USER MOD reduce.3.24.130724 H: found=0, std=0, add=1168, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 1162 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 58 TYR OH : rot 180:sc= 0.457 USER MOD Set 1.2: A 141 ASN : amide:sc= 1.94 K(o=2.4,f=0.67) USER MOD Set 2.1: A 69 MET CE :methyl 165:sc=-0.000451 (180deg=0) USER MOD Set 2.2: A 108 ASN : amide:sc= 0.478 K(o=0.48,f=-0.41) USER MOD Set 3.1: A 35 HIS : no HE2:sc= -2.66 K(o=-4.8,f=-7.6!) USER MOD Set 3.2: A 48 MET CE :methyl 146:sc= -1.79 (180deg=-2.8) USER MOD Set 3.3: A 92 GLN : amide:sc= -0.353 K(o=-4.8,f=-12!) USER MOD Set 4.1: A 22 THR OG1 : rot 180:sc= 0.68 USER MOD Set 4.2: A 25 GLN : amide:sc= 0.761 K(o=1.4,f=0.75) USER MOD Set 5.1: A 1 MET CE :methyl 144:sc= -0.147 (180deg=-1.72!) USER MOD Set 5.2: A 2 LYS NZ :NH3+ -156:sc= 1.08 (180deg=0) USER MOD Set 5.3: A 5 GLN : amide:sc= -1.42 K(o=-0.48,f=-9!) USER MOD Single : A 1 MET N :NH3+ 137:sc= 0.00374 (180deg=0) USER MOD Single : A 7 MET CE :methyl 160:sc= -0.129 (180deg=-0.781) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 167:sc= 0.843 (180deg=0.729) USER MOD Single : A 18 ASN : amide:sc= 0.308 K(o=0.31,f=-0.38) USER MOD Single : A 30 LYS NZ :NH3+ -158:sc= 1.22 (180deg=1.21) USER MOD Single : A 32 THR OG1 : rot 100:sc= 0 USER MOD Single : A 38 SER OG : rot -56:sc= 1.21 USER MOD Single : A 40 SER OG : rot 96:sc= 1.06 USER MOD Single : A 41 CYS SG : rot 180:sc= -0.0237 USER MOD Single : A 42 HIS : no HD1:sc= -0.0223 X(o=-0.022,f=0) USER MOD Single : A 44 CYS SG : rot -139:sc= 0.704 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 GLN : amide:sc=-0.000313 K(o=-0.00031,f=-3.9!) USER MOD Single : A 52 ASN : amide:sc= 0.826 K(o=0.83,f=-3.3!) USER MOD Single : A 57 LYS NZ :NH3+ -168:sc= 1.74 (180deg=1.22) USER MOD Single : A 59 GLN : amide:sc= 0.514 K(o=0.51,f=-0.31) USER MOD Single : A 61 GLN : amide:sc= 0.532 K(o=0.53,f=0) USER MOD Single : A 63 ASN : amide:sc= 0.392 X(o=0.39,f=0) USER MOD Single : A 68 HIS : no HE2:sc= -0.979 K(o=-0.98,f=-12!) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 80 LYS NZ :NH3+ 167:sc= 1.3 (180deg=1.21) USER MOD Single : A 82 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0157) USER MOD Single : A 84 THR OG1 : rot 77:sc= 1.19 USER MOD Single : A 88 HIS : no HD1:sc= -1.5 X(o=-1.5,f=-1.4) USER MOD Single : A 91 THR OG1 : rot 170:sc= 0.855 USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 100 HIS : no HE2:sc= -0.575 K(o=-0.58,f=-2.2!) USER MOD Single : A 103 THR OG1 : rot -67:sc= 1.3 USER MOD Single : A 110 TYR OH : rot 137:sc= 0.0676 USER MOD Single : A 114 TYR OH : rot 180:sc= 0 USER MOD Single : A 115 TYR OH : rot 60:sc= 1.7 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 GLN : amide:sc= 0.934 K(o=0.93,f=-4.4!) USER MOD Single : A 125 HIS : no HD1:sc= -2.03! C(o=-2!,f=-3.1!) USER MOD Single : A 127 GLN : amide:sc= 0.843 K(o=0.84,f=-0.13) USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -179:sc= -0.201 (180deg=-0.206) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 1.3 (180deg=1.3) USER MOD Single : A 135 MET CE :methyl -134:sc= -0.189 (180deg=-0.851) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 THR OG1 : rot 88:sc= 1.25 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.741 -2.179 -0.507 1.00 0.00 N ATOM 2 CA MET A 1 3.553 -1.435 -1.507 1.00 0.00 C ATOM 3 C MET A 1 4.824 -2.224 -1.823 1.00 0.00 C ATOM 4 O MET A 1 5.511 -2.695 -0.913 1.00 0.00 O ATOM 5 CB MET A 1 3.903 -0.001 -1.048 1.00 0.00 C ATOM 6 CG MET A 1 2.674 0.923 -1.061 1.00 0.00 C ATOM 7 SD MET A 1 3.008 2.702 -0.904 1.00 0.00 S ATOM 8 CE MET A 1 3.646 3.080 -2.560 1.00 0.00 C ATOM 0 H1 MET A 1 2.377 -1.516 0.207 1.00 0.00 H new ATOM 0 H2 MET A 1 1.943 -2.645 -0.985 1.00 0.00 H new ATOM 0 H3 MET A 1 3.334 -2.897 -0.043 1.00 0.00 H new ATOM 0 HA MET A 1 2.948 -1.330 -2.408 1.00 0.00 H new ATOM 0 HB2 MET A 1 4.321 -0.034 -0.042 1.00 0.00 H new ATOM 0 HB3 MET A 1 4.673 0.411 -1.700 1.00 0.00 H new ATOM 0 HG2 MET A 1 2.130 0.757 -1.991 1.00 0.00 H new ATOM 0 HG3 MET A 1 2.013 0.625 -0.247 1.00 0.00 H new ATOM 0 HE1 MET A 1 3.312 4.073 -2.861 1.00 0.00 H new ATOM 0 HE2 MET A 1 4.736 3.052 -2.545 1.00 0.00 H new ATOM 0 HE3 MET A 1 3.274 2.342 -3.271 1.00 0.00 H new ATOM 20 N LYS A 2 5.133 -2.394 -3.113 1.00 0.00 N ATOM 21 CA LYS A 2 6.348 -3.065 -3.561 1.00 0.00 C ATOM 22 C LYS A 2 7.457 -2.022 -3.635 1.00 0.00 C ATOM 23 O LYS A 2 7.200 -0.827 -3.795 1.00 0.00 O ATOM 24 CB LYS A 2 6.130 -3.736 -4.928 1.00 0.00 C ATOM 25 CG LYS A 2 4.959 -4.734 -4.909 1.00 0.00 C ATOM 26 CD LYS A 2 4.763 -5.440 -6.258 1.00 0.00 C ATOM 27 CE LYS A 2 4.457 -4.512 -7.450 1.00 0.00 C ATOM 28 NZ LYS A 2 3.221 -3.702 -7.275 1.00 0.00 N ATOM 0 H LYS A 2 4.541 -2.066 -3.876 1.00 0.00 H new ATOM 0 HA LYS A 2 6.623 -3.853 -2.860 1.00 0.00 H new ATOM 0 HB2 LYS A 2 5.939 -2.970 -5.680 1.00 0.00 H new ATOM 0 HB3 LYS A 2 7.042 -4.255 -5.225 1.00 0.00 H new ATOM 0 HG2 LYS A 2 5.135 -5.481 -4.135 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.042 -4.208 -4.642 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.664 -6.010 -6.485 1.00 0.00 H new ATOM 0 HD3 LYS A 2 3.948 -6.157 -6.159 1.00 0.00 H new ATOM 0 HE2 LYS A 2 5.302 -3.841 -7.603 1.00 0.00 H new ATOM 0 HE3 LYS A 2 4.361 -5.115 -8.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 2.851 -3.428 -8.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 2.506 -4.264 -6.770 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 3.441 -2.847 -6.725 1.00 0.00 H new ATOM 42 N LEU A 3 8.696 -2.474 -3.558 1.00 0.00 N ATOM 43 CA LEU A 3 9.858 -1.636 -3.811 1.00 0.00 C ATOM 44 C LEU A 3 9.979 -1.349 -5.309 1.00 0.00 C ATOM 45 O LEU A 3 9.353 -1.999 -6.149 1.00 0.00 O ATOM 46 CB LEU A 3 11.138 -2.270 -3.233 1.00 0.00 C ATOM 47 CG LEU A 3 11.072 -2.552 -1.716 1.00 0.00 C ATOM 48 CD1 LEU A 3 12.455 -2.959 -1.203 1.00 0.00 C ATOM 49 CD2 LEU A 3 10.553 -1.352 -0.911 1.00 0.00 C ATOM 0 H LEU A 3 8.927 -3.438 -3.317 1.00 0.00 H new ATOM 0 HA LEU A 3 9.726 -0.683 -3.299 1.00 0.00 H new ATOM 0 HB2 LEU A 3 11.336 -3.205 -3.757 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.981 -1.608 -3.432 1.00 0.00 H new ATOM 0 HG LEU A 3 10.362 -3.367 -1.573 1.00 0.00 H new ATOM 0 HD11 LEU A 3 12.402 -3.157 -0.132 1.00 0.00 H new ATOM 0 HD12 LEU A 3 12.785 -3.859 -1.722 1.00 0.00 H new ATOM 0 HD13 LEU A 3 13.164 -2.152 -1.388 1.00 0.00 H new ATOM 0 HD21 LEU A 3 10.528 -1.608 0.148 1.00 0.00 H new ATOM 0 HD22 LEU A 3 11.214 -0.499 -1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 3 9.548 -1.096 -1.246 1.00 0.00 H new ATOM 61 N ARG A 4 10.793 -0.341 -5.622 1.00 0.00 N ATOM 62 CA ARG A 4 10.970 0.308 -6.918 1.00 0.00 C ATOM 63 C ARG A 4 9.671 0.784 -7.579 1.00 0.00 C ATOM 64 O ARG A 4 9.703 1.148 -8.755 1.00 0.00 O ATOM 65 CB ARG A 4 11.882 -0.528 -7.841 1.00 0.00 C ATOM 66 CG ARG A 4 13.270 -0.758 -7.220 1.00 0.00 C ATOM 67 CD ARG A 4 14.229 -1.390 -8.236 1.00 0.00 C ATOM 68 NE ARG A 4 15.555 -1.648 -7.646 1.00 0.00 N ATOM 69 CZ ARG A 4 16.568 -0.777 -7.544 1.00 0.00 C ATOM 70 NH1 ARG A 4 16.444 0.481 -7.962 1.00 0.00 N ATOM 71 NH2 ARG A 4 17.720 -1.175 -7.012 1.00 0.00 N ATOM 0 H ARG A 4 11.396 0.077 -4.914 1.00 0.00 H new ATOM 0 HA ARG A 4 11.493 1.244 -6.722 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.411 -1.490 -8.043 1.00 0.00 H new ATOM 0 HB3 ARG A 4 11.993 -0.020 -8.799 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.678 0.191 -6.871 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.179 -1.406 -6.348 1.00 0.00 H new ATOM 0 HD2 ARG A 4 13.806 -2.325 -8.603 1.00 0.00 H new ATOM 0 HD3 ARG A 4 14.336 -0.729 -9.096 1.00 0.00 H new ATOM 0 HE ARG A 4 15.718 -2.585 -7.278 1.00 0.00 H new ATOM 0 HH11 ARG A 4 15.565 0.799 -8.370 1.00 0.00 H new ATOM 0 HH12 ARG A 4 17.228 1.127 -7.875 1.00 0.00 H new ATOM 0 HH21 ARG A 4 17.826 -2.136 -6.686 1.00 0.00 H new ATOM 0 HH22 ARG A 4 18.497 -0.520 -6.930 1.00 0.00 H new ATOM 85 N GLN A 5 8.543 0.845 -6.858 1.00 0.00 N ATOM 86 CA GLN A 5 7.352 1.505 -7.390 1.00 0.00 C ATOM 87 C GLN A 5 7.637 3.004 -7.436 1.00 0.00 C ATOM 88 O GLN A 5 8.259 3.504 -6.499 1.00 0.00 O ATOM 89 CB GLN A 5 6.156 1.268 -6.469 1.00 0.00 C ATOM 90 CG GLN A 5 5.725 -0.208 -6.475 1.00 0.00 C ATOM 91 CD GLN A 5 4.557 -0.452 -5.533 1.00 0.00 C ATOM 92 OE1 GLN A 5 3.722 -1.321 -5.770 1.00 0.00 O ATOM 93 NE2 GLN A 5 4.516 0.240 -4.406 1.00 0.00 N ATOM 0 H GLN A 5 8.434 0.452 -5.923 1.00 0.00 H new ATOM 0 HA GLN A 5 7.121 1.109 -8.379 1.00 0.00 H new ATOM 0 HB2 GLN A 5 6.412 1.569 -5.453 1.00 0.00 H new ATOM 0 HB3 GLN A 5 5.321 1.893 -6.786 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.445 -0.502 -7.487 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.567 -0.835 -6.182 1.00 0.00 H new ATOM 0 HE21 GLN A 5 5.216 0.959 -4.223 1.00 0.00 H new ATOM 0 HE22 GLN A 5 3.784 0.055 -3.720 1.00 0.00 H new ATOM 102 N PRO A 6 7.186 3.757 -8.445 1.00 0.00 N ATOM 103 CA PRO A 6 7.311 5.201 -8.394 1.00 0.00 C ATOM 104 C PRO A 6 6.361 5.765 -7.329 1.00 0.00 C ATOM 105 O PRO A 6 5.232 5.289 -7.182 1.00 0.00 O ATOM 106 CB PRO A 6 6.981 5.674 -9.806 1.00 0.00 C ATOM 107 CG PRO A 6 6.013 4.610 -10.330 1.00 0.00 C ATOM 108 CD PRO A 6 6.492 3.326 -9.649 1.00 0.00 C ATOM 0 HA PRO A 6 8.305 5.544 -8.106 1.00 0.00 H new ATOM 0 HB2 PRO A 6 6.523 6.663 -9.800 1.00 0.00 H new ATOM 0 HB3 PRO A 6 7.876 5.741 -10.425 1.00 0.00 H new ATOM 0 HG2 PRO A 6 4.981 4.842 -10.068 1.00 0.00 H new ATOM 0 HG3 PRO A 6 6.056 4.528 -11.416 1.00 0.00 H new ATOM 0 HD2 PRO A 6 5.652 2.675 -9.406 1.00 0.00 H new ATOM 0 HD3 PRO A 6 7.156 2.760 -10.303 1.00 0.00 H new ATOM 116 N MET A 7 6.811 6.793 -6.603 1.00 0.00 N ATOM 117 CA MET A 7 5.974 7.560 -5.676 1.00 0.00 C ATOM 118 C MET A 7 4.651 7.975 -6.355 1.00 0.00 C ATOM 119 O MET A 7 4.700 8.504 -7.471 1.00 0.00 O ATOM 120 CB MET A 7 6.726 8.758 -5.082 1.00 0.00 C ATOM 121 CG MET A 7 7.331 9.749 -6.080 1.00 0.00 C ATOM 122 SD MET A 7 8.074 11.210 -5.294 1.00 0.00 S ATOM 123 CE MET A 7 9.295 10.418 -4.216 1.00 0.00 C ATOM 0 H MET A 7 7.777 7.119 -6.643 1.00 0.00 H new ATOM 0 HA MET A 7 5.723 6.914 -4.835 1.00 0.00 H new ATOM 0 HB2 MET A 7 6.041 9.303 -4.433 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.529 8.378 -4.450 1.00 0.00 H new ATOM 0 HG2 MET A 7 8.091 9.238 -6.671 1.00 0.00 H new ATOM 0 HG3 MET A 7 6.555 10.074 -6.772 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.060 11.143 -3.938 1.00 0.00 H new ATOM 0 HE2 MET A 7 8.802 10.049 -3.317 1.00 0.00 H new ATOM 0 HE3 MET A 7 9.759 9.585 -4.743 1.00 0.00 H new ATOM 133 N PRO A 8 3.476 7.708 -5.755 1.00 0.00 N ATOM 134 CA PRO A 8 2.182 7.894 -6.406 1.00 0.00 C ATOM 135 C PRO A 8 1.641 9.326 -6.208 1.00 0.00 C ATOM 136 O PRO A 8 2.387 10.304 -6.216 1.00 0.00 O ATOM 137 CB PRO A 8 1.309 6.790 -5.789 1.00 0.00 C ATOM 138 CG PRO A 8 1.798 6.748 -4.347 1.00 0.00 C ATOM 139 CD PRO A 8 3.302 6.964 -4.512 1.00 0.00 C ATOM 0 HA PRO A 8 2.218 7.803 -7.492 1.00 0.00 H new ATOM 0 HB2 PRO A 8 0.248 7.030 -5.850 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.449 5.833 -6.293 1.00 0.00 H new ATOM 0 HG2 PRO A 8 1.339 7.527 -3.738 1.00 0.00 H new ATOM 0 HG3 PRO A 8 1.573 5.795 -3.868 1.00 0.00 H new ATOM 0 HD2 PRO A 8 3.710 7.518 -3.667 1.00 0.00 H new ATOM 0 HD3 PRO A 8 3.829 6.011 -4.552 1.00 0.00 H new ATOM 147 N GLU A 9 0.321 9.443 -6.077 1.00 0.00 N ATOM 148 CA GLU A 9 -0.482 10.648 -5.935 1.00 0.00 C ATOM 149 C GLU A 9 -0.343 11.262 -4.535 1.00 0.00 C ATOM 150 O GLU A 9 -1.268 11.226 -3.720 1.00 0.00 O ATOM 151 CB GLU A 9 -1.936 10.252 -6.239 1.00 0.00 C ATOM 152 CG GLU A 9 -2.174 9.909 -7.713 1.00 0.00 C ATOM 153 CD GLU A 9 -2.080 11.138 -8.636 1.00 0.00 C ATOM 154 OE1 GLU A 9 -3.092 11.856 -8.804 1.00 0.00 O ATOM 155 OE2 GLU A 9 -1.003 11.383 -9.225 1.00 0.00 O ATOM 0 H GLU A 9 -0.268 8.610 -6.067 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.141 11.418 -6.627 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -2.208 9.394 -5.625 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -2.596 11.071 -5.952 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -1.443 9.165 -8.031 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -3.159 9.454 -7.821 1.00 0.00 H new ATOM 162 N LEU A 10 0.830 11.814 -4.231 1.00 0.00 N ATOM 163 CA LEU A 10 1.055 12.620 -3.035 1.00 0.00 C ATOM 164 C LEU A 10 0.357 13.973 -3.236 1.00 0.00 C ATOM 165 O LEU A 10 0.994 14.945 -3.650 1.00 0.00 O ATOM 166 CB LEU A 10 2.562 12.808 -2.760 1.00 0.00 C ATOM 167 CG LEU A 10 3.363 11.592 -2.259 1.00 0.00 C ATOM 168 CD1 LEU A 10 2.782 10.985 -0.977 1.00 0.00 C ATOM 169 CD2 LEU A 10 3.538 10.488 -3.305 1.00 0.00 C ATOM 0 H LEU A 10 1.660 11.712 -4.816 1.00 0.00 H new ATOM 0 HA LEU A 10 0.640 12.112 -2.164 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.028 13.158 -3.681 1.00 0.00 H new ATOM 0 HB3 LEU A 10 2.670 13.605 -2.024 1.00 0.00 H new ATOM 0 HG LEU A 10 4.349 12.003 -2.043 1.00 0.00 H new ATOM 0 HD11 LEU A 10 3.388 10.132 -0.671 1.00 0.00 H new ATOM 0 HD12 LEU A 10 2.785 11.734 -0.186 1.00 0.00 H new ATOM 0 HD13 LEU A 10 1.759 10.656 -1.161 1.00 0.00 H new ATOM 0 HD21 LEU A 10 4.112 9.667 -2.875 1.00 0.00 H new ATOM 0 HD22 LEU A 10 2.559 10.122 -3.615 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.067 10.887 -4.170 1.00 0.00 H new ATOM 181 N THR A 11 -0.956 14.039 -3.011 1.00 0.00 N ATOM 182 CA THR A 11 -1.746 15.254 -3.176 1.00 0.00 C ATOM 183 C THR A 11 -2.994 15.173 -2.284 1.00 0.00 C ATOM 184 O THR A 11 -3.434 14.075 -1.914 1.00 0.00 O ATOM 185 CB THR A 11 -2.046 15.458 -4.681 1.00 0.00 C ATOM 186 OG1 THR A 11 -2.559 16.753 -4.926 1.00 0.00 O ATOM 187 CG2 THR A 11 -3.013 14.428 -5.275 1.00 0.00 C ATOM 0 H THR A 11 -1.506 13.237 -2.705 1.00 0.00 H new ATOM 0 HA THR A 11 -1.200 16.139 -2.849 1.00 0.00 H new ATOM 0 HB THR A 11 -1.084 15.324 -5.176 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.739 16.858 -5.884 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.169 14.643 -6.332 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.592 13.429 -5.166 1.00 0.00 H new ATOM 0 HG23 THR A 11 -3.967 14.479 -4.750 1.00 0.00 H new ATOM 195 N GLY A 12 -3.556 16.330 -1.917 1.00 0.00 N ATOM 196 CA GLY A 12 -4.631 16.449 -0.945 1.00 0.00 C ATOM 197 C GLY A 12 -5.056 17.902 -0.737 1.00 0.00 C ATOM 198 O GLY A 12 -4.438 18.812 -1.296 1.00 0.00 O ATOM 0 H GLY A 12 -3.263 17.228 -2.302 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -5.488 15.865 -1.279 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.308 16.026 0.006 1.00 0.00 H new ATOM 202 N GLU A 13 -6.104 18.117 0.068 1.00 0.00 N ATOM 203 CA GLU A 13 -6.777 19.410 0.206 1.00 0.00 C ATOM 204 C GLU A 13 -7.185 19.767 1.651 1.00 0.00 C ATOM 205 O GLU A 13 -7.550 20.920 1.894 1.00 0.00 O ATOM 206 CB GLU A 13 -8.038 19.402 -0.684 1.00 0.00 C ATOM 207 CG GLU A 13 -7.731 19.355 -2.190 1.00 0.00 C ATOM 208 CD GLU A 13 -9.013 19.491 -3.031 1.00 0.00 C ATOM 209 OE1 GLU A 13 -9.652 18.464 -3.355 1.00 0.00 O ATOM 210 OE2 GLU A 13 -9.390 20.628 -3.398 1.00 0.00 O ATOM 0 H GLU A 13 -6.513 17.385 0.649 1.00 0.00 H new ATOM 0 HA GLU A 13 -6.058 20.170 -0.101 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -8.653 18.541 -0.420 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -8.629 20.293 -0.470 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -7.039 20.157 -2.447 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -7.234 18.416 -2.432 1.00 0.00 H new ATOM 217 N LYS A 14 -7.156 18.835 2.618 1.00 0.00 N ATOM 218 CA LYS A 14 -7.678 19.100 3.973 1.00 0.00 C ATOM 219 C LYS A 14 -6.836 20.156 4.691 1.00 0.00 C ATOM 220 O LYS A 14 -7.408 21.089 5.258 1.00 0.00 O ATOM 221 CB LYS A 14 -7.786 17.801 4.785 1.00 0.00 C ATOM 222 CG LYS A 14 -8.388 17.976 6.189 1.00 0.00 C ATOM 223 CD LYS A 14 -8.516 16.605 6.874 1.00 0.00 C ATOM 224 CE LYS A 14 -8.756 16.727 8.386 1.00 0.00 C ATOM 225 NZ LYS A 14 -10.156 17.071 8.747 1.00 0.00 N ATOM 0 H LYS A 14 -6.779 17.896 2.490 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.685 19.505 3.876 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.395 17.089 4.228 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.792 17.364 4.881 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.757 18.634 6.786 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.367 18.451 6.119 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.339 16.051 6.422 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -7.608 16.028 6.698 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -8.489 15.784 8.864 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -8.089 17.489 8.