00 0.00 C ATOM 2012 O GLN A 131 8.400 -0.060 -9.244 1.00 0.00 O ATOM 2013 CB GLN A 131 9.616 2.842 -9.959 1.00 0.00 C ATOM 2014 CG GLN A 131 8.701 4.009 -9.630 1.00 0.00 C ATOM 2015 CD GLN A 131 9.398 5.085 -8.821 1.00 0.00 C ATOM 2016 OE1 GLN A 131 10.269 4.796 -8.000 1.00 0.00 O ATOM 2017 NE2 GLN A 131 9.017 6.338 -9.047 1.00 0.00 N ATOM 0 H GLN A 131 8.291 3.257 -12.027 1.00 0.00 H new ATOM 0 HA GLN A 131 9.707 1.055 -11.126 1.00 0.00 H new ATOM 0 HB2 GLN A 131 10.011 2.430 -9.030 1.00 0.00 H new ATOM 0 HB3 GLN A 131 10.467 3.211 -10.531 1.00 0.00 H new ATOM 0 HG2 GLN A 131 8.324 4.443 -10.556 1.00 0.00 H new ATOM 0 HG3 GLN A 131 7.837 3.644 -9.074 1.00 0.00 H new ATOM 0 HE21 GLN A 131 8.291 6.534 -9.736 1.00 0.00 H new ATOM 0 HE22 GLN A 131 9.450 7.104 -8.531 1.00 0.00 H new ATOM 2026 N VAL A 132 6.787 1.439 -9.661 1.00 0.00 N ATOM 2027 CA VAL A 132 5.825 0.775 -8.790 1.00 0.00 C ATOM 2028 C VAL A 132 5.658 -0.686 -9.195 1.00 0.00 C ATOM 2029 O VAL A 132 5.298 -1.528 -8.377 1.00 0.00 O ATOM 2030 CB VAL A 132 4.441 1.482 -8.772 1.00 0.00 C ATOM 2031 CG1 VAL A 132 4.578 2.974 -9.031 1.00 0.00 C ATOM 2032 CG2 VAL A 132 3.464 0.852 -9.762 1.00 0.00 C ATOM 0 H VAL A 132 6.437 2.279 -10.122 1.00 0.00 H new ATOM 0 HA VAL A 132 6.229 0.831 -7.779 1.00 0.00 H new ATOM 0 HB VAL A 132 4.030 1.345 -7.772 1.00 0.00 H new ATOM 0 HG11 VAL A 132 3.592 3.439 -9.012 1.00 0.00 H new ATOM 0 HG12 VAL A 132 5.205 3.421 -8.260 1.00 0.00 H new ATOM 0 HG13 VAL A 132 5.035 3.133 -10.008 1.00 0.00 H new ATOM 0 HG21 VAL A 132 2.510 1.377 -9.716 1.00 0.00 H new ATOM 0 HG22 VAL A 132 3.870 0.925 -10.771 1.00 0.00 H new ATOM 0 HG23 VAL A 132 3.313 -0.197 -9.507 1.00 0.00 H new ATOM 2042 N VAL A 133 5.927 -0.978 -10.466 1.00 0.00 N ATOM 2043 CA VAL A 133 5.805 -2.337 -10.972 1.00 0.00 C ATOM 2044 C VAL A 133 7.022 -3.176 -10.604 1.00 0.00 C ATOM 2045 O VAL A 133 6.904 -4.382 -10.392 1.00 0.00 O ATOM 2046 CB VAL A 133 5.612 -2.372 -12.502 1.00 0.00 C ATOM 2047 CG1 VAL A 133 6.945 -2.254 -13.227 1.00 0.00 C ATOM 2048 CG2 VAL A 133 4.900 -3.650 -12.907 1.00 0.00 C ATOM 0 H VAL A 133 6.229 -0.293 -11.159 1.00 0.00 H new ATOM 0 HA VAL A 133 4.918 -2.759 -10.500 1.00 0.00 H new ATOM 0 HB VAL A 133 4.999 -1.517 -12.789 1.00 0.00 H new ATOM 0 HG11 VAL A 133 6.777 -2.282 -14.304 1.00 0.00 H new ATOM 0 HG12 VAL A 133 7.423 -1.312 -12.958 1.00 0.00 H new ATOM 0 HG13 VAL A 133 7.591 -3.084 -12.939 1.00 0.00 H new ATOM 0 HG21 VAL A 133 4.768 -3.666 -13.989 1.00 0.00 H new ATOM 0 HG22 VAL A 133 5.495 -4.511 -12.601 1.00 0.00 H new ATOM 0 HG23 VAL A 133 3.925 -3.693 -12.422 1.00 0.00 H new ATOM 2058 N GLN A 134 8.194 -2.547 -10.535 1.00 0.00 N ATOM 2059 CA GLN A 134 9.404 -3.292 -10.190 1.00 0.00 C ATOM 2060 C GLN A 134 9.452 -3.531 -8.691 1.00 0.00 C ATOM 2061 O GLN A 134 9.748 -4.636 -8.234 1.00 0.00 O ATOM 2062 CB GLN A 134 10.667 -2.567 -10.660 1.00 0.00 C ATOM 2063 CG GLN A 134 10.584 -1.061 -10.547 1.00 0.00 C ATOM 2064 CD GLN A 134 11.888 -0.373 -10.906 1.00 0.00 C ATOM 2065 OE1 GLN A 134 12.873 -0.463 -10.173 1.00 0.00 O ATOM 2066 NE2 GLN A 134 11.900 0.317 -12.040 1.00 0.00 N