USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 738 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 160 SER OG : rot -165:sc= 0.636 USER MOD Set 1.2: A 163 SER OG : rot 73:sc= 0.495 USER MOD Set 2.1: A 107 CYS SG : rot -54:sc= 0.836 USER MOD Set 2.2: A 138 SER OG : rot 154:sc= 1.04 USER MOD Set 3.1: A 128 HIS : no HE2:sc= 0.426 K(o=0.8,f=-3.1) USER MOD Set 3.2: A 129 ASN : amide:sc= 0.379 K(o=0.8,f=-0.95) USER MOD Set 4.1: A 104 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: A 118 SER OG : rot 180:sc= 0 USER MOD Set 5.1: A 87 HIS :FLIP no HD1:sc= 0 F(o=-1.7,f=-0.32) USER MOD Set 5.2: A 88 HIS :FLIP no HD1:sc= -0.321 F(o=-1.1,f=-0.32) USER MOD Set 6.1: A 85 HIS : no HD1:sc= 0.136 K(o=-0.26,f=-0.95) USER MOD Set 6.2: A 89 HIS : no HE2:sc= -0.361 K(o=-0.26,f=-3.3) USER MOD Set 6.3: A 90 HIS : no HD1:sc= -0.0361 X(o=-0.26,f=-0.76) USER MOD Single : A 80 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 82 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 83 HIS : no HD1:sc= -0.0431 X(o=-0.043,f=-0.043) USER MOD Single : A 84 HIS : no HD1:sc= -0.123 X(o=-0.12,f=0.018) USER MOD Single : A 86 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 91 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 95 HIS : no HD1:sc= 0 X(o=0,f=-0.014) USER MOD Single : A 100 HIS : no HD1:sc= -0.0504 X(o=-0.05,f=0) USER MOD Single : A 101 MET CE :methyl -179:sc= -0.526 (180deg=-0.543) USER MOD Single : A 106 TYR OH : rot -6:sc= 1.03 USER MOD Single : A 113 SER OG : rot -46:sc= 0.614 USER MOD Single : A 116 THR OG1 : rot 29:sc= 0.838 USER MOD Single : A 120 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 134 CYS SG : rot -18:sc= 0.454 USER MOD Single : A 145 SER OG : rot 140:sc= -0.126 USER MOD Single : A 146 GLN : amide:sc= -0.53 X(o=-0.53,f=-0.2) USER MOD Single : A 149 TYR OH : rot 157:sc= 0.39 USER MOD Single : A 155 THR OG1 : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=-0.027) USER MOD Single : A 158 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 164 TYR OH : rot 159:sc= -0.108 USER MOD Single : A 167 LYS NZ :NH3+ 143:sc= 0.502 (180deg=-0.467) USER MOD Single : A 176 GLN : amide:sc= -0.0272 K(o=-0.027,f=-1) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 80 13.829 -14.571 -21.251 1.00 25.00 N ATOM 2 CA MET A 80 12.880 -14.490 -20.115 1.00 25.00 C ATOM 3 C MET A 80 13.527 -14.610 -18.742 1.00 25.00 C ATOM 4 O MET A 80 13.967 -15.647 -18.301 1.00 25.00 O ATOM 5 CB MET A 80 11.781 -15.556 -20.258 1.00 25.00 C ATOM 6 CG MET A 80 10.908 -15.286 -21.494 1.00 25.00 C ATOM 7 SD MET A 80 9.457 -16.383 -21.547 1.00 25.00 S ATOM 8 CE MET A 80 8.753 -15.925 -23.164 1.00 25.00 C ATOM 0 HA MET A 80 12.455 -13.488 -20.167 1.00 25.00 H new ATOM 0 HB2 MET A 80 12.236 -16.543 -20.338 1.00 25.00 H new ATOM 0 HB3 MET A 80 11.158 -15.564 -19.363 1.00 25.00 H new ATOM 0 HG2 MET A 80 10.578 -14.247 -21.487 1.00 25.00 H new ATOM 0 HG3 MET A 80 11.503 -15.425 -22.397 1.00 25.00 H new ATOM 0 HE1 MET A 80 7.853 -16.511 -23.348 1.00 25.00 H new ATOM 0 HE2 MET A 80 8.502 -14.864 -23.164 1.00 25.00 H new ATOM 0 HE3 MET A 80 9.483 -16.125 -23.948 1.00 25.00 H new ATOM 18 N GLY A 81 13.581 -13.467 -18.039 1.00 25.00 N ATOM 19 CA GLY A 81 14.101 -13.395 -16.679 1.00 25.00 C ATOM 20 C GLY A 81 15.588 -13.669 -16.531 1.00 25.00 C ATOM 21 O GLY A 81 16.064 -13.908 -15.425 1.00 25.00 O ATOM 0 H GLY A 81 13.263 -12.570 -18.405 1.00 25.00 H new ATOM 0 HA2 GLY A 81 13.891 -12.402 -16.281 1.00 25.00 H new ATOM 0 HA3 GLY A 81 13.555 -14.108 -16.062 1.00 25.00 H new ATOM 25 N HIS A 82 16.330 -13.637 -17.628 1.00 25.00 N ATOM 26 CA HIS A 82 17.769 -13.876 -17.569 1.00 25.00 C ATOM 27 C HIS A 82 18.445 -12.752 -16.790 1.00 25.00 C ATOM 28 O HIS A 82 18.143 -11.577 -16.992 1.00 25.00 O ATOM 29 CB HIS A 82 18.361 -13.959 -18.977 1.00 25.00 C ATOM 30 CG HIS A 82 17.748 -15.032 -19.822 1.00 25.00 C ATOM 31 ND1 HIS A 82 17.784 -16.372 -19.523 1.00 25.00 N ATOM 32 CD2 HIS A 82 17.057 -14.952 -20.992 1.00 25.00 C ATOM 33 CE1 HIS A 82 17.132 -17.029 -20.478 1.00 25.00 C ATOM 34 NE2 HIS A 82 16.671 -16.211 -21.402 1.00 25.00 N ATOM 0 H HIS A 82 15.966 -13.450 -18.562 1.00 25.00 H new ATOM 0 HA HIS A 82 17.944 -14.826 -17.064 1.00 25.00 H new ATOM 0 HB2 HIS A 82 18.231 -12.998 -19.474 1.00 25.00 H new ATOM 0 HB3 HIS A 82 19.434 -14.136 -18.901 1.00 25.00 H new ATOM 0 HD2 HIS A 82 16.842 -14.036 -21.522 1.00 25.00 H new ATOM 0 HE1 HIS A 82 16.997 -18.100 -20.494 1.00 25.00 H new ATOM 0 HE2 HIS A 82 16.143 -16.456 -22.240 1.00 25.00 H new ATOM 42 N HIS A 83 19.357 -13.119 -15.900 1.00 25.00 N ATOM 43 CA HIS A 83 20.045 -12.162 -15.029 1.00 25.00 C ATOM 44 C HIS A 83 21.190 -11.423 -15.741 1.00 25.00 C ATOM 45 O HIS A 83 22.343 -11.473 -15.321 1.00 25.00 O ATOM 46 CB HIS A 83 20.578 -12.900 -13.795 1.00 25.00 C ATOM 47 CG HIS A 83 19.599 -13.873 -13.214 1.00 25.00 C ATOM 48 ND1 HIS A 83 18.338 -13.544 -12.781 1.00 25.00 N ATOM 49 CD2 HIS A 83 19.703 -15.214 -13.004 1.00 25.00 C ATOM 50 CE1 HIS A 83 17.743 -14.653 -12.351 1.00 25.00 C ATOM 51 NE2 HIS A 83 18.535 -15.701 -12.457 1.00 25.00 N ATOM 0 H HIS A 83 19.644 -14.087 -15.758 1.00 25.00 H new ATOM 0 HA HIS A 83 19.321 -11.402 -14.735 1.00 25.00 H new ATOM 0 HB2 HIS A 83 21.490 -13.432 -14.065 1.00 25.00 H new ATOM 0 HB3 HIS A 83 20.848 -12.169 -13.033 1.00 25.00 H new ATOM 0 HD2 HIS A 83 20.574 -15.810 -13.233 1.00 25.00 H new ATOM 0 HE1 HIS A 83 16.736 -14.690 -11.963 1.00 25.00 H new ATOM 0 HE2 HIS A 83 18.329 -16.664 -12.192 1.00 25.00 H new ATOM 59 N HIS A 84 20.868 -10.771 -16.845 1.00 25.00 N ATOM 60 CA HIS A 84 21.854 -10.019 -17.609 1.00 25.00 C ATOM 61 C HIS A 84 22.200 -8.734 -16.853 1.00 25.00 C ATOM 62 O HIS A 84 21.367 -8.199 -16.122 1.00 25.00 O ATOM 63 CB HIS A 84 21.290 -9.680 -18.991 1.00 25.00 C ATOM 64 CG HIS A 84 22.342 -9.328 -19.997 1.00 25.00 C ATOM 65 ND1 HIS A 84 23.042 -10.249 -20.736 1.00 25.00 N ATOM 66 CD2 HIS A 84 22.827 -8.117 -20.391 1.00 25.00 C ATOM 67 CE1 HIS A 84 23.895 -9.594 -21.517 1.00 25.00 C ATOM 68 NE2 HIS A 84 23.813 -8.291 -21.342 1.00 25.00 N ATOM 0 H HIS A 84 19.926 -10.746 -17.236 1.00 25.00 H new ATOM 0 HA HIS A 84 22.755 -10.618 -17.736 1.00 25.00 H new ATOM 0 HB2 HIS A 84 20.717 -10.531 -19.359 1.00 25.00 H new ATOM 0 HB3 HIS A 84 20.596 -8.845 -18.896 1.00 25.00 H new ATOM 0 HD2 HIS A 84 22.490 -7.162 -20.015 1.00 25.00 H new ATOM 0 HE1 HIS A 84 24.572 -10.071 -22.210 1.00 25.00 H new ATOM 0 HE2 HIS A 84 24.360 -7.567 -21.808 1.00 25.00 H new ATOM 76 N HIS A 85 23.407 -8.222 -17.046 1.00 25.00 N ATOM 77 CA HIS A 85 23.794 -6.957 -16.428 1.00 25.00 C ATOM 78 C HIS A 85 22.923 -5.848 -17.000 1.00 25.00 C ATOM 79 O HIS A 85 22.685 -5.801 -18.198 1.00 25.00 O ATOM 80 CB HIS A 85 25.262 -6.623 -16.717 1.00 25.00 C ATOM 81 CG HIS A 85 26.233 -7.412 -15.897 1.00 25.00 C ATOM 82 ND1 HIS A 85 26.756 -8.628 -16.262 1.00 25.00 N ATOM 83 CD2 HIS A 85 26.799 -7.131 -14.691 1.00 25.00 C ATOM 84 CE1 HIS A 85 27.581 -9.031 -15.300 1.00 25.00 C ATOM 85 NE2 HIS A 85 27.652 -8.152 -14.322 1.00 25.00 N ATOM 0 H HIS A 85 24.131 -8.656 -17.619 1.00 25.00 H new ATOM 0 HA HIS A 85 23.663 -7.045 -15.349 1.00 25.00 H new ATOM 0 HB2 HIS A 85 25.464 -6.801 -17.773 1.00 25.00 H new ATOM 0 HB3 HIS A 85 25.426 -5.561 -16.535 1.00 25.00 H new ATOM 0 HD2 HIS A 85 26.609 -6.241 -14.109 1.00 25.00 H new ATOM 0 HE1 HIS A 85 28.125 -9.964 -15.319 1.00 25.00 H new ATOM 0 HE2 HIS A 85 28.216 -8.212 -13.474 1.00 25.00 H new ATOM 93 N HIS A 86 22.477 -4.942 -16.142 1.00 25.00 N ATOM 94 CA HIS A 86 21.675 -3.806 -16.589 1.00 25.00 C ATOM 95 C HIS A 86 22.515 -2.890 -17.477 1.00 25.00 C ATOM 96 O HIS A 86 22.043 -2.387 -18.490 1.00 25.00 O ATOM 97 CB HIS A 86 21.159 -3.024 -15.378 1.00 25.00 C ATOM 98 CG HIS A 86 20.272 -1.874 -15.744 1.00 25.00 C ATOM 99 ND1 HIS A 86 18.948 -1.994 -16.083 1.00 25.00 N ATOM 100 CD2 HIS A 86 20.541 -0.542 -15.838 1.00 25.00 C ATOM 101 CE1 HIS A 86 18.478 -0.782 -16.359 1.00 25.00 C ATOM 102 NE2 HIS A 86 19.404 0.144 -16.218 1.00 25.00 N ATOM 0 H HIS A 86 22.654 -4.968 -15.138 1.00 25.00 H new ATOM 0 HA HIS A 86 20.826 -4.177 -17.163 1.00 25.00 H new ATOM 0 HB2 HIS A 86 20.610 -3.702 -14.724 1.00 25.00 H new ATOM 0 HB3 HIS A 86 22.009 -2.650 -14.808 1.00 25.00 H new ATOM 0 HD2 HIS A 86 21.502 -0.089 -15.644 1.00 25.00 H new ATOM 0 HE1 HIS A 86 17.461 -0.581 -16.662 1.00 25.00 H new ATOM 0 HE2 HIS A 86 19.303 1.149 -16.359 1.00 25.00 H new ATOM 110 N HIS A 87 23.770 -2.692 -17.091 1.00 25.00 N ATOM 111 CA HIS A 87 24.684 -1.858 -17.868 1.00 25.00 C ATOM 112 C HIS A 87 26.146 -2.273 -17.687 1.00 25.00 C ATOM 113 O HIS A 87 26.853 -2.522 -18.654 1.00 25.00 O ATOM 114 CB HIS A 87 24.515 -0.392 -17.456 1.00 25.00 C ATOM 115 CG HIS A 87 25.181 0.570 -18.387 1.00 25.00 C ATOM 116 ND1 HIS A 87 26.411 1.147 -18.334 1.00 25.00 N flip ATOM 117 CD2 HIS A 87 24.613 1.049 -19.540 1.00 25.00 C flip ATOM 118 CE1 HIS A 87 26.595 1.975 -19.422 1.00 25.00 C flip ATOM 119 NE2 HIS A 87 25.482 1.874 -20.119 1.00 25.00 N flip ATOM 0 H HIS A 87 24.179 -3.095 -16.248 1.00 25.00 H new ATOM 0 HA HIS A 87 24.433 -1.990 -18.920 1.00 25.00 H new ATOM 0 HB2 HIS A 87 23.452 -0.158 -17.404 1.00 25.00 H new ATOM 0 HB3 HIS A 87 24.921 -0.255 -16.454 1.00 25.00 H new ATOM 0 HD2 HIS A 87 23.631 0.800 -19.913 1.00 25.00 H new ATOM 0 HE1 HIS A 87 27.463 2.575 -19.652 1.00 25.00 H new ATOM 0 HE2 HIS A 87 25.308 2.367 -20.995 1.00 25.00 H new ATOM 127 N HIS A 88 26.597 -2.344 -16.441 1.00 25.00 N ATOM 128 CA HIS A 88 27.989 -2.669 -16.133 1.00 25.00 C ATOM 129 C HIS A 88 28.064 -3.297 -14.746 1.00 25.00 C ATOM 130 O HIS A 88 27.043 -3.426 -14.072 1.00 25.00 O ATOM 131 CB HIS A 88 28.843 -1.385 -16.186 1.00 25.00 C ATOM 132 CG HIS A 88 28.359 -0.287 -15.282 1.00 25.00 C ATOM 133 ND1 HIS A 88 27.766 -0.329 -14.053 1.00 25.00 N flip ATOM 134 CD2 HIS A 88 28.450 1.050 -15.583 1.00 25.00 C flip ATOM 135 CE1 HIS A 88 27.487 0.950 -13.619 1.00 25.00 C flip ATOM 136 NE2 HIS A 88 27.919 1.741 -14.579 1.00 25.00 N flip ATOM 0 H HIS A 88 26.015 -2.180 -15.619 1.00 25.00 H new ATOM 0 HA HIS A 88 28.374 -3.378 -16.866 1.00 25.00 H new ATOM 0 HB2 HIS A 88 29.870 -1.634 -15.919 1.00 25.00 H new ATOM 0 HB3 HIS A 88 28.860 -1.015 -17.211 1.00 25.00 H new ATOM 0 HD2 HIS A 88 28.879 1.468 -16.481 1.00 25.00 H new ATOM 0 HE1 HIS A 88 27.016 1.240 -12.692 1.00 25.00 H new ATOM 0 HE2 HIS A 88 27.854 2.759 -14.555 1.00 25.00 H new ATOM 144 N HIS A 89 29.273 -3.636 -14.315 1.00 25.00 N ATOM 145 CA HIS A 89 29.521 -4.125 -12.954 1.00 25.00 C ATOM 146 C HIS A 89 30.487 -3.173 -12.239 1.00 25.00 C ATOM 147 O HIS A 89 30.175 -2.635 -11.187 1.00 25.00 O ATOM 148 CB HIS A 89 30.115 -5.541 -12.987 1.00 25.00 C ATOM 149 CG HIS A 89 30.777 -5.888 -14.286 1.00 25.00 C ATOM 150 ND1 HIS A 89 30.168 -6.579 -15.301 1.00 25.00 N ATOM 151 CD2 HIS A 89 32.037 -5.632 -14.740 1.00 25.00 C ATOM 152 CE1 HIS A 89 31.033 -6.700 -16.301 1.00 25.00 C ATOM 153 NE2 HIS A 89 32.188 -6.134 -16.017 1.00 25.00 N ATOM 0 H HIS A 89 30.111 -3.582 -14.894 1.00 25.00 H new ATOM 0 HA HIS A 89 28.574 -4.161 -12.415 1.00 25.00 H new ATOM 0 HB2 HIS A 89 30.843 -5.639 -12.181 1.00 25.00 H new ATOM 0 HB3 HIS A 89 29.322 -6.262 -12.790 1.00 25.00 H new ATOM 0 HD1 HIS A 89 29.214 -6.939 -15.290 1.00 25.00 H new