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -10.298 16.922 9.766 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -10.340 18.068 8.514 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.811 16.464 8.214 1.00 0.00 H new ATOM 239 N ALA A 15 -5.506 20.033 4.666 1.00 0.00 N ATOM 240 CA ALA A 15 -4.587 21.036 5.195 1.00 0.00 C ATOM 241 C ALA A 15 -3.209 20.836 4.574 1.00 0.00 C ATOM 242 O ALA A 15 -2.876 19.746 4.105 1.00 0.00 O ATOM 243 CB ALA A 15 -4.467 20.917 6.732 1.00 0.00 C ATOM 0 H ALA A 15 -5.033 19.220 4.271 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.975 22.024 4.948 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -3.777 21.675 7.103 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -5.447 21.065 7.186 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -4.093 19.927 6.992 1.00 0.00 H new ATOM 249 N TRP A 16 -2.386 21.878 4.629 1.00 0.00 N ATOM 250 CA TRP A 16 -0.970 21.811 4.317 1.00 0.00 C ATOM 251 C TRP A 16 -0.285 22.600 5.426 1.00 0.00 C ATOM 252 O TRP A 16 -0.828 23.583 5.942 1.00 0.00 O ATOM 253 CB TRP A 16 -0.635 22.290 2.899 1.00 0.00 C ATOM 254 CG TRP A 16 -0.866 23.735 2.575 1.00 0.00 C ATOM 255 CD1 TRP A 16 -1.912 24.227 1.877 1.00 0.00 C ATOM 256 CD2 TRP A 16 -0.014 24.886 2.873 1.00 0.00 C ATOM 257 NE1 TRP A 16 -1.768 25.589 1.714 1.00 0.00 N ATOM 258 CE2 TRP A 16 -0.616 26.054 2.313 1.00 0.00 C ATOM 259 CE3 TRP A 16 1.213 25.062 3.548 1.00 0.00 C ATOM 260 CZ2 TRP A 16 -0.031 27.326 2.423 1.00 0.00 C ATOM 261 CZ3 TRP A 16 1.808 26.332 3.667 1.00 0.00 C ATOM 262 CH2 TRP A 16 1.188 27.464 3.107 1.00 0.00 C ATOM 0 H TRP A 16 -2.696 22.812 4.898 1.00 0.00 H new ATOM 0 HA TRP A 16 -0.609 20.783 4.296 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.416 22.069 2.711 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -1.217 21.693 2.198 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -2.738 23.641 1.502 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -2.432 26.179 1.212 1.00 0.00 H new ATOM 0 HE3 TRP A 16 1.706 24.204 3.982 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -0.513 28.188 1.987 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 2.746 26.438 4.191 1.00 0.00 H new ATOM 0 HH2 TRP A 16 1.648 28.436 3.203 1.00 0.00 H new ATOM 273 N LEU A 17 0.892 22.134 5.813 1.00 0.00 N ATOM 274 CA LEU A 17 1.610 22.582 6.996 1.00 0.00 C ATOM 275 C LEU A 17 3.091 22.627 6.649 1.00 0.00 C ATOM 276 O LEU A 17 3.645 21.646 6.166 1.00 0.00 O ATOM 277 CB LEU A 17 1.265 21.582 8.114 1.00 0.00 C ATOM 278 CG LEU A 17 2.266 21.436 9.271 1.00 0.00 C ATOM 279 CD1 LEU A 17 2.433 22.715 10.099 1.00 0.00 C ATOM 280 CD2 LEU A 17 1.737 20.312 10.164 1.00 0.00 C ATOM 0 H LEU A 17 1.390 21.410 5.295 1.00 0.00 H new ATOM 0 HA LEU A 17 1.335 23.581 7.335 1.00 0.00 H new ATOM 0 HB2 LEU A 17 0.302 21.869 8.537 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.133 20.601 7.658 1.00 0.00 H new ATOM 0 HG LEU A 17 3.252 21.220 8.859 1.00 0.00 H new ATOM 0 HD11 LEU A 17 3.154 22.540 10.898 1.00 0.00 H new ATOM 0 HD12 LEU A 17 2.791 23.520 9.457 1.00 0.00 H new ATOM 0 HD13 LEU A 17 1.473 22.996 10.532 1.00 0.00 H new ATOM 0 HD21 LEU A 17 2.414 20.166 11.005 1.00 0.00 H new ATOM 0 HD22 LEU A 17 0.748 20.578 10.536 1.00 0.00 H new ATOM 0 HD23 LEU A 17 1.671 19.389 9.587 1.00 0.00 H new ATOM 292 N ASN A 18 3.708 23.796 6.835 1.00 0.00 N ATOM 293 CA ASN A 18 5.078 24.178 6.462 1.00 0.00 C ATOM 294 C ASN A 18 5.224 24.365 4.947 1.00 0.00 C ATOM 295 O ASN A 18 6.009 25.203 4.503 1.00 0.00 O ATOM 296 CB ASN A 18 6.152 23.207 6.973 1.00 0.00 C ATOM 297 CG ASN A 18 6.152 23.016 8.484 1.00 0.00 C ATOM 298 OD1 ASN A 18 6.087 23.971 9.251 1.00 0.00 O ATOM 299 ND2 ASN A 18 6.255 21.780 8.941 1.00 0.00 N ATOM 0 H ASN A 18 3.222 24.569 7.290 1.00 0.00 H new ATOM 0 HA ASN A 18 5.248 25.133 6.960 1.00 0.00 H new ATOM 0 HB2 ASN A 18 6.007 22.238 6.495 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.132 23.571 6.664 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.282 21.608 9.946 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.308 20.998 8.289 1.00 0.00 H new ATOM 306 N GLY A 19 4.460 23.608 4.161 1.00 0.00 N ATOM 307 CA GLY A 19 4.426 23.634 2.706 1.00 0.00 C ATOM 308 C GLY A 19 3.895 22.303 2.180 1.00 0.00 C ATOM 309 O GLY A 19 3.632 21.385 2.957 1.00 0.00 O ATOM 0 H GLY A 19 3.812 22.922 4.548 1.00 0.00 H new ATOM 0 HA2 GLY A 19 3.792 24.451 2.362 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.426 23.819 2.312 1.00 0.00 H new ATOM 313 N GLU A 20 3.786 22.177 0.859 1.00 0.00 N ATOM 314 CA GLU A 20 3.498 20.945 0.147 1.00 0.00 C ATOM 315 C GLU A 20 4.376 20.886 -1.114 1.00 0.00 C ATOM 316 O GLU A 20 4.818 21.925 -1.613 1.00 0.00 O ATOM 317 CB GLU A 20 1.996 20.887 -0.167 1.00 0.00 C ATOM 318 CG GLU A 20 1.439 22.059 -0.992 1.00 0.00 C ATOM 319 CD GLU A 20 0.063 21.727 -1.597 1.00 0.00 C ATOM 320 OE1 GLU A 20 -0.976 21.950 -0.936 1.00 0.00 O ATOM 321 OE2 GLU A 20 0.007 21.260 -2.758 1.00 0.00 O ATOM 0 H GLU A 20 3.903 22.972 0.231 1.00 0.00 H new ATOM 0 HA GLU A 20 3.735 20.070 0.752 1.00 0.00 H new ATOM 0 HB2 GLU A 20 1.792 19.960 -0.703 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.449 20.838 0.774 1.00 0.00 H new ATOM 0 HG2 GLU A 20 1.354 22.942 -0.359 1.00 0.00 H new ATOM 0 HG3 GLU A 20 2.138 22.306 -1.791 1.00 0.00 H new ATOM 328 N VAL A 21 4.649 19.676 -1.615 1.00 0.00 N ATOM 329 CA VAL A 21 5.551 19.402 -2.739 1.00 0.00 C ATOM 330 C VAL A 21 4.989 18.177 -3.486 1.00 0.00 C ATOM 331 O VAL A 21 4.100 17.493 -2.968 1.00 0.00 O ATOM 332 CB VAL A 21 7.004 19.152 -2.241 1.00 0.00 C ATOM 333 CG1 VAL A 21 8.038 19.356 -3.361 1.00 0.00 C ATOM 334 CG2 VAL A 21 7.454 20.057 -1.085 1.00 0.00 C ATOM 0 H VAL A 21 4.231 18.827 -1.233 1.00 0.00 H new ATOM 0 HA VAL A 21 5.602 20.260 -3.410 1.00 0.00 H new ATOM 0 HB VAL A 21 6.967 18.119 -1.895 1.00 0.00 H new ATOM 0 HG11 VAL A 21 9.039 19.171 -2.970 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.833 18.662 -4.176 1.00 0.00 H new ATOM 0 HG13 VAL A 21 7.976 20.379 -3.731 1.00 0.00 H new ATOM 0 HG21 VAL A 21 8.478 19.809 -0.807 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.405 21.100 -1.399 1.00 0.00 H new ATOM 0 HG23 VAL A 21 6.798 19.905 -0.228 1.00 0.00 H new ATOM 344 N THR A 22 5.498 17.882 -4.684 1.00 0.00 N ATOM 345 CA THR A 22 4.955 16.869 -5.580 1.00 0.00 C ATOM 346 C THR A 22 6.043 15.912 -6.056 1.00 0.00 C ATOM 347 O THR A 22 7.237 16.205 -5.978 1.00 0.00 O ATOM 348 CB THR A 22 4.337 17.574 -6.800 1.00 0.00 C ATOM 349 OG1 THR A 22 5.266 18.493 -7.354 1.00 0.00 O ATOM 350 CG2 THR A 22 3.076 18.342 -6.442 1.00 0.00 C ATOM 0 H THR A 22 6.319 18.354 -5.063 1.00 0.00 H new ATOM 0 HA THR A 22 4.203 16.292 -5.042 1.00 0.00 H new ATOM 0 HB THR A 22 4.083 16.793 -7.517 1.00 0.00 H new ATOM 0 HG1 THR A 22 4.865 18.936 -8.131 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.677 18.822 -7.335 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.334 17.654 -6.037 1.00 0.00 H new ATOM 0 HG23 THR A 22 3.312 19.101 -5.696 1.00 0.00 H new ATOM 358 N ARG A 23 5.614 14.810 -6.673 1.00 0.00 N ATOM 359 CA ARG A 23 6.415 13.835 -7.407 1.00 0.00 C ATOM 360 C ARG A 23 7.151 14.408 -8.627 1.00 0.00 C ATOM 361 O ARG A 23 7.699 13.640 -9.413 1.00 0.00 O ATOM 362 CB ARG A 23 5.490 12.661 -7.791 1.00 0.00 C ATOM 363 CG ARG A 23 4.443 13.029 -8.866 1.00 0.00 C ATOM 364 CD ARG A 23 3.278 12.032 -8.930 1.00 0.00 C ATOM 365 NE ARG A 23 3.735 10.648 -9.124 1.00 0.00 N ATOM 366 CZ ARG A 23 3.958 10.023 -10.286 1.00 0.00 C ATOM 367 NH1 ARG A 23 3.748 10.633 -11.450 1.00 0.00 N ATOM 368 NH2 ARG A 23 4.400 8.772 -10.254 1.00 0.00 N ATOM 0 H ARG A 23 4.625 14.559 -6.671 1.00 0.00 H new ATOM 0 HA ARG A 23 7.221 13.497 -6.756 1.00 0.00 H new ATOM 0 HB2 ARG A 23 6.098 11.833 -8.156 1.00 0.00 H new ATOM 0 HB3 ARG A 23 4.974 12.308 -6.898 1.00 0.00 H new ATOM 0 HG2 ARG A 23 4.051 14.025 -8.659 1.00 0.00 H new ATOM 0 HG3 ARG A 23 4.930 13.074 -9.840 1.00 0.00 H new ATOM 0 HD2 ARG A 23 2.699 12.095 -8.009 1.00 0.00 H new ATOM 0 HD3 ARG A 23 2.611 12.309 -9.746 1.00 0.00 H new ATOM 0 HE ARG A 23 3.901 10.103 -8.278 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.411 11.595 -11.468 1.00 0.00 H new ATOM 0 HH12 ARG A 23 3.924 10.138 -12.324 1.00 0.00 H new ATOM 0 HH21 ARG A 23 4.561 8.311 -9.359 1.00 0.00 H new ATOM 0 HH22 ARG A 23 4.578 8.272 -11.125 1.00 0.00 H new ATOM 382 N GLU A 24 7.166 15.726 -8.824 1.00 0.00 N ATOM 383 CA GLU A 24 7.976 16.370 -9.859 1.00 0.00 C ATOM 384 C GLU A 24 8.777 17.564 -9.314 1.00 0.00 C ATOM 385 O GLU A 24 9.406 18.292 -10.084 1.00 0.00 O ATOM 386 CB GLU A 24 7.067 16.742 -11.043 1.00 0.00 C ATOM 387 CG GLU A 24 5.998 17.790 -10.693 1.00 0.00 C ATOM 388 CD GLU A 24 5.150 18.160 -11.923 1.00 0.00 C ATOM 389 OE1 GLU A 24 4.107 17.512 -12.169 1.00 0.00 O ATOM 390 OE2 GLU A 24 5.507 19.113 -12.652 1.00 0.00 O ATOM 0 H GLU A 24 6.615 16.380 -8.268 1.00 0.00 H new ATOM 0 HA GLU A 24 8.732 15.669 -10.213 1.00 0.00 H new ATOM 0 HB2 GLU A 24 7.683 17.122 -11.858 1.00 0.00 H new ATOM 0 HB3 GLU A 24 6.574 15.841 -11.409 1.00 0.00 H new ATOM 0 HG2 GLU A 24 5.351 17.403 -9.906 1.00 0.00 H new ATOM 0 HG3 GLU A 24 6.479 18.685 -10.298 1.00 0.00 H new ATOM 397 N GLN A 25 8.782 17.754 -7.989 1.00 0.00 N ATOM 398 CA GLN A 25 9.544 18.794 -7.296 1.00 0.00 C ATOM 399 C GLN A 25 10.358 18.185 -6.143 1.00 0.00 C ATOM 400 O GLN A 25 11.437 18.684 -5.825 1.00 0.00 O ATOM 401 CB GLN A 25 8.583 19.878 -6.783 1.00 0.00 C ATOM 402 CG GLN A 25 7.921 20.703 -7.894 1.00 0.00 C ATOM 403 CD GLN A 25 6.967 21.743 -7.300 1.00 0.00 C ATOM 404 OE1 GLN A 25 7.274 22.932 -7.240 1.00 0.00 O ATOM 405 NE2 GLN A 25 5.803 21.321 -6.831 1.00 0.00 N ATOM 0 H GLN A 25 8.239 17.170 -7.353 1.00 0.00 H new ATOM 0 HA GLN A 25 10.247 19.252 -7.992 1.00 0.00 H new ATOM 0 HB2 GLN A 25 7.805 19.405 -6.184 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.130 20.551 -6.122 1.00 0.00 H new ATOM 0 HG2 GLN A 25 8.686 21.202 -8.489 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.374 20.043 -8.567 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.559 20.332 -6.886 1.00 0.00 H new ATOM 0 HE22 GLN A 25 5.150 21.985 -6.414 1.00 0.00 H new ATOM 414 N LEU A 26 9.884 17.077 -5.557 1.00 0.00 N ATOM 415 CA LEU A 26 10.629 16.261 -4.601 1.00 0.00 C ATOM 416 C LEU A 26 11.806 15.554 -5.269 1.00 0.00 C ATOM 417 O LEU A 26 12.776 15.233 -4.592 1.00 0.00 O ATOM 418 CB LEU A 26 9.704 15.175 -4.010 1.00 0.00 C ATOM 419 CG LEU A 26 8.702 15.689 -2.965 1.00 0.00 C ATOM 420 CD1 LEU A 26 7.672 14.603 -2.644 1.00 0.00 C ATOM 421 CD2 LEU A 26 9.415 16.145 -1.684 1.00 0.00 C ATOM 0 H LEU A 26 8.947 16.718 -5.743 1.00 0.00 H new ATOM 0 HA LEU A 26 11.000 16.928 -3.823 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.152 14.705 -4.823 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.320 14.400 -3.553 1.00 0.00 H new ATOM 0 HG LEU A 26 8.189 16.553 -3.386 1.00 0.00 H new ATOM 0 HD11 LEU A 26 6.967 14.978 -1.902 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.134 14.332 -3.552 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.181 13.724 -2.249 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.678 16.503 -0.965 1.00 0.00 H new ATOM 0 HD22 LEU A 26 9.963 15.306 -1.255 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.111 16.950 -1.922 1.00 0.00 H new ATOM 433 N ILE A 27 11.740 15.313 -6.578 1.00 0.00 N ATOM 434 CA ILE A 27 12.685 14.459 -7.281 1.00 0.00 C ATOM 435 C ILE A 27 13.217 15.113 -8.553 1.00 0.00 C ATOM 436 O ILE A 27 12.690 16.125 -9.024 1.00 0.00 O ATOM 437 CB ILE A 27 12.065 13.069 -7.558 1.00 0.00 C ATOM 438 CG1 ILE A 27 10.546 13.064 -7.877 1.00 0.00 C ATOM 439 CG2 ILE A 27 12.413 12.115 -6.397 1.00 0.00 C ATOM 440 CD1 ILE A 27 10.067 11.670 -8.301 1.00 0.00 C ATOM 0 H ILE A 27 11.021 15.711 -7.182 1.00 0.00 H new ATOM 0 HA ILE A 27 13.548 14.315 -6.630 1.00 0.00 H new ATOM 0 HB ILE A 27 12.515 12.715 -8.486 1.00 0.00 H new ATOM 0 HG12 ILE A 27 9.988 13.391 -7.000 1.00 0.00 H new ATOM 0 HG13 ILE A 27 10.338 13.779 -8.672 1.00 0.00 H new ATOM 0 HG21 ILE A 27 11.978 11.134 -6.589 1.00 0.00 H new ATOM 0 HG22 ILE A 27 13.496 12.021 -6.315 1.00 0.00 H new ATOM 0 HG23 ILE A 27 12.012 12.514 -5.465 1.00 0.00 H new ATOM 0 HD11 ILE A 27 8.999 11.702 -8.517 1.00 0.00 H new ATOM 0 HD12 ILE A 27 10.608 11.355 -9.193 1.00 0.00 H new ATOM 0 HD13 ILE A 27 10.253 10.961 -7.495 1.00 0.00 H new ATOM 452 N GLY A 28 14.295 14.519 -9.072 1.00 0.00 N ATOM 453 CA GLY A 28 15.088 15.014 -10.184 1.00 0.00 C ATOM 454 C GLY A 28 16.518 15.343 -9.746 1.00 0.00 C ATOM 455 O GLY A 28 17.322 15.726 -10.597 1.00 0.00 O ATOM 0 H GLY A 28 14.650 13.636 -8.705 1.00 0.00 H new ATOM 0 HA2 GLY A 28 15.111 14.267 -10.977 1.00 0.00 H new ATOM 0 HA3 GLY A 28 14.619 15.906 -10.599 1.00 0.00 H new ATOM 459 N GLU A 29 16.853 15.222 -8.449 1.00 0.00 N ATOM 460 CA GLU A 29 18.126 15.725 -7.931 1.00 0.00 C ATOM 461 C GLU A 29 18.636 14.967 -6.697 1.00 0.00 C ATOM 462 O GLU A 29 19.780 14.511 -6.699 1.00 0.00 O ATOM 463 CB GLU A 29 17.932 17.209 -7.578 1.00 0.00 C ATOM 464 CG GLU A 29 19.279 17.940 -7.488 1.00 0.00 C ATOM 465 CD GLU A 29 19.117 19.374 -6.963 1.00 0.00 C ATOM 466 OE1 GLU A 29 18.783 20.290 -7.749 1.00 0.00 O ATOM 467 OE2 GLU A 29 19.351 19.592 -5.752 1.00 0.00 O ATOM 0 H GLU A 29 16.258 14.781 -7.747 1.00 0.00 H new ATOM 0 HA GLU A 29 18.881 15.580 -8.704 1.00 0.00 H new ATOM 0 HB2 GLU A 29 17.306 17.686 -8.332 1.00 0.00 H new ATOM 0 HB3 GLU A 29 17.405 17.293 -6.627 1.00 0.00 H new ATOM 0 HG2 GLU A 29 19.950 17.386 -6.831 1.00 0.00 H new ATOM 0 HG3 GLU A 29 19.746 17.964 -8.473 1.00 0.00 H new ATOM 474 N LYS A 30 17.808 14.803 -5.656 1.00 0.00 N ATOM 475 CA LYS A 30 18.198 14.189 -4.381 1.00 0.00 C ATOM 476 C LYS A 30 17.130 13.185 -3.942 1.00 0.00 C ATOM 477 O LYS A 30 15.970 13.379 -4.313 1.00 0.00 O ATOM 478 CB LYS A 30 18.335 15.273 -3.298 1.00 0.00 C ATOM 479 CG LYS A 30 19.470 16.280 -3.530 1.00 0.00 C ATOM 480 CD LYS A 30 19.413 17.349 -2.428 1.00 0.00 C ATOM 481 CE LYS A 30 20.631 18.283 -2.438 1.00 0.00 C ATOM 482 NZ LYS A 30 20.401 19.530 -3.209 1.00 0.00 N ATOM 0 H LYS A 30 16.832 15.099 -5.678 1.00 0.00 H new ATOM 0 HA LYS A 30 19.152 13.680 -4.514 1.00 0.00 H new ATOM 0 HB2 LYS A 30 17.394 15.818 -3.230 1.00 0.00 H new ATOM 0 HB3 LYS A 30 18.492 14.786 -2.335 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.434 15.772 -3.515 1.00 0.00 H new ATOM 0 HG3 LYS A 30 19.369 16.743 -4.511 1.00 0.00 H new ATOM 0 HD2 LYS A 30 18.506 17.941 -2.550 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.345 16.859 -1.457 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.893 18.540 -1.412 1.00 0.00 H new ATOM 0 HE3 LYS A 30 21.484 17.753 -2.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.315 19.933 -3.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 19.834 19.316 -4.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 19.893 20.216 -2.615 1.00 0.00 H new ATOM 496 N PRO A 31 17.485 12.130 -3.181 1.00 0.00 N ATOM 497 CA PRO A 31 16.525 11.195 -2.598 1.00 0.00 C ATOM 498 C PRO A 31 15.459 11.894 -1.748 1.00 0.00 C ATOM 499 O PRO A 31 15.571 13.080 -1.426 1.00 0.00 O ATOM 500 CB PRO A 31 17.348 10.200 -1.768 1.00 0.00 C ATOM 501 CG PRO A 31 18.739 10.284 -2.377 1.00 0.00 C ATOM 502 CD PRO A 31 18.841 11.742 -2.810 1.00 0.00 C ATOM 0 HA PRO A 31 15.964 10.690 -3.384 1.00 0.00 H new ATOM 0 HB2 PRO A 31 17.356 10.470 -0.712 1.00 0.00 H new ATOM 0 HB3 PRO A 31 16.942 9.191 -1.835 1.00 0.00 H new ATOM 0 HG2 PRO A 31 19.512 10.024 -1.654 1.00 0.00 H new ATOM 0 HG3 PRO A 31 18.851 9.604 -3.222 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.221 12.366 -2.002 1.00 0.00 H new ATOM 0 HD3 PRO A 31 19.526 11.856 -3.650 1.00 0.00 H new ATOM 510 N THR A 32 14.440 11.147 -1.336 1.00 0.00 N ATOM 511 CA THR A 32 13.293 11.674 -0.603 1.00 0.00 C ATOM 512 C THR A 32 12.912 10.730 0.540 1.00 0.00 C ATOM 513 O THR A 32 13.042 9.512 0.407 1.00 0.00 O ATOM 514 CB THR A 32 12.124 11.846 -1.595 1.00 0.00 C ATOM 515 OG1 THR A 32 12.486 12.720 -2.641 1.00 0.00 O ATOM 516 CG2 THR A 32 10.835 12.397 -0.979 1.00 0.00 C ATOM 0 H THR A 32 14.387 10.142 -1.504 1.00 0.00 H new ATOM 0 HA THR A 32 13.539 12.639 -0.159 1.00 0.00 H new ATOM 0 HB THR A 32 11.923 10.835 -1.949 1.00 0.00 H new ATOM 0 HG1 THR A 32 12.733 12.198 -3.433 1.00 0.00 H new ATOM 0 HG21 THR A 32 10.071 12.483 -1.751 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.487 11.721 -0.198 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.028 13.380 -0.549 1.00 0.00 H new ATOM 524 N LEU A 33 12.421 11.289 1.650 1.00 0.00 N ATOM 525 CA LEU A 33 11.786 10.556 2.736 1.00 0.00 C ATOM 526 C LEU A 33 10.368 11.094 2.775 1.00 0.00 C ATOM 527 O LEU A 33 10.188 12.293 2.990 1.00 0.00 O ATOM 528 CB LEU A 33 12.434 10.817 4.114 1.00 0.00 C ATOM 529 CG LEU A 33 11.574 10.280 5.291 1.00 0.00 C ATOM 530 CD1 LEU A 33 11.513 8.751 5.285 1.00 0.00 C ATOM 531 CD2 LEU A 33 12.088 10.755 6.649 1.00 0.00 C ATOM 0 H LEU A 33 12.458 12.294 1.817 1.00 0.00 H new ATOM 0 HA LEU A 33 11.869 9.484 2.557 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.417 10.347 4.144 1.00 0.00 H new ATOM 0 HB3 LEU A 33 12.589 11.888 4.241 1.00 0.00 H new ATOM 0 HG LEU A 33 10.573 10.684 5.141 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.904 8.408 6.121 1.00 0.00 H new ATOM 0 HD12 LEU A 33 11.071 8.408 4.349 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.521 8.346 5.380 1.00 0.00 H new ATOM 0 HD21 LEU A 33 11.454 10.353 7.439 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.111 10.407 6.793 1.00 0.00 H new ATOM 0 HD23 LEU A 33 12.067 11.844 6.685 1.00 0.00 H new ATOM 543 N ILE A 34 9.386 10.218 2.599 1.00 0.00 N ATOM 544 CA ILE A 34 7.996 10.544 2.854 1.00 0.00 C ATOM 545 C ILE A 34 7.687 9.736 4.109 1.00 0.00 C ATOM 546 O ILE A 34 7.982 8.538 4.148 1.00 0.00 O ATOM 547 CB ILE A 34 7.073 10.168 1.676 1.00 0.00 C ATOM 548 CG1 ILE A 34 7.654 10.639 0.322 1.00 0.00 C ATOM 549 CG2 ILE A 34 5.669 10.750 1.938 1.00 0.00 C ATOM 550 CD1 ILE A 34 6.748 10.356 -0.873 1.00 0.00 C ATOM 0 H ILE A 34 9.535 9.262 2.275 1.00 0.00 H new ATOM 0 HA ILE A 34 7.827 11.614 2.978 1.00 0.00 H new ATOM 0 HB ILE A 34 6.999 9.083 1.608 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.846 11.711 0.374 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.615 10.150 