ATOM 0 H GLN A 134 8.331 -1.551 -10.708 1.00 0.00 H new ATOM 0 HA GLN A 134 9.370 -4.252 -10.706 1.00 0.00 H new ATOM 0 HB2 GLN A 134 11.516 -2.920 -10.075 1.00 0.00 H new ATOM 0 HB3 GLN A 134 10.863 -2.834 -11.699 1.00 0.00 H new ATOM 0 HG2 GLN A 134 9.793 -0.695 -11.201 1.00 0.00 H new ATOM 0 HG3 GLN A 134 10.305 -0.792 -9.528 1.00 0.00 H new ATOM 0 HE21 GLN A 134 11.060 0.365 -12.617 1.00 0.00 H new ATOM 0 HE22 GLN A 134 12.749 0.799 -12.334 1.00 0.00 H new ATOM 2075 N GLY A 135 9.133 -2.494 -7.932 1.00 0.00 N ATOM 2076 CA GLY A 135 9.120 -2.614 -6.492 1.00 0.00 C ATOM 2077 C GLY A 135 7.965 -3.471 -6.011 1.00 0.00 C ATOM 2078 O GLY A 135 7.980 -3.963 -4.883 1.00 0.00 O ATOM 0 H GLY A 135 8.883 -1.572 -8.289 1.00 0.00 H new ATOM 0 HA2 GLY A 135 10.061 -3.049 -6.155 1.00 0.00 H new ATOM 0 HA3 GLY A 135 9.048 -1.623 -6.045 1.00 0.00 H new ATOM 2082 N MET A 136 6.961 -3.662 -6.872 1.00 0.00 N ATOM 2083 CA MET A 136 5.807 -4.474 -6.512 1.00 0.00 C ATOM 2084 C MET A 136 5.960 -5.894 -7.041 1.00 0.00 C ATOM 2085 O MET A 136 5.575 -6.853 -6.377 1.00 0.00 O ATOM 2086 CB MET A 136 4.511 -3.842 -7.028 1.00 0.00 C ATOM 2087 CG MET A 136 4.268 -4.037 -8.517 1.00 0.00 C ATOM 2088 SD MET A 136 3.226 -5.465 -8.868 1.00 0.00 S ATOM 2089 CE MET A 136 1.691 -4.658 -9.319 1.00 0.00 C ATOM 0 H MET A 136 6.928 -3.268 -7.812 1.00 0.00 H new ATOM 0 HA MET A 136 5.753 -4.518 -5.424 1.00 0.00 H new ATOM 0 HB2 MET A 136 3.671 -4.263 -6.477 1.00 0.00 H new ATOM 0 HB3 MET A 136 4.531 -2.774 -6.812 1.00 0.00 H new ATOM 0 HG2 MET A 136 3.800 -3.141 -8.925 1.00 0.00 H new ATOM 0 HG3 MET A 136 5.225 -4.157 -9.025 1.00 0.00 H new ATOM 0 HE1 MET A 136 0.856 -5.169 -8.839 1.00 0.00 H new ATOM 0 HE2 MET A 136 1.716 -3.619 -8.992 1.00 0.00 H new ATOM 0 HE3 MET A 136 1.565 -4.694 -10.401 1.00 0.00 H new ATOM 2099 N LYS A 137 6.538 -6.021 -8.230 1.00 0.00 N ATOM 2100 CA LYS A 137 6.755 -7.329 -8.833 1.00 0.00 C ATOM 2101 C LYS A 137 7.825 -8.107 -8.066 1.00 0.00 C ATOM 2102 O LYS A 137 7.973 -9.317 -8.241 1.00 0.00 O ATOM 2103 CB LYS A 137 7.138 -7.192 -10.311 1.00 0.00 C ATOM 2104 CG LYS A 137 8.560 -6.708 -10.548 1.00 0.00 C ATOM 2105 CD LYS A 137 8.741 -6.190 -11.969 1.00 0.00 C ATOM 2106 CE LYS A 137 8.317 -7.219 -13.007 1.00 0.00 C ATOM 2107 NZ LYS A 137 9.327 -8.301 -13.163 1.00 0.00 N ATOM 0 H LYS A 137 6.864 -5.236 -8.794 1.00 0.00 H new ATOM 0 HA LYS A 137 5.821 -7.888 -8.776 1.00 0.00 H new ATOM 0 HB2 LYS A 137 7.010 -8.159 -10.798 1.00 0.00 H new ATOM 0 HB3 LYS A 137 6.446 -6.499 -10.791 1.00 0.00 H new ATOM 0 HG2 LYS A 137 8.800 -5.917 -9.837 1.00 0.00 H new ATOM 0 HG3 LYS A 137 9.259 -7.524 -10.365 1.00 0.00 H new ATOM 0 HD2 LYS A 137 8.156 -5.280 -12.101 1.00 0.00 H new ATOM 0 HD3 LYS A 137 9.786 -5.924 -12.128 1.00 0.00 H new ATOM 0 HE2 LYS A 137 7.361 -7.654 -12.717 1.00 0.00 H new ATOM 0 HE3 LYS A 137 8.164 -6.725 -13.966 1.00 0.00 H new ATOM 0 HZ1 LYS A 137 9.000 -8.981 -13.879 1.00 0.00 H new ATOM 0 HZ2 LYS A 137 10.233 -7.889 -13.