ATOM 0 HD2 HIS A 89 32.803 -5.113 -14.183 1.00 25.00 H new ATOM 0 HE1 HIS A 89 30.816 -7.201 -17.233 1.00 25.00 H new ATOM 161 N HIS A 90 31.650 -2.958 -12.838 1.00 25.00 N ATOM 162 CA HIS A 90 32.674 -2.069 -12.293 1.00 25.00 C ATOM 163 C HIS A 90 33.581 -1.674 -13.452 1.00 25.00 C ATOM 164 O HIS A 90 33.591 -2.356 -14.476 1.00 25.00 O ATOM 165 CB HIS A 90 33.489 -2.796 -11.214 1.00 0.00 C ATOM 166 CG HIS A 90 33.899 -4.186 -11.599 1.00 25.00 C ATOM 167 ND1 HIS A 90 34.799 -4.493 -12.593 1.00 25.00 N ATOM 168 CD2 HIS A 90 33.508 -5.390 -11.097 1.00 25.00 C ATOM 169 CE1 HIS A 90 34.910 -5.817 -12.659 1.00 25.00 C ATOM 170 NE2 HIS A 90 34.141 -6.413 -11.772 1.00 25.00 N ATOM 0 H HIS A 90 31.914 -3.396 -13.720 1.00 25.00 H new ATOM 0 HA HIS A 90 32.220 -1.191 -11.833 1.00 25.00 H new ATOM 0 HB2 HIS A 90 34.382 -2.212 -10.992 1.00 0.00 H new ATOM 0 HB3 HIS A 90 32.901 -2.841 -10.297 1.00 0.00 H new ATOM 0 HD2 HIS A 90 32.805 -5.524 -10.288 1.00 25.00 H new ATOM 0 HE1 HIS A 90 35.551 -6.338 -13.354 1.00 25.00 H new ATOM 0 HE2 HIS A 90 34.036 -7.416 -11.617 1.00 25.00 H new ATOM 178 N HIS A 91 34.344 -0.598 -13.296 1.00 25.00 N ATOM 179 CA HIS A 91 35.263 -0.147 -14.349 1.00 25.00 C ATOM 180 C HIS A 91 36.460 0.631 -13.775 1.00 25.00 C ATOM 181 O HIS A 91 36.947 1.582 -14.372 1.00 25.00 O ATOM 182 CB HIS A 91 34.499 0.719 -15.362 1.00 25.00 C ATOM 183 CG HIS A 91 35.114 0.726 -16.727 1.00 25.00 C ATOM 184 ND1 HIS A 91 34.960 -0.279 -17.650 1.00 25.00 N ATOM 185 CD2 HIS A 91 35.913 1.646 -17.338 1.00 25.00 C ATOM 186 CE1 HIS A 91 35.637 0.054 -18.745 1.00 25.00 C ATOM 187 NE2 HIS A 91 36.233 1.221 -18.612 1.00 25.00 N ATOM 0 H HIS A 91 34.349 -0.020 -12.456 1.00 25.00 H new ATOM 0 HA HIS A 91 35.663 -1.030 -14.848 1.00 25.00 H new ATOM 0 HB2 HIS A 91 33.473 0.357 -15.436 1.00 25.00 H new ATOM 0 HB3 HIS A 91 34.450 1.742 -14.989 1.00 25.00 H new ATOM 0 HD2 HIS A 91 36.247 2.571 -16.891 1.00 25.00 H new ATOM 0 HE1 HIS A 91 35.691 -0.557 -19.634 1.00 25.00 H new ATOM 0 HE2 HIS A 91 36.807 1.706 -19.302 1.00 25.00 H new ATOM 195 N SER A 92 36.910 0.246 -12.588 1.00 25.00 N ATOM 196 CA SER A 92 38.045 0.925 -11.959 1.00 25.00 C ATOM 197 C SER A 92 39.345 0.378 -12.540 1.00 25.00 C ATOM 198 O SER A 92 39.576 -0.831 -12.503 1.00 25.00 O ATOM 199 CB SER A 92 38.033 0.705 -10.446 1.00 25.00 C ATOM 200 OG SER A 92 39.070 1.445 -9.828 1.00 25.00 O ATOM 0 H SER A 92 36.516 -0.522 -12.044 1.00 25.00 H new ATOM 0 HA SER A 92 37.968 1.994 -12.157 1.00 25.00 H new ATOM 0 HB2 SER A 92 37.069 1.007 -10.037 1.00 25.00 H new ATOM 0 HB3 SER A 92 38.154 -0.356 -10.226 1.00 25.00 H new ATOM 0 HG SER A 92 39.047 1.294 -8.860 1.00 25.00 H new ATOM 206 N SER A 93 40.169 1.254 -13.098 1.00 25.00 N ATOM 207 CA SER A 93 41.449 0.870 -13.692 1.00 25.00 C ATOM 208 C SER A 93 42.303 2.129 -13.816 1.00 25.00 C ATOM 209 O SER A 93 41.791 3.233 -13.632 1.00 25.00 O ATOM 210 CB SER A 93 41.227 0.256 -15.078 1.00 25.00 C ATOM 211 OG SER A 93 40.599 1.180 -15.946 1.00 25.00 O ATOM 0 H SER A 93 39.972 2.253 -13.153 1.00 25.00 H new ATOM 0 HA SER A 93 41.946 0.129 -13.066 1.00 25.00 H new ATOM 0 HB2 SER A 93 42.183 -0.053 -15.500 1.00 25.00 H new ATOM 0 HB3 SER A 93 40.613 -0.640 -14.989 1.00 25.00 H new ATOM 0 HG SER A 93 40.469 0.767 -16.825 1.00 25.00 H new ATOM 217 N GLY A 94 43.578 1.964 -14.149 1.00 25.00 N ATOM 218 CA GLY A 94 44.478 3.095 -14.342 1.00 25.00 C ATOM 219 C GLY A 94 45.770 2.927 -13.566 1.00 25.00 C ATOM 220 O GLY A 94 45.831 2.129 -12.635 1.00 25.00 O ATOM 0 H GLY A 94 44.014 1.053 -14.292 1.00 25.00 H new ATOM 0 HA2 GLY A 94 44.703 3.203 -15.403 1.00 25.00 H new ATOM 0 HA3 GLY A 94 43.981 4.012 -14.026 1.00 25.00 H new ATOM 224 N HIS A 95 46.802 3.661 -13.963 1.00 25.00 N ATOM 225 CA HIS A 95 48.107 3.618 -13.306 1.00 25.00 C ATOM 226 C HIS A 95 48.845 4.887 -13.714 1.00 25.00 C ATOM 227 O HIS A 95 48.365 5.626 -14.574 1.00 25.00 O ATOM 228 CB HIS A 95 48.914 2.386 -13.747 1.00 25.00 C ATOM 229 CG HIS A 95 49.391 2.454 -15.166 1.00 25.00 C ATOM 230 ND1 HIS A 95 50.666 2.804 -15.539 1.00 25.00 N ATOM 231 CD2 HIS A 95 48.738 2.202 -16.334 1.00 25.00 C ATOM 232 CE1 HIS A 95 50.735 2.765 -16.867 1.00 25.00 C ATOM 233 NE2 HIS A 95 49.586 2.404 -17.403 1.00 25.00 N ATOM 0 H HIS A 95 46.760 4.306 -14.752 1.00 25.00 H new ATOM 0 HA HIS A 95 47.982 3.552 -12.225 1.00 25.00 H new ATOM 0 HB2 HIS A 95 49.775 2.272 -13.089 1.00 25.00 H new ATOM 0 HB3 HIS A 95 48.298 1.496 -13.623 1.00 25.00 H new ATOM 0 HD2 HIS A 95 47.707 1.890 -16.412 1.00 25.00 H new ATOM 0 HE1 HIS A 95 51.623 3.000 -17.436 1.00 25.00 H new ATOM 0 HE2 HIS A 95 49.371 2.297 -18.394 1.00 25.00 H new ATOM 241 N ILE A 96 50.012 5.111 -13.132 1.00 25.00 N ATOM 242 CA ILE A 96 50.882 6.229 -13.490 1.00 25.00 C ATOM 243 C ILE A 96 52.227 5.549 -13.729 1.00 25.00 C ATOM 244 O ILE A 96 52.500 4.521 -13.113 1.00 25.00 O ATOM 245 CB ILE A 96 50.967 7.294 -12.335 1.00 25.00 C ATOM 246 CG1 ILE A 96 49.560 7.869 -12.045 1.00 25.00 C ATOM 247 CG2 ILE A 96 51.945 8.453 -12.709 1.00 25.00 C ATOM 248 CD1 ILE A 96 49.474 8.767 -10.795 1.00 25.00 C ATOM 0 H ILE A 96 50.389 4.519 -12.391 1.00 25.00 H new ATOM 0 HA ILE A 96 50.525 6.790 -14.354 1.00 25.00 H new ATOM 0 HB ILE A 96 51.350 6.798 -11.443 1.00 25.00 H new ATOM 0 HG12 ILE A 96 49.232 8.444 -12.911 1.00 25.00 H new ATOM 0 HG13 ILE A 96 48.861 7.041 -11.929 1.00 25.00 H new ATOM 0 HG21 ILE A 96 51.984 9.174 -11.893 1.00 25.00 H new ATOM 0 HG22 ILE A 96 52.942 8.047 -12.882 1.00 25.00 H new ATOM 0 HG23 ILE A 96 51.593 8.948 -13.614 1.00 25.00 H new ATOM 0 HD11 ILE A 96 48.451 9.123 -10.673 1.00 25.00 H new ATOM 0 HD12 ILE A 96 49.767 8.194 -9.915 1.00 25.00 H new ATOM 0 HD13 ILE A 96 50.143 9.619 -10.913 1.00 25.00 H new ATOM 260 N GLU A 97 53.037 6.084 -14.629 1.00 25.00 N ATOM 261 CA GLU A 97 54.358 5.533 -14.927 1.00 25.00 C ATOM 262 C GLU A 97 55.337 6.697 -14.995 1.00 25.00 C ATOM 263 O GLU A 97 54.915 7.846 -15.140 1.00 25.00 O ATOM 264 CB GLU A 97 54.340 4.781 -16.264 1.00 25.00 C ATOM 265 CG GLU A 97 54.390 3.259 -16.116 1.00 25.00 C ATOM 266 CD GLU A 97 55.731 2.747 -15.575 1.00 25.00 C ATOM 267 OE1 GLU A 97 56.697 3.542 -15.471 1.00 25.00 O ATOM 268 OE2 GLU A 97 55.814 1.542 -15.267 1.00 25.00 O1- ATOM 0 H GLU A 97 52.801 6.912 -15.176 1.00 25.00 H new ATOM 0 HA GLU A 97 54.654 4.825 -14.153 1.00 25.00 H new ATOM 0 HB2 GLU A 97 53.438 5.054 -16.812 1.00 25.00 H new ATOM 0 HB3 GLU A 97 55.189 5.107 -16.865 1.00 25.00 H new ATOM 0 HG2 GLU A 97 53.590 2.939 -15.448 1.00 25.00 H new ATOM 0 HG3 GLU A 97 54.198 2.800 -17.086 1.00 25.00 H new ATOM 275 N GLY A 98 56.625 6.407 -14.879 1.00 25.00 N ATOM 276 CA GLY A 98 57.645 7.445 -14.894 1.00 25.00 C ATOM 277 C GLY A 98 58.788 7.101 -13.960 1.00 25.00 C ATOM 278 O GLY A 98 58.800 6.026 -13.364 1.00 25.00 O ATOM 0 H GLY A 98 56.989 5.460 -14.773 1.00 25.00 H new ATOM 0 HA2 GLY A 98 58.025 7.571 -15.908 1.00 25.00 H new ATOM 0 HA3 GLY A 98 57.204 8.397 -14.598 1.00 25.00 H new ATOM 282 N ARG A 99 59.753 8.003 -13.829 1.00 25.00 N ATOM 283 CA ARG A 99 60.908 7.796 -12.947 1.00 25.00 C ATOM 284 C ARG A 99 61.238 9.112 -12.279 1.00 25.00 C ATOM 285 O ARG A 99 60.804 10.157 -12.735 1.00 25.00 O ATOM 286 CB ARG A 99 62.128 7.321 -13.743 1.00 25.00 C ATOM 287 CG ARG A 99 61.972 5.935 -14.339 1.00 25.00 C ATOM 288 CD ARG A 99 63.269 5.473 -14.966 1.00 25.00 C ATOM 289 NE ARG A 99 63.125 4.130 -15.549 1.00 25.00 N ATOM 290 CZ ARG A 99 64.098 3.443 -16.137 1.00 25.00 C ATOM 291 NH1 ARG A 99 65.312 3.919 -16.264 1.00 25.00 N1+ ATOM 292 NH2 ARG A 99 63.840 2.254 -16.605 1.00 25.00 N ATOM 0 H ARG A 99 59.763 8.894 -14.325 1.00 25.00 H new ATOM 0 HA ARG A 99 60.660 7.033 -12.209 1.00 25.00 H new ATOM 0 HB2 ARG A 99 62.324 8.031 -14.546 1.00 25.00 H new ATOM 0 HB3 ARG A 99 63.001 7.329 -13.090 1.00 25.00 H new ATOM 0 HG2 ARG A 99 61.667 5.233 -13.563 1.00 25.00 H new ATOM 0 HG3 ARG A 99 61.182 5.944 -15.090 1.00 25.00 H new ATOM 0 HD2 ARG A 99 63.574 6.178 -15.739 1.00 25.00 H new ATOM 0 HD3 ARG A 99 64.058 5.464 -14.214 1.00 25.00 H new ATOM 0 HE ARG A 99 62.205 3.692 -15.498 1.00 25.00 H new ATOM 0 HH11 ARG A 99 65.536 4.847 -15.905 1.00 25.00 H new ATOM 0 HH12 ARG A 99 66.033 3.361 -16.722 1.00 25.00 H new ATOM 0 HH21 ARG A 99 62.902 1.864 -16.517 1.00 25.00 H new ATOM 0 HH22 ARG A 99 64.576 1.714 -17.059 1.00 25.00 H new ATOM 306 N HIS A 100 62.015 9.045 -11.211 1.00 25.00 N ATOM 307 CA HIS A 100 62.478 10.223 -10.495 1.00 25.00 C ATOM 308 C HIS A 100 63.671 9.763 -9.674 1.00 25.00 C ATOM 309 O HIS A 100 63.906 8.562 -9.553 1.00 25.00 O ATOM 310 CB HIS A 100 61.384 10.773 -9.574 1.00 25.00 C ATOM 311 CG HIS A 100 60.842 9.763 -8.611 1.00 25.00 C ATOM 312 ND1 HIS A 100 59.694 9.039 -8.816 1.00 25.00 N ATOM 313 CD2 HIS A 100 61.311 9.347 -7.401 1.00 25.00 C ATOM 314 CE1 HIS A 100 59.506 8.251 -7.762 1.00 25.00 C ATOM 315 NE2 HIS A 100 60.462 8.397 -6.868 1.00 25.00 N ATOM 0 H HIS A 100 62.345 8.166 -10.813 1.00 25.00 H new ATOM 0 HA HIS A 100 62.741 11.025 -11.185 1.00 25.00 H new ATOM 0 HB2 HIS A 100 61.785 11.618 -9.013 1.00 25.00 H new ATOM 0 HB3 HIS A 100 60.566 11.155 -10.185 1.00 25.00 H new ATOM 0 HD2 HIS A 100 62.213 9.707 -6.929 1.00 25.00 H new ATOM 0 HE1 HIS A 100 58.672 7.574 -7.652 1.00 25.00 H new ATOM 0 HE2 HIS A 100 60.555 7.913 -5.975 1.00 25.00 H new ATOM 323 N MET A 101 64.390 10.716 -9.106 1.00 25.00 N ATOM 324 CA MET A 101 65.534 10.467 -8.237 1.00 25.00 C ATOM 325 C MET A 101 65.413 11.461 -7.094 1.00 25.00 C ATOM 326 O MET A 101 64.696 12.468 -7.212 1.00 25.00 O ATOM 327 CB MET A 101 66.843 10.668 -9.005 1.00 25.00 C ATOM 328 CG MET A 101 67.054 12.071 -9.518 1.00 25.00 C ATOM 329 SD MET A 101 68.589 12.185 -10.416 1.00 25.00 S ATOM 330 CE MET A 101 68.693 13.917 -10.616 1.00 25.00 C ATOM 0 H MET A 101 64.192 11.708 -9.237 1.00 25.00 H new ATOM 0 HA MET A 101 65.544 9.442 -7.867 1.00 25.00 H new ATOM 0 HB2 MET A 101 67.676 10.403 -8.355 1.00 25.00 H new ATOM 0 HB3 MET A 101 66.865 9.978 -9.849 1.00 25.00 H new ATOM 0 HG2 MET A 101 66.225 12.356 -10.166 1.00 25.00 H new ATOM 0 HG3 MET A 101 67.062 12.772 -8.683 1.00 25.00 H new ATOM 0 HE1 MET A 101 69.593 14.165 -11.178 1.00 25.00 H new ATOM 0 HE2 MET A 101 67.817 14.274 -11.158 1.00 25.00 H new ATOM 0 HE3 MET A 101 68.734 14.395 -9.637 1.00 25.00 H new ATOM 340 N LEU A 102 66.073 11.172 -5.983 1.00 25.00 N ATOM 341 CA LEU A 102 65.993 12.024 -4.797 1.00 25.00 C ATOM 342 C LEU A 102 67.348 12.657 -4.498 1.00 25.00 C ATOM 343 O LEU A 102 68.354 11.959 -4.408 1.00 25.00 O ATOM 344 CB LEU A 102 65.539 11.188 -3.593 1.00 25.00 C ATOM 345 CG LEU A 102 65.159 11.981 -2.330 1.00 25.00 C ATOM 346 CD1 LEU A 102 63.788 12.645 -2.489 1.00 25.00 C ATOM 347 CD2 LEU A 102 65.137 11.052 -1.120 1.00 25.00 C ATOM 0 H LEU A 102 66.672 10.354 -5.874 1.00 25.00 H new ATOM 0 HA LEU A 102 65.271 12.818 -4.986 1.00 25.00 H new ATOM 0 HB2 LEU A 102 64.680 10.589 -3.894 1.00 25.00 H new ATOM 0 HB3 LEU A 102 66.338 10.493 -3.336 1.00 25.00 H new ATOM 0 HG LEU A 102 65.907 12.760 -2.182 1.00 25.00 H new ATOM 0 HD11 LEU A 102 63.544 13.199 -1.582 1.00 25.00 H new ATOM 0 HD12 LEU A 102 63.811 13.330 -3.337 1.00 25.00 H new ATOM 0 HD13 LEU A 102 63.031 11.880 -2.661 1.00 25.00 H new ATOM 0 HD21 LEU A 102 64.867 11.620 -0.230 1.00 