0.161 1.00 0.00 H new ATOM 0 HG21 ILE A 34 5.008 10.490 1.111 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.271 10.337 2.865 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.735 11.835 2.023 1.00 0.00 H new ATOM 0 HD11 ILE A 34 7.225 10.716 -1.785 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.576 9.283 -0.953 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.795 10.867 -0.736 1.00 0.00 H new ATOM 562 N HIS A 35 7.109 10.363 5.131 1.00 0.00 N ATOM 563 CA HIS A 35 6.643 9.625 6.296 1.00 0.00 C ATOM 564 C HIS A 35 5.172 9.928 6.563 1.00 0.00 C ATOM 565 O HIS A 35 4.639 10.949 6.129 1.00 0.00 O ATOM 566 CB HIS A 35 7.580 9.819 7.496 1.00 0.00 C ATOM 567 CG HIS A 35 7.293 11.016 8.357 1.00 0.00 C ATOM 568 ND1 HIS A 35 6.543 11.001 9.509 1.00 0.00 N ATOM 569 CD2 HIS A 35 7.743 12.295 8.173 1.00 0.00 C ATOM 570 CE1 HIS A 35 6.534 12.246 10.004 1.00 0.00 C ATOM 571 NE2 HIS A 35 7.255 13.077 9.230 1.00 0.00 N ATOM 0 H HIS A 35 6.954 11.370 5.174 1.00 0.00 H new ATOM 0 HA HIS A 35 6.686 8.555 6.095 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.533 8.926 8.119 1.00 0.00 H new ATOM 0 HB3 HIS A 35 8.603 9.896 7.127 1.00 0.00 H new ATOM 0 HD1 HIS A 35 6.077 10.189 9.914 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.363 12.641 7.359 1.00 0.00 H new ATOM 0 HE1 HIS A 35 6.017 12.543 10.904 1.00 0.00 H new ATOM 579 N PHE A 36 4.521 9.016 7.273 1.00 0.00 N ATOM 580 CA PHE A 36 3.087 8.947 7.482 1.00 0.00 C ATOM 581 C PHE A 36 2.897 8.833 8.987 1.00 0.00 C ATOM 582 O PHE A 36 3.582 8.020 9.607 1.00 0.00 O ATOM 583 CB PHE A 36 2.530 7.731 6.732 1.00 0.00 C ATOM 584 CG PHE A 36 2.669 7.851 5.223 1.00 0.00 C ATOM 585 CD1 PHE A 36 3.892 7.543 4.591 1.00 0.00 C ATOM 586 CD2 PHE A 36 1.576 8.281 4.444 1.00 0.00 C ATOM 587 CE1 PHE A 36 4.027 7.681 3.199 1.00 0.00 C ATOM 588 CE2 PHE A 36 1.711 8.416 3.051 1.00 0.00 C ATOM 589 CZ PHE A 36 2.936 8.121 2.428 1.00 0.00 C ATOM 0 H PHE A 36 5.014 8.259 7.746 1.00 0.00 H new ATOM 0 HA PHE A 36 2.555 9.820 7.103 1.00 0.00 H new ATOM 0 HB2 PHE A 36 3.049 6.834 7.069 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.477 7.605 6.986 1.00 0.00 H new ATOM 0 HD1 PHE A 36 4.729 7.199 5.180 1.00 0.00 H new ATOM 0 HD2 PHE A 36 0.632 8.507 4.918 1.00 0.00 H new ATOM 0 HE1 PHE A 36 4.968 7.449 2.722 1.00 0.00 H new ATOM 0 HE2 PHE A 36 0.871 8.747 2.458 1.00 0.00 H new ATOM 0 HZ PHE A 36 3.039 8.232 1.359 1.00 0.00 H new ATOM 599 N TRP A 37 2.026 9.634 9.598 1.00 0.00 N ATOM 600 CA TRP A 37 1.842 9.636 11.054 1.00 0.00 C ATOM 601 C TRP A 37 0.430 10.117 11.431 1.00 0.00 C ATOM 602 O TRP A 37 -0.296 10.621 10.572 1.00 0.00 O ATOM 603 CB TRP A 37 2.963 10.453 11.726 1.00 0.00 C ATOM 604 CG TRP A 37 3.129 11.873 11.287 1.00 0.00 C ATOM 605 CD1 TRP A 37 3.414 12.289 10.034 1.00 0.00 C ATOM 606 CD2 TRP A 37 3.062 13.083 12.097 1.00 0.00 C ATOM 607 NE1 TRP A 37 3.404 13.668 9.988 1.00 0.00 N ATOM 608 CE2 TRP A 37 3.183 14.214 11.235 1.00 0.00 C ATOM 609 CE3 TRP A 37 2.920 13.337 13.476 1.00 0.00 C ATOM 610 CZ2 TRP A 37 3.047 15.527 11.711 1.00 0.00 C ATOM 611 CZ3 TRP A 37 2.865 14.651 13.971 1.00 0.00 C ATOM 612 CH2 TRP A 37 2.881 15.743 13.090 1.00 0.00 C ATOM 0 H TRP A 37 1.429 10.298 9.104 1.00 0.00 H new ATOM 0 HA TRP A 37 1.921 8.616 11.431 1.00 0.00 H new ATOM 0 HB2 TRP A 37 2.785 10.450 12.801 1.00 0.00 H new ATOM 0 HB3 TRP A 37 3.907 9.934 11.558 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.619 11.640 9.195 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.543 14.215 9.138 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.852 12.507 14.164 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 3.070 16.362 11.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.810 14.821 15.036 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.766 16.747 13.471 1.00 0.00 H new ATOM 623 N SER A 38 0.052 9.940 12.701 1.00 0.00 N ATOM 624 CA SER A 38 -1.239 10.285 13.295 1.00 0.00 C ATOM 625 C SER A 38 -0.942 10.665 14.747 1.00 0.00 C ATOM 626 O SER A 38 -0.329 9.847 15.440 1.00 0.00 O ATOM 627 CB SER A 38 -2.180 9.072 13.254 1.00 0.00 C ATOM 628 OG SER A 38 -2.521 8.718 11.933 1.00 0.00 O ATOM 0 H SER A 38 0.684 9.524 13.385 1.00 0.00 H new ATOM 0 HA SER A 38 -1.724 11.098 12.755 1.00 0.00 H new ATOM 0 HB2 SER A 38 -1.702 8.225 13.745 1.00 0.00 H new ATOM 0 HB3 SER A 38 -3.087 9.296 13.816 1.00 0.00 H new ATOM 0 HG SER A 38 -2.911 9.493 11.477 1.00 0.00 H new ATOM 634 N ILE A 39 -1.307 11.871 15.217 1.00 0.00 N ATOM 635 CA ILE A 39 -0.907 12.340 16.555 1.00 0.00 C ATOM 636 C ILE A 39 -1.342 11.381 17.677 1.00 0.00 C ATOM 637 O ILE A 39 -0.728 11.373 18.742 1.00 0.00 O ATOM 638 CB ILE A 39 -1.303 13.813 16.867 1.00 0.00 C ATOM 639 CG1 ILE A 39 -2.762 14.060 17.325 1.00 0.00 C ATOM 640 CG2 ILE A 39 -0.923 14.758 15.716 1.00 0.00 C ATOM 641 CD1 ILE A 39 -2.993 15.503 17.796 1.00 0.00 C ATOM 0 H ILE A 39 -1.876 12.536 14.693 1.00 0.00 H new ATOM 0 HA ILE A 39 0.183 12.334 16.526 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.708 14.045 17.750 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -3.441 13.837 16.502 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.007 13.373 18.135 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -1.215 15.777 15.970 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.154 14.719 15.554 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -1.438 14.449 14.806 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -4.031 15.623 18.106 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.336 15.721 18.638 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.777 16.191 16.979 1.00 0.00 H new ATOM 653 N SER A 40 -2.368 10.560 17.457 1.00 0.00 N ATOM 654 CA SER A 40 -2.829 9.569 18.425 1.00 0.00 C ATOM 655 C SER A 40 -1.816 8.438 18.702 1.00 0.00 C ATOM 656 O SER A 40 -1.985 7.720 19.692 1.00 0.00 O ATOM 657 CB SER A 40 -4.157 8.975 17.944 1.00 0.00 C ATOM 658 OG SER A 40 -5.086 9.995 17.638 1.00 0.00 O ATOM 0 H SER A 40 -2.908 10.565 16.592 1.00 0.00 H new ATOM 0 HA SER A 40 -2.954 10.094 19.372 1.00 0.00 H new ATOM 0 HB2 SER A 40 -3.985 8.358 17.062 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.568 8.323 18.714 1.00 0.00 H new ATOM 0 HG SER A 40 -5.063 10.181 16.676 1.00 0.00 H new ATOM 664 N CYS A 41 -0.790 8.234 17.864 1.00 0.00 N ATOM 665 CA CYS A 41 0.094 7.075 17.944 1.00 0.00 C ATOM 666 C CYS A 41 1.357 7.458 18.714 1.00 0.00 C ATOM 667 O CYS A 41 2.129 8.289 18.237 1.00 0.00 O ATOM 668 CB CYS A 41 0.449 6.609 16.522 1.00 0.00 C ATOM 669 SG CYS A 41 -1.052 6.093 15.633 1.00 0.00 S ATOM 0 H CYS A 41 -0.553 8.876 17.108 1.00 0.00 H new ATOM 0 HA CYS A 41 -0.403 6.259 18.467 1.00 0.00 H new ATOM 0 HB2 CYS A 41 0.941 7.416 15.980 1.00 0.00 H new ATOM 0 HB3 CYS A 41 1.155 5.780 16.569 1.00 0.00 H new ATOM 0 HG CYS A 41 -0.734 5.705 14.434 1.00 0.00 H new ATOM 675 N HIS A 42 1.619 6.841 19.868 1.00 0.00 N ATOM 676 CA HIS A 42 2.792 7.183 20.676 1.00 0.00 C ATOM 677 C HIS A 42 4.110 6.945 19.923 1.00 0.00 C ATOM 678 O HIS A 42 5.077 7.692 20.088 1.00 0.00 O ATOM 679 CB HIS A 42 2.766 6.441 22.022 1.00 0.00 C ATOM 680 CG HIS A 42 2.827 4.933 21.919 1.00 0.00 C ATOM 681 ND1 HIS A 42 1.756 4.064 21.948 1.00 0.00 N ATOM 682 CD2 HIS A 42 3.959 4.170 21.801 1.00 0.00 C ATOM 683 CE1 HIS A 42 2.232 2.812 21.842 1.00 0.00 C ATOM 684 NE2 HIS A 42 3.576 2.823 21.747 1.00 0.00 N ATOM 0 H HIS A 42 1.036 6.103 20.264 1.00 0.00 H new ATOM 0 HA HIS A 42 2.743 8.253 20.880 1.00 0.00 H new ATOM 0 HB2 HIS A 42 3.606 6.784 22.626 1.00 0.00 H new ATOM 0 HB3 HIS A 42 1.857 6.718 22.555 1.00 0.00 H new ATOM 0 HD2 HIS A 42 4.972 4.542 21.757 1.00 0.00 H new ATOM 0 HE1 HIS A 42 1.622 1.921 21.834 1.00 0.00 H new ATOM 0 HE2 HIS A 42 4.191 2.014 21.654 1.00 0.00 H new ATOM 692 N LEU A 43 4.136 5.946 19.035 1.00 0.00 N ATOM 693 CA LEU A 43 5.290 5.681 18.182 1.00 0.00 C ATOM 694 C LEU A 43 5.621 6.898 17.325 1.00 0.00 C ATOM 695 O LEU A 43 6.805 7.196 17.145 1.00 0.00 O ATOM 696 CB LEU A 43 5.028 4.465 17.271 1.00 0.00 C ATOM 697 CG LEU A 43 5.305 3.104 17.930 1.00 0.00 C ATOM 698 CD1 LEU A 43 4.774 1.982 17.031 1.00 0.00 C ATOM 699 CD2 LEU A 43 6.803 2.890 18.167 1.00 0.00 C ATOM 0 H LEU A 43 3.358 5.302 18.890 1.00 0.00 H new ATOM 0 HA LEU A 43 6.139 5.463 18.831 1.00 0.00 H new ATOM 0 HB2 LEU A 43 3.989 4.491 16.942 1.00 0.00 H new ATOM 0 HB3 LEU A 43 5.647 4.555 16.379 1.00 0.00 H new ATOM 0 HG LEU A 43 4.799 3.089 18.895 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.971 1.017 17.499 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.700 2.105 16.891 1.00 0.00 H new ATOM 0 HD13 LEU A 43 5.273 2.024 16.063 1.00 0.00 H new ATOM 0 HD21 LEU A 43 6.962 1.918 18.634 1.00 0.00 H new ATOM 0 HD22 LEU A 43 7.331 2.925 17.214 1.00 0.00 H new ATOM 0 HD23 LEU A 43 7.183 3.674 18.822 1.00 0.00 H new ATOM 711 N CYS A 44 4.609 7.630 16.830 1.00 0.00 N ATOM 712 CA CYS A 44 4.897 8.866 16.124 1.00 0.00 C ATOM 713 C CYS A 44 5.527 9.865 17.079 1.00 0.00 C ATOM 714 O CYS A 44 6.489 10.497 16.688 1.00 0.00 O ATOM 715 CB CYS A 44 3.717 9.427 15.315 1.00 0.00 C ATOM 716 SG CYS A 44 2.628 10.548 16.237 1.00 0.00 S ATOM 0 H CYS A 44 3.621 7.390 16.907 1.00 0.00 H new ATOM 0 HA CYS A 44 5.626 8.639 15.346 1.00 0.00 H new ATOM 0 HB2 CYS A 44 4.109 9.956 14.447 1.00 0.00 H new ATOM 0 HB3 CYS A 44 3.123 8.594 14.939 1.00 0.00 H new ATOM 0 HG CYS A 44 1.389 10.294 15.936 1.00 0.00 H new ATOM 722 N LYS A 45 5.099 9.971 18.341 1.00 0.00 N ATOM 723 CA LYS A 45 5.682 10.940 19.271 1.00 0.00 C ATOM 724 C LYS A 45 7.157 10.701 19.557 1.00 0.00 C ATOM 725 O LYS A 45 7.815 11.625 20.024 1.00 0.00 O ATOM 726 CB LYS A 45 4.955 10.957 20.613 1.00 0.00 C ATOM 727 CG LYS A 45 3.440 11.205 20.531 1.00 0.00 C ATOM 728 CD LYS A 45 3.095 12.401 19.626 1.00 0.00 C ATOM 729 CE LYS A 45 1.668 12.910 19.854 1.00 0.00 C ATOM 730 NZ LYS A 45 1.510 13.667 21.124 1.00 0.00 N ATOM 0 H LYS A 45 4.354 9.400 18.740 1.00 0.00 H new ATOM 0 HA LYS A 45 5.570 11.896 18.760 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.125 10.003 21.113 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.400 11.729 21.240 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.947 10.310 20.151 1.00 0.00 H new ATOM 0 HG3 LYS A 45 3.048 11.384 21.532 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.801 13.210 19.812 1.00 0.00 H new ATOM 0 HD3 LYS A 45 3.212 12.110 18.582 1.00 0.00 H new ATOM 0 HE2 LYS A 45 1.380 13.549 19.020 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.983 12.062 19.857 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 0.524 13.984 21.219 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 1.756 13.053 21.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 2.140 14.494 21.116 1.00 0.00 H new ATOM 744 N GLU A 46 7.675 9.499 19.325 1.00 0.00 N ATOM 745 CA GLU A 46 9.113 9.236 19.437 1.00 0.00 C ATOM 746 C GLU A 46 9.818 9.560 18.103 1.00 0.00 C ATOM 747 O GLU A 46 10.864 10.230 18.030 1.00 0.00 O ATOM 748 CB GLU A 46 9.309 7.769 19.857 1.00 0.00 C ATOM 749 CG GLU A 46 8.493 7.423 21.117 1.00 0.00 C ATOM 750 CD GLU A 46 8.867 6.040 21.676 1.00 0.00 C ATOM 751 OE1 GLU A 46 8.457 5.012 21.093 1.00 0.00 O ATOM 752 OE2 GLU A 46 9.559 5.973 22.718 1.00 0.00 O ATOM 0 H GLU A 46 7.121 8.686 19.057 1.00 0.00 H new ATOM 0 HA GLU A 46 9.563 9.877 20.195 1.00 0.00 H new ATOM 0 HB2 GLU A 46 9.011 7.113 19.039 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.366 7.583 20.046 1.00 0.00 H new ATOM 0 HG2 GLU A 46 8.663 8.182 21.880 1.00 0.00 H new ATOM 0 HG3 GLU A 46 7.430 7.444 20.879 1.00 0.00 H new ATOM 759 N ALA A 47 9.195 9.142 17.000 1.00 0.00 N ATOM 760 CA ALA A 47 9.722 9.455 15.689 1.00 0.00 C ATOM 761 C ALA A 47 9.697 10.960 15.443 1.00 0.00 C ATOM 762 O ALA A 47 10.561 11.433 14.737 1.00 0.00 O ATOM 763 CB ALA A 47 8.944 8.704 14.609 1.00 0.00 C ATOM 0 H ALA A 47 8.335 8.593 16.996 1.00 0.00 H new ATOM 0 HA ALA A 47 10.761 9.129 15.645 1.00 0.00 H new ATOM 0 HB1 ALA A 47 9.352 8.950 13.629 1.00 0.00 H new ATOM 0 HB2 ALA A 47 9.030 7.631 14.779 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.894 8.995 14.648 1.00 0.00 H new ATOM 769 N MET A 48 8.781 11.730 16.024 1.00 0.00 N ATOM 770 CA MET A 48 8.603 13.151 15.775 1.00 0.00 C ATOM 771 C MET A 48 9.811 13.992 16.211 1.00 0.00 C ATOM 772 O MET A 48 10.315 14.750 15.380 1.00 0.00 O ATOM 773 CB MET A 48 7.270 13.645 16.381 1.00 0.00 C ATOM 774 CG MET A 48 5.993 13.249 15.604 1.00 0.00 C ATOM 775 SD MET A 48 6.180 12.505 13.951 1.00 0.00 S ATOM 776 CE MET A 48 6.567 14.018 13.042 1.00 0.00 C ATOM 0 H MET A 48 8.118 11.363 16.707 1.00 0.00 H new ATOM 0 HA MET A 48 8.543 13.291 14.696 1.00 0.00 H new ATOM 0 HB2 MET A 48 7.189 13.259 17.397 1.00 0.00 H new ATOM 0 HB3 MET A 48 7.306 14.732 16.454 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.432 12.548 16.222 1.00 0.00 H new ATOM 0 HG3 MET A 48 5.378 14.143 15.498 1.00 0.00 H new ATOM 0 HE1 MET A 48 7.268 13.791 12.239 1.00 0.00 H new ATOM 0 HE2 MET A 48 5.652 14.432 12.619 1.00 0.00 H new ATOM 0 HE3 MET A 48 7.015 14.745 13.719 1.00 0.00 H new ATOM 786 N PRO A 49 10.359 13.861 17.434 1.00 0.00 N ATOM 787 CA PRO A 49 11.625 14.488 17.764 1.00 0.00 C ATOM 788 C PRO A 49 12.732 13.947 16.862 1.00 0.00 C ATOM 789 O PRO A 49 13.591 14.730 16.451 1.00 0.00 O ATOM 790 CB PRO A 49 11.888 14.205 19.246 1.00 0.00 C ATOM 791 CG PRO A 49 10.975 13.032 19.580 1.00 0.00 C ATOM 792 CD PRO A 49 9.815 13.202 18.601 1.00 0.00 C ATOM 0 HA PRO A 49 11.598 15.565 17.598 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.934 13.956 19.423 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.659 15.074 19.863 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.481 12.076 19.443 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.636 13.068 20.615 1.00 0.00 H new ATOM 0 HD2 PRO A 49 9.385 12.236 18.336 1.00 0.00 H new ATOM 0 HD3 PRO A 49 9.016 13.796 19.045 1.00 0.00 H new ATOM 800 N GLN A 50 12.708 12.656 16.491 1.00 0.00 N ATOM 801 CA GLN A 50 13.730 12.190 15.553 1.00 0.00 C ATOM 802 C GLN A 50 13.597 12.836 14.170 1.00 0.00 C ATOM 803 O GLN A 50 14.612 13.173 13.569 1.00 0.00 O ATOM 804 CB GLN A 50 13.775 10.667 15.467 1.00 0.00 C ATOM 805 CG GLN A 50 14.310 10.103 16.783 1.00 0.00 C ATOM 806 CD GLN A 50 14.652 8.629 16.624 1.00 0.00 C ATOM 807 OE1 GLN A 50 13.859 7.749 16.931 1.00 0.00 O ATOM 808 NE2 GLN A 50 15.810 8.308 16.076 1.00 0.00 N ATOM 0 H GLN A 50 12.035 11.957 16.805 1.00 0.00 H new ATOM 0 HA GLN A 50 14.688 12.517 15.956 1.00 0.00 H new ATOM 0 HB2 GLN A 50 12.779 10.273 15.267 1.00 0.00 H new ATOM 0 HB3 GLN A 50 14.412 10.357 14.639 1.00 0.00 H new ATOM 0 HG2 GLN A 50 15.196 10.658 17.091 1.00 0.00 H new ATOM 0 HG3 GLN A 50 13.566 10.228 17.570 1.00 0.00 H new ATOM 0 HE21 GLN A 50 16.473 9.039 15.819 1.00 0.00 H new ATOM 0 HE22 GLN A 50 16.041 7.329 15.910 1.00 0.00 H new ATOM 817 N VAL A 51 12.380 13.074 13.680 1.00 0.00 N ATOM 818 CA VAL A 51 12.094 13.773 12.436 1.00 0.00 C ATOM 819 C VAL A 51 12.699 15.174 12.535 1.00 0.00 C ATOM 820 O VAL A 51 13.244 15.632 11.537 1.00 0.00 O ATOM 821 CB VAL A 51 10.571 13.754 12.120 1.00 0.00 C ATOM 822 CG1 VAL A 51 10.154 14.702 10.989 1.00 0.00 C ATOM 823 CG2 VAL A 51 10.062 12.367 11.684 1.00 0.00 C ATOM 0 H VAL A 51 11.534 12.770 14.163 1.00 0.00 H new ATOM 0 HA VAL A 51 12.554 13.270 11.585 1.00 0.00 H new ATOM 0 HB VAL A 51 10.134 14.067 13.068 1.00 0.00 H new ATOM 0 HG11 VAL A 51 9.078 14.629 10.831 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.412 15.726 11.259 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.675 14.426 10.072 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.993 12.420 11.478 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.590 12.052 10.784 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.243 11.646 12.481 1.00 0.00 H new ATOM 833 N ASN A 52 12.705 15.832 13.706 1.00 0.00 N ATOM 834 CA ASN A 52 13.342 17.143 13.839 1.00 0.00 C ATOM 835 C ASN A 52 14.856 17.073 13.584 1.00 0.00 C ATOM 836 O ASN A 52 15.380 17.859 12.783 1.00 0.00 O ATOM 837 CB ASN A 52 12.986 17.793 15.191 1.00 0.00 C ATOM 838 CG ASN A 52 14.189 18.139 16.073 1.00 0.00 C ATOM 839 OD1 ASN A 52 14.823 19.174 15.906 1.00 0.00 O ATOM 840 ND2 ASN A 52 14.548 17.281 17.010 1.00 0.00 N ATOM 0 H ASN A 52 12.280 15.478 14.563 1.00 0.00 H new ATOM 0 HA ASN A 52 12.942 17.794 13.062 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.418 18.704 15.002 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.332 17.118 15.742 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.357 17.478 17.599 1.00 0.00 H new ATOM 0 HD22 ASN A 52 14.016 16.421 17.145 1.00 0.00 H new ATOM 847 N GLU A 53 15.574 16.144 14.223 1.00 0.00 N ATOM 848 CA GLU A 53 17.028 16.118 14.049 1.00 0.00 C ATOM 849 C GLU A 53 17.390 15.564 12.670 1.00 0.00 C ATOM 850 O GLU A 53 18.326 16.048 12.036 1.00 0.00 O ATOM 851 CB GLU A 53 17.752 15.387 15.191 1.00 0.00 C ATOM 852 CG GLU A 53 17.414 13.900 15.353 1.00 0.00 C ATOM 853 CD GLU A 53 18.408 13.211 16.300 1.00 0.00 C ATOM 854 OE1 GLU A 53 19.502 12.825 15.826 1.00 0.00 O ATOM 855 OE2 GLU A 53 18.106 13.043 17.503 1.00 0.00 O ATOM 0 H GLU A 53 15.192 15.428 14.841 1.00 0.00 H new ATOM 0 HA GLU A 53 17.386 17.146 14.099 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.826 15.481 15.033 1.00 0.00 H new ATOM 0 HB3 GLU A 53 17.522 15.896 16.127 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.401 13.794 15.742 