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 137 9.455 -8.790 -12.254 1.00 0.00 H new ATOM 2121 N GLU A 138 8.566 -7.400 -7.214 1.00 0.00 N ATOM 2122 CA GLU A 138 9.618 -8.015 -6.412 1.00 0.00 C ATOM 2123 C GLU A 138 9.125 -8.299 -4.999 1.00 0.00 C ATOM 2124 O GLU A 138 9.106 -9.446 -4.551 1.00 0.00 O ATOM 2125 CB GLU A 138 10.845 -7.103 -6.355 1.00 0.00 C ATOM 2126 CG GLU A 138 11.916 -7.457 -7.373 1.00 0.00 C ATOM 2127 CD GLU A 138 11.440 -7.293 -8.803 1.00 0.00 C ATOM 2128 OE1 GLU A 138 11.408 -6.143 -9.291 1.00 0.00 O ATOM 2129 OE2 GLU A 138 11.101 -8.314 -9.437 1.00 0.00 O ATOM 0 H GLU A 138 8.455 -6.397 -7.062 1.00 0.00 H new ATOM 0 HA GLU A 138 9.894 -8.958 -6.883 1.00 0.00 H new ATOM 0 HB2 GLU A 138 10.529 -6.072 -6.517 1.00 0.00 H new ATOM 0 HB3 GLU A 138 11.276 -7.151 -5.355 1.00 0.00 H new ATOM 0 HG2 GLU A 138 12.789 -6.825 -7.210 1.00 0.00 H new ATOM 0 HG3 GLU A 138 12.234 -8.488 -7.216 1.00 0.00 H new ATOM 2136 N ALA A 139 8.729 -7.240 -4.303 1.00 0.00 N ATOM 2137 CA ALA A 139 8.236 -7.361 -2.936 1.00 0.00 C ATOM 2138 C ALA A 139 7.038 -8.302 -2.857 1.00 0.00 C ATOM 2139 O ALA A 139 6.723 -8.833 -1.792 1.00 0.00 O ATOM 2140 CB ALA A 139 7.863 -5.990 -2.391 1.00 0.00 C ATOM 0 H ALA A 139 8.740 -6.286 -4.664 1.00 0.00 H new ATOM 0 HA ALA A 139 9.035 -7.784 -2.327 1.00 0.00 H new ATOM 0 HB1 ALA A 139 7.496 -6.092 -1.370 1.00 0.00 H new ATOM 0 HB2 ALA A 139 8.741 -5.344 -2.398 1.00 0.00 H new ATOM 0 HB3 ALA A 139 7.084 -5.550 -3.014 1.00 0.00 H new ATOM 2146 N GLN A 140 6.369 -8.493 -3.988 1.00 0.00 N ATOM 2147 CA GLN A 140 5.199 -9.355 -4.053 1.00 0.00 C ATOM 2148 C GLN A 140 5.532 -10.811 -3.719 1.00 0.00 C ATOM 2149 O GLN A 140 4.631 -11.612 -3.471 1.00 0.00 O ATOM 2150 CB GLN A 140 4.568 -9.267 -5.442 1.00 0.00 C ATOM 2151 CG GLN A 140 5.539 -9.515 -6.584 1.00 0.00 C ATOM 2152 CD GLN A 140 5.736 -10.988 -6.887 1.00 0.00 C ATOM 2153 OE1 GLN A 140 6.865 -11.458 -7.016 1.00 0.00 O ATOM 2154 NE2 GLN A 140 4.637 -11.724 -7.013 1.00 0.00 N ATOM 0 H GLN A 140 6.620 -8.059 -4.876 1.00 0.00 H new ATOM 0 HA GLN A 140 4.491 -9.005 -3.302 1.00 0.00 H new ATOM 0 HB2 GLN A 140 3.756 -9.991 -5.506 1.00 0.00 H new ATOM 0 HB3 GLN A 140 4.124 -8.279 -5.565 1.00 0.00 H new ATOM 0 HG2 GLN A 140 5.174 -9.011 -7.479 1.00 0.00 H new ATOM 0 HG3 GLN A 140 6.502 -9.069 -6.338 1.00 0.00 H new ATOM 0 HE21 GLN A 140 3.719 -11.294 -6.898 1.00 0.00 H new ATOM 0 HE22 GLN A 140 4.711 -12.719 -7.225 1.00 0.00 H new ATOM 2163 N GLU A 141 6.817 -11.158 -3.722 1.00 0.00 N ATOM 2164 CA GLU A 141 7.233 -12.528 -3.424 1.00 0.00 C ATOM 2165 C GLU A 141 7.954 -12.623 -2.078 1.00 0.00 C ATOM 2166 O GLU A 141 7.765 -13.585 -1.333 1.00 0.00 O ATOM 2167 CB GLU A 141 8.114 -13.070 -4.552 1.00 0.00 C ATOM 2168 CG GLU A 141 9.590 -12.980 -4.256 1.00 0.00 C ATOM 2169 CD GLU A 141 10.450 -13.116 -5.498 1.00 0.00 C ATOM 2170 OE1 GLU A 141 10.508 -12.148 -6.287 1.00 0.00 O ATOM 2171 OE2 GLU A 141 11.065 -14.186 -5.682 1.00 0.00 O ATOM 0 H GLU A 141 7.583 -10.516 -3.926 1.00 0.00 H new ATOM 0 HA GLU A 141 6.335 -13.141 -3.352 1.00 0.00 H new ATOM 0 HB2 GLU A 141 7.852 -14.111 -4.739 1.00 0.00 H new ATOM 0 HB3 GLU A 141 7.900 -12.518 -5.467 1.00 0.00 H new ATOM 0 HG2 GLU A 141 9.802 -12.024 -3.776 1.00 