25.00 H new ATOM 0 HD22 LEU A 102 64.404 10.261 -1.282 1.00 25.00 H new ATOM 0 HD23 LEU A 102 66.124 10.610 -0.983 1.00 25.00 H new ATOM 359 N LEU A 103 67.367 13.969 -4.316 1.00 25.00 N ATOM 360 CA LEU A 103 68.591 14.697 -3.964 1.00 25.00 C ATOM 361 C LEU A 103 68.340 15.450 -2.677 1.00 25.00 C ATOM 362 O LEU A 103 67.209 15.828 -2.402 1.00 25.00 O ATOM 363 CB LEU A 103 68.959 15.704 -5.062 1.00 25.00 C ATOM 364 CG LEU A 103 69.327 15.124 -6.434 1.00 25.00 C ATOM 365 CD1 LEU A 103 69.567 16.274 -7.407 1.00 25.00 C ATOM 366 CD2 LEU A 103 70.569 14.254 -6.349 1.00 25.00 C ATOM 0 H LEU A 103 66.542 14.562 -4.406 1.00 25.00 H new ATOM 0 HA LEU A 103 69.411 13.988 -3.852 1.00 25.00 H new ATOM 0 HB2 LEU A 103 68.118 16.385 -5.195 1.00 25.00 H new ATOM 0 HB3 LEU A 103 69.800 16.301 -4.708 1.00 25.00 H new ATOM 0 HG LEU A 103 68.505 14.499 -6.783 1.00 25.00 H new ATOM 0 HD11 LEU A 103 69.829 15.873 -8.386 1.00 25.00 H new ATOM 0 HD12 LEU A 103 68.661 16.874 -7.491 1.00 25.00 H new ATOM 0 HD13 LEU A 103 70.382 16.897 -7.040 1.00 25.00 H new ATOM 0 HD21 LEU A 103 70.804 13.858 -7.337 1.00 25.00 H new ATOM 0 HD22 LEU A 103 71.407 14.850 -5.988 1.00 25.00 H new ATOM 0 HD23 LEU A 103 70.389 13.428 -5.661 1.00 25.00 H new ATOM 378 N THR A 104 69.382 15.702 -1.901 1.00 25.00 N ATOM 379 CA THR A 104 69.239 16.464 -0.665 1.00 25.00 C ATOM 380 C THR A 104 69.733 17.877 -0.929 1.00 25.00 C ATOM 381 O THR A 104 70.694 18.068 -1.659 1.00 25.00 O ATOM 382 CB THR A 104 70.054 15.813 0.472 1.00 25.00 C ATOM 383 OG1 THR A 104 69.729 14.423 0.538 1.00 25.00 O ATOM 384 CG2 THR A 104 69.736 16.435 1.826 1.00 25.00 C ATOM 0 H THR A 104 70.333 15.393 -2.101 1.00 25.00 H new ATOM 0 HA THR A 104 68.195 16.480 -0.353 1.00 25.00 H new ATOM 0 HB THR A 104 71.111 15.969 0.255 1.00 25.00 H new ATOM 0 HG1 THR A 104 70.244 14.000 1.257 1.00 25.00 H new ATOM 0 HG21 THR A 104 70.331 15.948 2.599 1.00 25.00 H new ATOM 0 HG22 THR A 104 69.973 17.499 1.802 1.00 25.00 H new ATOM 0 HG23 THR A 104 68.677 16.304 2.047 1.00 25.00 H new ATOM 392 N VAL A 105 69.082 18.871 -0.351 1.00 25.00 N ATOM 393 CA VAL A 105 69.517 20.254 -0.488 1.00 25.00 C ATOM 394 C VAL A 105 69.696 20.822 0.909 1.00 25.00 C ATOM 395 O VAL A 105 68.802 20.729 1.745 1.00 25.00 O ATOM 396 CB VAL A 105 68.500 21.111 -1.276 1.00 25.00 C ATOM 397 CG1 VAL A 105 69.027 22.553 -1.444 1.00 25.00 C ATOM 398 CG2 VAL A 105 68.232 20.495 -2.657 1.00 25.00 C ATOM 0 H VAL A 105 68.246 18.747 0.221 1.00 25.00 H new ATOM 0 HA VAL A 105 70.451 20.278 -1.049 1.00 25.00 H new ATOM 0 HB VAL A 105 67.567 21.136 -0.712 1.00 25.00 H new ATOM 0 HG11 VAL A 105 68.300 23.144 -2.001 1.00 25.00 H new ATOM 0 HG12 VAL A 105 69.182 23.000 -0.462 1.00 25.00 H new ATOM 0 HG13 VAL A 105 69.972 22.534 -1.988 1.00 25.00 H new ATOM 0 HG21 VAL A 105 67.514 21.112 -3.197 1.00 25.00 H new ATOM 0 HG22 VAL A 105 69.164 20.445 -3.220 1.00 25.00 H new ATOM 0 HG23 VAL A 105 67.828 19.490 -2.535 1.00 25.00 H new ATOM 408 N TYR A 106 70.859 21.394 1.166 1.00 25.00 N ATOM 409 CA TYR A 106 71.155 21.996 2.461 1.00 25.00 C ATOM 410 C TYR A 106 71.337 23.493 2.254 1.00 25.00 C ATOM 411 O TYR A 106 72.251 23.919 1.554 1.00 25.00 O ATOM 412 CB TYR A 106 72.418 21.360 3.049 1.00 25.00 C ATOM 413 CG TYR A 106 72.599 21.635 4.525 1.00 25.00 C ATOM 414 CD1 TYR A 106 72.857 22.938 4.993 1.00 25.00 C ATOM 415 CD2 TYR A 106 72.506 20.589 5.468 1.00 25.00 C ATOM 416 CE1 TYR A 106 73.013 23.193 6.374 1.00 25.00 C ATOM 417 CE2 TYR A 106 72.666 20.848 6.858 1.00 25.00 C ATOM 418 CZ TYR A 106 72.922 22.150 7.293 1.00 25.00 C ATOM 419 OH TYR A 106 73.091 22.416 8.626 1.00 25.00 O ATOM 0 H TYR A 106 71.621 21.456 0.491 1.00 25.00 H new ATOM 0 HA TYR A 106 70.340 21.825 3.164 1.00 25.00 H new ATOM 0 HB2 TYR A 106 72.381 20.282 2.890 1.00 25.00 H new ATOM 0 HB3 TYR A 106 73.288 21.732 2.508 1.00 25.00 H new ATOM 0 HD1 TYR A 106 72.937 23.752 4.288 1.00 25.00 H new ATOM 0 HD2 TYR A 106 72.311 19.582 5.131 1.00 25.00 H new ATOM 0 HE1 TYR A 106 73.203 24.199 6.718 1.00 25.00 H new ATOM 0 HE2 TYR A 106 72.590 20.042 7.573 1.00 25.00 H new ATOM 0 HH TYR A 106 73.359 23.351 8.741 1.00 25.00 H new ATOM 429 N CYS A 107 70.452 24.292 2.828 1.00 25.00 N ATOM 430 CA CYS A 107 70.512 25.740 2.673 1.00 25.00 C ATOM 431 C CYS A 107 71.054 26.402 3.928 1.00 25.00 C ATOM 432 O CYS A 107 70.426 26.368 4.976 1.00 25.00 O ATOM 433 CB CYS A 107 69.126 26.305 2.375 1.00 25.00 C ATOM 434 SG CYS A 107 69.159 28.106 2.192 1.00 25.00 S ATOM 0 H CYS A 107 69.680 23.963 3.408 1.00 25.00 H new ATOM 0 HA CYS A 107 71.182 25.952 1.840 1.00 25.00 H new ATOM 0 HB2 CYS A 107 68.738 25.854 1.462 1.00 25.00 H new ATOM 0 HB3 CYS A 107 68.442 26.034 3.179 1.00 25.00 H new ATOM 0 HG CYS A 107 69.715 28.638 3.239 1.00 25.00 H new ATOM 440 N VAL A 108 72.198 27.050 3.797 1.00 25.00 N ATOM 441 CA VAL A 108 72.827 27.762 4.903 1.00 25.00 C ATOM 442 C VAL A 108 72.497 29.246 4.801 1.00 25.00 C ATOM 443 O VAL A 108 72.736 29.872 3.765 1.00 25.00 O ATOM 444 CB VAL A 108 74.379 27.594 4.865 1.00 25.00 C ATOM 445 CG1 VAL A 108 75.038 28.280 6.079 1.00 25.00 C ATOM 446 CG2 VAL A 108 74.756 26.112 4.854 1.00 25.00 C ATOM 0 H VAL A 108 72.720 27.099 2.922 1.00 25.00 H new ATOM 0 HA VAL A 108 72.447 27.347 5.836 1.00 25.00 H new ATOM 0 HB VAL A 108 74.742 28.067 3.952 1.00 25.00 H new ATOM 0 HG11 VAL A 108 76.119 28.148 6.029 1.00 25.00 H new ATOM 0 HG12 VAL A 108 74.801 29.344 6.069 1.00 25.00 H new ATOM 0 HG13 VAL A 108 74.660 27.833 6.999 1.00 25.00 H new ATOM 0 HG21 VAL A 108 75.841 26.013 4.827 1.00 25.00 H new ATOM 0 HG22 VAL A 108 74.370 25.632 5.753 1.00 25.00 H new ATOM 0 HG23 VAL A 108 74.326 25.634 3.974 1.00 25.00 H new ATOM 456 N ARG A 109 72.004 29.825 5.887 1.00 25.00 N ATOM 457 CA ARG A 109 71.829 31.273 5.977 1.00 25.00 C ATOM 458 C ARG A 109 72.868 31.755 6.970 1.00 25.00 C ATOM 459 O ARG A 109 73.219 31.019 7.886 1.00 25.00 O ATOM 460 CB ARG A 109 70.441 31.642 6.489 1.00 25.00 C ATOM 461 CG ARG A 109 69.279 31.253 5.575 1.00 25.00 C ATOM 462 CD ARG A 109 68.140 32.266 5.723 1.00 25.00 C ATOM 463 NE ARG A 109 66.826 31.719 5.340 1.00 25.00 N ATOM 464 CZ ARG A 109 65.725 32.439 5.149 1.00 25.00 C ATOM 465 NH1 ARG A 109 65.718 33.749 5.246 1.00 25.00 N1+ ATOM 466 NH2 ARG A 109 64.608 31.834 4.849 1.00 25.00 N ATOM 0 H ARG A 109 71.716 29.315 6.722 1.00 25.00 H new ATOM 0 HA ARG A 109 71.940 31.729 4.993 1.00 25.00 H new ATOM 0 HB2 ARG A 109 70.292 31.168 7.459 1.00 25.00 H new ATOM 0 HB3 ARG A 109 70.407 32.719 6.653 1.00 25.00 H new ATOM 0 HG2 ARG A 109 69.615 31.219 4.539 1.00 25.00 H new ATOM 0 HG3 ARG A 109 68.924 30.254 5.828 1.00 25.00 H new ATOM 0 HD2 ARG A 109 68.097 32.607 6.757 1.00 25.00 H new ATOM 0 HD3 ARG A 109 68.356 33.139 5.108 1.00 25.00 H new ATOM 0 HE ARG A 109 66.756 30.710 5.212 1.00 25.00 H new ATOM 0 HH11 ARG A 109 66.578 34.248 5.475 1.00 25.00 H new ATOM 0 HH12 ARG A 109 64.853 34.267 5.092 1.00 25.00 H new ATOM 0 HH21 ARG A 109 64.585 30.818 4.763 1.00 25.00 H new ATOM 0 HH22 ARG A 109 63.758 32.377 4.700 1.00 25.00 H new ATOM 480 N ARG A 110 73.337 32.986 6.813 1.00 25.00 N ATOM 481 CA ARG A 110 74.366 33.545 7.707 1.00 25.00 C ATOM 482 C ARG A 110 74.004 33.445 9.192 1.00 25.00 C ATOM 483 O ARG A 110 74.863 33.175 10.020 1.00 25.00 O ATOM 484 CB ARG A 110 74.632 35.019 7.335 1.00 25.00 C ATOM 485 CG ARG A 110 75.800 35.674 8.104 1.00 25.00 C ATOM 486 CD ARG A 110 75.317 36.399 9.369 1.00 25.00 C ATOM 487 NE ARG A 110 76.427 36.755 10.269 1.00 25.00 N ATOM 488 CZ ARG A 110 76.290 37.110 11.544 1.00 25.00 C ATOM 489 NH1 ARG A 110 75.127 37.192 12.136 1.00 25.00 N1+ ATOM 490 NH2 ARG A 110 77.358 37.389 12.239 1.00 25.00 N ATOM 0 H ARG A 110 73.027 33.623 6.079 1.00 25.00 H new ATOM 0 HA ARG A 110 75.264 32.944 7.564 1.00 25.00 H new ATOM 0 HB2 ARG A 110 74.838 35.079 6.266 1.00 25.00 H new ATOM 0 HB3 ARG A 110 73.725 35.596 7.517 1.00 25.00 H new ATOM 0 HG2 ARG A 110 76.528 34.910 8.379 1.00 25.00 H new ATOM 0 HG3 ARG A 110 76.312 36.382 7.453 1.00 25.00 H new ATOM 0 HD2 ARG A 110 74.780 37.303 9.084 1.00 25.00 H new ATOM 0 HD3 ARG A 110 74.610 35.763 9.902 1.00 25.00 H new ATOM 0 HE ARG A 110 77.372 36.727 9.886 1.00 25.00 H new ATOM 0 HH11 ARG A 110 74.275 36.979 11.618 1.00 25.00 H new ATOM 0 HH12 ARG A 110 75.072 37.469 13.116 1.00 25.00 H new ATOM 0 HH21 ARG A 110 78.279 37.333 11.804 1.00 25.00 H new ATOM 0 HH22 ARG A 110 77.272 37.663 13.218 1.00 25.00 H new ATOM 504 N ASP A 111 72.747 33.695 9.521 1.00 25.00 N ATOM 505 CA ASP A 111 72.302 33.767 10.921 1.00 25.00 C ATOM 506 C ASP A 111 71.942 32.403 11.537 1.00 25.00 C ATOM 507 O ASP A 111 71.182 32.335 12.492 1.00 25.00 O ATOM 508 CB ASP A 111 71.108 34.736 11.015 1.00 25.00 C ATOM 509 CG ASP A 111 71.530 36.130 11.448 1.00 25.00 C ATOM 510 OD1 ASP A 111 72.625 36.577 11.032 1.00 25.00 O ATOM 511 OD2 ASP A 111 70.791 36.776 12.209 1.00 25.00 O1- ATOM 0 H ASP A 111 72.005 33.854 8.839 1.00 25.00 H new ATOM 0 HA ASP A 111 73.145 34.132 11.507 1.00 25.00 H new ATOM 0 HB2 ASP A 111 70.612 34.793 10.046 1.00 25.00 H new ATOM 0 HB3 ASP A 111 70.379 34.343 11.723 1.00 25.00 H new ATOM 516 N LEU A 112 72.487 31.327 10.970 1.00 25.00 N ATOM 517 CA LEU A 112 72.234 29.942 11.432 1.00 25.00 C ATOM 518 C LEU A 112 70.744 29.598 11.333 1.00 25.00 C ATOM 519 O LEU A 112 70.232 28.714 12.001 1.00 25.00 O ATOM 520 CB LEU A 112 72.761 29.708 12.860 1.00 25.00 C ATOM 521 CG LEU A 112 74.242 30.048 13.104 1.00 25.00 C ATOM 522 CD1 LEU A 112 74.560 29.902 14.592 1.00 25.00 C ATOM 523 CD2 LEU A 112 75.172 29.144 12.284 1.00 25.00 C ATOM 0 H LEU A 112 73.121 31.381 10.173 1.00 25.00 H new ATOM 0 HA LEU A 112 72.785 29.273 10.771 1.00 25.00 H new ATOM 0 HB2 LEU A 112 72.156 30.298 13.549 1.00 25.00 H new ATOM 0 HB3 LEU A 112 72.604 28.660 13.115 1.00 25.00 H new ATOM 0 HG LEU A 112 74.410 31.077 12.785 1.00 25.00 H new ATOM 0 HD11 LEU A 112 75.609 30.143 14.765 1.00 25.00 H new ATOM 0 HD12 LEU A 112 73.932 30.582 15.167 1.00 25.00 H new ATOM 0 HD13 LEU A 112 74.366 28.876 14.907 1.00 25.00 H new ATOM 0 HD21 LEU A 112 76.209 29.414 12.482 1.00 25.00 H new ATOM 0 HD22 LEU A 112 75.008 28.103 12.564 1.00 25.00 H new ATOM 0 HD23 LEU A 112 74.961 29.272 11.222 1.00 25.00 H new ATOM 535 N SER A 113 70.087 30.286 10.414 1.00 25.00 N ATOM 536 CA SER A 113 68.678 30.079 10.056 1.00 25.00 C ATOM 537 C SER A 113 68.600 28.962 9.007 1.00 25.00 C ATOM 538 O SER A 113 67.784 28.997 8.084 1.00 25.00 O ATOM 539 CB SER A 113 68.076 31.379 9.529 1.00 25.00 C ATOM 540 OG SER A 113 66.702 31.234 9.216 1.00 25.00 O ATOM 0 H SER A 113 70.527 31.031 9.874 1.00 25.00 H new ATOM 0 HA SER A 113 68.103 29.783 10.934 1.00 25.00 H new ATOM 0 HB2 SER A 113 68.198 32.164 10.275 1.00 25.00 H new ATOM 0 HB3 SER A 113 68.620 31.697 8.639 1.00 25.00 H new ATOM 0 HG SER A 113 66.568 30.407 8.707 1.00 25.00 H new ATOM 546 N GLU A 114 69.602 28.102 9.045 1.00 25.00 N ATOM 547 CA GLU A 114 69.827 27.082 8.031 1.00 25.00 C ATOM 548 C GLU A 114 68.796 25.952 8.122 1.00 25.00 C ATOM 549 O GLU A 114 68.167 25.744 9.157 1.00 25.00 O ATOM 550 CB GLU A 114 71.248 26.521 8.209 1.00 25.00 C ATOM 551 CG GLU A 114 71.497 25.819 9.550 1.00 25.00 C ATOM 552 CD GLU A 114 72.978 25.554 9.790 1.00 25.00 C ATOM 553 OE1 GLU A 114 73.673 25.140 8.835 