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.434 13.410 14.379 1.00 0.00 H new ATOM 862 N PHE A 54 16.615 14.606 12.161 1.00 0.00 N ATOM 863 CA PHE A 54 16.758 14.039 10.837 1.00 0.00 C ATOM 864 C PHE A 54 16.616 15.164 9.819 1.00 0.00 C ATOM 865 O PHE A 54 17.438 15.306 8.915 1.00 0.00 O ATOM 866 CB PHE A 54 15.667 12.975 10.675 1.00 0.00 C ATOM 867 CG PHE A 54 15.586 12.365 9.301 1.00 0.00 C ATOM 868 CD1 PHE A 54 14.940 13.062 8.264 1.00 0.00 C ATOM 869 CD2 PHE A 54 16.145 11.099 9.062 1.00 0.00 C ATOM 870 CE1 PHE A 54 14.922 12.526 6.970 1.00 0.00 C ATOM 871 CE2 PHE A 54 16.085 10.544 7.774 1.00 0.00 C ATOM 872 CZ PHE A 54 15.504 11.276 6.722 1.00 0.00 C ATOM 0 H PHE A 54 15.844 14.194 12.686 1.00 0.00 H new ATOM 0 HA PHE A 54 17.730 13.570 10.685 1.00 0.00 H new ATOM 0 HB2 PHE A 54 15.842 12.181 11.401 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.703 13.422 10.917 1.00 0.00 H new ATOM 0 HD1 PHE A 54 14.459 14.008 8.465 1.00 0.00 H new ATOM 0 HD2 PHE A 54 16.619 10.555 9.866 1.00 0.00 H new ATOM 0 HE1 PHE A 54 14.460 13.076 6.164 1.00 0.00 H new ATOM 0 HE2 PHE A 54 16.484 9.557 7.591 1.00 0.00 H new ATOM 0 HZ PHE A 54 15.507 10.873 5.720 1.00 0.00 H new ATOM 882 N ARG A 55 15.588 16.002 10.003 1.00 0.00 N ATOM 883 CA ARG A 55 15.304 17.111 9.117 1.00 0.00 C ATOM 884 C ARG A 55 16.510 18.018 9.019 1.00 0.00 C ATOM 885 O ARG A 55 16.859 18.402 7.912 1.00 0.00 O ATOM 886 CB ARG A 55 13.994 17.808 9.543 1.00 0.00 C ATOM 887 CG ARG A 55 13.698 19.231 9.016 1.00 0.00 C ATOM 888 CD ARG A 55 14.526 20.373 9.644 1.00 0.00 C ATOM 889 NE ARG A 55 14.731 20.188 11.096 1.00 0.00 N ATOM 890 CZ ARG A 55 14.161 20.852 12.110 1.00 0.00 C ATOM 891 NH1 ARG A 55 13.268 21.806 11.921 1.00 0.00 N ATOM 892 NH2 ARG A 55 14.477 20.539 13.355 1.00 0.00 N ATOM 0 H ARG A 55 14.932 15.919 10.780 1.00 0.00 H new ATOM 0 HA ARG A 55 15.125 16.759 8.101 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.166 17.166 9.241 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.983 17.851 10.632 1.00 0.00 H new ATOM 0 HG2 ARG A 55 13.864 19.239 7.939 1.00 0.00 H new ATOM 0 HG3 ARG A 55 12.641 19.444 9.178 1.00 0.00 H new ATOM 0 HD2 ARG A 55 15.495 20.431 9.148 1.00 0.00 H new ATOM 0 HD3 ARG A 55 14.021 21.323 9.469 1.00 0.00 H new ATOM 0 HE ARG A 55 15.394 19.459 11.361 1.00 0.00 H new ATOM 0 HH11 ARG A 55 12.988 22.062 10.974 1.00 0.00 H new ATOM 0 HH12 ARG A 55 12.858 22.287 12.722 1.00 0.00 H new ATOM 0 HH21 ARG A 55 15.151 19.796 13.539 1.00 0.00 H new ATOM 0 HH22 ARG A 55 14.047 21.041 14.132 1.00 0.00 H new ATOM 906 N ASP A 56 17.170 18.349 10.131 1.00 0.00 N ATOM 907 CA ASP A 56 18.296 19.275 10.073 1.00 0.00 C ATOM 908 C ASP A 56 19.493 18.610 9.407 1.00 0.00 C ATOM 909 O ASP A 56 20.152 19.216 8.559 1.00 0.00 O ATOM 910 CB ASP A 56 18.681 19.716 11.477 1.00 0.00 C ATOM 911 CG ASP A 56 19.912 20.636 11.447 1.00 0.00 C ATOM 912 OD1 ASP A 56 19.783 21.808 11.030 1.00 0.00 O ATOM 913 OD2 ASP A 56 21.009 20.200 11.863 1.00 0.00 O ATOM 0 H ASP A 56 16.949 17.997 11.062 1.00 0.00 H new ATOM 0 HA ASP A 56 17.998 20.145 9.488 1.00 0.00 H new ATOM 0 HB2 ASP A 56 17.844 20.238 11.941 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.891 18.841 12.092 1.00 0.00 H new ATOM 918 N LYS A 57 19.751 17.346 9.757 1.00 0.00 N ATOM 919 CA LYS A 57 20.917 16.633 9.261 1.00 0.00 C ATOM 920 C LYS A 57 20.844 16.400 7.753 1.00 0.00 C ATOM 921 O LYS A 57 21.891 16.384 7.099 1.00 0.00 O ATOM 922 CB LYS A 57 21.090 15.302 10.007 1.00 0.00 C ATOM 923 CG LYS A 57 21.541 15.519 11.464 1.00 0.00 C ATOM 924 CD LYS A 57 21.646 14.223 12.282 1.00 0.00 C ATOM 925 CE LYS A 57 20.323 13.446 12.304 1.00 0.00 C ATOM 926 NZ LYS A 57 20.345 12.313 13.250 1.00 0.00 N ATOM 0 H LYS A 57 19.161 16.800 10.385 1.00 0.00 H new ATOM 0 HA LYS A 57 21.789 17.259 9.451 1.00 0.00 H new ATOM 0 HB2 LYS A 57 20.148 14.754 9.996 1.00 0.00 H new ATOM 0 HB3 LYS A 57 21.824 14.686 9.487 1.00 0.00 H new ATOM 0 HG2 LYS A 57 22.511 16.017 11.464 1.00 0.00 H new ATOM 0 HG3 LYS A 57 20.838 16.191 11.955 1.00 0.00 H new ATOM 0 HD2 LYS A 57 22.430 13.592 11.862 1.00 0.00 H new ATOM 0 HD3 LYS A 57 21.942 14.462 13.303 1.00 0.00 H new ATOM 0 HE2 LYS A 57 19.513 14.123 12.573 1.00 0.00 H new ATOM 0 HE3 LYS A 57 20.108 13.074 11.302 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 19.518 11.705 13.083 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 21.215 11.760 13.109 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 20.318 12.674 14.225 1.00 0.00 H new ATOM 940 N TYR A 58 19.641 16.258 7.188 1.00 0.00 N ATOM 941 CA TYR A 58 19.479 15.813 5.808 1.00 0.00 C ATOM 942 C TYR A 58 18.728 16.805 4.924 1.00 0.00 C ATOM 943 O TYR A 58 18.614 16.517 3.735 1.00 0.00 O ATOM 944 CB TYR A 58 18.879 14.393 5.779 1.00 0.00 C ATOM 945 CG TYR A 58 19.600 13.408 6.689 1.00 0.00 C ATOM 946 CD1 TYR A 58 20.977 13.161 6.530 1.00 0.00 C ATOM 947 CD2 TYR A 58 18.911 12.809 7.759 1.00 0.00 C ATOM 948 CE1 TYR A 58 21.677 12.388 7.474 1.00 0.00 C ATOM 949 CE2 TYR A 58 19.597 12.026 8.702 1.00 0.00 C ATOM 950 CZ TYR A 58 20.991 11.836 8.580 1.00 0.00 C ATOM 951 OH TYR A 58 21.659 11.137 9.542 1.00 0.00 O ATOM 0 H TYR A 58 18.763 16.447 7.672 1.00 0.00 H new ATOM 0 HA TYR A 58 20.472 15.769 5.360 1.00 0.00 H new ATOM 0 HB2 TYR A 58 17.830 14.445 6.072 1.00 0.00 H new ATOM 0 HB3 TYR A 58 18.906 14.017 4.756 1.00 0.00 H new ATOM 0 HD1 TYR A 58 21.500 13.568 5.677 1.00 0.00 H new ATOM 0 HD2 TYR A 58 17.845 12.952 7.856 1.00 0.00 H new ATOM 0 HE1 TYR A 58 22.737 12.217 7.354 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.059 11.570 9.520 1.00 0.00 H new ATOM 0 HH TYR A 58 21.025 10.833 10.225 1.00 0.00 H new ATOM 961 N GLN A 59 18.295 17.983 5.405 1.00 0.00 N ATOM 962 CA GLN A 59 17.639 18.976 4.532 1.00 0.00 C ATOM 963 C GLN A 59 18.484 19.423 3.321 1.00 0.00 C ATOM 964 O GLN A 59 17.933 19.949 2.352 1.00 0.00 O ATOM 965 CB GLN A 59 17.093 20.189 5.318 1.00 0.00 C ATOM 966 CG GLN A 59 18.036 20.890 6.316 1.00 0.00 C ATOM 967 CD GLN A 59 19.348 21.395 5.721 1.00 0.00 C ATOM 968 OE1 GLN A 59 19.361 22.215 4.807 1.00 0.00 O ATOM 969 NE2 GLN A 59 20.474 20.920 6.232 1.00 0.00 N ATOM 0 H GLN A 59 18.385 18.270 6.380 1.00 0.00 H new ATOM 0 HA GLN A 59 16.788 18.440 4.112 1.00 0.00 H new ATOM 0 HB2 GLN A 59 16.760 20.933 4.594 1.00 0.00 H new ATOM 0 HB3 GLN A 59 16.210 19.861 5.867 1.00 0.00 H new ATOM 0 HG2 GLN A 59 17.508 21.734 6.760 1.00 0.00 H new ATOM 0 HG3 GLN A 59 18.265 20.196 7.125 1.00 0.00 H new ATOM 0 HE21 GLN A 59 20.442 20.239 6.991 1.00 0.00 H new ATOM 0 HE22 GLN A 59 21.373 21.235 5.866 1.00 0.00 H new ATOM 978 N ASP A 60 19.800 19.194 3.347 1.00 0.00 N ATOM 979 CA ASP A 60 20.739 19.549 2.275 1.00 0.00 C ATOM 980 C ASP A 60 21.177 18.311 1.474 1.00 0.00 C ATOM 981 O ASP A 60 22.061 18.392 0.623 1.00 0.00 O ATOM 982 CB ASP A 60 21.948 20.274 2.893 1.00 0.00 C ATOM 983 CG ASP A 60 22.912 20.849 1.840 1.00 0.00 C ATOM 984 OD1 ASP A 60 22.477 21.646 0.979 1.00 0.00 O ATOM 985 OD2 ASP A 60 24.131 20.568 1.913 1.00 0.00 O ATOM 0 H ASP A 60 20.257 18.742 4.139 1.00 0.00 H new ATOM 0 HA ASP A 60 20.241 20.214 1.569 1.00 0.00 H new ATOM 0 HB2 ASP A 60 21.592 21.083 3.530 1.00 0.00 H new ATOM 0 HB3 ASP A 60 22.492 19.580 3.533 1.00 0.00 H new ATOM 990 N GLN A 61 20.565 17.149 1.734 1.00 0.00 N ATOM 991 CA GLN A 61 20.999 15.846 1.228 1.00 0.00 C ATOM 992 C GLN A 61 19.829 15.003 0.701 1.00 0.00 C ATOM 993 O GLN A 61 20.038 14.154 -0.164 1.00 0.00 O ATOM 994 CB GLN A 61 21.739 15.079 2.343 1.00 0.00 C ATOM 995 CG GLN A 61 22.915 15.864 2.951 1.00 0.00 C ATOM 996 CD GLN A 61 23.787 14.987 3.850 1.00 0.00 C ATOM 997 OE1 GLN A 61 24.592 14.191 3.373 1.00 0.00 O ATOM 998 NE2 GLN A 61 23.667 15.107 5.164 1.00 0.00 N ATOM 0 H GLN A 61 19.731 17.090 2.319 1.00 0.00 H new ATOM 0 HA GLN A 61 21.669 16.027 0.388 1.00 0.00 H new ATOM 0 HB2 GLN A 61 21.031 14.830 3.134 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.111 14.137 1.940 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.525 16.281 2.150 1.00 0.00 H new ATOM 0 HG3 GLN A 61 22.530 16.704 3.528 1.00 0.00 H new ATOM 0 HE21 GLN A 61 22.998 15.769 5.557 1.00 0.00 H new ATOM 0 HE22 GLN A 61 24.244 14.537 5.783 1.00 0.00 H new ATOM 1007 N LEU A 62 18.605 15.232 1.184 1.00 0.00 N ATOM 1008 CA LEU A 62 17.408 14.463 0.883 1.00 0.00 C ATOM 1009 C LEU A 62 16.215 15.396 1.120 1.00 0.00 C ATOM 1010 O LEU A 62 16.301 16.367 1.873 1.00 0.00 O ATOM 1011 CB LEU A 62 17.412 13.165 1.735 1.00 0.00 C ATOM 1012 CG LEU A 62 16.049 12.554 2.132 1.00 0.00 C ATOM 1013 CD1 LEU A 62 16.151 11.040 2.355 1.00 0.00 C ATOM 1014 CD2 LEU A 62 15.530 13.184 3.424 1.00 0.00 C ATOM 0 H LEU A 62 18.419 16.000 1.829 1.00 0.00 H new ATOM 0 HA LEU A 62 17.354 14.121 -0.150 1.00 0.00 H new ATOM 0 HB2 LEU A 62 17.971 12.407 1.186 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.966 13.369 2.651 1.00 0.00 H new ATOM 0 HG LEU A 62 15.365 12.756 1.308 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.173 10.646 2.633 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.489 10.559 1.437 1.00 0.00 H new ATOM 0 HD13 LEU A 62 16.864 10.837 3.154 1.00 0.00 H new ATOM 0 HD21 LEU A 62 14.570 12.740 3.685 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.244 13.005 4.228 1.00 0.00 H new ATOM 0 HD23 LEU A 62 15.406 14.257 3.281 1.00 0.00 H new ATOM 1026 N ASN A 63 15.100 15.113 0.456 1.00 0.00 N ATOM 1027 CA ASN A 63 13.872 15.888 0.535 1.00 0.00 C ATOM 1028 C ASN A 63 13.036 15.250 1.625 1.00 0.00 C ATOM 1029 O ASN A 63 12.551 14.133 1.453 1.00 0.00 O ATOM 1030 CB ASN A 63 13.097 15.866 -0.790 1.00 0.00 C ATOM 1031 CG ASN A 63 13.886 16.491 -1.926 1.00 0.00 C ATOM 1032 OD1 ASN A 63 13.687 17.650 -2.280 1.00 0.00 O ATOM 1033 ND2 ASN A 63 14.819 15.744 -2.485 1.00 0.00 N ATOM 0 H ASN A 63 15.026 14.312 -0.171 1.00 0.00 H new ATOM 0 HA ASN A 63 14.101 16.932 0.748 1.00 0.00 H new ATOM 0 HB2 ASN A 63 12.848 14.836 -1.046 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.155 16.400 -0.667 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.398 16.126 -3.233 1.00 0.00 H new ATOM 0 HD22 ASN A 63 14.961 14.784 -2.170 1.00 0.00 H new ATOM 1040 N VAL A 64 12.898 15.921 2.758 1.00 0.00 N ATOM 1041 CA VAL A 64 12.016 15.469 3.820 1.00 0.00 C ATOM 1042 C VAL A 64 10.615 15.967 3.450 1.00 0.00 C ATOM 1043 O VAL A 64 10.467 17.114 3.023 1.00 0.00 O ATOM 1044 CB VAL A 64 12.504 16.031 5.174 1.00 0.00 C ATOM 1045 CG1 VAL A 64 11.923 15.206 6.330 1.00 0.00 C ATOM 1046 CG2 VAL A 64 14.035 16.029 5.315 1.00 0.00 C ATOM 0 H VAL A 64 13.392 16.789 2.966 1.00 0.00 H new ATOM 0 HA VAL A 64 12.007 14.384 3.924 1.00 0.00 H new ATOM 0 HB VAL A 64 12.159 17.064 5.210 1.00 0.00 H new ATOM 0 HG11 VAL A 64 12.274 15.612 7.279 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.834 15.250 6.297 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.247 14.170 6.236 1.00 0.00 H new ATOM 0 HG21 VAL A 64 14.311 16.436 6.288 1.00 0.00 H new ATOM 0 HG22 VAL A 64 14.407 15.008 5.230 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.474 16.642 4.528 1.00 0.00 H new ATOM 1056 N VAL A 65 9.587 15.140 3.623 1.00 0.00 N ATOM 1057 CA VAL A 65 8.189 15.523 3.473 1.00 0.00 C ATOM 1058 C VAL A 65 7.365 14.536 4.312 1.00 0.00 C ATOM 1059 O VAL A 65 7.843 13.450 4.663 1.00 0.00 O ATOM 1060 CB VAL A 65 7.813 15.582 1.967 1.00 0.00 C ATOM 1061 CG1 VAL A 65 8.059 14.254 1.243 1.00 0.00 C ATOM 1062 CG2 VAL A 65 6.371 16.033 1.687 1.00 0.00 C ATOM 0 H VAL A 65 9.708 14.160 3.878 1.00 0.00 H new ATOM 0 HA VAL A 65 7.980 16.527 3.843 1.00 0.00 H new ATOM 0 HB VAL A 65 8.483 16.346 1.573 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.779 14.354 0.194 1.00 0.00 H new ATOM 0 HG12 VAL A 65 9.115 13.992 1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.459 13.471 1.706 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.196 16.045 0.611 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.675 15.340 2.160 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.218 17.034 2.091 1.00 0.00 H new ATOM 1072 N ALA A 66 6.138 14.902 4.672 1.00 0.00 N ATOM 1073 CA ALA A 66 5.290 14.076 5.510 1.00 0.00 C ATOM 1074 C ALA A 66 3.831 14.146 5.076 1.00 0.00 C ATOM 1075 O ALA A 66 3.423 15.023 4.311 1.00 0.00 O ATOM 1076 CB ALA A 66 5.461 14.505 6.969 1.00 0.00 C ATOM 0 H ALA A 66 5.708 15.782 4.388 1.00 0.00 H new ATOM 0 HA ALA A 66 5.594 13.034 5.404 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.827 13.889 7.606 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.503 14.381 7.265 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.176 15.552 7.076 1.00 0.00 H new ATOM 1082 N VAL A 67 3.041 13.225 5.612 1.00 0.00 N ATOM 1083 CA VAL A 67 1.631 13.058 5.334 1.00 0.00 C ATOM 1084 C VAL A 67 1.009 12.702 6.680 1.00 0.00 C ATOM 1085 O VAL A 67 1.589 11.913 7.434 1.00 0.00 O ATOM 1086 CB VAL A 67 1.415 11.947 4.280 1.00 0.00 C ATOM 1087 CG1 VAL A 67 -0.051 11.906 3.829 1.00 0.00 C ATOM 1088 CG2 VAL A 67 2.299 12.112 3.031 1.00 0.00 C ATOM 0 H VAL A 67 3.389 12.543 6.286 1.00 0.00 H new ATOM 0 HA VAL A 67 1.174 13.953 4.913 1.00 0.00 H new ATOM 0 HB VAL A 67 1.696 11.017 4.774 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.182 11.118 3.088 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.691 11.705 4.688 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.324 12.866 3.390 1.00 0.00 H new ATOM 0 HG21 VAL A 67 2.097 11.300 2.333 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.078 13.066 2.552 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.349 12.087 3.323 1.00 0.00 H new ATOM 1098 N HIS A 68 -0.145 13.279 7.006 1.00 0.00 N ATOM 1099 CA HIS A 68 -0.774 13.062 8.298 1.00 0.00 C ATOM 1100 C HIS A 68 -2.098 12.350 8.076 1.00 0.00 C ATOM 1101 O HIS A 68 -3.001 12.920 7.469 1.00 0.00 O ATOM 1102 CB HIS A 68 -0.939 14.390 9.043 1.00 0.00 C ATOM 1103 CG HIS A 68 -0.994 14.150 10.521 1.00 0.00 C ATOM 1104 ND1 HIS A 68 0.073 14.227 11.379 1.00 0.00 N ATOM 1105 CD2 HIS A 68 -2.058 13.673 11.239 1.00 0.00 C ATOM 1106 CE1 HIS A 68 -0.333 13.812 12.582 1.00 0.00 C ATOM 1107 NE2 HIS A 68 -1.635 13.486 12.559 1.00 0.00 N ATOM 0 H HIS A 68 -0.663 13.903 6.387 1.00 0.00 H new ATOM 0 HA HIS A 68 -0.146 12.432 8.929 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.108 15.054 8.806 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.850 14.889 8.714 1.00 0.00 H new ATOM 0 HD1 HIS A 68 1.012 14.545 11.140 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -3.048 13.476 10.854 1.00 0.00 H new ATOM 0 HE1 HIS A 68 0.300 13.748 13.455 1.00 0.00 H new ATOM 1115 N MET A 69 -2.222 11.103 8.532 1.00 0.00 N ATOM 1116 CA MET A 69 -3.483 10.379 8.415 1.00 0.00 C ATOM 1117 C MET A 69 -4.400 10.809 9.576 1.00 0.00 C ATOM 1118 O MET A 69 -3.991 10.650 10.729 1.00 0.00 O ATOM 1119 CB MET A 69 -3.240 8.861 8.414 1.00 0.00 C ATOM 1120 CG MET A 69 -4.531 8.107 8.060 1.00 0.00 C ATOM 1121 SD MET A 69 -4.540 6.340 8.457 1.00 0.00 S ATOM 1122 CE MET A 69 -3.333 5.680 7.289 1.00 0.00 C ATOM 0 H MET A 69 -1.471 10.579 8.981 1.00 0.00 H new ATOM 0 HA MET A 69 -3.968 10.620 7.469 1.00 0.00 H new ATOM 0 HB2 MET A 69 -2.459 8.613 7.695 1.00 0.00 H new ATOM 0 HB3 MET A 69 -2.884 8.544 9.394 1.00 0.00 H new ATOM 0 HG2 MET A 69 -5.362 8.582 8.581 1.00 0.00 H new ATOM 0 HG3 MET A 69 -4.716 8.222 6.992 1.00 0.00 H new ATOM 0 HE1 MET A 69 -3.045 4.674 7.593 1.00 0.00 H new ATOM 0 HE2 MET A 69 -3.772 5.646 6.292 1.00 0.00 H new ATOM 0 HE3 MET A 69 -2.452 6.321 7.275 1.00 0.00 H new ATOM 1132 N PRO A 70 -5.627 11.308 9.320 1.00 0.00 N ATOM 1133 CA PRO A 70 -6.649 11.557 10.335 1.00 0.00 C ATOM 1134 C PRO A 70 -7.317 10.232 10.745 1.00 0.00 C ATOM 1135 O PRO A 70 -8.512 10.013 10.521 1.00 0.00 O ATOM 1136 CB PRO A 70 -7.618 12.545 9.677 1.00 0.00 C ATOM 1137 CG PRO A 70 -7.591 12.131 8.210 1.00 0.00 C ATOM 1138 CD PRO A 70 -6.135 11.721 8.017 1.00 0.00 C ATOM 0 HA PRO A 70 -6.253 11.974 11.261 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.620 12.468 10.099 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -7.294 13.577 9.811 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -8.276 11.308 8.007 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -7.874 12.951 7.550 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -6.057 10.906 7.298 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -5.550 12.552 7.622 1.00 0.00 H new ATOM 1146 N ARG A 71 -6.524 9.284 11.246 1.00 0.00 N ATOM 1147 CA ARG A 71 -6.988 7.933 11.541 1.00 0.00 C ATOM 1148 C ARG A 71 -7.939 7.922 12.742 1.00 0.00 C ATOM 1149 O ARG A 71 -8.801 7.041 12.815 1.00 0.00 O ATOM 1150 CB ARG A 71 -5.787 6.996 11.764 1.00 0.00 C ATOM 1151 CG ARG A 71 -6.215 5.539 11.506 1.00 0.00 C ATOM 1152 CD ARG A 71 -5.050 4.545 11.554 1.00 0.00 C ATOM 1153 NE ARG A 71 -5.494 3.164 11.269 1.00 0.00 N ATOM 1154 CZ ARG A 71 -5.836 2.667 10.069 1.00 0.00 C ATOM 1155 NH1 ARG A 71 -5.782 3.420 8.977 1.00 0.00 N ATOM 1156 NH2 ARG A 71 -6.240 1.409 9.954 1.00 0.00 N ATOM 0 H ARG A 71 -5.538 9.435 11.459 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.552 7.566 10.683 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.970 7.270 11.096 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.415 7.101 12.783 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.960 5.250 12.247 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -6.696 5.477 10.530 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -4.291 4.840 10.829 