0.00 H new ATOM 0 HG3 GLU A 141 9.861 -13.760 -3.545 1.00 0.00 H new ATOM 2178 N ARG A 142 8.784 -11.632 -1.778 1.00 0.00 N ATOM 2179 CA ARG A 142 9.537 -11.619 -0.528 1.00 0.00 C ATOM 2180 C ARG A 142 8.675 -11.135 0.636 1.00 0.00 C ATOM 2181 O ARG A 142 8.948 -11.453 1.794 1.00 0.00 O ATOM 2182 CB ARG A 142 10.771 -10.726 -0.663 1.00 0.00 C ATOM 2183 CG ARG A 142 10.469 -9.367 -1.269 1.00 0.00 C ATOM 2184 CD ARG A 142 11.614 -8.390 -1.056 1.00 0.00 C ATOM 2185 NE ARG A 142 12.825 -8.805 -1.758 1.00 0.00 N ATOM 2186 CZ ARG A 142 13.805 -7.974 -2.104 1.00 0.00 C ATOM 2187 NH1 ARG A 142 13.728 -6.683 -1.807 1.00 0.00 N ATOM 2188 NH2 ARG A 142 14.870 -8.435 -2.747 1.00 0.00 N ATOM 0 H ARG A 142 8.953 -10.827 -2.382 1.00 0.00 H new ATOM 0 HA ARG A 142 9.851 -12.642 -0.319 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.218 -10.585 0.321 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.512 -11.234 -1.280 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.279 -9.478 -2.337 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.559 -8.964 -0.824 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.315 -7.401 -1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.824 -8.305 0.010 1.00 0.00 H new ATOM 0 HE ARG A 142 12.926 -9.791 -1.998 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.914 -6.322 -1.310 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.483 -6.052 -2.075 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.938 -9.427 -2.976 1.00 0.00 H new ATOM 0 HH22 ARG A 142 15.621 -7.798 -3.012 1.00 0.00 H new ATOM 2202 N LEU A 143 7.640 -10.360 0.327 1.00 0.00 N ATOM 2203 CA LEU A 143 6.752 -9.831 1.354 1.00 0.00 C ATOM 2204 C LEU A 143 5.663 -10.836 1.718 1.00 0.00 C ATOM 2205 O LEU A 143 5.480 -11.167 2.889 1.00 0.00 O ATOM 2206 CB LEU A 143 6.119 -8.523 0.879 1.00 0.00 C ATOM 2207 CG LEU A 143 5.307 -7.772 1.935 1.00 0.00 C ATOM 2208 CD1 LEU A 143 6.053 -7.725 3.261 1.00 0.00 C ATOM 2209 CD2 LEU A 143 4.988 -6.365 1.453 1.00 0.00 C ATOM 0 H LEU A 143 7.397 -10.085 -0.625 1.00 0.00 H new ATOM 0 HA LEU A 143 7.348 -9.640 2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 143 6.910 -7.866 0.516 1.00 0.00 H new ATOM 0 HB3 LEU A 143 5.470 -8.739 0.030 1.00 0.00 H new ATOM 0 HG LEU A 143 4.371 -8.308 2.092 1.00 0.00 H new ATOM 0 HD11 LEU A 143 5.455 -7.186 3.996 1.00 0.00 H new ATOM 0 HD12 LEU A 143 6.232 -8.741 3.614 1.00 0.00 H new ATOM 0 HD13 LEU A 143 7.006 -7.215 3.124 1.00 0.00 H new ATOM 0 HD21 LEU A 143 4.410 -5.842 2.215 1.00 0.00 H new ATOM 0 HD22 LEU A 143 5.916 -5.825 1.267 1.00 0.00 H new ATOM 0 HD23 LEU A 143 4.409 -6.419 0.531 1.00 0.00 H new ATOM 2221 N THR A 144 4.941 -11.317 0.711 1.00 0.00 N ATOM 2222 CA THR A 144 3.868 -12.282 0.936 1.00 0.00 C ATOM 2223 C THR A 144 4.387 -13.512 1.675 1.00 0.00 C ATOM 2224 O THR A 144 5.106 -14.333 1.107 1.00 0.00 O ATOM 2225 CB THR A 144 3.233 -12.696 -0.393 1.00 0.00 C ATOM 2226 OG1 THR A 144 2.193 -13.634 -0.181 1.00 0.00 O ATOM 2227 CG2 THR A 144 4.216 -13.313 -1.363 1.00 0.00 C ATOM 0 H THR A 144 5.078 -11.056 -0.266 1.00 0.00 H new ATOM 0 HA THR A 144 3.109 -11.804 1.555 1.00 0.00 H new ATOM 0 HB THR A 144 2.851 -11.773 -0.828 1.00 0.00 H new ATOM 0 HG1 THR A 144 1.799 -13.885 -1.042 1.00 0.00 H new ATOM 0 HG21 THR A 144 3.698 -13.583 -2.283 1.00 0.00 H new ATOM 0 HG22 THR A 144 5.005 -12.595 -1.587 1.00 0.00 H new ATOM 0 HG23 THR A 144 4.654 -14.206 -0.918 1.00 0.00 H new ATOM 2235 N GLY A 145 4.017 -13.627 2.947 1.00 0.00 N ATOM 2236 CA GLY A 145 4.454 -14.755 3.749 1.00 0.00 C ATOM 2237 C GLY A 145 5.325 -14.328 4.915 1.00 0.00 C ATOM 2238 O GLY A 145 4.838 -13.738 5.879 1.00 0.00 O ATOM 0 H GLY A 145 3.422 -12.959 3.437 1.00 0.00 H new ATOM 0 HA2 GLY A 145 3.582 -15.290 4.126 1.00 0.00 H new ATOM 0 HA3 GLY A 145 5.008 -15.452 3.120 1.00 0.00 H new ATOM 2242 N ASP A 146 6.616 -14.629 4.827 1.00 0.00 N ATOM 2243 CA ASP A 146 7.558 -14.272 5.882 1.00 0.00 C ATOM 2244 C ASP A 146 8.991 -14.274 5.358 1.00 0.00 C ATOM 2245 O ASP A 146 9.937 -14.508 6.110 1.00 0.00 O ATOM 2246 CB ASP A 146 7.432 -15.242 7.057 1.00 0.00 C ATOM 2247 CG ASP A 146 6.352 -14.825 8.038 1.00 0.00 C ATOM 2248 OD1 ASP A 146 6.466 -13.721 8.611 1.00 0.00 O ATOM 2249 OD2 ASP A 146 5.394 -15.603 8.232 1.00 0.00 O ATOM 0 H ASP A 146 7.034 -15.119 4.036 1.00 0.00 H new ATOM 0 HA ASP A 146 7.317 -13.265 6.223 1.00 0.00 H new ATOM 0 HB2 ASP A 146 7.210 -16.240 6.679 1.00 0.00 H new ATOM 0 HB3 ASP A 146 8.388 -15.304 7.578 1.00 0.00 H new ATOM 2254 N ALA A 147 9.144 -14.008 4.065 1.00 0.00 N ATOM 2255 CA ALA A 147 10.461 -13.973 3.444 1.00 0.00 C ATOM 2256 C ALA A 147 10.959 -12.539 3.309 1.00 0.00 C ATOM 2257 O ALA A 147 11.758 -12.228 2.426 1.00 0.00 O ATOM 2258 CB ALA A 147 10.424 -14.651 2.084 1.00 0.00 C ATOM 0 H ALA A 147 8.372 -13.814 3.428 1.00 0.00 H new ATOM 0 HA ALA A 147 11.155 -14.516 4.086 1.00 0.00 H new ATOM 0 HB1 ALA A 147 11.416 -14.616 1.633 1.00 0.00 H new ATOM 0 HB2 ALA A 147 10.116 -15.690 2.204 1.00 0.00 H new ATOM 0 HB3 ALA A 147 9.714 -14.134 1.439 1.00 0.00 H new ATOM 2264 N PHE A 148 10.480 -11.667 4.192 1.00 0.00 N ATOM 2265 CA PHE A 148 10.873 -10.264 4.172 1.00 0.00 C ATOM 2266 C PHE A 148 11.559 -9.874 5.477 1.00 0.00 C ATOM 2267 O PHE A 148 12.541 -9.131 5.476 1.00 0.00 O ATOM 2268 CB PHE A 148 9.650 -9.373 3.937 1.00 0.00 C ATOM 2269 CG PHE A 148 8.538 -9.604 4.921 1.00 0.00 C ATOM 2270 CD1 PHE A 148 7.708 -10.707 4.804 1.00 0.00 C ATOM 2271 CD2 PHE A 148 8.323 -8.714 5.962 1.00 0.00 C ATOM 2272 CE1 PHE A 148 6.684 -10.920 5.708 1.00 0.00 C ATOM 2273 CE2 PHE A 148 7.300 -8.922 6.868 1.00 0.00 C ATOM 2274 CZ PHE A 148 6.480 -10.026 6.741 1.00 0.00 C ATOM 0 H PHE A 148 9.819 -11.909 4.930 1.00 0.00 H new ATOM 0 HA PHE A 148 11.579 -10.121 3.354 1.00 0.00 H new ATOM 0 HB2 PHE A 148 9.957 -8.328 3.988 1.00 0.00 H new ATOM 0 HB3 PHE A 148 9.273 -9.546 2.929 1.00 0.00 H new ATOM 0 HD1 PHE A 148 7.863 -11.408 3.997 1.00 0.00 H new ATOM 0 HD2 PHE A 148 8.961 -7.849 6.066 1.00 0.00 H new ATOM 0 HE1 PHE A 148 6.044 -11.784 5.607 1.00 0.00 H new ATOM 0 HE2 PHE A 148 7.142 -8.222 7.675 1.00 0.00 H new ATOM 0 HZ PHE A 148 5.680 -10.190 7.448 1.00 0.00 H new ATOM 2284 N ARG A 149 11.040 -10.383 6.590 1.00 0.00 N ATOM 