1.00 25.00 O1- ATOM 554 OE2 GLU A 114 73.457 25.794 10.915 1.00 25.00 O1- ATOM 0 H GLU A 114 70.295 28.091 9.793 1.00 25.00 H new ATOM 0 HA GLU A 114 69.718 27.536 7.046 1.00 25.00 H new ATOM 0 HB2 GLU A 114 71.449 25.816 7.402 1.00 25.00 H new ATOM 0 HB3 GLU A 114 71.962 27.338 8.104 1.00 25.00 H new ATOM 0 HG2 GLU A 114 71.103 26.434 10.359 1.00 25.00 H new ATOM 0 HG3 GLU A 114 70.952 24.875 9.572 1.00 25.00 H new ATOM 561 N VAL A 115 68.590 25.267 7.005 1.00 25.00 N ATOM 562 CA VAL A 115 67.560 24.233 6.896 1.00 25.00 C ATOM 563 C VAL A 115 68.031 23.239 5.840 1.00 25.00 C ATOM 564 O VAL A 115 68.828 23.591 4.972 1.00 25.00 O ATOM 565 CB VAL A 115 66.168 24.875 6.492 1.00 25.00 C ATOM 566 CG1 VAL A 115 66.207 25.469 5.067 1.00 25.00 C ATOM 567 CG2 VAL A 115 65.014 23.864 6.617 1.00 25.00 C ATOM 0 H VAL A 115 69.128 25.409 6.150 1.00 25.00 H new ATOM 0 HA VAL A 115 67.413 23.730 7.852 1.00 25.00 H new ATOM 0 HB VAL A 115 65.984 25.687 7.195 1.00 25.00 H new ATOM 0 HG11 VAL A 115 65.235 25.900 4.826 1.00 25.00 H new ATOM 0 HG12 VAL A 115 66.971 26.245 5.017 1.00 25.00 H new ATOM 0 HG13 VAL A 115 66.443 24.682 4.351 1.00 25.00 H new ATOM 0 HG21 VAL A 115 64.078 24.343 6.331 1.00 25.00 H new ATOM 0 HG22 VAL A 115 65.202 23.014 5.961 1.00 25.00 H new ATOM 0 HG23 VAL A 115 64.944 23.517 7.648 1.00 25.00 H new ATOM 577 N THR A 116 67.537 22.015 5.885 1.00 25.00 N ATOM 578 CA THR A 116 67.840 21.040 4.850 1.00 25.00 C ATOM 579 C THR A 116 66.554 20.291 4.550 1.00 25.00 C ATOM 580 O THR A 116 65.675 20.186 5.407 1.00 25.00 O ATOM 581 CB THR A 116 68.997 20.087 5.262 1.00 25.00 C ATOM 582 OG1 THR A 116 69.367 19.266 4.149 1.00 25.00 O ATOM 583 CG2 THR A 116 68.618 19.183 6.426 1.00 25.00 C ATOM 0 H THR A 116 66.925 21.672 6.625 1.00 25.00 H new ATOM 0 HA THR A 116 68.199 21.542 3.952 1.00 25.00 H new ATOM 0 HB THR A 116 69.830 20.716 5.577 1.00 25.00 H new ATOM 0 HG1 THR A 116 69.182 19.744 3.314 1.00 25.00 H new ATOM 0 HG21 THR A 116 69.460 18.537 6.674 1.00 25.00 H new ATOM 0 HG22 THR A 116 68.361 19.793 7.292 1.00 25.00 H new ATOM 0 HG23 THR A 116 67.761 18.570 6.147 1.00 25.00 H new ATOM 591 N PHE A 117 66.421 19.848 3.313 1.00 25.00 N ATOM 592 CA PHE A 117 65.222 19.184 2.828 1.00 25.00 C ATOM 593 C PHE A 117 65.677 18.344 1.646 1.00 25.00 C ATOM 594 O PHE A 117 66.839 18.421 1.257 1.00 25.00 O ATOM 595 CB PHE A 117 64.164 20.219 2.410 1.00 25.00 C ATOM 596 CG PHE A 117 64.684 21.285 1.481 1.00 25.00 C ATOM 597 CD1 PHE A 117 64.652 21.097 0.088 1.00 25.00 C ATOM 598 CD2 PHE A 117 65.188 22.498 1.999 1.00 25.00 C ATOM 599 CE1 PHE A 117 65.119 22.105 -0.792 1.00 25.00 C ATOM 600 CE2 PHE A 117 65.658 23.517 1.131 1.00 25.00 C ATOM 601 CZ PHE A 117 65.624 23.320 -0.265 1.00 25.00 C ATOM 0 H PHE A 117 67.151 19.940 2.607 1.00 25.00 H new ATOM 0 HA PHE A 117 64.755 18.566 3.595 1.00 25.00 H new ATOM 0 HB2 PHE A 117 63.336 19.702 1.926 1.00 25.00 H new ATOM 0 HB3 PHE A 117 63.763 20.695 3.305 1.00 25.00 H new ATOM 0 HD1 PHE A 117 64.267 20.173 -0.317 1.00 25.00 H new ATOM 0 HD2 PHE A 117 65.216 22.652 3.068 1.00 25.00 H new ATOM 0 HE1 PHE A 117 65.090 21.948 -1.860 1.00 25.00 H new ATOM 0 HE2 PHE A 117 66.041 24.441 1.538 1.00 25.00 H new ATOM 0 HZ PHE A 117 65.981 24.092 -0.930 1.00 25.00 H new ATOM 611 N SER A 118 64.786 17.560 1.066 1.00 25.00 N ATOM 612 CA SER A 118 65.131 16.744 -0.093 1.00 25.00 C ATOM 613 C SER A 118 64.154 17.044 -1.211 1.00 25.00 C ATOM 614 O SER A 118 63.019 17.431 -0.955 1.00 25.00 O ATOM 615 CB SER A 118 65.092 15.258 0.262 1.00 25.00 C ATOM 616 OG SER A 118 66.023 14.962 1.293 1.00 25.00 O ATOM 0 H SER A 118 63.818 17.468 1.375 1.00 25.00 H new ATOM 0 HA SER A 118 66.144 16.984 -0.415 1.00 25.00 H new ATOM 0 HB2 SER A 118 64.087 14.982 0.583 1.00 25.00 H new ATOM 0 HB3 SER A 118 65.319 14.662 -0.622 1.00 25.00 H new ATOM 0 HG SER A 118 65.981 14.007 1.507 1.00 25.00 H new ATOM 622 N LEU A 119 64.606 16.880 -2.444 1.00 25.00 N ATOM 623 CA LEU A 119 63.791 17.156 -3.617 1.00 25.00 C ATOM 624 C LEU A 119 63.704 15.933 -4.498 1.00 25.00 C ATOM 625 O LEU A 119 64.691 15.227 -4.708 1.00 25.00 O ATOM 626 CB LEU A 119 64.391 18.301 -4.433 1.00 25.00 C ATOM 627 CG LEU A 119 64.190 19.718 -3.888 1.00 25.00 C ATOM 628 CD1 LEU A 119 64.893 20.679 -4.822 1.00 25.00 C ATOM 629 CD2 LEU A 119 62.709 20.075 -3.800 1.00 25.00 C ATOM 0 H LEU A 119 65.547 16.552 -2.660 1.00 25.00 H new ATOM 0 HA LEU A 119 62.796 17.435 -3.271 1.00 25.00 H new ATOM 0 HB2 LEU A 119 65.462 18.124 -4.531 1.00 25.00 H new ATOM 0 HB3 LEU A 119 63.968 18.260 -5.437 1.00 25.00 H new ATOM 0 HG LEU A 119 64.602 19.780 -2.881 1.00 25.00 H new ATOM 0 HD11 LEU A 119 64.766 21.699 -4.458 1.00 25.00 H new ATOM 0 HD12 LEU A 119 65.955 20.437 -4.861 1.00 25.00 H new ATOM 0 HD13 LEU A 119 64.465 20.595 -5.821 1.00 25.00 H new ATOM 0 HD21 LEU A 119 62.601 21.087 -3.410 1.00 25.00 H new ATOM 0 HD22 LEU A 119 62.262 20.019 -4.792 1.00 25.00 H new ATOM 0 HD23 LEU A 119 62.205 19.374 -3.135 1.00 25.00 H new ATOM 641 N GLN A 120 62.514 15.715 -5.029 1.00 25.00 N ATOM 642 CA GLN A 120 62.238 14.602 -5.929 1.00 25.00 C ATOM 643 C GLN A 120 62.164 15.187 -7.331 1.00 25.00 C ATOM 644 O GLN A 120 61.287 15.998 -7.623 1.00 25.00 O ATOM 645 CB GLN A 120 60.915 13.933 -5.547 1.00 25.00 C ATOM 646 CG GLN A 120 60.598 12.701 -6.372 1.00 25.00 C ATOM 647 CD GLN A 120 59.249 12.110 -6.028 1.00 25.00 C ATOM 648 OE1 GLN A 120 58.963 11.807 -4.885 1.00 25.00 O ATOM 649 NE2 GLN A 120 58.406 11.967 -7.018 1.00 25.00 N ATOM 0 H GLN A 120 61.704 16.308 -4.848 1.00 25.00 H new ATOM 0 HA GLN A 120 63.014 13.839 -5.870 1.00 25.00 H new ATOM 0 HB2 GLN A 120 60.948 13.656 -4.493 1.00 25.00 H new ATOM 0 HB3 GLN A 120 60.106 14.655 -5.661 1.00 25.00 H new ATOM 0 HG2 GLN A 120 60.619 12.960 -7.431 1.00 25.00 H new ATOM 0 HG3 GLN A 120 61.372 11.951 -6.212 1.00 25.00 H new ATOM 0 HE21 GLN A 120 58.681 12.232 -7.964 1.00 25.00 H new ATOM 0 HE22 GLN A 120 57.474 11.591 -6.844 1.00 25.00 H new ATOM 658 N VAL A 121 63.121 14.830 -8.170 1.00 25.00 N ATOM 659 CA VAL A 121 63.261 15.432 -9.498 1.00 25.00 C ATOM 660 C VAL A 121 63.562 14.362 -10.531 1.00 25.00 C ATOM 661 O VAL A 121 63.906 13.244 -10.180 1.00 25.00 O ATOM 662 CB VAL A 121 64.418 16.477 -9.499 1.00 25.00 C ATOM 663 CG1 VAL A 121 64.038 17.679 -8.645 1.00 25.00 C ATOM 664 CG2 VAL A 121 65.725 15.854 -8.963 1.00 25.00 C ATOM 0 H VAL A 121 63.822 14.120 -7.958 1.00 25.00 H new ATOM 0 HA VAL A 121 62.323 15.927 -9.748 1.00 25.00 H new ATOM 0 HB VAL A 121 64.582 16.799 -10.527 1.00 25.00 H new ATOM 0 HG11 VAL A 121 64.853 18.403 -8.652 1.00 25.00 H new ATOM 0 HG12 VAL A 121 63.138 18.142 -9.049 1.00 25.00 H new ATOM 0 HG13 VAL A 121 63.851 17.354 -7.622 1.00 25.00 H new ATOM 0 HG21 VAL A 121 66.516 16.603 -8.974 1.00 25.00 H new ATOM 0 HG22 VAL A 121 65.570 15.505 -7.942 1.00 25.00 H new ATOM 0 HG23 VAL A 121 66.013 15.013 -9.594 1.00 25.00 H new ATOM 674 N ASP A 122 63.444 14.705 -11.801 1.00 25.00 N ATOM 675 CA ASP A 122 63.808 13.783 -12.874 1.00 25.00 C ATOM 676 C ASP A 122 65.324 13.847 -13.058 1.00 25.00 C ATOM 677 O ASP A 122 65.958 14.828 -12.673 1.00 25.00 O ATOM 678 CB ASP A 122 63.093 14.172 -14.176 1.00 25.00 C ATOM 679 CG ASP A 122 63.126 13.058 -15.217 1.00 25.00 C ATOM 680 OD1 ASP A 122 64.175 12.876 -15.871 1.00 25.00 O1- ATOM 681 OD2 ASP A 122 62.124 12.332 -15.339 1.00 25.00 O1- ATOM 0 H ASP A 122 63.101 15.611 -12.119 1.00 25.00 H new ATOM 0 HA ASP A 122 63.504 12.768 -12.618 1.00 25.00 H new ATOM 0 HB2 ASP A 122 62.057 14.427 -13.955 1.00 25.00 H new ATOM 0 HB3 ASP A 122 63.560 15.066 -14.590 1.00 25.00 H new ATOM 686 N ALA A 123 65.903 12.826 -13.666 1.00 25.00 N ATOM 687 CA ALA A 123 67.329 12.824 -13.953 1.00 25.00 C ATOM 688 C ALA A 123 67.656 13.948 -14.947 1.00 25.00 C ATOM 689 O ALA A 123 68.694 14.609 -14.841 1.00 25.00 O ATOM 690 CB ALA A 123 67.735 11.460 -14.524 1.00 25.00 C ATOM 0 H ALA A 123 65.409 11.987 -13.971 1.00 25.00 H new ATOM 0 HA ALA A 123 67.890 12.998 -13.035 1.00 25.00 H new ATOM 0 HB1 ALA A 123 68.804 11.459 -14.739 1.00 25.00 H new ATOM 0 HB2 ALA A 123 67.510 10.680 -13.797 1.00 25.00 H new ATOM 0 HB3 ALA A 123 67.180 11.270 -15.443 1.00 25.00 H new ATOM 696 N ASP A 124 66.763 14.166 -15.903 1.00 25.00 N ATOM 697 CA ASP A 124 66.992 15.162 -16.950 1.00 25.00 C ATOM 698 C ASP A 124 66.414 16.536 -16.588 1.00 25.00 C ATOM 699 O ASP A 124 66.306 17.424 -17.426 1.00 25.00 O ATOM 700 CB ASP A 124 66.417 14.675 -18.282 1.00 25.00 C ATOM 701 CG ASP A 124 67.234 15.157 -19.482 1.00 25.00 C ATOM 702 OD1 ASP A 124 68.475 15.328 -19.341 1.00 25.00 O ATOM 703 OD2 ASP A 124 66.657 15.280 -20.583 1.00 25.00 O1- ATOM 0 H ASP A 124 65.875 13.670 -15.978 1.00 25.00 H new ATOM 0 HA ASP A 124 68.071 15.285 -17.046 1.00 25.00 H new ATOM 0 HB2 ASP A 124 66.383 13.586 -18.283 1.00 25.00 H new ATOM 0 HB3 ASP A 124 65.390 15.026 -18.381 1.00 25.00 H new ATOM 708 N PHE A 125 66.060 16.712 -15.321 1.00 25.00 N ATOM 709 CA PHE A 125 65.539 17.990 -14.834 1.00 25.00 C ATOM 710 C PHE A 125 66.636 19.047 -14.996 1.00 25.00 C ATOM 711 O PHE A 125 67.795 18.793 -14.673 1.00 25.00 O ATOM 712 CB PHE A 125 65.150 17.837 -13.360 1.00 25.00 C ATOM 713 CG PHE A 125 64.114 18.817 -12.879 1.00 25.00 C ATOM 714 CD1 PHE A 125 62.760 18.638 -13.221 1.00 25.00 C ATOM 715 CD2 PHE A 125 64.466 19.885 -12.032 1.00 25.00 C ATOM 716 CE1 PHE A 125 61.766 19.519 -12.732 1.00 25.00 C ATOM 717 CE2 PHE A 125 63.474 20.767 -11.529 1.00 25.00 C ATOM 718 CZ PHE A 125 62.126 20.585 -11.884 1.00 25.00 C ATOM 0 H PHE A 125 66.123 15.986 -14.608 1.00 25.00 H new ATOM 0 HA PHE A 125 64.658 18.295 -15.398 1.00 25.00 H new ATOM 0 HB2 PHE A 125 64.776 16.826 -13.200 1.00 25.00 H new ATOM 0 HB3 PHE A 125 66.046 17.946 -12.749 1.00 25.00 H new ATOM 0 HD1 PHE A 125 62.476 17.818 -13.864 1.00 25.00 H new ATOM 0 HD2 PHE A 125 65.501 20.035 -11.762 1.00 25.00 H new ATOM 0 HE1 PHE A 125 60.732 19.374 -13.009 1.00 25.00 H new ATOM 0 HE2 PHE A 125 63.755 21.578 -10.873 1.00 25.00 H new ATOM 0 HZ PHE A 125 61.370 21.259 -11.509 1.00 25.00 H new ATOM 728 N GLU A 126 66.288 20.213 -15.519 1.00 25.00 N ATOM 729 CA GLU A 126 67.276 21.270 -15.750 1.00 25.00 C ATOM 730 C GLU A 126 67.803 21.818 -14.436 1.00 25.00 C ATOM 731 O GLU A 126 67.046 21.976 -13.478 1.00 25.00 O ATOM 732 CB GLU A 126 66.652 22.458 -16.478 1.00 25.00 C ATOM 733 CG GLU A 126 66.163 22.194 -17.878 1.00 25.00 C ATOM 734 CD GLU A 126 65.562 23.454 -18.478 1.00 25.00 C ATOM 735 OE1 GLU A 126 66.298 24.459 -18.605 1.00 25.00 O ATOM 736 OE2 GLU A 126 64.334 23.479 -18.716 1.00 25.00 O1- ATOM 0 H GLU A 126 65.336 20.456 -15.792 1.00 25.00 H new ATOM 0 HA GLU A 126 68.072 20.818 -16.341 1.00 25.00 H new ATOM 0 HB2 GLU A 126 65.813 22.822 -15.885 1.00 25.00 H new ATOM 0 HB3 GLU A 126 67.388 23.261 -16.517 1.00 25.00 H new ATOM 0 HG2 GLU A 126 66.989 21.847 -18.499 1.00 25.00 H new ATOM 0 HG3 GLU A 126 65.418 21.399 -17.865 1.00 25.00 H new ATOM 743 N LEU A 127 69.061 22.234 -14.428 1.00 25.00 N ATOM 744 CA LEU A 127 69.627 22.936 -13.279 1.00 25.00 C ATOM 745 C LEU A 127 68.857 24.247 -13.085 1.00 25.00 C ATOM 746 O LEU A 127 68.566 24.650 -11.961 1.00 25.00 O ATOM 747 CB LEU A 127 71.096 23.245 -13.546 1.00 25.00 C ATOM 748 CG LEU A 127 72.097 23.393 -12.389 1.00 