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -4.582 4.581 12.538 1.00 0.00 H new ATOM 0 HE ARG A 71 -5.546 2.525 12.062 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.477 4.391 9.042 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -6.045 3.027 8.073 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -6.292 0.813 10.780 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -6.498 1.038 9.040 1.00 0.00 H new ATOM 1170 N SER A 72 -7.821 8.890 13.648 1.00 0.00 N ATOM 1171 CA SER A 72 -8.520 8.919 14.922 1.00 0.00 C ATOM 1172 C SER A 72 -8.943 10.358 15.222 1.00 0.00 C ATOM 1173 O SER A 72 -8.427 11.309 14.635 1.00 0.00 O ATOM 1174 CB SER A 72 -7.580 8.367 16.002 1.00 0.00 C ATOM 1175 OG SER A 72 -7.215 7.021 15.726 1.00 0.00 O ATOM 0 H SER A 72 -7.216 9.699 13.507 1.00 0.00 H new ATOM 0 HA SER A 72 -9.418 8.302 14.896 1.00 0.00 H new ATOM 0 HB2 SER A 72 -6.684 8.985 16.059 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.068 8.422 16.975 1.00 0.00 H new ATOM 0 HG SER A 72 -6.615 6.694 16.428 1.00 0.00 H new ATOM 1181 N GLU A 73 -9.897 10.534 16.142 1.00 0.00 N ATOM 1182 CA GLU A 73 -10.548 11.823 16.369 1.00 0.00 C ATOM 1183 C GLU A 73 -9.585 12.907 16.878 1.00 0.00 C ATOM 1184 O GLU A 73 -9.913 14.092 16.799 1.00 0.00 O ATOM 1185 CB GLU A 73 -11.745 11.667 17.320 1.00 0.00 C ATOM 1186 CG GLU A 73 -12.823 10.722 16.765 1.00 0.00 C ATOM 1187 CD GLU A 73 -14.042 10.647 17.701 1.00 0.00 C ATOM 1188 OE1 GLU A 73 -14.070 9.784 18.608 1.00 0.00 O ATOM 1189 OE2 GLU A 73 -14.999 11.437 17.530 1.00 0.00 O ATOM 0 H GLU A 73 -10.237 9.787 16.748 1.00 0.00 H new ATOM 0 HA GLU A 73 -10.906 12.163 15.397 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -11.394 11.288 18.280 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -12.186 12.646 17.506 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -13.139 11.067 15.781 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -12.402 9.725 16.633 1.00 0.00 H new ATOM 1196 N ASP A 74 -8.399 12.544 17.380 1.00 0.00 N ATOM 1197 CA ASP A 74 -7.430 13.530 17.859 1.00 0.00 C ATOM 1198 C ASP A 74 -6.549 14.074 16.728 1.00 0.00 C ATOM 1199 O ASP A 74 -6.035 15.180 16.836 1.00 0.00 O ATOM 1200 CB ASP A 74 -6.590 12.967 19.012 1.00 0.00 C ATOM 1201 CG ASP A 74 -6.015 14.081 19.905 1.00 0.00 C ATOM 1202 OD1 ASP A 74 -6.752 15.046 20.220 1.00 0.00 O ATOM 1203 OD2 ASP A 74 -4.868 13.940 20.383 1.00 0.00 O ATOM 0 H ASP A 74 -8.090 11.576 17.464 1.00 0.00 H new ATOM 0 HA ASP A 74 -7.997 14.377 18.245 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.205 12.299 19.616 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -5.773 12.369 18.607 1.00 0.00 H new ATOM 1208 N ASP A 75 -6.432 13.362 15.602 1.00 0.00 N ATOM 1209 CA ASP A 75 -5.731 13.790 14.392 1.00 0.00 C ATOM 1210 C ASP A 75 -6.721 14.065 13.255 1.00 0.00 C ATOM 1211 O ASP A 75 -6.328 14.387 12.137 1.00 0.00 O ATOM 1212 CB ASP A 75 -4.630 12.792 13.992 1.00 0.00 C ATOM 1213 CG ASP A 75 -4.892 11.323 14.312 1.00 0.00 C ATOM 1214 OD1 ASP A 75 -5.612 10.654 13.543 1.00 0.00 O ATOM 1215 OD2 ASP A 75 -4.351 10.847 15.339 1.00 0.00 O ATOM 0 H ASP A 75 -6.842 12.433 15.508 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.225 14.731 14.608 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.461 12.882 12.919 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -3.705 13.089 14.486 1.00 0.00 H new ATOM 1220 N LEU A 76 -8.024 14.027 13.534 1.00 0.00 N ATOM 1221 CA LEU A 76 -9.089 14.428 12.643 1.00 0.00 C ATOM 1222 C LEU A 76 -9.121 15.954 12.451 1.00 0.00 C ATOM 1223 O LEU A 76 -9.761 16.440 11.516 1.00 0.00 O ATOM 1224 CB LEU A 76 -10.358 13.854 13.287 1.00 0.00 C ATOM 1225 CG LEU A 76 -11.686 14.247 12.653 1.00 0.00 C ATOM 1226 CD1 LEU A 76 -11.794 13.799 11.189 1.00 0.00 C ATOM 1227 CD2 LEU A 76 -12.830 13.632 13.469 1.00 0.00 C ATOM 0 H LEU A 76 -8.372 13.698 14.434 1.00 0.00 H new ATOM 0 HA LEU A 76 -8.966 14.049 11.628 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -10.284 12.767 13.274 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -10.377 14.160 14.333 1.00 0.00 H new ATOM 0 HG LEU A 76 -11.750 15.335 12.659 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.759 14.104 10.785 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.996 14.260 10.608 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -11.704 12.714 11.133 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -13.785 13.908 13.022 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -12.732 12.546 13.473 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -12.787 14.004 14.493 1.00 0.00 H new ATOM 1239 N ASP A 77 -8.419 16.720 13.294 1.00 0.00 N ATOM 1240 CA ASP A 77 -8.446 18.178 13.300 1.00 0.00 C ATOM 1241 C ASP A 77 -7.080 18.724 12.862 1.00 0.00 C ATOM 1242 O ASP A 77 -6.068 18.430 13.507 1.00 0.00 O ATOM 1243 CB ASP A 77 -8.784 18.693 14.699 1.00 0.00 C ATOM 1244 CG ASP A 77 -8.901 20.220 14.690 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -7.850 20.893 14.740 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -10.036 20.742 14.613 1.00 0.00 O ATOM 0 H ASP A 77 -7.803 16.329 14.006 1.00 0.00 H new ATOM 0 HA ASP A 77 -9.211 18.520 12.603 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.721 18.252 15.040 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.012 18.385 15.404 1.00 0.00 H new ATOM 1251 N PRO A 78 -7.007 19.521 11.785 1.00 0.00 N ATOM 1252 CA PRO A 78 -5.739 20.010 11.264 1.00 0.00 C ATOM 1253 C PRO A 78 -5.079 21.075 12.141 1.00 0.00 C ATOM 1254 O PRO A 78 -3.872 21.283 12.023 1.00 0.00 O ATOM 1255 CB PRO A 78 -6.054 20.553 9.875 1.00 0.00 C ATOM 1256 CG PRO A 78 -7.529 20.943 9.946 1.00 0.00 C ATOM 1257 CD PRO A 78 -8.111 19.937 10.935 1.00 0.00 C ATOM 0 HA PRO A 78 -5.009 19.201 11.241 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -5.427 21.411 9.632 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -5.878 19.802 9.105 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.658 21.968 10.293 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -8.011 20.873 8.971 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -8.909 20.388 11.525 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -8.544 19.084 10.413 1.00 0.00 H new ATOM 1265 N GLY A 79 -5.822 21.730 13.036 1.00 0.00 N ATOM 1266 CA GLY A 79 -5.260 22.720 13.937 1.00 0.00 C ATOM 1267 C GLY A 79 -4.467 22.003 15.019 1.00 0.00 C ATOM 1268 O GLY A 79 -3.389 22.460 15.399 1.00 0.00 O ATOM 0 H GLY A 79 -6.825 21.585 13.151 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.615 23.407 13.389 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.054 23.317 14.384 1.00 0.00 H new ATOM 1272 N LYS A 80 -4.941 20.828 15.450 1.00 0.00 N ATOM 1273 CA LYS A 80 -4.182 19.984 16.366 1.00 0.00 C ATOM 1274 C LYS A 80 -2.911 19.509 15.688 1.00 0.00 C ATOM 1275 O LYS A 80 -1.858 19.555 16.317 1.00 0.00 O ATOM 1276 CB LYS A 80 -4.997 18.773 16.827 1.00 0.00 C ATOM 1277 CG LYS A 80 -6.179 19.152 17.721 1.00 0.00 C ATOM 1278 CD LYS A 80 -6.920 17.867 18.087 1.00 0.00 C ATOM 1279 CE LYS A 80 -8.070 18.150 19.056 1.00 0.00 C ATOM 1280 NZ LYS A 80 -8.710 16.897 19.523 1.00 0.00 N ATOM 0 H LYS A 80 -5.846 20.445 15.177 1.00 0.00 H new ATOM 0 HA LYS A 80 -3.938 20.581 17.245 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.367 18.237 15.953 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.345 18.088 17.368 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -5.830 19.661 18.620 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -6.844 19.842 17.202 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.309 17.398 17.183 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.225 17.159 18.539 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -7.695 18.709 19.913 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -8.814 18.778 18.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.328 17.104 20.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -9.275 16.488 18.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -7.976 16.219 19.812 1.00 0.00 H new ATOM 1294 N ILE A 81 -2.984 19.080 14.425 1.00 0.00 N ATOM 1295 CA ILE A 81 -1.812 18.623 13.684 1.00 0.00 C ATOM 1296 C ILE A 81 -0.787 19.762 13.611 1.00 0.00 C ATOM 1297 O ILE A 81 0.360 19.562 14.012 1.00 0.00 O ATOM 1298 CB ILE A 81 -2.219 18.082 12.294 1.00 0.00 C ATOM 1299 CG1 ILE A 81 -3.115 16.834 12.443 1.00 0.00 C ATOM 1300 CG2 ILE A 81 -0.960 17.730 11.470 1.00 0.00 C ATOM 1301 CD1 ILE A 81 -3.818 16.424 11.143 1.00 0.00 C ATOM 0 H ILE A 81 -3.853 19.041 13.893 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.341 17.788 14.203 1.00 0.00 H new ATOM 0 HB ILE A 81 -2.781 18.857 11.772 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.507 16.001 12.796 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.867 17.026 13.208 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.259 17.350 10.493 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.349 18.623 11.340 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.383 16.968 11.994 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.430 15.540 11.323 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.453 17.241 10.799 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -3.072 16.199 10.381 1.00 0.00 H new ATOM 1313 N LYS A 82 -1.189 20.957 13.153 1.00 0.00 N ATOM 1314 CA LYS A 82 -0.351 22.138 13.079 1.00 0.00 C ATOM 1315 C LYS A 82 0.294 22.406 14.447 1.00 0.00 C ATOM 1316 O LYS A 82 1.516 22.516 14.526 1.00 0.00 O ATOM 1317 CB LYS A 82 -1.278 23.248 12.524 1.00 0.00 C ATOM 1318 CG LYS A 82 -0.676 24.603 12.138 1.00 0.00 C ATOM 1319 CD LYS A 82 0.025 25.245 13.327 1.00 0.00 C ATOM 1320 CE LYS A 82 0.325 26.741 13.143 1.00 0.00 C ATOM 1321 NZ LYS A 82 -0.896 27.588 13.152 1.00 0.00 N ATOM 0 H LYS A 82 -2.138 21.121 12.816 1.00 0.00 H new ATOM 0 HA LYS A 82 0.509 22.051 12.415 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.777 22.848 11.641 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -2.051 23.433 13.270 1.00 0.00 H new ATOM 0 HG2 LYS A 82 0.033 24.471 11.321 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -1.462 25.264 11.774 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -0.595 25.116 14.214 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.961 24.717 13.512 1.00 0.00 H new ATOM 0 HE2 LYS A 82 0.994 27.071 13.937 1.00 0.00 H new ATOM 0 HE3 LYS A 82 0.853 26.886 12.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -0.623 28.591 13.126 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -1.478 27.366 12.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -1.442 27.400 14.017 1.00 0.00 H new ATOM 1335 N GLU A 83 -0.490 22.486 15.523 1.00 0.00 N ATOM 1336 CA GLU A 83 0.023 22.831 16.850 1.00 0.00 C ATOM 1337 C GLU A 83 1.002 21.766 17.365 1.00 0.00 C ATOM 1338 O GLU A 83 2.046 22.096 17.925 1.00 0.00 O ATOM 1339 CB GLU A 83 -1.165 23.023 17.806 1.00 0.00 C ATOM 1340 CG GLU A 83 -0.729 23.512 19.193 1.00 0.00 C ATOM 1341 CD GLU A 83 -1.942 23.813 20.091 1.00 0.00 C ATOM 1342 OE1 GLU A 83 -2.417 22.903 20.808 1.00 0.00 O ATOM 1343 OE2 GLU A 83 -2.421 24.971 20.111 1.00 0.00 O ATOM 0 H GLU A 83 -1.495 22.314 15.500 1.00 0.00 H new ATOM 0 HA GLU A 83 0.586 23.763 16.791 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.863 23.740 17.374 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -1.701 22.079 17.909 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -0.103 22.756 19.667 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.120 24.410 19.089 1.00 0.00 H new ATOM 1350 N THR A 84 0.693 20.489 17.149 1.00 0.00 N ATOM 1351 CA THR A 84 1.528 19.367 17.552 1.00 0.00 C ATOM 1352 C THR A 84 2.882 19.443 16.831 1.00 0.00 C ATOM 1353 O THR A 84 3.940 19.414 17.464 1.00 0.00 O ATOM 1354 CB THR A 84 0.740 18.081 17.238 1.00 0.00 C ATOM 1355 OG1 THR A 84 -0.430 18.027 18.028 1.00 0.00 O ATOM 1356 CG2 THR A 84 1.543 16.811 17.466 1.00 0.00 C ATOM 0 H THR A 84 -0.165 20.203 16.678 1.00 0.00 H new ATOM 0 HA THR A 84 1.756 19.383 18.618 1.00 0.00 H new ATOM 0 HB THR A 84 0.494 18.126 16.177 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.106 18.630 17.654 1.00 0.00 H new ATOM 0 HG21 THR A 84 0.928 15.944 17.226 1.00 0.00 H new ATOM 0 HG22 THR A 84 2.425 16.819 16.826 1.00 0.00 H new ATOM 0 HG23 THR A 84 1.852 16.759 18.510 1.00 0.00 H new ATOM 1364 N ALA A 85 2.858 19.609 15.509 1.00 0.00 N ATOM 1365 CA ALA A 85 4.047 19.763 14.686 1.00 0.00 C ATOM 1366 C ALA A 85 4.919 20.941 15.130 1.00 0.00 C ATOM 1367 O ALA A 85 6.140 20.808 15.218 1.00 0.00 O ATOM 1368 CB ALA A 85 3.596 19.955 13.243 1.00 0.00 C ATOM 0 H ALA A 85 1.991 19.640 14.973 1.00 0.00 H new ATOM 0 HA ALA A 85 4.663 18.870 14.789 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.469 20.073 12.602 1.00 0.00 H new ATOM 0 HB2 ALA A 85 3.025 19.084 12.921 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.971 20.845 13.173 1.00 0.00 H new ATOM 1374 N ALA A 86 4.294 22.077 15.446 1.00 0.00 N ATOM 1375 CA ALA A 86 4.993 23.273 15.900 1.00 0.00 C ATOM 1376 C ALA A 86 5.844 22.996 17.146 1.00 0.00 C ATOM 1377 O ALA A 86 6.896 23.609 17.327 1.00 0.00 O ATOM 1378 CB ALA A 86 3.977 24.372 16.217 1.00 0.00 C ATOM 0 H ALA A 86 3.282 22.190 15.392 1.00 0.00 H new ATOM 0 HA ALA A 86 5.659 23.593 15.099 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.501 25.265 16.556 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.403 24.607 15.320 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.302 24.028 17.000 1.00 0.00 H new ATOM 1384 N GLU A 87 5.395 22.072 17.995 1.00 0.00 N ATOM 1385 CA GLU A 87 6.056 21.724 19.245 1.00 0.00 C ATOM 1386 C GLU A 87 7.119 20.645 18.995 1.00 0.00 C ATOM 1387 O GLU A 87 8.189 20.689 19.604 1.00 0.00 O ATOM 1388 CB GLU A 87 4.992 21.260 20.254 1.00 0.00 C ATOM 1389 CG GLU A 87 4.175 22.419 20.849 1.00 0.00 C ATOM 1390 CD GLU A 87 5.013 23.328 21.767 1.00 0.00 C ATOM 1391 OE1 GLU A 87 5.256 22.959 22.939 1.00 0.00 O ATOM 1392 OE2 GLU A 87 5.423 24.430 21.338 1.00 0.00 O ATOM 0 H GLU A 87 4.544 21.536 17.826 1.00 0.00 H new ATOM 0 HA GLU A 87 6.570 22.592 19.659 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.315 20.561 19.763 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.480 20.716 21.062 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.755 23.016 20.039 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.336 22.014 21.414 1.00 0.00 H new ATOM 1399 N HIS A 88 6.865 19.716 18.066 1.00 0.00 N ATOM 1400 CA HIS A 88 7.842 18.733 17.601 1.00 0.00 C ATOM 1401 C HIS A 88 9.013 19.338 16.813 1.00 0.00 C ATOM 1402 O HIS A 88 9.983 18.624 16.563 1.00 0.00 O ATOM 1403 CB HIS A 88 7.131 17.672 16.754 1.00 0.00 C ATOM 1404 CG HIS A 88 6.134 16.853 17.528 1.00 0.00 C ATOM 1405 ND1 HIS A 88 6.250 16.468 18.844 1.00 0.00 N ATOM 1406 CD2 HIS A 88 4.989 16.284 17.038 1.00 0.00 C ATOM 1407 CE1 HIS A 88 5.195 15.699 19.142 1.00 0.00 C ATOM 1408 NE2 HIS A 88 4.408 15.531 18.066 1.00 0.00 N ATOM 0 H HIS A 88 5.957 19.627 17.610 1.00 0.00 H new ATOM 0 HA HIS A 88 8.283 18.287 18.493 1.00 0.00 H new ATOM 0 HB2 HIS A 88 6.620 18.163 15.925 1.00 0.00 H new ATOM 0 HB3 HIS A 88 7.877 17.006 16.320 1.00 0.00 H new ATOM 0 HD2 HIS A 88 4.602 16.396 16.036 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.003 15.272 20.115 1.00 0.00 H new ATOM 0 HE2 HIS A 88 3.559 14.969 18.009 1.00 0.00 H new ATOM 1416 N ASP A 89 8.944 20.618 16.425 1.00 0.00 N ATOM 1417 CA ASP A 89 9.983 21.349 15.688 1.00 0.00 C ATOM 1418 C ASP A 89 10.119 20.857 14.244 1.00 0.00 C ATOM 1419 O ASP A 89 11.131 21.103 13.590 1.00 0.00 O ATOM 1420 CB ASP A 89 11.336 21.343 16.432 1.00 0.00 C ATOM 1421 CG ASP A 89 12.284 22.428 15.883 1.00 0.00 C ATOM 1422 OD1 ASP A 89 11.956 23.631 16.002 1.00 0.00 O ATOM 1423 OD2 ASP A 89 13.374 22.091 15.370 1.00 0.00 O ATOM 0 H ASP A 89 8.128 21.197 16.625 1.00 0.00 H new ATOM 0 HA ASP A 89 9.658 22.388 15.636 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.169 21.508 17.496 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.804 20.364 16.331 1.00 0.00 H new ATOM 1428 N ILE A 90 9.123 20.132 13.731 1.00 0.00 N ATOM 1429 CA ILE A 90 9.162 19.568 12.393 1.00 0.00 C ATOM 1430 C ILE A 90 8.789 20.661 11.389 1.00 0.00 C ATOM 1431 O ILE A 90 7.727 21.283 11.491 1.00 0.00 O ATOM 1432 CB ILE A 90 8.276 18.306 12.326 1.00 0.00 C ATOM 1433 CG1 ILE A 90 6.791 18.566 12.631 1.00 0.00 C ATOM 1434 CG2 ILE A 90 8.886 17.213 13.216 1.00 0.00 C ATOM 1435 CD1 ILE A 90 5.932 17.308 12.696 1.00 0.00 C ATOM 0 H ILE A 90 8.265 19.922 14.240 1.00 0.00 H new ATOM 0 HA ILE A 90 10.164 19.230 12.130 1.00 0.00 H new ATOM 0 HB ILE A 90 8.269 17.960 11.292 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.715 19.093 13.582 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.386 19.229 11.866 1.00 0.00 H new ATOM 0 HG21 ILE A 90 8.264 16.319 13.172 1.00 0.00 H new ATOM 0 HG22 ILE A 90 9.889 16.974 12.863 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.938 17.569 14.245 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.900 17.583 12.915 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.974 16.789 11.738 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.307 16.651 13.481 1.00 0.00 H new ATOM 1447 N THR A 91 9.671 20.906 10.420 1.00 0.00 N ATOM 1448 CA THR A 91 9.534 22.002 9.464 1.00 0.00 C ATOM 1449 C THR A 91 9.559 21.490 8.019 1.00 0.00 C ATOM 1450 O THR A 91 9.484 22.296 7.088 1.00 0.00 O ATOM 1451 CB THR A 91 10.586 23.086 9.743 1.00 0.00 C ATOM 1452 OG1 THR