2285 CA ARG A 149 11.599 -10.092 7.900 1.00 0.00 C ATOM 2286 C ARG A 149 13.061 -10.523 7.977 1.00 0.00 C ATOM 2287 O ARG A 149 13.869 -9.893 8.659 1.00 0.00 O ATOM 2288 CB ARG A 149 10.787 -10.803 8.979 1.00 0.00 C ATOM 2289 CG ARG A 149 9.286 -10.645 8.809 1.00 0.00 C ATOM 2290 CD ARG A 149 8.553 -10.838 10.125 1.00 0.00 C ATOM 2291 NE ARG A 149 7.908 -12.145 10.209 1.00 0.00 N ATOM 2292 CZ ARG A 149 7.107 -12.515 11.207 1.00 0.00 C ATOM 2293 NH1 ARG A 149 6.854 -11.679 12.207 1.00 0.00 N ATOM 2294 NH2 ARG A 149 6.562 -13.722 11.207 1.00 0.00 N ATOM 0 H ARG A 149 10.229 -11.002 6.607 1.00 0.00 H new ATOM 0 HA ARG A 149 11.552 -9.015 8.063 1.00 0.00 H new ATOM 0 HB2 ARG A 149 11.036 -11.864 8.970 1.00 0.00 H new ATOM 0 HB3 ARG A 149 11.077 -10.416 9.956 1.00 0.00 H new ATOM 0 HG2 ARG A 149 9.066 -9.654 8.411 1.00 0.00 H new ATOM 0 HG3 ARG A 149 8.923 -11.369 8.080 1.00 0.00 H new ATOM 0 HD2 ARG A 149 9.256 -10.728 10.950 1.00 0.00 H new ATOM 0 HD3 ARG A 149 7.802 -10.056 10.239 1.00 0.00 H new ATOM 0 HE ARG A 149 8.081 -12.814 9.459 1.00 0.00 H new ATOM 0 HH11 ARG A 149 7.274 -10.749 12.213 1.00 0.00 H new ATOM 0 HH12 ARG A 149 6.240 -11.966 12.969 1.00 0.00 H new ATOM 0 HH21 ARG A 149 6.756 -14.369 10.443 1.00 0.00 H new ATOM 0 HH22 ARG A 149 5.949 -14.005 11.971 1.00 0.00 H new ATOM 2308 N LYS A 150 13.392 -11.600 7.272 1.00 0.00 N ATOM 2309 CA LYS A 150 14.755 -12.116 7.259 1.00 0.00 C ATOM 2310 C LYS A 150 15.633 -11.311 6.307 1.00 0.00 C ATOM 2311 O LYS A 150 15.816 -11.686 5.148 1.00 0.00 O ATOM 2312 CB LYS A 150 14.761 -13.592 6.855 1.00 0.00 C ATOM 2313 CG LYS A 150 15.752 -14.435 7.641 1.00 0.00 C ATOM 2314 CD LYS A 150 16.252 -15.615 6.821 1.00 0.00 C ATOM 2315 CE LYS A 150 17.574 -15.300 6.140 1.00 0.00 C ATOM 2316 NZ LYS A 150 17.843 -16.216 4.997 1.00 0.00 N ATOM 0 H LYS A 150 12.734 -12.132 6.702 1.00 0.00 H new ATOM 0 HA LYS A 150 15.162 -12.021 8.266 1.00 0.00 H new ATOM 0 HB2 LYS A 150 13.760 -14.001 6.992 1.00 0.00 H new ATOM 0 HB3 LYS A 150 14.994 -13.668 5.793 1.00 0.00 H new ATOM 0 HG2 LYS A 150 16.597 -13.817 7.944 1.00 0.00 H new ATOM 0 HG3 LYS A 150 15.279 -14.799 8.553 1.00 0.00 H new ATOM 0 HD2 LYS A 150 16.373 -16.484 7.468 1.00 0.00 H new ATOM 0 HD3 LYS A 150 15.508 -15.878 6.069 1.00 0.00 H new ATOM 0 HE2 LYS A 150 17.563 -14.270 5.784 1.00 0.00 H new ATOM 0 HE3 LYS A 150 18.384 -15.378 6.866 1.00 0.00 H new ATOM 0 HZ1 LYS A 150 18.754 -15.968 4.560 1.00 0.00 H new ATOM 0 HZ2 LYS A 150 17.879 -17.197 5.340 1.00 0.00 H new ATOM 0 HZ3 LYS A 150 17.084 -16.124 4.292 1.00 0.00 H new ATOM 2330 N LYS A 151 16.173 -10.203 6.803 1.00 0.00 N ATOM 2331 CA LYS A 151 17.031 -9.343 5.996 1.00 0.00 C ATOM 2332 C LYS A 151 17.715 -8.290 6.864 1.00 0.00 C ATOM 2333 O LYS A 151 17.121 -7.768 7.806 1.00 0.00 O ATOM 2334 CB LYS A 151 16.216 -8.663 4.894 1.00 0.00 C ATOM 2335 CG LYS A 151 16.967 -8.525 3.581 1.00 0.00 C ATOM 2336 CD LYS A 151 16.083 -7.930 2.494 1.00 0.00 C ATOM 2337 CE LYS A 151 16.587 -8.292 1.106 1.00 0.00 C ATOM 2338 NZ LYS A 151 15.808 -9.409 0.506 1.00 0.00 N ATOM 0 H LYS A 151 16.032 -9.879 7.760 1.00 0.00 H