25.00 C ATOM 749 CD1 LEU A 127 73.333 24.077 -12.970 1.00 25.00 C ATOM 750 CD2 LEU A 127 71.591 24.192 -11.188 1.00 25.00 C ATOM 0 H LEU A 127 69.711 22.099 -15.202 1.00 25.00 H new ATOM 0 HA LEU A 127 69.548 22.318 -12.385 1.00 25.00 H new ATOM 0 HB2 LEU A 127 71.475 22.457 -14.197 1.00 25.00 H new ATOM 0 HB3 LEU A 127 71.128 24.173 -14.117 1.00 25.00 H new ATOM 0 HG LEU A 127 72.294 22.397 -11.993 1.00 25.00 H new ATOM 0 HD11 LEU A 127 74.079 24.207 -12.186 1.00 25.00 H new ATOM 0 HD12 LEU A 127 73.748 23.461 -13.768 1.00 25.00 H new ATOM 0 HD13 LEU A 127 73.055 25.052 -13.371 1.00 25.00 H new ATOM 0 HD21 LEU A 127 72.370 24.239 -10.427 1.00 25.00 H new ATOM 0 HD22 LEU A 127 71.333 25.202 -11.506 1.00 25.00 H new ATOM 0 HD23 LEU A 127 70.708 23.706 -10.773 1.00 25.00 H new ATOM 762 N HIS A 128 68.482 24.882 -14.189 1.00 25.00 N ATOM 763 CA HIS A 128 67.703 26.118 -14.140 1.00 25.00 C ATOM 764 C HIS A 128 66.411 25.929 -13.354 1.00 25.00 C ATOM 765 O HIS A 128 66.023 26.779 -12.552 1.00 25.00 O ATOM 766 CB HIS A 128 67.335 26.579 -15.553 1.00 25.00 C ATOM 767 CG HIS A 128 66.412 27.757 -15.566 1.00 25.00 C ATOM 768 ND1 HIS A 128 65.050 27.671 -15.726 1.00 25.00 N ATOM 769 CD2 HIS A 128 66.666 29.084 -15.407 1.00 25.00 C ATOM 770 CE1 HIS A 128 64.546 28.897 -15.656 1.00 25.00 C ATOM 771 NE2 HIS A 128 65.486 29.800 -15.453 1.00 25.00 N ATOM 0 H HIS A 128 68.704 24.562 -15.132 1.00 25.00 H new ATOM 0 HA HIS A 128 68.324 26.866 -13.647 1.00 25.00 H new ATOM 0 HB2 HIS A 128 68.246 26.833 -16.094 1.00 25.00 H new ATOM 0 HB3 HIS A 128 66.867 25.753 -16.088 1.00 25.00 H new ATOM 0 HD1 HIS A 128 64.518 26.813 -15.873 1.00 25.00 H new ATOM 0 HD2 HIS A 128 67.646 29.514 -15.266 1.00 25.00 H new ATOM 0 HE1 HIS A 128 63.495 29.127 -15.753 1.00 25.00 H new ATOM 779 N ASN A 129 65.734 24.821 -13.594 1.00 25.00 N ATOM 780 CA ASN A 129 64.479 24.552 -12.911 1.00 25.00 C ATOM 781 C ASN A 129 64.750 24.065 -11.490 1.00 25.00 C ATOM 782 O ASN A 129 63.998 24.360 -10.575 1.00 25.00 O ATOM 783 CB ASN A 129 63.652 23.542 -13.708 1.00 25.00 C ATOM 784 CG ASN A 129 63.297 24.057 -15.087 1.00 25.00 C ATOM 785 OD1 ASN A 129 63.269 25.259 -15.323 1.00 25.00 O ATOM 786 ND2 ASN A 129 63.071 23.160 -16.003 1.00 25.00 N ATOM 0 H ASN A 129 66.027 24.098 -14.251 1.00 25.00 H new ATOM 0 HA ASN A 129 63.900 25.473 -12.842 1.00 25.00 H new ATOM 0 HB2 ASN A 129 64.211 22.611 -13.802 1.00 25.00 H new ATOM 0 HB3 ASN A 129 62.738 23.311 -13.161 1.00 25.00 H new ATOM 0 HD21 ASN A 129 62.861 23.449 -16.959 1.00 25.00 H new ATOM 0 HD22 ASN A 129 63.104 22.169 -15.765 1.00 25.00 H new ATOM 793 N PHE A 130 65.843 23.342 -11.298 1.00 25.00 N ATOM 794 CA PHE A 130 66.213 22.833 -9.976 1.00 25.00 C ATOM 795 C PHE A 130 66.529 23.944 -8.986 1.00 25.00 C ATOM 796 O PHE A 130 66.073 23.909 -7.845 1.00 25.00 O ATOM 797 CB PHE A 130 67.432 21.924 -10.084 1.00 25.00 C ATOM 798 CG PHE A 130 67.800 21.268 -8.787 1.00 25.00 C ATOM 799 CD1 PHE A 130 67.126 20.112 -8.369 1.00 25.00 C ATOM 800 CD2 PHE A 130 68.815 21.801 -7.971 1.00 25.00 C ATOM 801 CE1 PHE A 130 67.465 19.470 -7.155 1.00 25.00 C ATOM 802 CE2 PHE A 130 69.161 21.174 -6.747 1.00 25.00 C ATOM 803 CZ PHE A 130 68.487 20.001 -6.344 1.00 25.00 C ATOM 0 H PHE A 130 66.495 23.091 -12.041 1.00 25.00 H new ATOM 0 HA PHE A 130 65.349 22.281 -9.606 1.00 25.00 H new ATOM 0 HB2 PHE A 130 67.237 21.154 -10.830 1.00 25.00 H new ATOM 0 HB3 PHE A 130 68.281 22.507 -10.442 1.00 25.00 H new ATOM 0 HD1 PHE A 130 66.336 19.705 -8.983 1.00 25.00 H new ATOM 0 HD2 PHE A 130 69.335 22.696 -8.280 1.00 25.00 H new ATOM 0 HE1 PHE A 130 66.942 18.575 -6.851 1.00 25.00 H new ATOM 0 HE2 PHE A 130 69.938 21.593 -6.125 1.00 25.00 H new ATOM 0 HZ PHE A 130 68.754 19.513 -5.418 1.00 25.00 H new ATOM 813 N ARG A 131 67.299 24.940 -9.410 1.00 25.00 N ATOM 814 CA ARG A 131 67.644 26.044 -8.510 1.00 25.00 C ATOM 815 C ARG A 131 66.386 26.820 -8.142 1.00 25.00 C ATOM 816 O ARG A 131 66.314 27.387 -7.069 1.00 25.00 O ATOM 817 CB ARG A 131 68.749 26.957 -9.096 1.00 25.00 C ATOM 818 CG ARG A 131 68.395 27.715 -10.381 1.00 25.00 C ATOM 819 CD ARG A 131 67.691 29.052 -10.111 1.00 25.00 C ATOM 820 NE ARG A 131 66.777 29.412 -11.209 1.00 25.00 N ATOM 821 CZ ARG A 131 65.703 30.189 -11.093 1.00 25.00 C ATOM 822 NH1 ARG A 131 65.340 30.722 -9.952 1.00 25.00 N1+ ATOM 823 NH2 ARG A 131 64.972 30.418 -12.149 1.00 25.00 N ATOM 0 H ARG A 131 67.691 25.010 -10.349 1.00 25.00 H new ATOM 0 HA ARG A 131 68.067 25.624 -7.597 1.00 25.00 H new ATOM 0 HB2 ARG A 131 69.029 27.686 -8.335 1.00 25.00 H new ATOM 0 HB3 ARG A 131 69.630 26.345 -9.291 1.00 25.00 H new ATOM 0 HG2 ARG A 131 69.306 27.898 -10.951 1.00 25.00 H new ATOM 0 HG3 ARG A 131 67.752 27.090 -11.000 1.00 25.00 H new ATOM 0 HD2 ARG A 131 67.132 28.988 -9.177 1.00 25.00 H new ATOM 0 HD3 ARG A 131 68.436 29.838 -9.984 1.00 25.00 H new ATOM 0 HE ARG A 131 66.984 29.035 -12.134 1.00 25.00 H new ATOM 0 HH11 ARG A 131 65.888 30.547 -9.110 1.00 25.00 H new ATOM 0 HH12 ARG A 131 64.509 31.312 -9.906 1.00 25.00 H new ATOM 0 HH21 ARG A 131 65.227 30.004 -13.046 1.00 25.00 H new ATOM 0 HH22 ARG A 131 64.145 31.011 -12.078 1.00 25.00 H new ATOM 837 N ALA A 132 65.388 26.819 -9.018 1.00 25.00 N ATOM 838 CA ALA A 132 64.112 27.460 -8.717 1.00 25.00 C ATOM 839 C ALA A 132 63.328 26.604 -7.718 1.00 25.00 C ATOM 840 O ALA A 132 62.691 27.110 -6.806 1.00 25.00 O ATOM 841 CB ALA A 132 63.298 27.651 -10.007 1.00 25.00 C ATOM 0 H ALA A 132 65.436 26.384 -9.939 1.00 25.00 H new ATOM 0 HA ALA A 132 64.299 28.439 -8.277 1.00 25.00 H new ATOM 0 HB1 ALA A 132 62.348 28.130 -9.770 1.00 25.00 H new ATOM 0 HB2 ALA A 132 63.858 28.278 -10.701 1.00 25.00 H new ATOM 0 HB3 ALA A 132 63.110 26.680 -10.466 1.00 25.00 H new ATOM 847 N LEU A 133 63.377 25.294 -7.907 1.00 25.00 N ATOM 848 CA LEU A 133 62.628 24.372 -7.064 1.00 25.00 C ATOM 849 C LEU A 133 63.126 24.417 -5.620 1.00 25.00 C ATOM 850 O LEU A 133 62.339 24.409 -4.685 1.00 25.00 O ATOM 851 CB LEU A 133 62.741 22.953 -7.638 1.00 25.00 C ATOM 852 CG LEU A 133 61.724 21.920 -7.133 1.00 25.00 C ATOM 853 CD1 LEU A 133 60.297 22.291 -7.535 1.00 25.00 C ATOM 854 CD2 LEU A 133 62.063 20.556 -7.721 1.00 25.00 C ATOM 0 H LEU A 133 63.928 24.844 -8.638 1.00 25.00 H new ATOM 0 HA LEU A 133 61.580 24.673 -7.055 1.00 25.00 H new ATOM 0 HB2 LEU A 133 62.651 23.017 -8.722 1.00 25.00 H new ATOM 0 HB3 LEU A 133 63.742 22.578 -7.423 1.00 25.00 H new ATOM 0 HG LEU A 133 61.778 21.897 -6.045 1.00 25.00 H new ATOM 0 HD11 LEU A 133 59.606 21.537 -7.160 1.00 25.00 H new ATOM 0 HD12 LEU A 133 60.040 23.262 -7.111 1.00 25.00 H new ATOM 0 HD13 LEU A 133 60.226 22.340 -8.622 1.00 25.00 H new ATOM 0 HD21 LEU A 133 61.344 19.818 -7.366 1.00 25.00 H new ATOM 0 HD22 LEU A 133 62.022 20.608 -8.809 1.00 25.00 H new ATOM 0 HD23 LEU A 133 63.066 20.265 -7.409 1.00 25.00 H new ATOM 866 N CYS A 134 64.435 24.517 -5.429 1.00 25.00 N ATOM 867 CA CYS A 134 64.975 24.622 -4.075 1.00 25.00 C ATOM 868 C CYS A 134 64.714 26.008 -3.479 1.00 25.00 C ATOM 869 O CYS A 134 64.671 26.161 -2.264 1.00 25.00 O ATOM 870 CB CYS A 134 66.470 24.286 -4.039 1.00 25.00 C ATOM 871 SG CYS A 134 67.555 25.470 -4.867 1.00 25.00 S ATOM 0 H CYS A 134 65.131 24.528 -6.174 1.00 25.00 H new ATOM 0 HA CYS A 134 64.454 23.888 -3.461 1.00 25.00 H new ATOM 0 HB2 CYS A 134 66.781 24.202 -2.998 1.00 25.00 H new ATOM 0 HB3 CYS A 134 66.615 23.307 -4.495 1.00 25.00 H new ATOM 0 HG CYS A 134 66.856 26.202 -5.684 1.00 25.00 H new ATOM 877 N GLU A 135 64.556 27.015 -4.329 1.00 25.00 N ATOM 878 CA GLU A 135 64.273 28.377 -3.864 1.00 25.00 C ATOM 879 C GLU A 135 62.865 28.414 -3.259 1.00 25.00 C ATOM 880 O GLU A 135 62.637 29.059 -2.232 1.00 25.00 O ATOM 881 CB GLU A 135 64.473 29.384 -5.026 1.00 25.00 C ATOM 882 CG GLU A 135 63.253 30.160 -5.552 1.00 25.00 C ATOM 883 CD GLU A 135 63.589 30.926 -6.844 1.00 25.00 C ATOM 884 OE1 GLU A 135 64.474 31.812 -6.805 1.00 25.00 O1- ATOM 885 OE2 GLU A 135 63.018 30.610 -7.911 1.00 25.00 O1- ATOM 0 H GLU A 135 64.618 26.920 -5.343 1.00 25.00 H new ATOM 0 HA GLU A 135 64.969 28.675 -3.080 1.00 25.00 H new ATOM 0 HB2 GLU A 135 65.216 30.115 -4.706 1.00 25.00 H new ATOM 0 HB3 GLU A 135 64.904 28.838 -5.865 1.00 25.00 H new ATOM 0 HG2 GLU A 135 62.433 29.467 -5.741 1.00 25.00 H new ATOM 0 HG3 GLU A 135 62.910 30.860 -4.791 1.00 25.00 H new ATOM 892 N LEU A 136 61.957 27.641 -3.843 1.00 25.00 N ATOM 893 CA LEU A 136 60.588 27.536 -3.343 1.00 25.00 C ATOM 894 C LEU A 136 60.548 26.909 -1.950 1.00 25.00 C ATOM 895 O LEU A 136 59.893 27.426 -1.053 1.00 25.00 O ATOM 896 CB LEU A 136 59.751 26.686 -4.310 1.00 25.00 C ATOM 897 CG LEU A 136 58.263 26.505 -3.965 1.00 25.00 C ATOM 898 CD1 LEU A 136 57.498 27.831 -4.046 1.00 25.00 C ATOM 899 CD2 LEU A 136 57.646 25.490 -4.926 1.00 25.00 C ATOM 0 H LEU A 136 62.145 27.073 -4.669 1.00 25.00 H new ATOM 0 HA LEU A 136 60.175 28.543 -3.275 1.00 25.00 H new ATOM 0 HB2 LEU A 136 59.818 27.134 -5.301 1.00 25.00 H new ATOM 0 HB3 LEU A 136 60.207 25.698 -4.376 1.00 25.00 H new ATOM 0 HG LEU A 136 58.190 26.145 -2.939 1.00 25.00 H new ATOM 0 HD11 LEU A 136 56.451 27.663 -3.796 1.00 25.00 H new ATOM 0 HD12 LEU A 136 57.929 28.543 -3.343 1.00 25.00 H new ATOM 0 HD13 LEU A 136 57.570 28.231 -5.057 1.00 25.00 H new ATOM 0 HD21 LEU A 136 56.591 25.357 -4.687 1.00 25.00 H new ATOM 0 HD22 LEU A 136 57.743 25.852 -5.949 1.00 25.00 H new ATOM 0 HD23 LEU A 136 58.163 24.535 -4.828 1.00 25.00 H new ATOM 911 N GLU A 137 61.259 25.804 -1.777 1.00 25.00 N ATOM 912 CA GLU A 137 61.274 25.092 -0.493 1.00 25.00 C ATOM 913 C GLU A 137 61.989 25.894 0.593 1.00 25.00 C ATOM 914 O GLU A 137 61.595 25.882 1.755 1.00 25.00 O ATOM 915 CB GLU A 137 61.994 23.752 -0.648 1.00 25.00 C ATOM 916 CG GLU A 137 61.320 22.768 -1.592 1.00 25.00 C ATOM 917 CD GLU A 137 59.921 22.376 -1.145 1.00 25.00 C ATOM 918 OE1 GLU A 137 59.768 21.898 0.000 1.00 25.00 O1- ATOM 919 OE2 GLU A 137 58.976 22.516 -1.954 1.00 25.00 O1- ATOM 0 H GLU A 137 61.834 25.377 -2.503 1.00 25.00 H new ATOM 0 HA GLU A 137 60.236 24.943 -0.197 1.00 25.00 H new ATOM 0 HB2 GLU A 137 63.007 23.939 -1.005 1.00 25.00 H new ATOM 0 HB3 GLU A 137 62.083 23.288 0.334 1.00 25.00 H new ATOM 0 HG2 GLU A 137 61.267 23.207 -2.588 1.00 25.00 H new ATOM 0 HG3 GLU A 137 61.934 21.871 -1.672 1.00 25.00 H new ATOM 926 N SER A 138 63.062 26.574 0.216 1.00 25.00 N ATOM 927 CA SER A 138 63.852 27.342 1.180 1.00 25.00 C ATOM 928 C SER A 138 63.183 28.681 1.507 1.00 25.00 C ATOM 929 O SER A 138 63.406 29.262 2.578 1.00 25.00 O ATOM 930 CB SER A 138 65.256 27.574 0.629 1.00 25.00 C ATOM 931 OG SER A 138 66.101 28.134 1.618 1.00 25.00 O ATOM 0 H SER A 138 63.408 26.613 -0.743 1.00 25.00 H new ATOM 0 HA SER A 138 63.916 26.767 2.104 1.00 25.00 H new ATOM 0 HB2 SER A 138 65.674 26.630 0.280 1.00 25.00 H new ATOM 0 HB3 SER A 138 65.207 28.240 -0.233 1.00 25.00 H new ATOM 0 HG SER A 138 67.032 27.894 1.427 1.00 25.00 H new ATOM 937 N GLY A 139 62.356 29.168 0.591 1.00 25.00 N ATOM 938 CA GLY A 139 61.618 30.397 0.824 1.00 25.00 C ATOM 939 C GLY A 139 62.460 31.635 0.603 1.00 25.00 C ATOM 940 O GLY A 139 62.184 32.691 1.176 1.00 25.00 O ATOM 0 H GLY A 139 62.182 28.732 -0.314 1.00 25.00 H new ATOM 0 HA2 GLY A 139 60.753 30.428 0.161 1.00 25.00 H new ATOM 0 HA3 