A 91 11.881 22.534 9.625 1.00 0.00 O ATOM 1453 CG2 THR A 91 10.431 23.693 11.145 1.00 0.00 C ATOM 0 H THR A 91 10.509 20.343 10.276 1.00 0.00 H new ATOM 0 HA THR A 91 8.557 22.467 9.595 1.00 0.00 H new ATOM 0 HB THR A 91 10.438 23.879 9.010 1.00 0.00 H new ATOM 0 HG1 THR A 91 12.546 23.253 9.643 1.00 0.00 H new ATOM 0 HG21 THR A 91 11.196 24.455 11.298 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.444 24.146 11.238 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.543 22.910 11.895 1.00 0.00 H new ATOM 1461 N GLN A 92 9.651 20.168 7.806 1.00 0.00 N ATOM 1462 CA GLN A 92 9.460 19.592 6.482 1.00 0.00 C ATOM 1463 C GLN A 92 8.043 19.929 6.004 1.00 0.00 C ATOM 1464 O GLN A 92 7.155 20.067 6.849 1.00 0.00 O ATOM 1465 CB GLN A 92 9.709 18.066 6.470 1.00 0.00 C ATOM 1466 CG GLN A 92 8.629 17.136 7.070 1.00 0.00 C ATOM 1467 CD GLN A 92 8.642 17.046 8.590 1.00 0.00 C ATOM 1468 OE1 GLN A 92 9.411 17.732 9.256 1.00 0.00 O ATOM 1469 NE2 GLN A 92 7.798 16.202 9.173 1.00 0.00 N ATOM 0 H GLN A 92 9.856 19.486 8.537 1.00 0.00 H new ATOM 0 HA GLN A 92 10.192 20.022 5.799 1.00 0.00 H new ATOM 0 HB2 GLN A 92 9.868 17.764 5.435 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.641 17.878 7.003 1.00 0.00 H new ATOM 0 HG2 GLN A 92 7.648 17.486 6.748 1.00 0.00 H new ATOM 0 HG3 GLN A 92 8.761 16.135 6.659 1.00 0.00 H new ATOM 0 HE21 GLN A 92 7.165 15.639 8.604 1.00 0.00 H new ATOM 0 HE22 GLN A 92 7.783 16.117 10.189 1.00 0.00 H new ATOM 1478 N PRO A 93 7.793 20.018 4.691 1.00 0.00 N ATOM 1479 CA PRO A 93 6.442 20.115 4.154 1.00 0.00 C ATOM 1480 C PRO A 93 5.609 18.916 4.623 1.00 0.00 C ATOM 1481 O PRO A 93 6.094 17.783 4.622 1.00 0.00 O ATOM 1482 CB PRO A 93 6.611 20.167 2.629 1.00 0.00 C ATOM 1483 CG PRO A 93 8.025 19.647 2.372 1.00 0.00 C ATOM 1484 CD PRO A 93 8.783 20.029 3.630 1.00 0.00 C ATOM 0 HA PRO A 93 5.906 20.999 4.500 1.00 0.00 H new ATOM 0 HB2 PRO A 93 5.866 19.549 2.128 1.00 0.00 H new ATOM 0 HB3 PRO A 93 6.489 21.183 2.252 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.032 18.569 2.212 1.00 0.00 H new ATOM 0 HG3 PRO A 93 8.465 20.104 1.485 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.587 19.322 3.835 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.241 21.013 3.530 1.00 0.00 H new ATOM 1492 N ILE A 94 4.359 19.150 5.013 1.00 0.00 N ATOM 1493 CA ILE A 94 3.431 18.143 5.511 1.00 0.00 C ATOM 1494 C ILE A 94 2.103 18.452 4.828 1.00 0.00 C ATOM 1495 O ILE A 94 1.686 19.613 4.803 1.00 0.00 O ATOM 1496 CB ILE A 94 3.298 18.182 7.060 1.00 0.00 C ATOM 1497 CG1 ILE A 94 4.678 18.266 7.755 1.00 0.00 C ATOM 1498 CG2 ILE A 94 2.432 17.006 7.559 1.00 0.00 C ATOM 1499 CD1 ILE A 94 4.764 17.981 9.259 1.00 0.00 C ATOM 0 H ILE A 94 3.950 20.084 4.989 1.00 0.00 H new ATOM 0 HA ILE A 94 3.781 17.136 5.285 1.00 0.00 H new ATOM 0 HB ILE A 94 2.778 19.098 7.339 1.00 0.00 H new ATOM 0 HG12 ILE A 94 5.346 17.570 7.248 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.073 19.268 7.585 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.350 17.050 8.645 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.438 17.073 7.117 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.896 16.063 7.268 1.00 0.00 H new ATOM 0 HD11 ILE A 94 5.798 18.082 9.590 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.139 18.691 9.800 1.00 0.00 H new ATOM 0 HD13 ILE A 94 4.417 16.967 9.458 1.00 0.00 H new ATOM 1511 N PHE A 95 1.407 17.438 4.318 1.00 0.00 N ATOM 1512 CA PHE A 95 0.047 17.618 3.825 1.00 0.00 C ATOM 1513 C PHE A 95 -0.890 16.656 4.545 1.00 0.00 C ATOM 1514 O PHE A 95 -0.482 15.612 5.058 1.00 0.00 O ATOM 1515 CB PHE A 95 -0.021 17.548 2.288 1.00 0.00 C ATOM 1516 CG PHE A 95 -0.316 16.191 1.670 1.00 0.00 C ATOM 1517 CD1 PHE A 95 -1.652 15.802 1.455 1.00 0.00 C ATOM 1518 CD2 PHE A 95 0.730 15.343 1.257 1.00 0.00 C ATOM 1519 CE1 PHE A 95 -1.939 14.575 0.836 1.00 0.00 C ATOM 1520 CE2 PHE A 95 0.436 14.120 0.621 1.00 0.00 C ATOM 1521 CZ PHE A 95 -0.899 13.733 0.411 1.00 0.00 C ATOM 0 H PHE A 95 1.763 16.486 4.236 1.00 0.00 H new ATOM 0 HA PHE A 95 -0.298 18.625 4.061 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -0.786 18.247 1.951 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.931 17.901 1.891 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -2.458 16.449 1.767 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.757 15.630 1.428 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -2.966 14.277 0.686 1.00 0.00 H new ATOM 0 HE2 PHE A 95 1.240 13.477 0.294 1.00 0.00 H new ATOM 0 HZ PHE A 95 -1.123 12.794 -0.074 1.00 0.00 H new ATOM 1531 N VAL A 96 -2.157 17.036 4.588 1.00 0.00 N ATOM 1532 CA VAL A 96 -3.234 16.284 5.205 1.00 0.00 C ATOM 1533 C VAL A 96 -4.378 16.270 4.201 1.00 0.00 C ATOM 1534 O VAL A 96 -4.618 17.266 3.510 1.00 0.00 O ATOM 1535 CB VAL A 96 -3.674 16.960 6.524 1.00 0.00 C ATOM 1536 CG1 VAL A 96 -4.509 15.991 7.370 1.00 0.00 C ATOM 1537 CG2 VAL A 96 -2.499 17.493 7.363 1.00 0.00 C ATOM 0 H VAL A 96 -2.474 17.914 4.176 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.919 15.270 5.453 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.275 17.822 6.233 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.811 16.483 8.295 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.396 15.692 6.812 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.914 15.108 7.605 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.882 17.954 8.274 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.836 16.669 7.625 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.946 18.234 6.786 1.00 0.00 H new ATOM 1547 N ASP A 97 -5.125 15.173 4.141 1.00 0.00 N ATOM 1548 CA ASP A 97 -6.281 15.062 3.274 1.00 0.00 C ATOM 1549 C ASP A 97 -7.365 14.190 3.891 1.00 0.00 C ATOM 1550 O ASP A 97 -7.085 13.338 4.735 1.00 0.00 O ATOM 1551 CB ASP A 97 -5.860 14.495 1.926 1.00 0.00 C ATOM 1552 CG ASP A 97 -6.998 14.671 0.930 1.00 0.00 C ATOM 1553 OD1 ASP A 97 -7.507 15.805 0.813 1.00 0.00 O ATOM 1554 OD2 ASP A 97 -7.411 13.656 0.340 1.00 0.00 O ATOM 0 H ASP A 97 -4.941 14.337 4.695 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.697 16.060 3.139 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -4.965 15.004 1.568 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.608 13.439 2.025 1.00 0.00 H new ATOM 1559 N SER A 98 -8.605 14.407 3.459 1.00 0.00 N ATOM 1560 CA SER A 98 -9.758 13.617 3.863 1.00 0.00 C ATOM 1561 C SER A 98 -9.748 12.219 3.223 1.00 0.00 C ATOM 1562 O SER A 98 -10.466 11.336 3.696 1.00 0.00 O ATOM 1563 CB SER A 98 -11.031 14.381 3.473 1.00 0.00 C ATOM 1564 OG SER A 98 -10.950 15.738 3.892 1.00 0.00 O ATOM 0 H SER A 98 -8.838 15.154 2.804 1.00 0.00 H new ATOM 0 HA SER A 98 -9.724 13.467 4.942 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.172 14.336 2.393 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.900 13.906 3.928 1.00 0.00 H new ATOM 0 HG SER A 98 -11.769 16.210 3.633 1.00 0.00 H new ATOM 1570 N ASP A 99 -8.951 11.998 2.167 1.00 0.00 N ATOM 1571 CA ASP A 99 -8.949 10.765 1.383 1.00 0.00 C ATOM 1572 C ASP A 99 -7.535 10.210 1.183 1.00 0.00 C ATOM 1573 O ASP A 99 -7.368 9.000 1.314 1.00 0.00 O ATOM 1574 CB ASP A 99 -9.629 11.020 0.033 1.00 0.00 C ATOM 1575 CG ASP A 99 -9.628 9.760 -0.846 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -10.396 8.816 -0.551 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -8.908 9.740 -1.869 1.00 0.00 O ATOM 0 H ASP A 99 -8.279 12.688 1.832 1.00 0.00 H new ATOM 0 HA ASP A 99 -9.506 10.009 1.937 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -10.655 11.349 0.198 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -9.115 11.828 -0.487 1.00 0.00 H new ATOM 1582 N HIS A 100 -6.524 11.072 0.972 1.00 0.00 N ATOM 1583 CA HIS A 100 -5.155 10.750 0.613 1.00 0.00 C ATOM 1584 C HIS A 100 -5.187 10.049 -0.733 1.00 0.00 C ATOM 1585 O HIS A 100 -5.406 8.844 -0.808 1.00 0.00 O ATOM 1586 CB HIS A 100 -4.406 10.019 1.738 1.00 0.00 C ATOM 1587 CG HIS A 100 -4.179 10.911 2.926 1.00 0.00 C ATOM 1588 ND1 HIS A 100 -4.756 10.802 4.169 1.00 0.00 N ATOM 1589 CD2 HIS A 100 -3.421 12.049 2.929 1.00 0.00 C ATOM 1590 CE1 HIS A 100 -4.345 11.855 4.893 1.00 0.00 C ATOM 1591 NE2 HIS A 100 -3.522 12.644 4.187 1.00 0.00 N ATOM 0 H HIS A 100 -6.665 12.079 1.057 1.00 0.00 H new ATOM 0 HA HIS A 100 -4.554 11.652 0.496 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -4.976 9.142 2.045 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -3.447 9.661 1.364 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -5.380 10.059 4.483 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -2.842 12.424 2.098 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -4.640 12.043 5.915 1.00 0.00 H new ATOM 1599 N ALA A 101 -4.989 10.821 -1.807 1.00 0.00 N ATOM 1600 CA ALA A 101 -5.204 10.359 -3.177 1.00 0.00 C ATOM 1601 C ALA A 101 -4.379 9.118 -3.537 1.00 0.00 C ATOM 1602 O ALA A 101 -4.769 8.361 -4.426 1.00 0.00 O ATOM 1603 CB ALA A 101 -4.905 11.508 -4.142 1.00 0.00 C ATOM 0 H ALA A 101 -4.673 11.789 -1.747 1.00 0.00 H new ATOM 0 HA ALA A 101 -6.247 10.054 -3.262 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -5.063 11.173 -5.167 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -5.569 12.345 -3.928 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -3.870 11.826 -4.020 1.00 0.00 H new ATOM 1609 N LEU A 102 -3.275 8.860 -2.830 1.00 0.00 N ATOM 1610 CA LEU A 102 -2.492 7.639 -3.056 1.00 0.00 C ATOM 1611 C LEU A 102 -3.205 6.383 -2.581 1.00 0.00 C ATOM 1612 O LEU A 102 -2.805 5.286 -2.966 1.00 0.00 O ATOM 1613 CB LEU A 102 -1.061 7.658 -2.507 1.00 0.00 C ATOM 1614 CG LEU A 102 -0.847 7.556 -0.987 1.00 0.00 C ATOM 1615 CD1 LEU A 102 0.649 7.386 -0.698 1.00 0.00 C ATOM 1616 CD2 LEU A 102 -1.362 8.796 -0.255 1.00 0.00 C ATOM 0 H LEU A 102 -2.905 9.473 -2.103 1.00 0.00 H new ATOM 0 HA LEU A 102 -2.401 7.615 -4.142 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -0.518 6.835 -2.972 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.590 8.581 -2.845 1.00 0.00 H new ATOM 0 HG LEU A 102 -1.409 6.695 -0.626 1.00 0.00 H new ATOM 0 HD11 LEU A 102 0.806 7.313 0.378 1.00 0.00 H new ATOM 0 HD12 LEU A 102 1.012 6.478 -1.180 1.00 0.00 H new ATOM 0 HD13 LEU A 102 1.195 8.246 -1.087 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -1.192 8.683 0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -0.832 9.678 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -2.429 8.912 -0.442 1.00 0.00 H new ATOM 1628 N THR A 103 -4.279 6.491 -1.807 1.00 0.00 N ATOM 1629 CA THR A 103 -5.101 5.333 -1.522 1.00 0.00 C ATOM 1630 C THR A 103 -5.737 4.775 -2.802 1.00 0.00 C ATOM 1631 O THR A 103 -6.105 3.604 -2.831 1.00 0.00 O ATOM 1632 CB THR A 103 -6.176 5.620 -0.474 1.00 0.00 C ATOM 1633 OG1 THR A 103 -7.014 6.687 -0.857 1.00 0.00 O ATOM 1634 CG2 THR A 103 -5.609 5.891 0.922 1.00 0.00 C ATOM 0 H THR A 103 -4.594 7.359 -1.373 1.00 0.00 H new ATOM 0 HA THR A 103 -4.435 4.578 -1.104 1.00 0.00 H new ATOM 0 HB THR A 103 -6.764 4.704 -0.418 1.00 0.00 H new ATOM 0 HG1 THR A 103 -6.499 7.521 -0.864 1.00 0.00 H new ATOM 0 HG21 THR A 103 -6.427 6.087 1.615 1.00 0.00 H new ATOM 0 HG22 THR A 103 -5.046 5.021 1.261 1.00 0.00 H new ATOM 0 HG23 THR A 103 -4.950 6.758 0.885 1.00 0.00 H new ATOM 1642 N ASP A 104 -5.815 5.552 -3.884 1.00 0.00 N ATOM 1643 CA ASP A 104 -6.328 5.025 -5.144 1.00 0.00 C ATOM 1644 C ASP A 104 -5.223 4.304 -5.911 1.00 0.00 C ATOM 1645 O ASP A 104 -5.501 3.432 -6.734 1.00 0.00 O ATOM 1646 CB ASP A 104 -6.907 6.160 -5.987 1.00 0.00 C ATOM 1647 CG ASP A 104 -7.468 5.649 -7.324 1.00 0.00 C ATOM 1648 OD1 ASP A 104 -8.522 4.973 -7.325 1.00 0.00 O ATOM 1649 OD2 ASP A 104 -6.884 5.956 -8.388 1.00 0.00 O ATOM 0 H ASP A 104 -5.534 6.532 -3.912 1.00 0.00 H new ATOM 0 HA ASP A 104 -7.119 4.307 -4.927 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -7.698 6.661 -5.429 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -6.132 6.903 -6.178 1.00 0.00 H new ATOM 1654 N ALA A 105 -3.965 4.641 -5.609 1.00 0.00 N ATOM 1655 CA ALA A 105 -2.818 4.002 -6.223 1.00 0.00 C ATOM 1656 C ALA A 105 -2.453 2.714 -5.482 1.00 0.00 C ATOM 1657 O ALA A 105 -2.174 1.710 -6.139 1.00 0.00 O ATOM 1658 CB ALA A 105 -1.636 4.973 -6.228 1.00 0.00 C ATOM 0 H ALA A 105 -3.723 5.365 -4.932 1.00 0.00 H new ATOM 0 HA ALA A 105 -3.068 3.736 -7.250 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -0.773 4.493 -6.690 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.901 5.866 -6.794 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -1.391 5.253 -5.203 1.00 0.00 H new ATOM 1664 N PHE A 106 -2.479 2.723 -4.138 1.00 0.00 N ATOM 1665 CA PHE A 106 -1.935 1.632 -3.327 1.00 0.00 C ATOM 1666 C PHE A 106 -2.705 1.407 -2.022 1.00 0.00 C ATOM 1667 O PHE A 106 -2.311 0.554 -1.227 1.00 0.00 O ATOM 1668 CB PHE A 106 -0.442 1.884 -3.062 1.00 0.00 C ATOM 1669 CG PHE A 106 0.410 1.785 -4.315 1.00 0.00 C ATOM 1670 CD1 PHE A 106 0.603 0.537 -4.937 1.00 0.00 C ATOM 1671 CD2 PHE A 106 0.955 2.943 -4.897 1.00 0.00 C ATOM 1672 CE1 PHE A 106 1.322 0.455 -6.141 1.00 0.00 C ATOM 1673 CE2 PHE A 106 1.720 2.851 -6.074 1.00 0.00 C ATOM 1674 CZ PHE A 106 1.896 1.607 -6.703 1.00 0.00 C ATOM 0 H PHE A 106 -2.877 3.486 -3.590 1.00 0.00 H new ATOM 0 HA PHE A 106 -2.052 0.710 -3.896 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -0.319 2.874 -2.623 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.083 1.163 -2.328 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.198 -0.358 -4.488 1.00 0.00 H new ATOM 0 HD2 PHE A 106 0.786 3.906 -4.439 1.00 0.00 H new ATOM 0 HE1 PHE A 106 1.434 -0.498 -6.637 1.00 0.00 H new ATOM 0 HE2 PHE A 106 2.172 3.737 -6.494 1.00 0.00 H new ATOM 0 HZ PHE A 106 2.470 1.537 -7.615 1.00 0.00 H new ATOM 1684 N GLU A 107 -3.814 2.126 -1.813 1.00 0.00 N ATOM 1685 CA GLU A 107 -4.762 1.866 -0.723 1.00 0.00 C ATOM 1686 C GLU A 107 -4.089 1.818 0.663 1.00 0.00 C ATOM 1687 O GLU A 107 -4.290 0.888 1.444 1.00 0.00 O ATOM 1688 CB GLU A 107 -5.653 0.673 -1.110 1.00 0.00 C ATOM 1689 CG GLU A 107 -7.043 0.779 -0.469 1.00 0.00 C ATOM 1690 CD GLU A 107 -7.923 -0.434 -0.824 1.00 0.00 C ATOM 1691 OE1 GLU A 107 -7.879 -1.458 -0.105 1.00 0.00 O ATOM 1692 OE2 GLU A 107 -8.685 -0.372 -1.815 1.00 0.00 O ATOM 0 H GLU A 107 -4.082 2.914 -2.403 1.00 0.00 H new ATOM 0 HA GLU A 107 -5.438 2.711 -0.595 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -5.754 0.629 -2.194 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -5.176 -0.256 -0.796 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.941 0.851 0.614 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -7.531 1.694 -0.805 1.00 0.00 H new ATOM 1699 N ASN A 108 -3.263 2.844 0.931 1.00 0.00 N ATOM 1700 CA ASN A 108 -2.595 3.117 2.209 1.00 0.00 C ATOM 1701 C ASN A 108 -3.483 2.781 3.418 1.00 0.00 C ATOM 1702 O ASN A 108 -4.530 3.393 3.616 1.00 0.00 O ATOM 1703 CB ASN A 108 -2.121 4.590 2.246 1.00 0.00 C ATOM 1704 CG ASN A 108 -2.020 5.169 3.663 1.00 0.00 C ATOM 1705 OD1 ASN A 108 -2.721 6.116 3.999 1.00 0.00 O ATOM 1706 ND2 ASN A 108 -1.171 4.626 4.522 1.00 0.00 N ATOM 0 H ASN A 108 -3.033 3.540 0.222 1.00 0.00 H new ATOM 0 HA ASN A 108 -1.726 2.463 2.281 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.146 4.661 1.763 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -2.811 5.199 1.662 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.098 4.996 5.470 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -0.590 3.838 4.236 1.00 0.00 H new ATOM 1713 N GLU A 109 -3.011 1.834 4.233 1.00 0.00 N ATOM 1714 CA GLU A 109 -3.603 1.385 5.492 1.00 0.00 C ATOM 1715 C GLU A 109 -2.440 1.058 6.451 1.00 0.00 C ATOM 1716 O GLU A 109 -2.369 -0.011 7.060 1.00 0.00 O ATOM 1717 CB GLU A 109 -4.571 0.200 5.238 1.00 0.00 C ATOM 1718 CG GLU A 109 -6.040 0.629 5.116 1.00 0.00 C ATOM 1719 CD GLU A 109 -6.564 1.222 6.435 1.00 0.00 C ATOM 1720 OE1 GLU A 109 -6.824 0.466 7.398 1.00 0.00 O ATOM 1721 OE2 GLU A 109 -6.675 2.461 6.553 1.00 0.00 O ATOM 0 H GLU A 109 -2.151 1.330 4.016 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.219 2.155 5.956 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -4.273 -0.314 4.324 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -4.476 -0.518 6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -6.140 1.366 4.319 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.649 -0.230 4.834 1.00 0.00 H new ATOM 1728 N TYR A 110 -1.474 1.977 6.538 1.00 0.00 N ATOM 1729 CA TYR A 110 -0.265 1.899 7.313 1.00 0.00 C ATOM 1730 C TYR A 110 -0.076 3.279 7.927 1.00 0.00 C ATOM 1731 O TYR A 110 -0.328 4.291 7.267 1.00 0.00 O ATOM 1732 CB TYR A 110 0.902 1.517 6.389 1.00 0.00 C ATOM 1733 CG TYR A 110 1.125 2.387 5.152 1.00 0.00 C ATOM 1734 CD1 TYR A 110 1.706 3.664 5.271 1.00 0.00 C ATOM 1735 CD2 TYR A 110 0.754 1.921 3.876 1.00 0.00 C ATOM 1736 CE1 TYR A 110 1.880 4.488 4.145 1.00 0.00 C ATOM 1737 CE2 TYR A 110 0.959 2.723 2.735 1.00 0.00 C ATOM 1738 CZ TYR A 110 1.530 4.011 2.862 1.00 0.00 C ATOM 1739 OH TYR A 110 1.709 4.806 1.771 1.00 0.00 O ATOM 0 H TYR A 110 -1.536 2.856 6.024 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.311 1.142 8.096 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.818 1.527 6.979 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.748 0.490 6.057 1.00 0.00 H new ATOM 0 HD1 TYR A 110 2.023 4.016 6.242 1.00 0.00 H new ATOM 0 HD2 TYR A 110 0.309 0.942 3.771 1.00 0.00 H new ATOM 0 HE1 TYR A 110 2.281 5.484 4.261 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.679 