USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=46 USER MOD reduce.3.24.130724 removed 1156 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 20 THR OG1 : rot -74:sc= 0.478 USER MOD Set 1.2: A 117 ASN :FLIP amide:sc= -1.65 F(o=-1.7,f=-1.2) USER MOD Set 2.1: A 16 GLN :FLIP amide:sc= -6.95! C(o=-8.2!,f=-7.4!) USER MOD Set 2.2: A 98 HIS : no HD1:sc= -0.407 K(o=-7.4,f=-10) USER MOD Set 3.1: A 62 CYS SG : rot -19:sc= -0.303 USER MOD Set 3.2: A 66 SER OG : rot 63:sc= 0.445 USER MOD Set 3.3: A 115 CYS SG : rot 180:sc= 0 USER MOD Set 4.1: A 47 SER OG : rot -109:sc= -0.271 USER MOD Set 4.2: A 92 SER OG : rot -130:sc= -0.0571 USER MOD Set 4.3: A 94 THR OG1 : rot -150:sc= 0.0675 USER MOD Single : A 1 MET CE :methyl 159:sc= -0.143 (180deg=-0.677) USER MOD Single : A 1 MET N :NH3+ 169:sc= -0.229 (180deg=-0.387) USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 LYS NZ :NH3+ -118:sc= -0.111 (180deg=-1.1) USER MOD Single : A 8 LYS NZ :NH3+ -179:sc= 0.427 (180deg=0.426) USER MOD Single : A 10 LYS NZ :NH3+ -134:sc= -0.0761 (180deg=-0.213) USER MOD Single : A 11 SER OG : rot 77:sc= 0.8 USER MOD Single : A 13 ASN :FLIP amide:sc= -0.551 F(o=-2.3,f=-0.55) USER MOD Single : A 15 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0.16) USER MOD Single : A 22 ASN : amide:sc= -0.094 X(o=-0.094,f=-0.13) USER MOD Single : A 23 ASN : amide:sc= -0.484 X(o=-0.48,f=-0.15) USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 GLN : amide:sc= -1.29 K(o=-1.3,f=-3.6!) USER MOD Single : A 31 ASN : amide:sc= -1.23 K(o=-1.2,f=-4.1!) USER MOD Single : A 33 TYR OH : rot 180:sc= 0 USER MOD Single : A 36 HIS : no HD1:sc= 0 X(o=0,f=-0.1) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot -61:sc= -2.52! USER MOD Single : A 49 LYS NZ :NH3+ -137:sc= -1.9 (180deg=-4.58!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 171:sc= -0.495 (180deg=-0.72) USER MOD Single : A 57 LYS NZ :NH3+ 135:sc= -0.838 (180deg=-3.11!) USER MOD Single : A 60 SER OG : rot 150:sc= -0.639 USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00358) USER MOD Single : A 78 LYS NZ :NH3+ -111:sc= -0.29 (180deg=-0.866) USER MOD Single : A 81 THR OG1 : rot -24:sc= 0.624 USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HE2:sc= 0.275 K(o=0.28,f=-1.2) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot 31:sc= -0.794 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= 0.703 K(o=0.7,f=-4.2!) USER MOD Single : A 104 ASN : amide:sc= -0.25 K(o=-0.25,f=-0.83) USER MOD Single : A 110 ASN :FLIP amide:sc= -0.158 F(o=-2,f=-0.16) USER MOD Single : A 114 TYR OH : rot 107:sc= 1.07 USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ -157:sc= 0 (180deg=-0.0464) USER MOD Single : A 127 HIS : no HE2:sc= 0.326 K(o=0.33,f=-1.1) USER MOD Single : A 128 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0598) USER MOD Single : A 130 LYS NZ :NH3+ 165:sc= 0.478 (180deg=0.257) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 136 SER OG : rot 180:sc= 0 USER MOD Single : A 137 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 142 ASN : amide:sc=-0.00861 K(o=-0.0086,f=-2.4!) USER MOD Single : A 143 LYS NZ :NH3+ 172:sc= 0.597 (180deg=0.529) USER MOD Single : A 146 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 147 HIS : no HD1:sc= 0 X(o=0,f=-0.022) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.526 13.244 19.929 1.00 0.00 N ATOM 2 CA MET A 1 -17.401 12.512 20.876 1.00 0.00 C ATOM 3 C MET A 1 -18.266 11.454 20.152 1.00 0.00 C ATOM 4 O MET A 1 -19.110 10.803 20.770 1.00 0.00 O ATOM 5 CB MET A 1 -18.258 13.529 21.680 1.00 0.00 C ATOM 6 CG MET A 1 -19.095 14.500 20.824 1.00 0.00 C ATOM 7 SD MET A 1 -19.926 15.770 21.801 1.00 0.00 S ATOM 8 CE MET A 1 -18.541 16.645 22.535 1.00 0.00 C ATOM 0 H1 MET A 1 -16.102 14.063 20.410 1.00 0.00 H new ATOM 0 H2 MET A 1 -15.772 12.611 19.593 1.00 0.00 H new ATOM 0 H3 MET A 1 -17.089 13.572 19.119 1.00 0.00 H new ATOM 0 HA MET A 1 -16.780 11.958 21.580 1.00 0.00 H new ATOM 0 HB2 MET A 1 -18.930 12.976 22.336 1.00 0.00 H new ATOM 0 HB3 MET A 1 -17.596 14.112 22.320 1.00 0.00 H new ATOM 0 HG2 MET A 1 -18.446 14.980 20.091 1.00 0.00 H new ATOM 0 HG3 MET A 1 -19.841 13.933 20.267 1.00 0.00 H new ATOM 0 HE1 MET A 1 -18.861 17.641 22.842 1.00 0.00 H new ATOM 0 HE2 MET A 1 -18.183 16.095 23.405 1.00 0.00 H new ATOM 0 HE3 MET A 1 -17.737 16.732 21.804 1.00 0.00 H new ATOM 20 N ALA A 2 -18.025 11.284 18.836 1.00 0.00 N ATOM 21 CA ALA A 2 -18.639 10.227 18.004 1.00 0.00 C ATOM 22 C ALA A 2 -17.555 9.621 17.087 1.00 0.00 C ATOM 23 O ALA A 2 -16.370 9.959 17.220 1.00 0.00 O ATOM 24 CB ALA A 2 -19.813 10.803 17.185 1.00 0.00 C ATOM 0 H ALA A 2 -17.389 11.886 18.313 1.00 0.00 H new ATOM 0 HA ALA A 2 -19.043 9.440 18.640 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -20.255 10.013 16.578 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -20.567 11.205 17.862 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -19.448 11.599 16.536 1.00 0.00 H new ATOM 30 N TYR A 3 -17.963 8.725 16.170 1.00 0.00 N ATOM 31 CA TYR A 3 -17.052 8.059 15.223 1.00 0.00 C ATOM 32 C TYR A 3 -17.730 7.925 13.837 1.00 0.00 C ATOM 33 O TYR A 3 -18.628 7.102 13.625 1.00 0.00 O ATOM 34 CB TYR A 3 -16.580 6.674 15.787 1.00 0.00 C ATOM 35 CG TYR A 3 -17.712 5.696 16.179 1.00 0.00 C ATOM 36 CD1 TYR A 3 -18.448 5.875 17.357 1.00 0.00 C ATOM 37 CD2 TYR A 3 -18.058 4.613 15.353 1.00 0.00 C ATOM 38 CE1 TYR A 3 -19.476 5.014 17.698 1.00 0.00 C ATOM 39 CE2 TYR A 3 -19.088 3.757 15.688 1.00 0.00 C ATOM 40 CZ TYR A 3 -19.796 3.963 16.859 1.00 0.00 C ATOM 41 OH TYR A 3 -20.838 3.119 17.187 1.00 0.00 O ATOM 0 H TYR A 3 -18.937 8.442 16.065 1.00 0.00 H new ATOM 0 HA TYR A 3 -16.159 8.671 15.096 1.00 0.00 H new ATOM 0 HB2 TYR A 3 -15.950 6.192 15.039 1.00 0.00 H new