GLY A 139 61.237 30.399 1.845 1.00 25.00 H new ATOM 944 N ILE A 140 63.499 31.510 -0.213 1.00 25.00 N ATOM 945 CA ILE A 140 64.386 32.626 -0.522 1.00 25.00 C ATOM 946 C ILE A 140 64.649 32.673 -2.021 1.00 25.00 C ATOM 947 O ILE A 140 64.680 31.633 -2.677 1.00 25.00 O ATOM 948 CB ILE A 140 65.753 32.503 0.219 1.00 25.00 C ATOM 949 CG1 ILE A 140 66.475 31.181 -0.129 1.00 25.00 C ATOM 950 CG2 ILE A 140 65.537 32.608 1.733 1.00 25.00 C ATOM 951 CD1 ILE A 140 67.922 31.113 0.341 1.00 25.00 C ATOM 0 H ILE A 140 63.750 30.637 -0.677 1.00 25.00 H new ATOM 0 HA ILE A 140 63.891 33.538 -0.188 1.00 25.00 H new ATOM 0 HB ILE A 140 66.390 33.322 -0.114 1.00 25.00 H new ATOM 0 HG12 ILE A 140 65.923 30.352 0.313 1.00 25.00 H new ATOM 0 HG13 ILE A 140 66.450 31.041 -1.210 1.00 25.00 H new ATOM 0 HG21 ILE A 140 66.496 32.521 2.244 1.00 25.00 H new ATOM 0 HG22 ILE A 140 65.085 33.571 1.970 1.00 25.00 H new ATOM 0 HG23 ILE A 140 64.876 31.806 2.063 1.00 25.00 H new ATOM 0 HD11 ILE A 140 68.352 30.153 0.056 1.00 25.00 H new ATOM 0 HD12 ILE A 140 68.493 31.918 -0.121 1.00 25.00 H new ATOM 0 HD13 ILE A 140 67.958 31.219 1.425 1.00 25.00 H new ATOM 963 N PRO A 141 64.850 33.875 -2.588 1.00 25.00 N ATOM 964 CA PRO A 141 65.197 33.852 -4.010 1.00 25.00 C ATOM 965 C PRO A 141 66.570 33.226 -4.238 1.00 25.00 C ATOM 966 O PRO A 141 67.537 33.556 -3.546 1.00 25.00 O ATOM 967 CB PRO A 141 65.228 35.342 -4.386 1.00 25.00 C ATOM 968 CG PRO A 141 64.458 36.028 -3.299 1.00 25.00 C ATOM 969 CD PRO A 141 64.812 35.254 -2.073 1.00 25.00 C ATOM 0 HA PRO A 141 64.497 33.263 -4.602 1.00 25.00 H new ATOM 0 HB2 PRO A 141 66.251 35.715 -4.442 1.00 25.00 H new ATOM 0 HB3 PRO A 141 64.773 35.513 -5.362 1.00 25.00 H new ATOM 0 HG2 PRO A 141 64.742 37.076 -3.207 1.00 25.00 H new ATOM 0 HG3 PRO A 141 63.385 36.004 -3.492 1.00 25.00 H new ATOM 0 HD2 PRO A 141 65.772 35.562 -1.658 1.00 25.00 H new ATOM 0 HD3 PRO A 141 64.070 35.376 -1.284 1.00 25.00 H new ATOM 977 N ALA A 142 66.675 32.361 -5.234 1.00 25.00 N ATOM 978 CA ALA A 142 67.953 31.760 -5.602 1.00 25.00 C ATOM 979 C ALA A 142 68.899 32.851 -6.103 1.00 25.00 C ATOM 980 O ALA A 142 70.105 32.713 -6.035 1.00 25.00 O ATOM 981 CB ALA A 142 67.743 30.693 -6.681 1.00 25.00 C ATOM 0 H ALA A 142 65.888 32.056 -5.807 1.00 25.00 H new ATOM 0 HA ALA A 142 68.394 31.280 -4.729 1.00 25.00 H new ATOM 0 HB1 ALA A 142 68.703 30.251 -6.948 1.00 25.00 H new ATOM 0 HB2 ALA A 142 67.080 29.916 -6.300 1.00 25.00 H new ATOM 0 HB3 ALA A 142 67.297 31.151 -7.564 1.00 25.00 H new ATOM 987 N ALA A 143 68.324 33.942 -6.594 1.00 25.00 N ATOM 988 CA ALA A 143 69.094 35.077 -7.100 1.00 25.00 C ATOM 989 C ALA A 143 69.869 35.804 -5.986 1.00 25.00 C ATOM 990 O ALA A 143 70.826 36.517 -6.258 1.00 25.00 O ATOM 991 CB ALA A 143 68.144 36.058 -7.803 1.00 25.00 C ATOM 0 H ALA A 143 67.313 34.067 -6.654 1.00 25.00 H new ATOM 0 HA ALA A 143 69.832 34.692 -7.804 1.00 25.00 H new ATOM 0 HB1 ALA A 143 68.713 36.907 -8.182 1.00 25.00 H new ATOM 0 HB2 ALA A 143 67.648 35.553 -8.632 1.00 25.00 H new ATOM 0 HB3 ALA A 143 67.395 36.411 -7.094 1.00 25.00 H new ATOM 997 N GLU A 144 69.444 35.623 -4.744 1.00 25.00 N ATOM 998 CA GLU A 144 70.085 36.267 -3.592 1.00 25.00 C ATOM 999 C GLU A 144 70.999 35.270 -2.882 1.00 25.00 C ATOM 1000 O GLU A 144 71.422 35.484 -1.742 1.00 25.00 O ATOM 1001 CB GLU A 144 69.017 36.752 -2.609 1.00 25.00 C ATOM 1002 CG GLU A 144 68.134 37.862 -3.159 1.00 25.00 C ATOM 1003 CD GLU A 144 67.092 38.320 -2.148 1.00 25.00 C ATOM 1004 OE1 GLU A 144 67.053 37.761 -1.026 1.00 25.00 O1- ATOM 1005 OE2 GLU A 144 66.301 39.225 -2.481 1.00 25.00 O1- ATOM 0 H GLU A 144 68.650 35.030 -4.500 1.00 25.00 H new ATOM 0 HA GLU A 144 70.672 37.115 -3.944 1.00 25.00 H new ATOM 0 HB2 GLU A 144 68.389 35.908 -2.324 1.00 25.00 H new ATOM 0 HB3 GLU A 144 69.506 37.106 -1.701 1.00 25.00 H new ATOM 0 HG2 GLU A 144 68.756 38.710 -3.447 1.00 25.00 H new ATOM 0 HG3 GLU A 144 67.633 37.512 -4.062 1.00 25.00 H new ATOM 1012 N SER A 145 71.260 34.151 -3.538 1.00 25.00 N ATOM 1013 CA SER A 145 71.997 33.056 -2.930 1.00 25.00 C ATOM 1014 C SER A 145 72.962 32.456 -3.946 1.00 25.00 C ATOM 1015 O SER A 145 72.872 32.725 -5.133 1.00 25.00 O ATOM 1016 CB SER A 145 70.987 32.004 -2.462 1.00 25.00 C ATOM 1017 OG SER A 145 71.579 31.043 -1.607 1.00 25.00 O ATOM 0 H SER A 145 70.969 33.977 -4.500 1.00 25.00 H new ATOM 0 HA SER A 145 72.579 33.413 -2.080 1.00 25.00 H new ATOM 0 HB2 SER A 145 70.166 32.496 -1.940 1.00 25.00 H new ATOM 0 HB3 SER A 145 70.558 31.502 -3.329 1.00 25.00 H new ATOM 0 HG SER A 145 70.961 30.829 -0.877 1.00 25.00 H new ATOM 1023 N GLN A 146 73.877 31.621 -3.480 1.00 25.00 N ATOM 1024 CA GLN A 146 74.793 30.909 -4.369 1.00 25.00 C ATOM 1025 C GLN A 146 74.593 29.428 -4.140 1.00 25.00 C ATOM 1026 O GLN A 146 74.475 28.988 -3.004 1.00 25.00 O ATOM 1027 CB GLN A 146 76.245 31.296 -4.085 1.00 25.00 C ATOM 1028 CG GLN A 146 76.678 32.604 -4.754 1.00 25.00 C ATOM 1029 CD GLN A 146 76.669 32.526 -6.278 1.00 25.00 C ATOM 1030 OE1 GLN A 146 76.186 33.414 -6.945 1.00 25.00 O ATOM 1031 NE2 GLN A 146 77.227 31.471 -6.823 1.00 25.00 N ATOM 0 H GLN A 146 74.008 31.417 -2.489 1.00 25.00 H new ATOM 0 HA GLN A 146 74.584 31.172 -5.406 1.00 25.00 H new ATOM 0 HB2 GLN A 146 76.383 31.387 -3.008 1.00 25.00 H new ATOM 0 HB3 GLN A 146 76.898 30.492 -4.423 1.00 25.00 H new ATOM 0 HG2 GLN A 146 76.014 33.407 -4.433 1.00 25.00 H new ATOM 0 HG3 GLN A 146 77.681 32.864 -4.415 1.00 25.00 H new ATOM 0 HE21 GLN A 146 77.624 30.741 -6.231 1.00 25.00 H new ATOM 0 HE22 GLN A 146 77.263 31.381 -7.838 1.00 25.00 H new ATOM 1040 N ILE A 147 74.541 28.665 -5.220 1.00 25.00 N ATOM 1041 CA ILE A 147 74.287 27.230 -5.141 1.00 25.00 C ATOM 1042 C ILE A 147 75.525 26.468 -5.645 1.00 25.00 C ATOM 1043 O ILE A 147 76.139 26.833 -6.661 1.00 25.00 O ATOM 1044 CB ILE A 147 72.963 26.880 -5.912 1.00 25.00 C ATOM 1045 CG1 ILE A 147 72.505 25.454 -5.561 1.00 25.00 C ATOM 1046 CG2 ILE A 147 73.112 27.095 -7.439 1.00 25.00 C ATOM 1047 CD1 ILE A 147 71.215 24.999 -6.278 1.00 25.00 C ATOM 0 H ILE A 147 74.672 29.016 -6.169 1.00 25.00 H new ATOM 0 HA ILE A 147 74.126 26.916 -4.110 1.00 25.00 H new ATOM 0 HB ILE A 147 72.183 27.568 -5.587 1.00 25.00 H new ATOM 0 HG12 ILE A 147 73.307 24.758 -5.807 1.00 25.00 H new ATOM 0 HG13 ILE A 147 72.348 25.391 -4.484 1.00 25.00 H new ATOM 0 HG21 ILE A 147 72.175 26.842 -7.935 1.00 25.00 H new ATOM 0 HG22 ILE A 147 73.357 28.138 -7.637 1.00 25.00 H new ATOM 0 HG23 ILE A 147 73.909 26.456 -7.820 1.00 25.00 H new ATOM 0 HD11 ILE A 147 70.967 23.983 -5.971 1.00 25.00 H new ATOM 0 HD12 ILE A 147 70.396 25.668 -6.013 1.00 25.00 H new ATOM 0 HD13 ILE A 147 71.370 25.025 -7.357 1.00 25.00 H new ATOM 1059 N VAL A 148 75.942 25.470 -4.877 1.00 25.00 N ATOM 1060 CA VAL A 148 77.148 24.695 -5.169 1.00 25.00 C ATOM 1061 C VAL A 148 76.862 23.201 -5.008 1.00 25.00 C ATOM 1062 O VAL A 148 75.986 22.805 -4.246 1.00 25.00 O ATOM 1063 CB VAL A 148 78.362 25.101 -4.235 1.00 25.00 C ATOM 1064 CG1 VAL A 148 78.687 26.597 -4.363 1.00 25.00 C ATOM 1065 CG2 VAL A 148 78.094 24.776 -2.775 1.00 25.00 C ATOM 0 H VAL A 148 75.455 25.172 -4.032 1.00 25.00 H new ATOM 0 HA VAL A 148 77.430 24.915 -6.199 1.00 25.00 H new ATOM 0 HB VAL A 148 79.216 24.513 -4.571 1.00 25.00 H new ATOM 0 HG11 VAL A 148 79.524 26.845 -3.710 1.00 25.00 H new ATOM 0 HG12 VAL A 148 78.952 26.825 -5.395 1.00 25.00 H new ATOM 0 HG13 VAL A 148 77.816 27.185 -4.074 1.00 25.00 H new ATOM 0 HG21 VAL A 148 78.953 25.072 -2.173 1.00 25.00 H new ATOM 0 HG22 VAL A 148 77.211 25.318 -2.438 1.00 25.00 H new ATOM 0 HG23 VAL A 148 77.926 23.705 -2.666 1.00 25.00 H new ATOM 1075 N TYR A 149 77.604 22.378 -5.725 1.00 25.00 N ATOM 1076 CA TYR A 149 77.487 20.922 -5.639 1.00 25.00 C ATOM 1077 C TYR A 149 78.914 20.418 -5.700 1.00 25.00 C ATOM 1078 O TYR A 149 79.715 20.957 -6.459 1.00 25.00 O ATOM 1079 CB TYR A 149 76.651 20.391 -6.803 1.00 25.00 C ATOM 1080 CG TYR A 149 77.004 18.989 -7.242 1.00 25.00 C ATOM 1081 CD1 TYR A 149 76.876 17.888 -6.366 1.00 25.00 C ATOM 1082 CD2 TYR A 149 77.461 18.752 -8.553 1.00 25.00 C ATOM 1083 CE1 TYR A 149 77.198 16.573 -6.805 1.00 25.00 C ATOM 1084 CE2 TYR A 149 77.773 17.444 -8.989 1.00 25.00 C ATOM 1085 CZ TYR A 149 77.633 16.365 -8.116 1.00 25.00 C ATOM 1086 OH TYR A 149 77.921 15.104 -8.565 1.00 25.00 O ATOM 0 H TYR A 149 78.310 22.696 -6.389 1.00 25.00 H new ATOM 0 HA TYR A 149 76.985 20.590 -4.730 1.00 25.00 H new ATOM 0 HB2 TYR A 149 75.599 20.415 -6.518 1.00 25.00 H new ATOM 0 HB3 TYR A 149 76.766 21.064 -7.653 1.00 25.00 H new ATOM 0 HD1 TYR A 149 76.531 18.046 -5.355 1.00 25.00 H new ATOM 0 HD2 TYR A 149 77.575 19.582 -9.235 1.00 25.00 H new ATOM 0 HE1 TYR A 149 77.106 15.738 -6.126 1.00 25.00 H new ATOM 0 HE2 TYR A 149 78.120 17.280 -9.999 1.00 25.00 H new ATOM 0 HH TYR A 149 77.851 15.081 -9.542 1.00 25.00 H new ATOM 1096 N ALA A 150 79.251 19.471 -4.827 1.00 25.00 N ATOM 1097 CA ALA A 150 80.630 18.989 -4.662 1.00 25.00 C ATOM 1098 C ALA A 150 81.584 20.181 -4.437 1.00 25.00 C ATOM 1099 O ALA A 150 82.667 20.240 -5.009 1.00 25.00 O ATOM 1100 CB ALA A 150 81.058 18.142 -5.883 1.00 25.00 C ATOM 0 H ALA A 150 78.579 19.013 -4.211 1.00 25.00 H new ATOM 0 HA ALA A 150 80.680 18.346 -3.783 1.00 25.00 H new ATOM 0 HB1 ALA A 150 82.081 17.794 -5.743 1.00 25.00 H new ATOM 0 HB2 ALA A 150 80.393 17.284 -5.982 1.00 25.00 H new ATOM 0 HB3 ALA A 150 81.002 18.750 -6.786 1.00 25.00 H new ATOM 1106 N GLU A 151 81.109 21.139 -3.640 1.00 25.00 N ATOM 1107 CA GLU A 151 81.824 22.391 -3.303 1.00 25.00 C ATOM 1108 C GLU A 151 82.212 23.266 -4.510 1.00 25.00 C ATOM 1109 O GLU A 151 82.991 24.210 -4.384 1.00 25.00 O ATOM 1110 CB GLU A 151 83.064 22.095 -2.443 1.00 25.00 C ATOM 1111 CG GLU A 151 82.732 21.394 -1.133 1.00 25.00 C ATOM 1112 CD GLU A 151 83.923 21.351 -0.189 1.00 25.00 C ATOM 1113 OE1 GLU A 151 84.942 20.713 -0.529 1.00 25.00 O ATOM 1114 OE2 GLU A 151 83.841 21.975 0.892 1.00 25.00 O1- ATOM 0 H GLU A 151 80.194 21.073 -3.195 1.00 25.00 H new ATOM 0 HA GLU A 151 81.103 22.980 -2.737 1.00 25.00 H new ATOM 0 HB2 GLU A 151 83.755 21.475 -3.014 1.00 25.00 H new ATOM 0 HB3 GLU A 151 83.580 23.031 -2.226 1.00 25.00 H new ATOM 0 HG2 GLU A 151 81.903 21.909 -0.647 1.00 25.00 H new ATOM 0 HG3 GLU A 151 82.398 20.377 -1.341 1.00 25.00 H new ATOM 1121 N ARG A 152 81.630 22.989 -5.669 1.00 25.00 N ATOM 1122 CA ARG A 152 81.909 23.750 -6.889 1.00 25.00 C ATOM 1123 C ARG A 152 80.660 24.510 -7.296 1.00 25.00 C ATOM 1124 O ARG A 152 79.555 23.995 -7.150 1.00 25.00 O ATOM 1125 CB ARG A 152 82.296 22.794 -8.014 1.00 25.00 C ATOM 1126 CG ARG A 152 83.629 22.088 -7.800 1.00 25.00 C ATOM 1127 CD ARG A 152 83.750 20.904 -8.742 1.00 25.00 C ATOM 1128 NE ARG A 152 83.692 21.329 -10.152 1.00 25.00 N ATOM 1129 CZ ARG A 152 83.558 20.514 -11.192 1.00 25.00 C ATOM 1130 NH1 ARG A 152 83.472 19.214 -11.056 1.00 25.00 N1+ ATOM 1131 NH2 ARG A 152 83.508 21.022 -12.392 1.00 25.00 N ATOM 0 H ARG A 152 80.954 22.236 -5.795 1.00 25.00 H new ATOM 0 HA ARG A 152 82.728 24.445 -6.703 1.00 25.00 H new ATOM 0 HB2 ARG A 152 81.513 22.043 -8.124 1.00 25.00 H new ATOM 0 HB3 ARG A 152 82.338 23.350 -8.950 1.00 25.00 H new ATOM 0 HG2 ARG A 152 84.450 22.784 -7.972 1.00 25.00 H new ATOM 0 HG3 ARG A 152 83.709 