2.353 1.760 1.00 0.00 H new ATOM 0 HH TYR A 110 2.090 4.277 1.040 1.00 0.00 H new ATOM 1749 N VAL A 111 0.355 3.295 9.182 1.00 0.00 N ATOM 1750 CA VAL A 111 0.791 4.456 9.960 1.00 0.00 C ATOM 1751 C VAL A 111 1.241 3.945 11.354 1.00 0.00 C ATOM 1752 O VAL A 111 0.643 2.982 11.844 1.00 0.00 O ATOM 1753 CB VAL A 111 -0.361 5.500 10.056 1.00 0.00 C ATOM 1754 CG1 VAL A 111 -1.613 5.024 10.799 1.00 0.00 C ATOM 1755 CG2 VAL A 111 0.107 6.823 10.643 1.00 0.00 C ATOM 0 H VAL A 111 0.415 2.434 9.726 1.00 0.00 H new ATOM 0 HA VAL A 111 1.628 4.963 9.480 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.656 5.643 9.017 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.355 5.823 10.811 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -2.027 4.152 10.293 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.350 4.758 11.823 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -0.732 7.518 10.689 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.497 6.658 11.647 1.00 0.00 H new ATOM 0 HG23 VAL A 111 0.891 7.243 10.014 1.00 0.00 H new ATOM 1765 N PRO A 112 2.265 4.529 12.012 1.00 0.00 N ATOM 1766 CA PRO A 112 3.202 5.504 11.472 1.00 0.00 C ATOM 1767 C PRO A 112 4.220 4.775 10.590 1.00 0.00 C ATOM 1768 O PRO A 112 4.646 3.662 10.924 1.00 0.00 O ATOM 1769 CB PRO A 112 3.863 6.158 12.687 1.00 0.00 C ATOM 1770 CG PRO A 112 3.851 5.048 13.736 1.00 0.00 C ATOM 1771 CD PRO A 112 2.588 4.249 13.408 1.00 0.00 C ATOM 0 HA PRO A 112 2.724 6.261 10.851 1.00 0.00 H new ATOM 0 HB2 PRO A 112 4.877 6.489 12.463 1.00 0.00 H new ATOM 0 HB3 PRO A 112 3.309 7.034 13.023 1.00 0.00 H new ATOM 0 HG2 PRO A 112 4.745 4.427 13.672 1.00 0.00 H new ATOM 0 HG3 PRO A 112 3.816 5.454 14.747 1.00 0.00 H new ATOM 0 HD2 PRO A 112 2.754 3.183 13.560 1.00 0.00 H new ATOM 0 HD3 PRO A 112 1.765 4.540 14.061 1.00 0.00 H new ATOM 1779 N ALA A 113 4.601 5.369 9.457 1.00 0.00 N ATOM 1780 CA ALA A 113 5.439 4.664 8.485 1.00 0.00 C ATOM 1781 C ALA A 113 6.377 5.601 7.751 1.00 0.00 C ATOM 1782 O ALA A 113 6.162 6.809 7.731 1.00 0.00 O ATOM 1783 CB ALA A 113 4.572 3.904 7.477 1.00 0.00 C ATOM 0 H ALA A 113 4.348 6.321 9.193 1.00 0.00 H new ATOM 0 HA ALA A 113 6.048 3.956 9.047 1.00 0.00 H new ATOM 0 HB1 ALA A 113 5.213 3.387 6.763 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.954 3.177 8.004 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.931 4.607 6.946 1.00 0.00 H new ATOM 1789 N TYR A 114 7.391 5.019 7.117 1.00 0.00 N ATOM 1790 CA TYR A 114 8.514 5.730 6.529 1.00 0.00 C ATOM 1791 C TYR A 114 8.858 5.056 5.204 1.00 0.00 C ATOM 1792 O TYR A 114 8.994 3.832 5.142 1.00 0.00 O ATOM 1793 CB TYR A 114 9.716 5.685 7.489 1.00 0.00 C ATOM 1794 CG TYR A 114 9.365 5.830 8.962 1.00 0.00 C ATOM 1795 CD1 TYR A 114 9.168 7.101 9.534 1.00 0.00 C ATOM 1796 CD2 TYR A 114 9.134 4.674 9.733 1.00 0.00 C ATOM 1797 CE1 TYR A 114 8.662 7.218 10.841 1.00 0.00 C ATOM 1798 CE2 TYR A 114 8.647 4.783 11.045 1.00 0.00 C ATOM 1799 CZ TYR A 114 8.375 6.054 11.593 1.00 0.00 C ATOM 1800 OH TYR A 114 7.812 6.134 12.831 1.00 0.00 O ATOM 0 H TYR A 114 7.452 4.008 6.996 1.00 0.00 H new ATOM 0 HA TYR A 114 8.259 6.775 6.355 1.00 0.00 H new ATOM 0 HB2 TYR A 114 10.241 4.740 7.347 1.00 0.00 H new ATOM 0 HB3 TYR A 114 10.410 6.480 7.216 1.00 0.00 H new ATOM 0 HD1 TYR A 114 9.406 7.989 8.967 1.00 0.00 H new ATOM 0 HD2 TYR A 114 9.333 3.699 9.313 1.00 0.00 H new ATOM 0 HE1 TYR A 114 8.493 8.195 11.270 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.481 3.894 11.635 1.00 0.00 H new ATOM 0 HH TYR A 114 7.688 5.232 13.193 1.00 0.00 H new ATOM 1810 N TYR A 115 9.001 5.847 4.146 1.00 0.00 N ATOM 1811 CA TYR A 115 9.186 5.377 2.783 1.00 0.00 C ATOM 1812 C TYR A 115 10.331 6.190 2.193 1.00 0.00 C ATOM 1813 O TYR A 115 10.272 7.423 2.174 1.00 0.00 O ATOM 1814 CB TYR A 115 7.888 5.584 1.990 1.00 0.00 C ATOM 1815 CG TYR A 115 6.783 4.581 2.267 1.00 0.00 C ATOM 1816 CD1 TYR A 115 6.011 4.640 3.444 1.00 0.00 C ATOM 1817 CD2 TYR A 115 6.520 3.583 1.316 1.00 0.00 C ATOM 1818 CE1 TYR A 115 5.013 3.676 3.679 1.00 0.00 C ATOM 1819 CE2 TYR A 115 5.544 2.608 1.551 1.00 0.00 C ATOM 1820 CZ TYR A 115 4.782 2.645 2.737 1.00 0.00 C ATOM 1821 OH TYR A 115 3.858 1.670 2.957 1.00 0.00 O ATOM 0 H TYR A 115 8.991 6.864 4.219 1.00 0.00 H new ATOM 0 HA TYR A 115 9.423 4.314 2.747 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.509 6.583 2.203 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.124 5.553 0.926 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.185 5.425 4.166 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.078 3.567 0.391 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.421 3.723 4.581 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.374 1.827 0.824 1.00 0.00 H new ATOM 0 HH TYR A 115 2.973 2.077 3.068 1.00 0.00 H new ATOM 1831 N VAL A 116 11.382 5.509 1.741 1.00 0.00 N ATOM 1832 CA VAL A 116 12.610 6.139 1.275 1.00 0.00 C ATOM 1833 C VAL A 116 12.602 5.964 -0.234 1.00 0.00 C ATOM 1834 O VAL A 116 12.445 4.840 -0.709 1.00 0.00 O ATOM 1835 CB VAL A 116 13.852 5.481 1.923 1.00 0.00 C ATOM 1836 CG1 VAL A 116 15.118 6.288 1.606 1.00 0.00 C ATOM 1837 CG2 VAL A 116 13.744 5.379 3.450 1.00 0.00 C ATOM 0 H VAL A 116 11.402 4.491 1.688 1.00 0.00 H new ATOM 0 HA VAL A 116 12.660 7.192 1.551 1.00 0.00 H new ATOM 0 HB VAL A 116 13.906 4.477 1.503 1.00 0.00 H new ATOM 0 HG11 VAL A 116 15.980 5.809 2.070 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.263 6.328 0.526 1.00 0.00 H new ATOM 0 HG13 VAL A 116 15.011 7.300 1.996 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.644 4.910 3.848 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.637 6.377 3.875 1.00 0.00 H new ATOM 0 HG23 VAL A 116 12.874 4.778 3.714 1.00 0.00 H new ATOM 1847 N PHE A 117 12.779 7.043 -0.990 1.00 0.00 N ATOM 1848 CA PHE A 117 12.731 7.013 -2.442 1.00 0.00 C ATOM 1849 C PHE A 117 14.046 7.528 -2.994 1.00 0.00 C ATOM 1850 O PHE A 117 14.608 8.500 -2.489 1.00 0.00 O ATOM 1851 CB PHE A 117 11.569 7.847 -2.998 1.00 0.00 C ATOM 1852 CG PHE A 117 10.190 7.427 -2.527 1.00 0.00 C ATOM 1853 CD1 PHE A 117 9.724 7.828 -1.262 1.00 0.00 C ATOM 1854 CD2 PHE A 117 9.361 6.647 -3.354 1.00 0.00 C ATOM 1855 CE1 PHE A 117 8.446 7.439 -0.832 1.00 0.00 C ATOM 1856 CE2 PHE A 117 8.081 6.259 -2.919 1.00 0.00 C ATOM 1857 CZ PHE A 117 7.620 6.659 -1.656 1.00 0.00 C ATOM 0 H PHE A 117 12.961 7.970 -0.605 1.00 0.00 H new ATOM 0 HA PHE A 117 12.568 5.981 -2.754 1.00 0.00 H new ATOM 0 HB2 PHE A 117 11.727 8.890 -2.723 1.00 0.00 H new ATOM 0 HB3 PHE A 117 11.595 7.797 -4.087 1.00 0.00 H new ATOM 0 HD1 PHE A 117 10.349 8.434 -0.623 1.00 0.00 H new ATOM 0 HD2 PHE A 117 9.710 6.344 -4.330 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.095 7.743 0.143 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.454 5.654 -3.557 1.00 0.00 H new ATOM 0 HZ PHE A 117 6.636 6.369 -1.320 1.00 0.00 H new ATOM 1867 N ASP A 118 14.509 6.871 -4.050 1.00 0.00 N ATOM 1868 CA ASP A 118 15.627 7.303 -4.878 1.00 0.00 C ATOM 1869 C ASP A 118 15.358 8.704 -5.438 1.00 0.00 C ATOM 1870 O ASP A 118 14.199 9.086 -5.613 1.00 0.00 O ATOM 1871 CB ASP A 118 15.762 6.293 -6.023 1.00 0.00 C ATOM 1872 CG ASP A 118 17.024 6.525 -6.851 1.00 0.00 C ATOM 1873 OD1 ASP A 118 16.983 7.391 -7.750 1.00 0.00 O ATOM 1874 OD2 ASP A 118 18.025 5.826 -6.578 1.00 0.00 O ATOM 0 H ASP A 118 14.101 5.991 -4.364 1.00 0.00 H new ATOM 0 HA ASP A 118 16.546 7.347 -4.293 1.00 0.00 H new ATOM 0 HB2 ASP A 118 15.778 5.283 -5.614 1.00 0.00 H new ATOM 0 HB3 ASP A 118 14.887 6.361 -6.670 1.00 0.00 H new ATOM 1879 N LYS A 119 16.410 9.453 -5.785 1.00 0.00 N ATOM 1880 CA LYS A 119 16.312 10.764 -6.430 1.00 0.00 C ATOM 1881 C LYS A 119 15.465 10.796 -7.707 1.00 0.00 C ATOM 1882 O LYS A 119 15.109 11.889 -8.147 1.00 0.00 O ATOM 1883 CB LYS A 119 17.727 11.340 -6.640 1.00 0.00 C ATOM 1884 CG LYS A 119 18.467 10.863 -7.902 1.00 0.00 C ATOM 1885 CD LYS A 119 18.436 11.946 -8.996 1.00 0.00 C ATOM 1886 CE LYS A 119 18.717 11.394 -10.394 1.00 0.00 C ATOM 1887 NZ LYS A 119 20.095 10.860 -10.555 1.00 0.00 N ATOM 0 H LYS A 119 17.372 9.158 -5.621 1.00 0.00 H new ATOM 0 HA LYS A 119 15.756 11.409 -5.749 1.00 0.00 H new ATOM 0 HB2 LYS A 119 17.654 12.427 -6.674 1.00 0.00 H new ATOM 0 HB3 LYS A 119 18.333 11.088 -5.770 1.00 0.00 H new ATOM 0 HG2 LYS A 119 19.500 10.620 -7.653 1.00 0.00 H new ATOM 0 HG3 LYS A 119 18.006 9.949 -8.276 1.00 0.00 H new ATOM 0 HD2 LYS A 119 17.459 12.430 -8.992 1.00 0.00 H new ATOM 0 HD3 LYS A 119 19.173 12.714 -8.760 1.00 0.00 H new ATOM 0 HE2 LYS A 119 18.001 10.602 -10.614 1.00 0.00 H new ATOM 0 HE3 LYS A 119 18.554 12.184 -11.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 20.218 10.503 -11.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 20.784 11.618 -10.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 20.248 10.085 -9.878 1.00 0.00 H new ATOM 1901 N THR A 120 15.143 9.645 -8.295 1.00 0.00 N ATOM 1902 CA THR A 120 14.337 9.542 -9.508 1.00 0.00 C ATOM 1903 C THR A 120 12.896 9.078 -9.209 1.00 0.00 C ATOM 1904 O THR A 120 12.062 9.043 -10.114 1.00 0.00 O ATOM 1905 CB THR A 120 15.120 8.660 -10.498 1.00 0.00 C ATOM 1906 OG1 THR A 120 14.898 9.045 -11.841 1.00 0.00 O ATOM 1907 CG2 THR A 120 14.849 7.154 -10.368 1.00 0.00 C ATOM 0 H THR A 120 15.442 8.740 -7.933 1.00 0.00 H new ATOM 0 HA THR A 120 14.183 10.517 -9.971 1.00 0.00 H new ATOM 0 HB THR A 120 16.161 8.828 -10.224 1.00 0.00 H new ATOM 0 HG1 THR A 120 15.413 8.463 -12.438 1.00 0.00 H new ATOM 0 HG21 THR A 120 15.443 6.613 -11.104 1.00 0.00 H new ATOM 0 HG22 THR A 120 15.121 6.821 -9.366 1.00 0.00 H new ATOM 0 HG23 THR A 120 13.791 6.958 -10.541 1.00 0.00 H new ATOM 1915 N GLY A 121 12.578 8.739 -7.951 1.00 0.00 N ATOM 1916 CA GLY A 121 11.214 8.488 -7.493 1.00 0.00 C ATOM 1917 C GLY A 121 10.906 7.032 -7.183 1.00 0.00 C ATOM 1918 O GLY A 121 9.790 6.750 -6.750 1.00 0.00 O ATOM 0 H GLY A 121 13.277 8.631 -7.216 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.031 9.083 -6.598 1.00 0.00 H new ATOM 0 HA3 GLY A 121 10.519 8.838 -8.256 1.00 0.00 H new ATOM 1922 N GLN A 122 11.850 6.112 -7.398 1.00 0.00 N ATOM 1923 CA GLN A 122 11.669 4.700 -7.084 1.00 0.00 C ATOM 1924 C GLN A 122 11.629 4.524 -5.570 1.00 0.00 C ATOM 1925 O GLN A 122 12.552 4.965 -4.890 1.00 0.00 O ATOM 1926 CB GLN A 122 12.836 3.880 -7.655 1.00 0.00 C ATOM 1927 CG GLN A 122 12.774 3.756 -9.184 1.00 0.00 C ATOM 1928 CD GLN A 122 13.875 2.854 -9.750 1.00 0.00 C ATOM 1929 OE1 GLN A 122 14.318 1.897 -9.118 1.00 0.00 O ATOM 1930 NE2 GLN A 122 14.349 3.132 -10.953 1.00 0.00 N ATOM 0 H GLN A 122 12.763 6.331 -7.796 1.00 0.00 H new ATOM 0 HA GLN A 122 10.735 4.352 -7.526 1.00 0.00 H new ATOM 0 HB2 GLN A 122 13.778 4.347 -7.369 1.00 0.00 H new ATOM 0 HB3 GLN A 122 12.827 2.884 -7.212 1.00 0.00 H new ATOM 0 HG2 GLN A 122 11.801 3.359 -9.473 1.00 0.00 H new ATOM 0 HG3 GLN A 122 12.858 4.748 -9.628 1.00 0.00 H new ATOM 0 HE21 GLN A 122 13.980 3.926 -11.476 1.00 0.00 H new ATOM 0 HE22 GLN A 122 15.084 2.552 -11.358 1.00 0.00 H new ATOM 1939 N LEU A 123 10.595 3.855 -5.059 1.00 0.00 N ATOM 1940 CA LEU A 123 10.467 3.416 -3.671 1.00 0.00 C ATOM 1941 C LEU A 123 11.623 2.486 -3.310 1.00 0.00 C ATOM 1942 O LEU A 123 11.576 1.286 -3.561 1.00 0.00 O ATOM 1943 CB LEU A 123 9.093 2.768 -3.437 1.00 0.00 C ATOM 1944 CG LEU A 123 8.906 2.234 -2.004 1.00 0.00 C ATOM 1945 CD1 LEU A 123 9.384 3.195 -0.911 1.00 0.00 C ATOM 1946 CD2 LEU A 123 7.428 1.913 -1.767 1.00 0.00 C ATOM 0 H LEU A 123 9.789 3.593 -5.627 1.00 0.00 H new ATOM 0 HA LEU A 123 10.525 4.279 -3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.313 3.500 -3.649 1.00 0.00 H new ATOM 0 HB3 LEU A 123 8.961 1.948 -4.143 1.00 0.00 H new ATOM 0 HG LEU A 123 9.527 1.341 -1.932 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.217 2.745 0.068 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.447 3.395 -1.042 1.00 0.00 H new ATOM 0 HD13 LEU A 123 8.828 4.130 -0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.296 1.535 -0.753 1.00 0.00 H new ATOM 0 HD22 LEU A 123 6.834 2.817 -1.898 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.101 1.158 -2.481 1.00 0.00 H new ATOM 1958 N ARG A 124 12.695 3.045 -2.767 1.00 0.00 N ATOM 1959 CA ARG A 124 13.959 2.362 -2.555 1.00 0.00 C ATOM 1960 C ARG A 124 13.859 1.409 -1.361 1.00 0.00 C ATOM 1961 O ARG A 124 14.411 0.314 -1.442 1.00 0.00 O ATOM 1962 CB ARG A 124 15.044 3.446 -2.391 1.00 0.00 C ATOM 1963 CG ARG A 124 16.461 3.056 -2.835 1.00 0.00 C ATOM 1964 CD ARG A 124 16.576 2.733 -4.340 1.00 0.00 C ATOM 1965 NE ARG A 124 17.709 3.437 -4.976 1.00 0.00 N ATOM 1966 CZ ARG A 124 19.012 3.142 -4.920 1.00 0.00 C ATOM 1967 NH1 ARG A 124 19.441 2.037 -4.311 1.00 0.00 N ATOM 1968 NH2 ARG A 124 19.848 3.998 -5.495 1.00 0.00 N ATOM 0 H ARG A 124 12.707 4.015 -2.453 1.00 0.00 H new ATOM 0 HA ARG A 124 14.225 1.731 -3.403 1.00 0.00 H new ATOM 0 HB2 ARG A 124 14.738 4.326 -2.956 1.00 0.00 H new ATOM 0 HB3 ARG A 124 15.081 3.738 -1.341 1.00 0.00 H new ATOM 0 HG2 ARG A 124 17.144 3.871 -2.595 1.00 0.00 H new ATOM 0 HG3 ARG A 124 16.786 2.188 -2.261 1.00 0.00 H new ATOM 0 HD2 ARG A 124 16.699 1.658 -4.471 1.00 0.00 H new ATOM 0 HD3 ARG A 124 15.649 3.012 -4.842 1.00 0.00 H new ATOM 0 HE ARG A 124 17.465 4.257 -5.531 1.00 0.00 H new ATOM 0 HH11 ARG A 124 18.772 1.401 -3.878 1.00 0.00 H new ATOM 0 HH12 ARG A 124 20.439 1.828 -4.278 1.00 0.00 H new ATOM 0 HH21 ARG A 124 19.486 4.835 -5.952 1.00 0.00 H new ATOM 0 HH22 ARG A 124 20.852 3.819 -5.480 1.00 0.00 H new ATOM 1982 N HIS A 125 13.148 1.778 -0.283 1.00 0.00 N ATOM 1983 CA HIS A 125 12.904 0.923 0.878 1.00 0.00 C ATOM 1984 C HIS A 125 11.717 1.476 1.686 1.00 0.00 C ATOM 1985 O HIS A 125 11.383 2.653 1.546 1.00 0.00 O ATOM 1986 CB HIS A 125 14.176 0.891 1.736 1.00 0.00 C ATOM 1987 CG HIS A 125 14.161 -0.187 2.783 1.00 0.00 C ATOM 1988 ND1 HIS A 125 14.553 -1.497 2.621 1.00 0.00 N ATOM 1989 CD2 HIS A 125 13.776 -0.034 4.084 1.00 0.00 C ATOM 1990 CE1 HIS A 125 14.412 -2.121 3.802 1.00 0.00 C ATOM 1991 NE2 HIS A 125 13.983 -1.255 4.742 1.00 0.00 N ATOM 0 H HIS A 125 12.720 2.700 -0.198 1.00 0.00 H new ATOM 0 HA HIS A 125 12.658 -0.090 0.560 1.00 0.00 H new ATOM 0 HB2 HIS A 125 15.040 0.745 1.087 1.00 0.00 H new ATOM 0 HB3 HIS A 125 14.302 1.858 2.222 1.00 0.00 H new ATOM 0 HD2 HIS A 125 13.382 0.868 4.528 1.00 0.00 H new ATOM 0 HE1 HIS A 125 14.614 -3.168 3.974 1.00 0.00 H new ATOM 0 HE2 HIS A 125 13.838 -1.449 5.733 1.00 0.00 H new ATOM 1999 N PHE A 126 11.115 0.673 2.571 1.00 0.00 N ATOM 2000 CA PHE A 126 10.013 1.071 3.454 1.00 0.00 C ATOM 2001 C PHE A 126 10.195 0.420 4.835 1.00 0.00 C ATOM 2002 O PHE A 126 10.719 -0.692 4.934 1.00 0.00 O ATOM 2003 CB PHE A 126 8.663 0.698 2.806 1.00 0.00 C ATOM 2004 CG PHE A 126 7.591 0.176 3.749 1.00 0.00 C ATOM 2005 CD1 PHE A 126 6.882 1.074 4.564 1.00 0.00 C ATOM 2006 CD2 PHE A 126 7.322 -1.204 3.837 1.00 0.00 C ATOM 2007 CE1 PHE A 126 5.897 0.600 5.447 1.00 0.00 C ATOM 2008 CE2 PHE A 126 6.343 -1.678 4.731 1.00 0.00 C ATOM 2009 CZ PHE A 126 5.627 -0.773 5.535 1.00 0.00 C ATOM 0 H PHE A 126 11.390 -0.301 2.696 1.00 0.00 H new ATOM 0 HA PHE A 126 10.019 2.152 3.597 1.00 0.00 H new ATOM 0 HB2 PHE A 126 8.272 1.578 2.296 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.846 -0.058 2.042 1.00 0.00 H new ATOM 0 HD1 PHE A 126 7.095 2.132 4.512 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.868 -1.900 3.217 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.345 1.297 6.061 1.00 0.00 H new ATOM 0 HE2 PHE A 126 6.142 -2.737 4.799 1.00 0.00 H new ATOM 0 HZ PHE A 126 4.872 -1.134 6.218 1.00 0.00 H new ATOM 2019 N GLN A 127 9.734 1.104 5.884 1.00 0.00 N ATOM 2020 CA GLN A 127 9.746 0.689 7.283 1.00 0.00 C ATOM 2021 C GLN A 127 8.457 1.229 7.924 1.00 0.00 C ATOM 2022 O GLN A 127 7.951 2.268 7.499 1.00 0.00 O ATOM 2023 CB GLN A 127 11.020 1.278 7.936 1.00 0.00 C ATOM 2024 CG GLN A 127 11.154 1.145 9.467 1.00 0.00 C ATOM 2025 CD GLN A 127 11.151 -0.293 9.993 1.00 0.00 C ATOM 2026 OE1 GLN A 127 11.547 -1.236 9.315 1.00 0.00 O ATOM 2027 NE2 GLN A 127 10.688 -0.492 11.215 1.00 0.00 N ATOM 0 H GLN A 127 9.314 2.026 5.767 1.00 0.00 H new ATOM 0 HA GLN A 127 9.771 -0.393 7.411 1.00 0.00 H new ATOM 0 HB2 GLN A 127 11.886 0.800 7.478 1.00 0.00 H new ATOM 0 HB3 GLN A 127 11.070 2.337 7.683 1.00 0.00 H new ATOM 0 HG2 GLN A 127 12.080 1.628 9.779 1.00 0.00 H new ATOM 0 HG3 GLN A 127 10.335 1.690 9.937 1.00 0.00 H new ATOM 0 HE21 GLN A 127 10.361 0.298 11.771 1.00 0.00 H new ATOM 0 HE22 GLN A 127 10.658 -1.435 11.602 1.00 0.00 H new ATOM 2036 N ALA A 128 7.948 0.591 8.981 1.00 0.00 N ATOM 2037 CA ALA A 128 6.857 1.132 9.786 1.00 0.00 C ATOM 2038 C ALA A 128 7.125 0.810 11.255 1.00 0.00 C ATOM 2039 O ALA A 128 7.581 -0.293 11.570 1.00 0.00 O ATOM 2040 CB ALA A 128 5.513 0.544 9.341 1.00 0.00 C ATOM 0 H ALA A 128 8.284 -0.317 9.301 1.00 0.00 H new ATOM 0 HA ALA A 128 6.805 2.212 9.652 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.713 0.960 9.954 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.336 0.793 8.295 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.533 -0.540 9.458 1.00 0.00 H new ATOM 2046 N GLY A 129 6.832 1.763 12.144 1.00 0.00 N ATOM 2047 CA GLY A 129 7.224 1.706 13.551 1.00 0.00 C ATOM 2048 C GLY A 129 8.748 1.621 13.737 1.00 0.00 C ATOM 2049 O GLY A 129 9.514 1.663 12.767 1.00 0.00 O ATOM 0 H GLY A 129 6.310 2.605 11.902 1.00 0.00 H new ATOM 0 HA2 GLY A 129 6.848 2.590 14.065 1.00 0.00 H new ATOM 