ATOM 0 HB3 TYR A 3 -15.957 6.851 16.663 1.00 0.00 H new ATOM 0 HD1 TYR A 3 -18.209 6.700 18.011 1.00 0.00 H new ATOM 0 HD2 TYR A 3 -17.508 4.447 14.439 1.00 0.00 H new ATOM 0 HE1 TYR A 3 -20.026 5.162 18.616 1.00 0.00 H new ATOM 0 HE2 TYR A 3 -19.340 2.931 15.040 1.00 0.00 H new ATOM 0 HH TYR A 3 -20.934 2.433 16.494 1.00 0.00 H new ATOM 51 N ASN A 4 -17.335 8.812 12.921 1.00 0.00 N ATOM 52 CA ASN A 4 -17.696 8.750 11.491 1.00 0.00 C ATOM 53 C ASN A 4 -16.423 8.411 10.723 1.00 0.00 C ATOM 54 O ASN A 4 -15.399 9.041 10.971 1.00 0.00 O ATOM 55 CB ASN A 4 -18.285 10.108 11.012 1.00 0.00 C ATOM 56 CG ASN A 4 -19.604 10.474 11.710 1.00 0.00 C ATOM 57 OD1 ASN A 4 -19.606 11.096 12.773 1.00 0.00 O ATOM 58 ND2 ASN A 4 -20.730 10.103 11.118 1.00 0.00 N ATOM 0 H ASN A 4 -16.744 9.611 13.150 1.00 0.00 H new ATOM 0 HA ASN A 4 -18.462 7.993 11.319 1.00 0.00 H new ATOM 0 HB2 ASN A 4 -17.555 10.897 11.192 1.00 0.00 H new ATOM 0 HB3 ASN A 4 -18.450 10.066 9.935 1.00 0.00 H new ATOM 0 HD21 ASN A 4 -21.629 10.332 11.543 1.00 0.00 H new ATOM 0 HD22 ASN A 4 -20.698 9.589 10.238 1.00 0.00 H new ATOM 65 N LYS A 5 -16.481 7.427 9.797 1.00 0.00 N ATOM 66 CA LYS A 5 -15.272 6.908 9.103 1.00 0.00 C ATOM 67 C LYS A 5 -14.527 8.025 8.343 1.00 0.00 C ATOM 68 O LYS A 5 -13.305 7.986 8.232 1.00 0.00 O ATOM 69 CB LYS A 5 -15.632 5.764 8.124 1.00 0.00 C ATOM 70 CG LYS A 5 -16.379 4.569 8.756 1.00 0.00 C ATOM 71 CD LYS A 5 -16.457 3.310 7.846 1.00 0.00 C ATOM 72 CE LYS A 5 -17.107 3.543 6.459 1.00 0.00 C ATOM 73 NZ LYS A 5 -16.179 4.154 5.470 1.00 0.00 N ATOM 0 H LYS A 5 -17.349 6.975 9.511 1.00 0.00 H new ATOM 0 HA LYS A 5 -14.611 6.516 9.876 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -16.247 6.173 7.322 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -14.714 5.397 7.666 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -15.884 4.299 9.689 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -17.391 4.882 9.011 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -15.448 2.925 7.697 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.020 2.537 8.369 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -17.467 2.591 6.069 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.977 4.188 6.577 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -16.548 5.080 5.173 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -15.242 4.278 5.904 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -16.097 3.532 4.641 1.00 0.00 H new ATOM 87 N GLU A 6 -15.303 9.010 7.846 1.00 0.00 N ATOM 88 CA GLU A 6 -14.776 10.201 7.154 1.00 0.00 C ATOM 89 C GLU A 6 -13.798 11.006 8.041 1.00 0.00 C ATOM 90 O GLU A 6 -12.842 11.563 7.528 1.00 0.00 O ATOM 91 CB GLU A 6 -15.932 11.111 6.673 1.00 0.00 C ATOM 92 CG GLU A 6 -16.820 11.698 7.793 1.00 0.00 C ATOM 93 CD GLU A 6 -17.783 12.781 7.283 1.00 0.00 C ATOM 94 OE1 GLU A 6 -17.324 13.915 7.052 1.00 