21.750 -6.767 1.00 25.00 H new ATOM 0 HD2 ARG A 152 84.690 20.384 -8.556 1.00 25.00 H new ATOM 0 HD3 ARG A 152 82.948 20.194 -8.541 1.00 25.00 H new ATOM 0 HE ARG A 152 83.760 22.328 -10.344 1.00 25.00 H new ATOM 0 HH11 ARG A 152 83.507 18.795 -10.127 1.00 25.00 H new ATOM 0 HH12 ARG A 152 83.370 18.621 -11.879 1.00 25.00 H new ATOM 0 HH21 ARG A 152 83.572 22.032 -12.521 1.00 25.00 H new ATOM 0 HH22 ARG A 152 83.405 20.410 -13.201 1.00 25.00 H new ATOM 1145 N PRO A 153 80.810 25.738 -7.821 1.00 25.00 N ATOM 1146 CA PRO A 153 79.578 26.435 -8.196 1.00 25.00 C ATOM 1147 C PRO A 153 78.879 25.805 -9.387 1.00 25.00 C ATOM 1148 O PRO A 153 79.510 25.281 -10.307 1.00 25.00 O ATOM 1149 CB PRO A 153 80.066 27.849 -8.518 1.00 25.00 C ATOM 1150 CG PRO A 153 81.457 27.651 -8.990 1.00 25.00 C ATOM 1151 CD PRO A 153 81.999 26.567 -8.095 1.00 25.00 C ATOM 0 HA PRO A 153 78.829 26.400 -7.405 1.00 25.00 H new ATOM 0 HB2 PRO A 153 79.448 28.320 -9.283 1.00 25.00 H new ATOM 0 HB3 PRO A 153 80.031 28.493 -7.639 1.00 25.00 H new ATOM 0 HG2 PRO A 153 81.483 27.353 -10.038 1.00 25.00 H new ATOM 0 HG3 PRO A 153 82.041 28.567 -8.905 1.00 25.00 H new ATOM 0 HD2 PRO A 153 82.786 25.994 -8.586 1.00 25.00 H new ATOM 0 HD3 PRO A 153 82.426 26.976 -7.179 1.00 25.00 H new ATOM 1159 N LEU A 154 77.562 25.867 -9.352 1.00 25.00 N ATOM 1160 CA LEU A 154 76.720 25.353 -10.420 1.00 25.00 C ATOM 1161 C LEU A 154 76.405 26.532 -11.334 1.00 0.00 C ATOM 1162 O LEU A 154 75.753 27.481 -10.910 1.00 25.00 O ATOM 1163 CB LEU A 154 75.443 24.792 -9.801 1.00 25.00 C ATOM 1164 CG LEU A 154 75.561 23.413 -9.134 1.00 25.00 C ATOM 1165 CD1 LEU A 154 74.457 23.247 -8.106 1.00 25.00 C ATOM 1166 CD2 LEU A 154 75.471 22.291 -10.159 1.00 25.00 C ATOM 0 H LEU A 154 77.041 26.278 -8.577 1.00 25.00 H new ATOM 0 HA LEU A 154 77.206 24.558 -10.986 1.00 25.00 H new ATOM 0 HB2 LEU A 154 75.082 25.502 -9.057 1.00 25.00 H new ATOM 0 HB3 LEU A 154 74.683 24.732 -10.580 1.00 25.00 H new ATOM 0 HG LEU A 154 76.535 23.355 -8.649 1.00 25.00 H new ATOM 0 HD11 LEU A 154 74.543 22.268 -7.634 1.00 25.00 H new ATOM 0 HD12 LEU A 154 74.547 24.024 -7.347 1.00 25.00 H new ATOM 0 HD13 LEU A 154 73.487 23.329 -8.597 1.00 25.00 H new ATOM 0 HD21 LEU A 154 75.558 21.329 -9.654 1.00 25.00 H new ATOM 0 HD22 LEU A 154 74.512 22.345 -10.674 1.00 25.00 H new ATOM 0 HD23 LEU A 154 76.279 22.395 -10.884 1.00 25.00 H new ATOM 1178 N THR A 155 76.940 26.517 -12.548 1.00 25.00 N ATOM 1179 CA THR A 155 76.828 27.672 -13.452 1.00 25.00 C ATOM 1180 C THR A 155 76.177 27.379 -14.800 1.00 25.00 C ATOM 1181 O THR A 155 75.527 28.251 -15.378 1.00 25.00 O ATOM 1182 CB THR A 155 78.230 28.254 -13.747 1.00 25.00 C ATOM 1183 OG1 THR A 155 79.055 27.235 -14.322 1.00 25.00 O ATOM 1184 CG2 THR A 155 78.905 28.732 -12.465 1.00 25.00 C ATOM 0 H THR A 155 77.455 25.726 -12.935 1.00 25.00 H new ATOM 0 HA THR A 155 76.183 28.370 -12.918 1.00 25.00 H new ATOM 0 HB THR A 155 78.108 29.095 -14.430 1.00 25.00 H new ATOM 0 HG1 THR A 155 79.944 27.602 -14.512 1.00 25.00 H new ATOM 0 HG21 THR A 155 79.889 29.137 -12.701 1.00 25.00 H new ATOM 0 HG22 THR A 155 78.296 29.507 -12.000 1.00 25.00 H new ATOM 0 HG23 THR A 155 79.013 27.894 -11.776 1.00 25.00 H new ATOM 1192 N ASP A 156 76.352 26.172 -15.319 1.00 25.00 N ATOM 1193 CA ASP A 156 75.819 25.832 -16.639 1.00 25.00 C ATOM 1194 C ASP A 156 74.368 25.389 -16.476 1.00 25.00 C ATOM 1195 O ASP A 156 74.059 24.200 -16.428 1.00 25.00 O ATOM 1196 CB ASP A 156 76.657 24.740 -17.306 1.00 25.00 C ATOM 1197 CG ASP A 156 78.116 25.125 -17.438 1.00 25.00 C ATOM 1198 OD1 ASP A 156 78.405 26.251 -17.879 1.00 25.00 O1- ATOM 1199 OD2 ASP A 156 78.979 24.292 -17.085 1.00 25.00 O1- ATOM 0 H ASP A 156 76.854 25.415 -14.855 1.00 25.00 H new ATOM 0 HA ASP A 156 75.863 26.707 -17.288 1.00 25.00 H new ATOM 0 HB2 ASP A 156 76.579 23.821 -16.725 1.00 25.00 H new ATOM 0 HB3 ASP A 156 76.250 24.528 -18.295 1.00 25.00 H new ATOM 1204 N ASN A 157 73.493 26.371 -16.312 1.00 25.00 N ATOM 1205 CA ASN A 157 72.090 26.139 -15.961 1.00 25.00 C ATOM 1206 C ASN A 157 71.285 25.327 -16.974 1.00 25.00 C ATOM 1207 O ASN A 157 70.278 24.721 -16.623 1.00 25.00 O ATOM 1208 CB ASN A 157 71.395 27.482 -15.730 1.00 25.00 C ATOM 1209 CG ASN A 157 71.678 28.046 -14.365 1.00 25.00 C ATOM 1210 OD1 ASN A 157 71.387 27.426 -13.358 1.00 25.00 O ATOM 1211 ND2 ASN A 157 72.252 29.217 -14.322 1.00 25.00 N ATOM 0 H ASN A 157 73.732 27.357 -16.418 1.00 25.00 H new ATOM 0 HA ASN A 157 72.118 25.532 -15.056 1.00 25.00 H new ATOM 0 HB2 ASN A 157 71.722 28.193 -16.489 1.00 25.00 H new ATOM 0 HB3 ASN A 157 70.319 27.357 -15.853 1.00 25.00 H new ATOM 0 HD21 ASN A 157 72.472 29.644 -13.422 1.00 25.00 H new ATOM 0 HD22 ASN A 157 72.480 29.705 -15.188 1.00 25.00 H new ATOM 1218 N HIS A 158 71.734 25.308 -18.219 1.00 25.00 N ATOM 1219 CA HIS A 158 71.038 24.582 -19.283 1.00 25.00 C ATOM 1220 C HIS A 158 71.324 23.079 -19.255 1.00 25.00 C ATOM 1221 O HIS A 158 70.780 22.324 -20.050 1.00 25.00 O ATOM 1222 CB HIS A 158 71.461 25.144 -20.641 1.00 25.00 C ATOM 1223 CG HIS A 158 71.215 26.615 -20.782 1.00 25.00 C ATOM 1224 ND1 HIS A 158 72.006 27.464 -21.513 1.00 25.00 N ATOM 1225 CD2 HIS A 158 70.233 27.405 -20.263 1.00 25.00 C ATOM 1226 CE1 HIS A 158 71.504 28.690 -21.412 1.00 25.00 C ATOM 1227 NE2 HIS A 158 70.426 28.715 -20.656 1.00 25.00 N ATOM 0 H HIS A 158 72.581 25.788 -18.524 1.00 25.00 H new ATOM 0 HA HIS A 158 69.969 24.717 -19.120 1.00 25.00 H new ATOM 0 HB2 HIS A 158 72.522 24.945 -20.793 1.00 25.00 H new ATOM 0 HB3 HIS A 158 70.922 24.616 -21.428 1.00 25.00 H new ATOM 0 HD2 HIS A 158 69.424 27.058 -19.637 1.00 25.00 H new ATOM 0 HE1 HIS A 158 71.928 29.560 -21.891 1.00 25.00 H new ATOM 0 HE2 HIS A 158 69.857 29.526 -20.413 1.00 25.00 H new ATOM 1235 N ARG A 159 72.200 22.640 -18.360 1.00 25.00 N ATOM 1236 CA ARG A 159 72.511 21.217 -18.248 1.00 25.00 C ATOM 1237 C ARG A 159 71.538 20.578 -17.283 1.00 25.00 C ATOM 1238 O ARG A 159 71.068 21.225 -16.349 1.00 25.00 O ATOM 1239 CB ARG A 159 73.931 21.004 -17.730 1.00 25.00 C ATOM 1240 CG ARG A 159 75.003 21.459 -18.686 1.00 25.00 C ATOM 1241 CD ARG A 159 76.372 21.137 -18.123 1.00 25.00 C ATOM 1242 NE ARG A 159 77.439 21.710 -18.956 1.00 25.00 N ATOM 1243 CZ ARG A 159 78.733 21.696 -18.657 1.00 25.00 C ATOM 1244 NH1 ARG A 159 79.192 21.131 -17.567 1.00 25.00 N1+ ATOM 1245 NH2 ARG A 159 79.578 22.264 -19.471 1.00 25.00 N ATOM 0 H ARG A 159 72.704 23.240 -17.707 1.00 25.00 H new ATOM 0 HA ARG A 159 72.430 20.765 -19.237 1.00 25.00 H new ATOM 0 HB2 ARG A 159 74.048 21.539 -16.787 1.00 25.00 H new ATOM 0 HB3 ARG A 159 74.074 19.945 -17.516 1.00 25.00 H new ATOM 0 HG2 ARG A 159 74.873 20.968 -19.651 1.00 25.00 H new ATOM 0 HG3 ARG A 159 74.915 22.532 -18.859 1.00 25.00 H new ATOM 0 HD2 ARG A 159 76.451 21.526 -17.108 1.00 25.00 H new ATOM 0 HD3 ARG A 159 76.497 20.056 -18.060 1.00 25.00 H new ATOM 0 HE ARG A 159 77.164 22.153 -19.833 1.00 25.00 H new ATOM 0 HH11 ARG A 159 78.548 20.682 -16.915 1.00 25.00 H new ATOM 0 HH12 ARG A 159 80.193 21.140 -17.371 1.00 25.00 H new ATOM 0 HH21 ARG A 159 79.242 22.711 -20.324 1.00 25.00 H new ATOM 0 HH22 ARG A 159 80.575 22.261 -19.255 1.00 25.00 H new ATOM 1259 N SER A 160 71.273 19.302 -17.480 1.00 25.00 N ATOM 1260 CA SER A 160 70.430 18.557 -16.564 1.00 25.00 C ATOM 1261 C SER A 160 71.258 18.078 -15.382 1.00 25.00 C ATOM 1262 O SER A 160 72.486 18.107 -15.417 1.00 25.00 O ATOM 1263 CB SER A 160 69.810 17.370 -17.280 1.00 25.00 C ATOM 1264 OG SER A 160 70.798 16.514 -17.833 1.00 25.00 O ATOM 0 H SER A 160 71.629 18.758 -18.266 1.00 25.00 H new ATOM 0 HA SER A 160 69.632 19.206 -16.202 1.00 25.00 H new ATOM 0 HB2 SER A 160 69.191 16.807 -16.582 1.00 25.00 H new ATOM 0 HB3 SER A 160 69.153 17.727 -18.073 1.00 25.00 H new ATOM 0 HG SER A 160 70.379 15.902 -18.474 1.00 25.00 H new ATOM 1270 N LEU A 161 70.594 17.627 -14.332 1.00 25.00 N ATOM 1271 CA LEU A 161 71.281 17.163 -13.124 1.00 25.00 C ATOM 1272 C LEU A 161 72.075 15.875 -13.399 1.00 25.00 C ATOM 1273 O LEU A 161 73.173 15.662 -12.851 1.00 25.00 O ATOM 1274 CB LEU A 161 70.244 16.951 -12.020 1.00 25.00 C ATOM 1275 CG LEU A 161 69.396 18.198 -11.694 1.00 25.00 C ATOM 1276 CD1 LEU A 161 68.240 17.804 -10.815 1.00 25.00 C ATOM 1277 CD2 LEU A 161 70.198 19.318 -11.024 1.00 25.00 C ATOM 0 H LEU A 161 69.577 17.569 -14.285 1.00 25.00 H new ATOM 0 HA LEU A 161 72.001 17.916 -12.803 1.00 25.00 H new ATOM 0 HB2 LEU A 161 69.578 16.140 -12.315 1.00 25.00 H new ATOM 0 HB3 LEU A 161 70.757 16.628 -11.114 1.00 25.00 H new ATOM 0 HG LEU A 161 69.038 18.595 -12.644 1.00 25.00 H new ATOM 0 HD11 LEU A 161 67.641 18.685 -10.585 1.00 25.00 H new ATOM 0 HD12 LEU A 161 67.622 17.071 -11.333 1.00 25.00 H new ATOM 0 HD13 LEU A 161 68.618 17.370 -9.889 1.00 25.00 H new ATOM 0 HD21 LEU A 161 69.542 20.165 -10.822 1.00 25.00 H new ATOM 0 HD22 LEU A 161 70.619 18.954 -10.087 1.00 25.00 H new ATOM 0 HD23 LEU A 161 71.005 19.634 -11.686 1.00 25.00 H new ATOM 1289 N ALA A 162 71.575 15.064 -14.322 1.00 25.00 N ATOM 1290 CA ALA A 162 72.288 13.868 -14.768 1.00 25.00 C ATOM 1291 C ALA A 162 73.627 14.246 -15.411 1.00 25.00 C ATOM 1292 O ALA A 162 74.599 13.504 -15.313 1.00 25.00 O ATOM 1293 CB ALA A 162 71.428 13.090 -15.766 1.00 25.00 C ATOM 0 H ALA A 162 70.675 15.211 -14.780 1.00 25.00 H new ATOM 0 HA ALA A 162 72.487 13.239 -13.901 1.00 25.00 H new ATOM 0 HB1 ALA A 162 71.966 12.200 -16.094 1.00 25.00 H new ATOM 0 HB2 ALA A 162 70.494 12.794 -15.288 1.00 25.00 H new ATOM 0 HB3 ALA A 162 71.211 13.721 -16.628 1.00 25.00 H new ATOM 1299 N SER A 163 73.690 15.422 -16.021 1.00 25.00 N ATOM 1300 CA SER A 163 74.927 15.898 -16.648 1.00 25.00 C ATOM 1301 C SER A 163 75.978 16.278 -15.604 1.00 25.00 C ATOM 1302 O SER A 163 77.160 16.387 -15.920 1.00 25.00 O ATOM 1303 CB SER A 163 74.650 17.108 -17.539 1.00 25.00 C ATOM 1304 OG SER A 163 73.658 16.820 -18.513 1.00 25.00 O ATOM 0 H SER A 163 72.903 16.067 -16.098 1.00 25.00 H new ATOM 0 HA SER A 163 75.314 15.078 -17.252 1.00 25.00 H new ATOM 0 HB2 SER A 163 74.325 17.947 -16.924 1.00 25.00 H new ATOM 0 HB3 SER A 163 75.571 17.414 -18.035 1.00 25.00 H new ATOM 0 HG SER A 163 72.779 16.774 -18.081 1.00 25.00 H new ATOM 1310 N TYR A 164 75.554 16.461 -14.359 1.00 25.00 N ATOM 1311 CA TYR A 164 76.480 16.745 -13.262 1.00 25.00 C ATOM 1312 C TYR A 164 76.762 15.462 -12.490 1.00 25.00 C ATOM 1313 O TYR A 164 77.549 15.452 -11.544 1.00 25.00 O ATOM 1314 CB TYR A 164 75.886 17.794 -12.322 1.00 25.00 C ATOM 1315 CG TYR A 164 75.887 19.179 -12.913 1.00 25.00 C ATOM 1316 CD1 TYR A 164 77.048 19.976 -12.858 1.00 25.00 C ATOM 1317 CD2 TYR A 164 74.737 19.708 -13.530 1.00 25.00 C ATOM 1318 CE1 TYR A 164 77.064 21.274 -13.421 1.00 25.00 C ATOM 1319 CE2 TYR A 164 74.750 21.008 -14.095 1.00 25.00 C ATOM 1320 CZ TYR A 164 75.917 21.777 -14.030 1.00 25.00 C ATOM 1321 OH TYR A 164 75.953 23.037 -14.555 1.00 25.00 O ATOM 0 H TYR A 164 74.574 16.418 -14.081 1.00 25.00 H new ATOM 0 HA TYR A 164 77.410 17.134 -13.676 1.00 25.00 H new ATOM 0 HB2 TYR A 164 74.863 17.512 -12.071 1.00 25.00 H new ATOM 0 HB3 TYR A 164 76.452 17.802 -11.390 1.00 25.00 H new ATOM 0 HD1 TYR A 164 77.937 19.591 -12.380 1.00 25.00 H new ATOM 0 HD2 TYR A 164 73.835 19.116 -13.573 1.00 25.00 H new ATOM 0 HE1 