new ATOM 0 HA LYS A 151 17.800 -9.965 5.537 1.00 0.00 H new ATOM 0 HB2 LYS A 151 15.304 -9.234 4.723 1.00 0.00 H new ATOM 0 HB3 LYS A 151 15.913 -7.673 5.236 1.00 0.00 H new ATOM 0 HG2 LYS A 151 17.843 -7.893 3.726 1.00 0.00 H new ATOM 0 HG3 LYS A 151 17.329 -9.503 3.263 1.00 0.00 H new ATOM 0 HD2 LYS A 151 15.061 -8.290 2.617 1.00 0.00 H new ATOM 0 HD3 LYS A 151 16.054 -6.846 2.600 1.00 0.00 H new ATOM 0 HE2 LYS A 151 16.526 -7.418 0.458 1.00 0.00 H new ATOM 0 HE3 LYS A 151 17.639 -8.573 1.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 16.183 -9.625 -0.440 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 15.887 -10.251 1.111 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 14.809 -9.132 0.427 1.00 0.00 H new ATOM 2352 N HIS A 152 18.966 -7.984 6.537 1.00 0.00 N ATOM 2353 CA HIS A 152 19.731 -6.996 7.286 1.00 0.00 C ATOM 2354 C HIS A 152 20.239 -5.890 6.365 1.00 0.00 C ATOM 2355 O HIS A 152 20.879 -6.159 5.350 1.00 0.00 O ATOM 2356 CB HIS A 152 20.909 -7.662 7.999 1.00 0.00 C ATOM 2357 CG HIS A 152 20.493 -8.641 9.053 1.00 0.00 C ATOM 2358 ND1 HIS A 152 19.803 -8.274 10.190 1.00 0.00 N ATOM 2359 CD2 HIS A 152 20.673 -9.980 9.139 1.00 0.00 C ATOM 2360 CE1 HIS A 152 19.577 -9.347 10.929 1.00 0.00 C ATOM 2361 NE2 HIS A 152 20.093 -10.394 10.314 1.00 0.00 N ATOM 0 H HIS A 152 19.471 -8.406 5.758 1.00 0.00 H new ATOM 0 HA HIS A 152 19.071 -6.551 8.031 1.00 0.00 H new ATOM 0 HB2 HIS A 152 21.527 -8.175 7.262 1.00 0.00 H new ATOM 0 HB3 HIS A 152 21.530 -6.891 8.455 1.00 0.00 H new ATOM 0 HD2 HIS A 152 21.178 -10.606 8.418 1.00 0.00 H new ATOM 0 HE1 HIS A 152 19.058 -9.364 11.876 1.00 0.00 H new ATOM 0 HE2 HIS A 152 20.066 -11.355 10.655 1.00 0.00 H new ATOM 2370 N LEU A 153 19.948 -4.645 6.728 1.00 0.00 N ATOM 2371 CA LEU A 153 20.374 -3.498 5.935 1.00 0.00 C ATOM 2372 C LEU A 153 21.672 -2.911 6.481 1.00 0.00 C ATOM 2373 O LEU A 153 21.696 -2.339 7.570 1.00 0.00 O ATOM 2374 CB LEU A 153 19.283 -2.427 5.920 1.00 0.00 C ATOM 2375 CG LEU A 153 18.876 -1.899 7.299 1.00 0.00 C ATOM 2376 CD1 LEU A 153 19.492 -0.532 7.553 1.00 0.00 C ATOM 2377 CD2 LEU A 153 17.359 -1.833 7.420 1.00 0.00 C ATOM 0 H LEU A 153 19.419 -4.405 7.566 1.00 0.00 H new ATOM 0 HA LEU A 153 20.551 -3.839 4.915 1.00 0.00 H new ATOM 0 HB2 LEU A 153 19.626 -1.589 5.313 1.00 0.00 H new ATOM 0 HB3 LEU A 153 18.400 -2.836 5.429 1.00 0.00 H new ATOM 0 HG LEU A 153 19.252 -2.589 8.054 1.00 0.00 H new ATOM 0 HD11 LEU A 153 19.191 -0.174 8.538 1.00 0.00 H new ATOM 0 HD12 LEU A 153 20.578 -0.609 7.512 1.00 0.00 H new ATOM 0 HD13 LEU A 153 19.149 0.169 6.792 1.00 0.00 H new ATOM 0 HD21 LEU A 153 17.089 -1.456 8.406 1.00 0.00 H new ATOM 0 HD22 LEU A 153 16.962 -1.166 6.655 1.00 0.00 H new ATOM 0 HD23 LEU A 153 16.940 -2.830 7.286 1.00 0.00 H new ATOM 2389 N GLU A 154 22.750 -3.058 5.717 1.00 0.00 N ATOM 2390 CA GLU A 154 24.051 -2.540 6.123 1.00 0.00 C ATOM 2391 C GLU A 154 24.882 -2.143 4.909 1.00 0.00 C ATOM 2392 O GLU A 154 25.329 -2.997 4.143 1.00 0.00 O ATOM 2393 CB GLU A 154 24.803 -3.586 6.950 1.00 0.00 C ATOM 2394 CG GLU A 154 25.791 -2.987 7.935 1.00 0.00 C ATOM 2395 CD