0 HA3 GLY A 129 6.756 0.841 14.020 1.00 0.00 H new ATOM 2053 N GLY A 130 9.193 1.502 14.993 1.00 0.00 N ATOM 2054 CA GLY A 130 10.611 1.340 15.325 1.00 0.00 C ATOM 2055 C GLY A 130 11.016 1.914 16.686 1.00 0.00 C ATOM 2056 O GLY A 130 12.180 2.286 16.841 1.00 0.00 O ATOM 0 H GLY A 130 8.579 1.515 15.807 1.00 0.00 H new ATOM 0 HA2 GLY A 130 10.856 0.278 15.306 1.00 0.00 H new ATOM 0 HA3 GLY A 130 11.209 1.820 14.550 1.00 0.00 H new ATOM 2060 N SER A 131 10.085 2.043 17.647 1.00 0.00 N ATOM 2061 CA SER A 131 10.292 2.735 18.932 1.00 0.00 C ATOM 2062 C SER A 131 10.940 4.124 18.744 1.00 0.00 C ATOM 2063 O SER A 131 11.757 4.571 19.554 1.00 0.00 O ATOM 2064 CB SER A 131 11.070 1.817 19.889 1.00 0.00 C ATOM 2065 OG SER A 131 10.457 0.537 19.978 1.00 0.00 O ATOM 0 H SER A 131 9.145 1.660 17.550 1.00 0.00 H new ATOM 0 HA SER A 131 9.324 2.941 19.389 1.00 0.00 H new ATOM 0 HB2 SER A 131 12.097 1.709 19.540 1.00 0.00 H new ATOM 0 HB3 SER A 131 11.116 2.272 20.878 1.00 0.00 H new ATOM 0 HG SER A 131 10.970 -0.030 20.591 1.00 0.00 H new ATOM 2071 N GLY A 132 10.598 4.782 17.636 1.00 0.00 N ATOM 2072 CA GLY A 132 11.228 5.981 17.113 1.00 0.00 C ATOM 2073 C GLY A 132 11.378 5.718 15.612 1.00 0.00 C ATOM 2074 O GLY A 132 10.546 5.014 15.031 1.00 0.00 O ATOM 0 H GLY A 132 9.826 4.468 17.048 1.00 0.00 H new ATOM 0 HA2 GLY A 132 10.617 6.864 17.301 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.196 6.157 17.583 1.00 0.00 H new ATOM 2078 N MET A 133 12.449 6.217 14.991 1.00 0.00 N ATOM 2079 CA MET A 133 12.787 5.895 13.601 1.00 0.00 C ATOM 2080 C MET A 133 14.303 5.777 13.367 1.00 0.00 C ATOM 2081 O MET A 133 14.784 6.054 12.270 1.00 0.00 O ATOM 2082 CB MET A 133 12.086 6.870 12.633 1.00 0.00 C ATOM 2083 CG MET A 133 12.623 8.306 12.653 1.00 0.00 C ATOM 2084 SD MET A 133 12.039 9.293 11.250 1.00 0.00 S ATOM 2085 CE MET A 133 13.403 10.477 11.135 1.00 0.00 C ATOM 0 H MET A 133 13.107 6.856 15.437 1.00 0.00 H new ATOM 0 HA MET A 133 12.401 4.899 13.385 1.00 0.00 H new ATOM 0 HB2 MET A 133 12.177 6.479 11.620 1.00 0.00 H new ATOM 0 HB3 MET A 133 11.023 6.893 12.872 1.00 0.00 H new ATOM 0 HG2 MET A 133 12.321 8.789 13.582 1.00 0.00 H new ATOM 0 HG3 MET A 133 13.713 8.282 12.646 1.00 0.00 H new ATOM 0 HE1 MET A 133 13.205 11.182 10.328 1.00 0.00 H new ATOM 0 HE2 MET A 133 13.495 11.019 12.076 1.00 0.00 H new ATOM 0 HE3 MET A 133 14.332 9.944 10.932 1.00 0.00 H new ATOM 2095 N LYS A 134 15.100 5.381 14.371 1.00 0.00 N ATOM 2096 CA LYS A 134 16.555 5.301 14.174 1.00 0.00 C ATOM 2097 C LYS A 134 16.930 4.309 13.065 1.00 0.00 C ATOM 2098 O LYS A 134 17.886 4.563 12.337 1.00 0.00 O ATOM 2099 CB LYS A 134 17.282 4.977 15.496 1.00 0.00 C ATOM 2100 CG LYS A 134 18.817 5.100 15.403 1.00 0.00 C ATOM 2101 CD LYS A 134 19.313 6.537 15.157 1.00 0.00 C ATOM 2102 CE LYS A 134 20.817 6.535 14.856 1.00 0.00 C ATOM 2103 NZ LYS A 134 21.374 7.907 14.779 1.00 0.00 N ATOM 0 H LYS A 134 14.774 5.118 15.301 1.00 0.00 H new ATOM 0 HA LYS A 134 16.891 6.284 13.845 1.00 0.00 H new ATOM 0 HB2 LYS A 134 16.919 5.648 16.275 1.00 0.00 H new ATOM 0 HB3 LYS A 134 17.025 3.963 15.803 1.00 0.00 H new ATOM 0 HG2 LYS A 134 19.258 4.727 16.327 1.00 0.00 H new ATOM 0 HG3 LYS A 134 19.175 4.459 14.597 1.00 0.00 H new ATOM 0 HD2 LYS A 134 18.769 6.979 14.323 1.00 0.00 H new ATOM 0 HD3 LYS A 134 19.111 7.154 16.033 1.00 0.00 H new ATOM 0 HE2 LYS A 134 21.340 5.975 15.631 1.00 0.00 H new ATOM 0 HE3 LYS A 134 20.997 6.018 13.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 22.392 7.857 14.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 20.894 8.435 14.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 21.227 8.393 15.687 1.00 0.00 H new ATOM 2117 N MET A 135 16.178 3.215 12.894 1.00 0.00 N ATOM 2118 CA MET A 135 16.436 2.239 11.836 1.00 0.00 C ATOM 2119 C MET A 135 16.272 2.924 10.471 1.00 0.00 C ATOM 2120 O MET A 135 17.148 2.816 9.612 1.00 0.00 O ATOM 2121 CB MET A 135 15.497 1.028 12.015 1.00 0.00 C ATOM 2122 CG MET A 135 16.040 -0.281 11.418 1.00 0.00 C ATOM 2123 SD MET A 135 16.512 -0.302 9.663 1.00 0.00 S ATOM 2124 CE MET A 135 14.972 0.261 8.890 1.00 0.00 C ATOM 0 H MET A 135 15.378 2.985 13.484 1.00 0.00 H new ATOM 0 HA MET A 135 17.457 1.863 11.892 1.00 0.00 H new ATOM 0 HB2 MET A 135 15.311 0.880 13.079 1.00 0.00 H new ATOM 0 HB3 MET A 135 14.537 1.255 11.552 1.00 0.00 H new ATOM 0 HG2 MET A 135 16.914 -0.574 12.000 1.00 0.00 H new ATOM 0 HG3 MET A 135 15.284 -1.052 11.568 1.00 0.00 H new ATOM 0 HE1 MET A 135 14.738 -0.377 8.038 1.00 0.00 H new ATOM 0 HE2 MET A 135 14.160 0.209 9.616 1.00 0.00 H new ATOM 0 HE3 MET A 135 15.090 1.290 8.551 1.00 0.00 H new ATOM 2134 N LEU A 136 15.185 3.688 10.291 1.00 0.00 N ATOM 2135 CA LEU A 136 14.943 4.471 9.078 1.00 0.00 C ATOM 2136 C LEU A 136 16.135 5.374 8.801 1.00 0.00 C ATOM 2137 O LEU A 136 16.596 5.436 7.664 1.00 0.00 O ATOM 2138 CB LEU A 136 13.648 5.291 9.228 1.00 0.00 C ATOM 2139 CG LEU A 136 13.284 6.264 8.090 1.00 0.00 C ATOM 2140 CD1 LEU A 136 14.100 7.559 8.039 1.00 0.00 C ATOM 2141 CD2 LEU A 136 13.252 5.545 6.739 1.00 0.00 C ATOM 0 H LEU A 136 14.447 3.778 10.989 1.00 0.00 H new ATOM 0 HA LEU A 136 14.820 3.797 8.230 1.00 0.00 H new ATOM 0 HB2 LEU A 136 12.820 4.592 9.350 1.00 0.00 H new ATOM 0 HB3 LEU A 136 13.719 5.866 10.151 1.00 0.00 H new ATOM 0 HG LEU A 136 12.278 6.608 8.329 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.762 8.169 7.202 1.00 0.00 H new ATOM 0 HD12 LEU A 136 13.964 8.111 8.969 1.00 0.00 H new ATOM 0 HD13 LEU A 136 15.155 7.319 7.910 1.00 0.00 H new ATOM 0 HD21 LEU A 136 12.992 6.256 5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 136 14.233 5.117 6.531 1.00 0.00 H new ATOM 0 HD23 LEU A 136 12.508 4.749 6.768 1.00 0.00 H new ATOM 2153 N GLU A 137 16.661 6.046 9.824 1.00 0.00 N ATOM 2154 CA GLU A 137 17.815 6.917 9.654 1.00 0.00 C ATOM 2155 C GLU A 137 19.025 6.159 9.088 1.00 0.00 C ATOM 2156 O GLU A 137 19.736 6.706 8.240 1.00 0.00 O ATOM 2157 CB GLU A 137 18.123 7.643 10.969 1.00 0.00 C ATOM 2158 CG GLU A 137 19.203 8.706 10.758 1.00 0.00 C ATOM 2159 CD GLU A 137 19.290 9.654 11.954 1.00 0.00 C ATOM 2160 OE1 GLU A 137 18.543 10.655 11.996 1.00 0.00 O ATOM 2161 OE2 GLU A 137 20.133 9.433 12.851 1.00 0.00 O ATOM 0 H GLU A 137 16.304 6.002 10.778 1.00 0.00 H new ATOM 0 HA GLU A 137 17.574 7.676 8.910 1.00 0.00 H new ATOM 0 HB2 GLU A 137 17.216 8.110 11.354 1.00 0.00 H new ATOM 0 HB3 GLU A 137 18.454 6.924 11.718 1.00 0.00 H new ATOM 0 HG2 GLU A 137 20.167 8.222 10.604 1.00 0.00 H new ATOM 0 HG3 GLU A 137 18.984 9.276 9.855 1.00 0.00 H new ATOM 2168 N LYS A 138 19.241 4.890 9.465 1.00 0.00 N ATOM 2169 CA LYS A 138 20.317 4.093 8.873 1.00 0.00 C ATOM 2170 C LYS A 138 20.014 3.897 7.395 1.00 0.00 C ATOM 2171 O LYS A 138 20.895 4.076 6.555 1.00 0.00 O ATOM 2172 CB LYS A 138 20.483 2.710 9.544 1.00 0.00 C ATOM 2173 CG LYS A 138 20.449 2.667 11.079 1.00 0.00 C ATOM 2174 CD LYS A 138 21.327 3.696 11.803 1.00 0.00 C ATOM 2175 CE LYS A 138 22.826 3.606 11.467 1.00 0.00 C ATOM 2176 NZ LYS A 138 23.459 2.352 11.957 1.00 0.00 N ATOM 0 H LYS A 138 18.689 4.401 10.170 1.00 0.00 H new ATOM 0 HA LYS A 138 21.251 4.634 9.023 1.00 0.00 H new ATOM 0 HB2 LYS A 138 19.695 2.056 9.170 1.00 0.00 H new ATOM 0 HB3 LYS A 138 21.432 2.286 9.215 1.00 0.00 H new ATOM 0 HG2 LYS A 138 19.418 2.807 11.403 1.00 0.00 H new ATOM 0 HG3 LYS A 138 20.752 1.671 11.401 1.00 0.00 H new ATOM 0 HD2 LYS A 138 20.972 4.696 11.555 1.00 0.00 H new ATOM 0 HD3 LYS A 138 21.201 3.570 12.878 1.00 0.00 H new ATOM 0 HE2 LYS A 138 22.955 3.673 10.387 1.00 0.00 H new ATOM 0 HE3 LYS A 138 23.342 4.461 11.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 24.467 2.349 11.701 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 23.364 2.296 12.991 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 22.989 1.533 11.522 1.00 0.00 H new ATOM 2190 N ARG A 139 18.764 3.559 7.063 1.00 0.00 N ATOM 2191 CA ARG A 139 18.382 3.281 5.693 1.00 0.00 C ATOM 2192 C ARG A 139 18.529 4.511 4.814 1.00 0.00 C ATOM 2193 O ARG A 139 19.078 4.390 3.725 1.00 0.00 O ATOM 2194 CB ARG A 139 16.957 2.714 5.644 1.00 0.00 C ATOM 2195 CG ARG A 139 16.619 2.149 4.258 1.00 0.00 C ATOM 2196 CD ARG A 139 17.357 0.841 3.924 1.00 0.00 C ATOM 2197 NE ARG A 139 16.879 -0.265 4.774 1.00 0.00 N ATOM 2198 CZ ARG A 139 17.540 -0.938 5.722 1.00 0.00 C ATOM 2199 NH1 ARG A 139 18.832 -0.721 5.956 1.00 0.00 N ATOM 2200 NH2 ARG A 139 16.875 -1.838 6.439 1.00 0.00 N ATOM 0 H ARG A 139 18.002 3.474 7.736 1.00 0.00 H new ATOM 0 HA ARG A 139 19.060 2.527 5.294 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.852 1.929 6.393 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.244 3.498 5.901 1.00 0.00 H new ATOM 0 HG2 ARG A 139 15.545 1.974 4.199 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.862 2.896 3.502 1.00 0.00 H new ATOM 0 HD2 ARG A 139 17.204 0.590 2.874 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.429 0.977 4.066 1.00 0.00 H new ATOM 0 HE ARG A 139 15.914 -0.556 4.618 1.00 0.00 H new ATOM 0 HH11 ARG A 139 19.340 -0.028 5.407 1.00 0.00 H new ATOM 0 HH12 ARG A 139 19.314 -1.247 6.685 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.884 -2.002 6.260 1.00 0.00 H new ATOM 0 HH22 ARG A 139 17.355 -2.365 7.168 1.00 0.00 H new ATOM 2214 N VAL A 140 18.103 5.686 5.262 1.00 0.00 N ATOM 2215 CA VAL A 140 18.312 6.923 4.535 1.00 0.00 C ATOM 2216 C VAL A 140 19.801 7.134 4.271 1.00 0.00 C ATOM 2217 O VAL A 140 20.166 7.470 3.147 1.00 0.00 O ATOM 2218 CB VAL A 140 17.642 8.059 5.331 1.00 0.00 C ATOM 2219 CG1 VAL A 140 18.274 9.428 5.041 1.00 0.00 C ATOM 2220 CG2 VAL A 140 16.136 8.024 5.013 1.00 0.00 C ATOM 0 H VAL A 140 17.602 5.803 6.143 1.00 0.00 H new ATOM 0 HA VAL A 140 17.850 6.897 3.548 1.00 0.00 H new ATOM 0 HB VAL A 140 17.796 7.905 6.399 1.00 0.00 H new ATOM 0 HG11 VAL A 140 17.766 10.195 5.626 1.00 0.00 H new ATOM 0 HG12 VAL A 140 19.330 9.406 5.310 1.00 0.00 H new ATOM 0 HG13 VAL A 140 18.175 9.657 3.980 1.00 0.00 H new ATOM 0 HG21 VAL A 140 15.630 8.818 5.562 1.00 0.00 H new ATOM 0 HG22 VAL A 140 15.987 8.170 3.943 1.00 0.00 H new ATOM 0 HG23 VAL A 140 15.724 7.059 5.308 1.00 0.00 H new ATOM 2230 N ASN A 141 20.674 6.895 5.253 1.00 0.00 N ATOM 2231 CA ASN A 141 22.105 7.116 5.059 1.00 0.00 C ATOM 2232 C ASN A 141 22.654 6.112 4.050 1.00 0.00 C ATOM 2233 O ASN A 141 23.468 6.482 3.204 1.00 0.00 O ATOM 2234 CB ASN A 141 22.877 7.049 6.387 1.00 0.00 C ATOM 2235 CG ASN A 141 22.814 8.377 7.135 1.00 0.00 C ATOM 2236 OD1 ASN A 141 23.677 9.234 6.974 1.00 0.00 O ATOM 2237 ND2 ASN A 141 21.792 8.589 7.946 1.00 0.00 N ATOM 0 H ASN A 141 20.417 6.553 6.179 1.00 0.00 H new ATOM 0 HA ASN A 141 22.244 8.122 4.664 1.00 0.00 H new ATOM 0 HB2 ASN A 141 22.462 6.258 7.011 1.00 0.00 H new ATOM 0 HB3 ASN A 141 23.917 6.788 6.192 1.00 0.00 H new ATOM 0 HD21 ASN A 141 21.714 9.474 8.447 1.00 0.00 H new ATOM 0 HD22 ASN A 141 21.082 7.868 8.071 1.00 0.00 H new ATOM 2244 N ARG A 142 22.170 4.864 4.068 1.00 0.00 N ATOM 2245 CA ARG A 142 22.494 3.899 3.024 1.00 0.00 C ATOM 2246 C ARG A 142 21.996 4.392 1.667 1.00 0.00 C ATOM 2247 O ARG A 142 22.741 4.294 0.703 1.00 0.00 O ATOM 2248 CB ARG A 142 21.936 2.514 3.396 1.00 0.00 C ATOM 2249 CG ARG A 142 22.013 1.475 2.267 1.00 0.00 C ATOM 2250 CD ARG A 142 23.442 1.227 1.756 1.00 0.00 C ATOM 2251 NE ARG A 142 23.472 0.273 0.636 1.00 0.00 N ATOM 2252 CZ ARG A 142 23.499 -1.062 0.698 1.00 0.00 C ATOM 2253 NH1 ARG A 142 23.484 -1.708 1.862 1.00 0.00 N ATOM 2254 NH2 ARG A 142 23.542 -1.730 -0.446 1.00 0.00 N ATOM 0 H ARG A 142 21.553 4.504 4.796 1.00 0.00 H new ATOM 0 HA ARG A 142 23.576 3.799 2.942 1.00 0.00 H new ATOM 0 HB2 ARG A 142 22.483 2.135 4.260 1.00 0.00 H new ATOM 0 HB3 ARG A 142 20.895 2.625 3.701 1.00 0.00 H new ATOM 0 HG2 ARG A 142 21.594 0.533 2.622 1.00 0.00 H new ATOM 0 HG3 ARG A 142 21.391 1.807 1.436 1.00 0.00 H new ATOM 0 HD2 ARG A 142 23.882 2.172 1.438 1.00 0.00 H new ATOM 0 HD3 ARG A 142 24.057 0.847 2.572 1.00 0.00 H new ATOM 0 HE ARG A 142 23.472 0.679 -0.300 1.00 0.00 H new ATOM 0 HH11 ARG A 142 23.451 -1.183 2.736 1.00 0.00 H new ATOM 0 HH12 ARG A 142 23.505 -2.728 1.880 1.00 0.00 H new ATOM 0 HH21 ARG A 142 23.553 -1.224 -1.332 1.00 0.00 H new ATOM 0 HH22 ARG A 142 23.564 -2.750 -0.441 1.00 0.00 H new ATOM 2268 N VAL A 143 20.782 4.929 1.556 1.00 0.00 N ATOM 2269 CA VAL A 143 20.274 5.404 0.274 1.00 0.00 C ATOM 2270 C VAL A 143 21.089 6.609 -0.215 1.00 0.00 C ATOM 2271 O VAL A 143 21.335 6.701 -1.417 1.00 0.00 O ATOM 2272 CB VAL A 143 18.749 5.622 0.331 1.00 0.00 C ATOM 2273 CG1 VAL A 143 18.211 6.324 -0.924 1.00 0.00 C ATOM 2274 CG2 VAL A 143 18.058 4.250 0.450 1.00 0.00 C ATOM 0 H VAL A 143 20.135 5.045 2.336 1.00 0.00 H new ATOM 0 HA VAL A 143 20.414 4.637 -0.488 1.00 0.00 H new ATOM 0 HB VAL A 143 18.538 6.258 1.191 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.132 6.454 -0.834 1.00 0.00 H new ATOM 0 HG12 VAL A 143 18.687 7.299 -1.027 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.431 5.718 -1.803 1.00 0.00 H new ATOM 0 HG21 VAL A 143 16.978 4.389 0.491 1.00 0.00 H new ATOM 0 HG22 VAL A 143 18.312 3.638 -0.416 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.395 3.751 1.359 1.00 0.00 H new ATOM 2284 N LEU A 144 21.599 7.484 0.659 1.00 0.00 N ATOM 2285 CA LEU A 144 22.555 8.509 0.232 1.00 0.00 C ATOM 2286 C LEU A 144 23.794 7.831 -0.350 1.00 0.00 C ATOM 2287 O LEU A 144 24.221 8.177 -1.447 1.00 0.00 O ATOM 2288 CB LEU A 144 22.976 9.447 1.373 1.00 0.00 C ATOM 2289 CG LEU A 144 21.836 10.288 1.964 1.00 0.00 C ATOM 2290 CD1 LEU A 144 22.323 11.031 3.213 1.00 0.00 C ATOM 2291 CD2 LEU A 144 21.263 11.294 0.962 1.00 0.00 C ATOM 0 H LEU A 144 21.369 7.503 1.653 1.00 0.00 H new ATOM 0 HA LEU A 144 22.057 9.122 -0.520 1.00 0.00 H new ATOM 0 HB2 LEU A 144 23.421 8.851 2.170 1.00 0.00 H new ATOM 0 HB3 LEU A 144 23.752 10.118 1.006 1.00 0.00 H new ATOM 0 HG LEU A 144 21.036 9.596 2.226 1.00 0.00 H new ATOM 0 HD11 LEU A 144 21.507 11.625 3.625 1.00 0.00 H new ATOM 0 HD12 LEU A 144 22.658 10.309 3.958 1.00 0.00 H new ATOM 0 HD13 LEU A 144 23.151 11.688 2.946 1.00 0.00 H new ATOM 0 HD21 LEU A 144 20.461 11.861 1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 144 22.050 11.977 0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 144 20.870 10.761 0.096 1.00 0.00 H new ATOM 2303 N ALA A 145 24.321 6.814 0.337 1.00 0.00 N ATOM 2304 CA ALA A 145 25.439 5.997 -0.133 1.00 0.00 C ATOM 2305 C ALA A 145 25.105 5.137 -1.372 1.00 0.00 C ATOM 2306 O ALA A 145 25.988 4.438 -1.874 1.00 0.00 O ATOM 2307 CB ALA A 145 25.966 5.133 1.020 1.00 0.00 C ATOM 0 H ALA A 145 23.974 6.531 1.254 1.00 0.00 H new ATOM 0 HA ALA A 145 26.218 6.683 -0.464 1.00 0.00 H new ATOM 0 HB1 ALA A 145 26.799 4.525 0.668 1.00 0.00 H new ATOM 0 HB2 ALA A 145 26.305 5.777 1.832 1.00 0.00 H new ATOM 0 HB3 ALA A 145 25.169 4.483 1.381 1.00 0.00 H new ATOM 2313 N GLU A 146 23.875 5.184 -1.892 1.00 0.00 N ATOM 2314 CA GLU A 146 23.431 4.499 -3.100 1.00 0.00 C ATOM 2315 C GLU A 146 23.066 5.528 -4.179 1.00 0.00 C ATOM 2316 O GLU A 146 22.733 5.137 -5.303 1.00 0.00 O ATOM 2317 CB GLU A 146 22.165 3.688 -2.783 1.00 0.00 C ATOM 2318 CG GLU A 146 22.355 2.447 -1.902 1.00 0.00 C ATOM 2319 CD GLU A 146 22.626 1.166 -2.707 1.00 0.00 C ATOM 2320 OE1 GLU A 146 21.956 0.934 -3.740 1.00 0.00 O ATOM 2321 OE2 GLU A 146 23.468 0.358 -2.255 1.00 0.00 O ATOM 0 H GLU A 146 23.129 5.728 -1.458 1.00 0.00 H new ATOM 0 HA GLU A 146 24.233 3.850 -3.452 1.00 0.00 H new ATOM 0 HB2 GLU A 146 21.449 4.349 -2.294 1.00 0.00 H new ATOM 0 HB3 GLU A 146 21.716 3.373 -3.725 1.00 0.00 H new ATOM 0 HG2 GLU A 146 23.185 2.620 -1.217 1.00 0.00 H new ATOM 0 HG3 GLU A 146 21.463 2.303 -1.292 1.00 0.00 H new ATOM 2328 N THR A 147 23.104 6.825 -3.848 1.00 0.00 N ATOM 2329 CA THR A 147 22.570 7.893 -4.675 1.00 0.00 C ATOM 2330 C THR A 147 23.424 9.167 -4.540 1.00 0.00 C ATOM 2331 O THR A 147 22.926 10.283 -4.371 1.00 0.00 O ATOM 2332 CB THR A 147 21.087 8.122 -4.313 1.00 0.00 C ATOM 2333 OG1 THR A 147 20.390 6.955 -3.913 1.00 0.00 O ATOM 2334 CG2 THR A 147 20.388 8.657 -5.549 1.00 0.00 C ATOM 0 H THR A 147 23.518 7.159 -2.977 1.00 0.00 H new ATOM 0 HA THR A 147 22.615 7.609 -5.726 1.00 0.00 H new ATOM 0 HB THR A 147 21.078 8.807 -3.465 1.00 0.00 H new ATOM 0 HG1 THR A 147 20.498 6.824 -2.948 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.335 8.830 -5.326 1.00 0.00 H new ATOM 0 HG22 THR A 147 20.853 9.595 -5.853 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.473 7.931 -6.358 1.00 0.00 H new ATOM 2342 N GLU A 148 24.740 8.991 -4.595 1.00 0.00 N ATOM 2343 CA GLU A 148 25.749 10.033 -4.521 1.00 0.00 C ATOM 2344 C GLU A 148 26.934 9.554 -5.360 1.00 0.00 C ATOM 2345 O GLU A 148 27.316 8.370 -5.233 1.00 0.00 O ATOM 2346 CB GLU A 148 26.126 10.284 -3.049 1.00 0.00 C ATOM 2347 CG GLU A 148 27.145 11.420 -2.923 1.00 0.00 C ATOM 2348 CD GLU A 148 27.491 11.727 -1.451 1.00 0.00 C ATOM 2349 OE1 GLU A 148 28.428 11.107 -0.894 1.00 0.00 O ATOM 2350 OE2 GLU A 148 26.851 12.614 -0.839 1.00 0.00 O ATOM 2351 OXT GLU A 148 27.428 10.332 -6.200 1.00 0.00 O ATOM 0 H GLU A 148 25.151 8.063 -4.698 1.00 0.00 H new ATOM 0 HA GLU A 148 25.392 10.986 -4.912 1.00 0.00 H new ATOM 0 HB2 GLU A 148 25.230 10.531 -2.479 1.00 0.00 H new ATOM 0 HB3 GLU A 148 26.538 9.373 -2.616 1.00 0.00 H new ATOM 0 HG2 GLU A 148 28.055 11.152 -3.461 1.00 0.00 H new ATOM 0 HG3 GLU A 148 26.747 12.318 -3.397 1.00 0.00 H new TER 2358 GLU A 148