TYR A 164 77.962 21.872 -13.379 1.00 25.00 H new ATOM 0 HE2 TYR A 164 73.865 21.402 -14.572 1.00 25.00 H new ATOM 0 HH TYR A 164 75.237 23.136 -15.216 1.00 25.00 H new ATOM 1331 N GLY A 165 76.107 14.382 -12.892 1.00 25.00 N ATOM 1332 CA GLY A 165 76.255 13.120 -12.197 1.00 25.00 C ATOM 1333 C GLY A 165 75.551 13.154 -10.857 1.00 25.00 C ATOM 1334 O GLY A 165 75.965 12.461 -9.926 1.00 25.00 O ATOM 0 H GLY A 165 75.473 14.358 -13.691 1.00 25.00 H new ATOM 0 HA2 GLY A 165 75.846 12.315 -12.807 1.00 25.00 H new ATOM 0 HA3 GLY A 165 77.313 12.903 -12.051 1.00 25.00 H new ATOM 1338 N LEU A 166 74.505 13.968 -10.738 1.00 25.00 N ATOM 1339 CA LEU A 166 73.783 14.083 -9.469 1.00 25.00 C ATOM 1340 C LEU A 166 72.898 12.858 -9.239 1.00 25.00 C ATOM 1341 O LEU A 166 71.708 12.863 -9.515 1.00 25.00 O ATOM 1342 CB LEU A 166 72.960 15.372 -9.439 1.00 25.00 C ATOM 1343 CG LEU A 166 73.766 16.585 -8.956 1.00 25.00 C ATOM 1344 CD1 LEU A 166 73.154 17.881 -9.440 1.00 25.00 C ATOM 1345 CD2 LEU A 166 73.821 16.586 -7.432 1.00 25.00 C ATOM 0 H LEU A 166 74.141 14.551 -11.492 1.00 25.00 H new ATOM 0 HA LEU A 166 74.510 14.126 -8.658 1.00 25.00 H new ATOM 0 HB2 LEU A 166 72.574 15.574 -10.438 1.00 25.00 H new ATOM 0 HB3 LEU A 166 72.098 15.232 -8.786 1.00 25.00 H new ATOM 0 HG LEU A 166 74.773 16.510 -9.367 1.00 25.00 H new ATOM 0 HD11 LEU A 166 73.749 18.721 -9.081 1.00 25.00 H new ATOM 0 HD12 LEU A 166 73.135 17.890 -10.530 1.00 25.00 H new ATOM 0 HD13 LEU A 166 72.137 17.968 -9.059 1.00 25.00 H new ATOM 0 HD21 LEU A 166 74.394 17.448 -7.089 1.00 25.00 H new ATOM 0 HD22 LEU A 166 72.809 16.640 -7.031 1.00 25.00 H new ATOM 0 HD23 LEU A 166 74.300 15.671 -7.085 1.00 25.00 H new ATOM 1357 N LYS A 167 73.535 11.797 -8.774 1.00 25.00 N ATOM 1358 CA LYS A 167 72.883 10.516 -8.494 1.00 25.00 C ATOM 1359 C LYS A 167 71.997 10.573 -7.247 1.00 25.00 C ATOM 1360 O LYS A 167 72.156 11.443 -6.385 1.00 25.00 O ATOM 1361 CB LYS A 167 73.962 9.443 -8.302 1.00 25.00 C ATOM 1362 CG LYS A 167 74.974 9.790 -7.204 1.00 25.00 C ATOM 1363 CD LYS A 167 75.130 8.653 -6.206 1.00 25.00 C ATOM 1364 CE LYS A 167 75.919 9.098 -4.978 1.00 25.00 C ATOM 1365 NZ LYS A 167 75.186 10.171 -4.235 1.00 25.00 N1+ ATOM 0 H LYS A 167 74.535 11.795 -8.575 1.00 25.00 H new ATOM 0 HA LYS A 167 72.239 10.276 -9.340 1.00 25.00 H new ATOM 0 HB2 LYS A 167 73.482 8.495 -8.058 1.00 25.00 H new ATOM 0 HB3 LYS A 167 74.493 9.299 -9.243 1.00 25.00 H new ATOM 0 HG2 LYS A 167 75.940 10.013 -7.656 1.00 25.00 H new ATOM 0 HG3 LYS A 167 74.651 10.691 -6.682 1.00 25.00 H new ATOM 0 HD2 LYS A 167 74.146 8.298 -5.900 1.00 25.00 H new ATOM 0 HD3 LYS A 167 75.638 7.815 -6.683 1.00 25.00 H new ATOM 0 HE2 LYS A 167 76.089 8.245 -4.321 1.00 25.00 H new ATOM 0 HE3 LYS A 167 76.899 9.465 -5.283 1.00 25.00 H new ATOM 0 HZ1 LYS A 167 75.322 10.040 -3.212 1.00 25.00 H new ATOM 0 HZ2 LYS A 167 75.554 11.102 -4.517 1.00 25.00 H new ATOM 0 HZ3 LYS A 167 74.172 10.118 -4.459 1.00 25.00 H new ATOM 1379 N ASP A 168 71.106 9.604 -7.120 1.00 25.00 N ATOM 1380 CA ASP A 168 70.226 9.529 -5.961 1.00 25.00 C ATOM 1381 C ASP A 168 71.043 9.562 -4.672 1.00 25.00 C ATOM 1382 O ASP A 168 72.056 8.864 -4.524 1.00 25.00 O ATOM 1383 CB ASP A 168 69.389 8.242 -5.967 1.00 25.00 C ATOM 1384 CG ASP A 168 68.573 8.077 -7.213 1.00 25.00 C ATOM 1385 OD1 ASP A 168 69.150 7.874 -8.306 1.00 25.00 O ATOM 1386 OD2 ASP A 168 67.336 8.105 -7.088 1.00 25.00 O1- ATOM 0 H ASP A 168 70.971 8.858 -7.803 1.00 25.00 H new ATOM 0 HA ASP A 168 69.558 10.389 -6.012 1.00 25.00 H new ATOM 0 HB2 ASP A 168 70.052 7.384 -5.858 1.00 25.00 H new ATOM 0 HB3 ASP A 168 68.725 8.244 -5.103 1.00 25.00 H new ATOM 1391 N GLY A 169 70.608 10.394 -3.744 1.00 25.00 N ATOM 1392 CA GLY A 169 71.256 10.492 -2.454 1.00 25.00 C ATOM 1393 C GLY A 169 72.374 11.507 -2.423 1.00 25.00 C ATOM 1394 O GLY A 169 72.988 11.697 -1.378 1.00 25.00 O ATOM 0 H GLY A 169 69.806 11.013 -3.862 1.00 25.00 H new ATOM 0 HA2 GLY A 169 70.513 10.757 -1.701 1.00 25.00 H new ATOM 0 HA3 GLY A 169 71.654 9.515 -2.180 1.00 25.00 H new ATOM 1398 N ASP A 170 72.668 12.162 -3.540 1.00 25.00 N ATOM 1399 CA ASP A 170 73.686 13.210 -3.513 1.00 25.00 C ATOM 1400 C ASP A 170 73.122 14.488 -2.906 1.00 25.00 C ATOM 1401 O ASP A 170 71.912 14.595 -2.672 1.00 25.00 O ATOM 1402 CB ASP A 170 74.246 13.475 -4.895 1.00 25.00 C ATOM 1403 CG ASP A 170 75.746 13.559 -4.878 1.00 25.00 C ATOM 1404 OD1 ASP A 170 76.287 14.453 -4.195 1.00 25.00 O ATOM 1405 OD2 ASP A 170 76.383 12.604 -5.375 1.00 25.00 O1- ATOM 0 H ASP A 170 72.234 11.996 -4.448 1.00 25.00 H new ATOM 0 HA ASP A 170 74.507 12.861 -2.886 1.00 25.00 H new ATOM 0 HB2 ASP A 170 73.933 12.681 -5.573 1.00 25.00 H new ATOM 0 HB3 ASP A 170 73.833 14.406 -5.283 1.00 25.00 H new ATOM 1410 N VAL A 171 73.996 15.438 -2.607 1.00 25.00 N ATOM 1411 CA VAL A 171 73.594 16.644 -1.889 1.00 25.00 C ATOM 1412 C VAL A 171 74.112 17.927 -2.545 1.00 25.00 C ATOM 1413 O VAL A 171 75.260 18.027 -2.994 1.00 25.00 O ATOM 1414 CB VAL A 171 74.013 16.543 -0.378 1.00 25.00 C ATOM 1415 CG1 VAL A 171 75.504 16.257 -0.240 1.00 25.00 C ATOM 1416 CG2 VAL A 171 73.625 17.809 0.416 1.00 25.00 C ATOM 0 H VAL A 171 74.986 15.400 -2.849 1.00 25.00 H new ATOM 0 HA VAL A 171 72.507 16.709 -1.940 1.00 25.00 H new ATOM 0 HB VAL A 171 73.461 15.707 0.050 1.00 25.00 H new ATOM 0 HG11 VAL A 171 75.766 16.192 0.816 1.00 25.00 H new ATOM 0 HG12 VAL A 171 75.740 15.313 -0.731 1.00 25.00 H new ATOM 0 HG13 VAL A 171 76.073 17.061 -0.706 1.00 25.00 H new ATOM 0 HG21 VAL A 171 73.933 17.695 1.455 1.00 25.00 H new ATOM 0 HG22 VAL A 171 74.122 18.677 -0.017 1.00 25.00 H new ATOM 0 HG23 VAL A 171 72.545 17.950 0.371 1.00 25.00 H new ATOM 1426 N VAL A 172 73.224 18.906 -2.602 1.00 25.00 N ATOM 1427 CA VAL A 172 73.497 20.216 -3.175 1.00 25.00 C ATOM 1428 C VAL A 172 73.440 21.214 -2.019 1.00 25.00 C ATOM 1429 O VAL A 172 72.636 21.063 -1.104 1.00 25.00 O ATOM 1430 CB VAL A 172 72.436 20.558 -4.261 1.00 25.00 C ATOM 1431 CG1 VAL A 172 72.760 21.881 -4.935 1.00 25.00 C ATOM 1432 CG2 VAL A 172 72.377 19.440 -5.319 1.00 25.00 C ATOM 0 H VAL A 172 72.274 18.811 -2.244 1.00 25.00 H new ATOM 0 HA VAL A 172 74.472 20.245 -3.661 1.00 25.00 H new ATOM 0 HB VAL A 172 71.466 20.643 -3.771 1.00 25.00 H new ATOM 0 HG11 VAL A 172 72.005 22.099 -5.690 1.00 25.00 H new ATOM 0 HG12 VAL A 172 72.768 22.676 -4.190 1.00 25.00 H new ATOM 0 HG13 VAL A 172 73.739 21.818 -5.409 1.00 25.00 H new ATOM 0 HG21 VAL A 172 71.631 19.691 -6.073 1.00 25.00 H new ATOM 0 HG22 VAL A 172 73.353 19.337 -5.794 1.00 25.00 H new ATOM 0 HG23 VAL A 172 72.106 18.499 -4.840 1.00 25.00 H new ATOM 1442 N ILE A 173 74.313 22.206 -2.030 1.00 25.00 N ATOM 1443 CA ILE A 173 74.406 23.173 -0.939 1.00 25.00 C ATOM 1444 C ILE A 173 74.050 24.564 -1.468 1.00 25.00 C ATOM 1445 O ILE A 173 74.569 25.010 -2.483 1.00 25.00 O ATOM 1446 CB ILE A 173 75.837 23.139 -0.324 1.00 25.00 C ATOM 1447 CG1 ILE A 173 76.058 21.793 0.401 1.00 25.00 C ATOM 1448 CG2 ILE A 173 76.067 24.333 0.633 1.00 25.00 C ATOM 1449 CD1 ILE A 173 77.523 21.501 0.773 1.00 25.00 C ATOM 0 H ILE A 173 74.976 22.368 -2.788 1.00 25.00 H new ATOM 0 HA ILE A 173 73.701 22.918 -0.148 1.00 25.00 H new ATOM 0 HB ILE A 173 76.566 23.230 -1.130 1.00 25.00 H new ATOM 0 HG12 ILE A 173 75.456 21.781 1.310 1.00 25.00 H new ATOM 0 HG13 ILE A 173 75.690 20.988 -0.235 1.00 25.00 H new ATOM 0 HG21 ILE A 173 77.075 24.280 1.045 1.00 25.00 H new ATOM 0 HG22 ILE A 173 75.948 25.267 0.084 1.00 25.00 H new ATOM 0 HG23 ILE A 173 75.340 24.294 1.445 1.00 25.00 H new ATOM 0 HD11 ILE A 173 77.585 20.537 1.278 1.00 25.00 H new ATOM 0 HD12 ILE A 173 78.130 21.477 -0.132 1.00 25.00 H new ATOM 0 HD13 ILE A 173 77.893 22.283 1.437 1.00 25.00 H new ATOM 1461 N LEU A 174 73.147 25.234 -0.770 1.00 25.00 N ATOM 1462 CA LEU A 174 72.677 26.571 -1.132 1.00 25.00 C ATOM 1463 C LEU A 174 73.130 27.517 -0.018 1.00 25.00 C ATOM 1464 O LEU A 174 73.071 27.159 1.148 1.00 25.00 O ATOM 1465 CB LEU A 174 71.146 26.539 -1.257 1.00 25.00 C ATOM 1466 CG LEU A 174 70.419 27.829 -1.672 1.00 25.00 C ATOM 1467 CD1 LEU A 174 70.794 28.248 -3.088 1.00 25.00 C ATOM 1468 CD2 LEU A 174 68.910 27.612 -1.593 1.00 25.00 C ATOM 0 H LEU A 174 72.712 24.864 0.075 1.00 25.00 H new ATOM 0 HA LEU A 174 73.081 26.909 -2.086 1.00 25.00 H new ATOM 0 HB2 LEU A 174 70.888 25.765 -1.980 1.00 25.00 H new ATOM 0 HB3 LEU A 174 70.741 26.224 -0.295 1.00 25.00 H new ATOM 0 HG LEU A 174 70.722 28.622 -0.989 1.00 25.00 H new ATOM 0 HD11 LEU A 174 70.263 29.163 -3.349 1.00 25.00 H new ATOM 0 HD12 LEU A 174 71.868 28.424 -3.143 1.00 25.00 H new ATOM 0 HD13 LEU A 174 70.520 27.457 -3.786 1.00 25.00 H new ATOM 0 HD21 LEU A 174 68.395 28.527 -1.887 1.00 25.00 H new ATOM 0 HD22 LEU A 174 68.623 26.802 -2.264 1.00 25.00 H new ATOM 0 HD23 LEU A 174 68.633 27.352 -0.571 1.00 25.00 H new ATOM 1480 N ARG A 175 73.654 28.685 -0.365 1.00 25.00 N ATOM 1481 CA ARG A 175 74.221 29.609 0.631 1.00 25.00 C ATOM 1482 C ARG A 175 73.744 31.046 0.462 1.00 25.00 C ATOM 1483 O ARG A 175 74.212 31.773 -0.415 1.00 25.00 O ATOM 1484 CB ARG A 175 75.750 29.592 0.530 1.00 25.00 C ATOM 1485 CG ARG A 175 76.375 28.243 0.878 1.00 25.00 C ATOM 1486 CD ARG A 175 77.880 28.256 0.654 1.00 25.00 C ATOM 1487 NE ARG A 175 78.560 29.200 1.559 1.00 25.00 N ATOM 1488 CZ ARG A 175 79.864 29.451 1.564 1.00 25.00 C ATOM 1489 NH1 ARG A 175 80.696 28.854 0.745 1.00 25.00 N1+ ATOM 1490 NH2 ARG A 175 80.340 30.320 2.412 1.00 25.00 N ATOM 0 H ARG A 175 73.702 29.023 -1.326 1.00 25.00 H new ATOM 0 HA ARG A 175 73.879 29.261 1.606 1.00 25.00 H new ATOM 0 HB2 ARG A 175 76.041 29.866 -0.484 1.00 25.00 H new ATOM 0 HB3 ARG A 175 76.157 30.353 1.195 1.00 25.00 H new ATOM 0 HG2 ARG A 175 76.162 27.999 1.919 1.00 25.00 H new ATOM 0 HG3 ARG A 175 75.921 27.462 0.268 1.00 25.00 H new ATOM 0 HD2 ARG A 175 78.279 27.253 0.808 1.00 25.00 H new ATOM 0 HD3 ARG A 175 78.091 28.528 -0.380 1.00 25.00 H new ATOM 0 HE ARG A 175 77.983 29.700 2.235 1.00 25.00 H new ATOM 0 HH11 ARG A 175 80.348 28.170 0.073 1.00 25.00 H new ATOM 0 HH12 ARG A 175 81.691 29.074 0.779 1.00 25.00 H new ATOM 0 HH21 ARG A 175 79.713 30.797 3.060 1.00 25.00 H new ATOM 0 HH22 ARG A 175 81.339 30.523 2.427 1.00 25.00 H new ATOM 1504 N GLN A 176 72.865 31.485 1.364 1.00 25.00 N ATOM 1505 CA GLN A 176 72.412 32.883 1.416 1.00 25.00 C ATOM 1506 C GLN A 176 73.272 33.686 2.400 1.00 25.00 C ATOM 1507 O GLN A 176 73.228 33.574 3.616 1.00 25.00 O ATOM 1508 CB GLN A 176 70.911 33.005 1.748 1.00 25.00 C ATOM 1509 CG GLN A 176 70.429 34.455 1.504 1.00 25.00 C ATOM 1510 CD GLN A 176 68.965 34.629 1.821 1.00 25.00 C ATOM 1511 OE1 GLN A 176 68.459 34.244 2.851 1.00 25.00 O ATOM 1512 NE2 GLN A 176 68.247 35.270 0.912 1.00 25.00 N ATOM 1513 OXT GLN A 176 74.055 34.413 1.854 1.00 25.00 O ATOM 0 H GLN A 176 72.447 30.888 2.077 1.00 25.00 H new ATOM 0 HA GLN A 176 72.539 33.305 0.419 1.00 25.00 H new ATOM 0 HB2 GLN A 176 70.337 32.314 1.131 1.00 25.00 H new ATOM 0 HB3 GLN A 176 70.736 32.725 2.787 1.00 25.00 H new ATOM 0 HG2 GLN A 176 71.016 35.139 2.117 1.00 25.00 H new ATOM 0 HG3 GLN A 176 70.608 34.726 0.463 1.00 25.00 H new ATOM 0 HE21 GLN A 176 68.685 35.589 0.048 1.00 25.00 H new ATOM 0 HE22 GLN A 176 67.255 35.445 1.076 1.00 25.00 H new TER 1523 GLN A 176