GLU A 154 27.200 -2.916 7.380 1.00 0.00 C ATOM 2396 OE1 GLU A 154 27.454 -2.050 6.515 1.00 0.00 O ATOM 2397 OE2 GLU A 154 28.049 -3.725 7.806 1.00 0.00 O ATOM 0 H GLU A 154 22.748 -3.532 4.814 1.00 0.00 H new ATOM 0 HA GLU A 154 23.886 -1.652 6.733 1.00 0.00 H new ATOM 0 HB2 GLU A 154 24.081 -4.193 7.496 1.00 0.00 H new ATOM 0 HB3 GLU A 154 25.336 -4.256 6.275 1.00 0.00 H new ATOM 0 HG2 GLU A 154 25.462 -1.985 8.209 1.00 0.00 H new ATOM 0 HG3 GLU A 154 25.794 -3.583 8.848 1.00 0.00 H new ATOM 2404 N ASP A 155 25.086 -0.840 4.737 1.00 0.00 N ATOM 2405 CA ASP A 155 25.864 -0.330 3.615 1.00 0.00 C ATOM 2406 C ASP A 155 26.684 0.889 4.029 1.00 0.00 C ATOM 2407 O ASP A 155 27.896 0.933 3.824 1.00 0.00 O ATOM 2408 CB ASP A 155 24.940 0.031 2.449 1.00 0.00 C ATOM 2409 CG ASP A 155 25.331 -0.669 1.162 1.00 0.00 C ATOM 2410 OD1 ASP A 155 25.332 -1.918 1.142 1.00 0.00 O ATOM 2411 OD2 ASP A 155 25.637 0.031 0.175 1.00 0.00 O ATOM 0 H ASP A 155 24.723 -0.119 5.361 1.00 0.00 H new ATOM 0 HA ASP A 155 26.551 -1.114 3.295 1.00 0.00 H new ATOM 0 HB2 ASP A 155 23.915 -0.234 2.706 1.00 0.00 H new ATOM 0 HB3 ASP A 155 24.961 1.110 2.293 1.00 0.00 H new ATOM 2416 N GLU A 156 26.013 1.876 4.613 1.00 0.00 N ATOM 2417 CA GLU A 156 26.679 3.094 5.058 1.00 0.00 C ATOM 2418 C GLU A 156 26.242 3.470 6.471 1.00 0.00 C ATOM 2419 O GLU A 156 25.151 3.109 6.910 1.00 0.00 O ATOM 2420 CB GLU A 156 26.378 4.245 4.091 1.00 0.00 C ATOM 2421 CG GLU A 156 27.624 4.921 3.548 1.00 0.00 C ATOM 2422 CD GLU A 156 28.387 5.684 4.614 1.00 0.00 C ATOM 2423 OE1 GLU A 156 29.186 5.055 5.337 1.00 0.00 O ATOM 2424 OE2 GLU A 156 28.183 6.912 4.726 1.00 0.00 O ATOM 0 H GLU A 156 25.009 1.856 4.789 1.00 0.00 H new ATOM 0 HA GLU A 156 27.753 2.909 5.070 1.00 0.00 H new ATOM 0 HB2 GLU A 156 25.788 3.864 3.257 1.00 0.00 H new ATOM 0 HB3 GLU A 156 25.765 4.987 4.602 1.00 0.00 H new ATOM 0 HG2 GLU A 156 28.278 4.169 3.107 1.00 0.00 H new ATOM 0 HG3 GLU A 156 27.342 5.606 2.748 1.00 0.00 H new ATOM 2431 N LEU A 157 27.103 4.195 7.176 1.00 0.00 N ATOM 2432 CA LEU A 157 26.806 4.620 8.541 1.00 0.00 C ATOM 2433 C LEU A 157 26.000 5.915 8.543 1.00 0.00 C ATOM 2434 O LEU A 157 26.340 6.824 7.759 1.00 0.00 O ATOM 2435 CB LEU A 157 28.103 4.808 9.332 1.00 0.00 C ATOM 2436 CG LEU A 157 28.578 3.573 10.098 1.00 0.00 C ATOM 2437 CD1 LEU A 157 29.394 2.664 9.192 1.00 0.00 C ATOM 2438 CD2 LEU A 157 29.394 3.984 11.316 1.00 0.00 C ATOM 2439 OXT LEU A 157 25.035 6.008 9.331 1.00 0.00 O ATOM 0 H LEU A 157 28.011 4.501 6.827 1.00 0.00 H new ATOM 0 HA LEU A 157 26.209 3.842 9.017 1.00 0.00 H new ATOM 0 HB2 LEU A 157 28.890 5.114 8.643 1.00 0.00 H new ATOM 0 HB3 LEU A 157 27.964 5.625 10.040 1.00 0.00 H new ATOM 0 HG LEU A 157 27.702 3.021 10.439 1.00 0.00 H new ATOM 0 HD11 LEU A 157 29.723 1.790 9.754 1.00 0.00 H new ATOM 0 HD12 LEU A 157 28.780 2.343 8.350 1.00 0.00 H new ATOM 0 HD13 LEU A 157 30.264 3.206 8.821 1.00 0.00 H new ATOM 0 HD21 LEU A 157 29.724 3.093 11.850 1.00 0.00 H new ATOM 0 HD22 LEU A 157 30.263 4.558 10.995 1.00 0.00 H new ATOM 0 HD23 LEU A 157 28.779 4.596 11.976 1.00 0.00 H new TER 2451 LEU A 157