0.00 O ATOM 95 OE2 GLU A 6 -18.979 12.497 7.077 1.00 0.00 O ATOM 0 H GLU A 6 -16.321 9.000 7.915 1.00 0.00 H new ATOM 0 HA GLU A 6 -14.218 9.845 6.288 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -15.509 11.935 6.098 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -16.564 10.539 5.993 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -17.395 10.894 8.253 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -16.184 12.121 8.571 1.00 0.00 H new ATOM 102 N GLU A 7 -14.070 11.064 9.365 1.00 0.00 N ATOM 103 CA GLU A 7 -13.164 11.690 10.358 1.00 0.00 C ATOM 104 C GLU A 7 -11.787 11.005 10.339 1.00 0.00 C ATOM 105 O GLU A 7 -10.748 11.673 10.286 1.00 0.00 O ATOM 106 CB GLU A 7 -13.778 11.583 11.779 1.00 0.00 C ATOM 107 CG GLU A 7 -12.847 12.042 12.925 1.00 0.00 C ATOM 108 CD GLU A 7 -13.407 11.729 14.316 1.00 0.00 C ATOM 109 OE1 GLU A 7 -13.173 10.610 14.822 1.00 0.00 O ATOM 110 OE2 GLU A 7 -14.090 12.601 14.907 1.00 0.00 O ATOM 0 H GLU A 7 -14.921 10.680 9.775 1.00 0.00 H new ATOM 0 HA GLU A 7 -13.039 12.741 10.096 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -14.690 12.178 11.811 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -14.067 10.547 11.957 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -11.877 11.558 12.813 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -12.679 13.116 12.841 1.00 0.00 H new ATOM 117 N LYS A 8 -11.827 9.660 10.333 1.00 0.00 N ATOM 118 CA LYS A 8 -10.620 8.808 10.390 1.00 0.00 C ATOM 119 C LYS A 8 -9.801 9.037 9.122 1.00 0.00 C ATOM 120 O LYS A 8 -8.592 9.197 9.188 1.00 0.00 O ATOM 121 CB LYS A 8 -10.973 7.293 10.542 1.00 0.00 C ATOM 122 CG LYS A 8 -11.571 6.866 11.904 1.00 0.00 C ATOM 123 CD LYS A 8 -12.990 7.414 12.159 1.00 0.00 C ATOM 124 CE LYS A 8 -13.554 7.014 13.528 1.00 0.00 C ATOM 125 NZ LYS A 8 -12.769 7.607 14.644 1.00 0.00 N ATOM 0 H LYS A 8 -12.698 9.130 10.288 1.00 0.00 H new ATOM 0 HA LYS A 8 -10.042 9.086 11.272 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -11.681 7.025 9.758 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -10.068 6.711 10.367 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -11.597 5.777 11.954 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -10.911 7.206 12.703 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -12.972 8.501 12.084 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -13.658 7.052 11.378 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -14.592 7.338 13.602 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -13.551 5.928 13.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -13.171 7.300 15.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -11.780 7.292 14.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -12.807 8.644 14.582 1.00 0.00 H new ATOM 139 N ILE A 9 -10.516 9.079 7.988 1.00 0.00 N ATOM 140 CA ILE A 9 -9.967 9.375 6.663 1.00 0.00 C ATOM 141 C ILE A 9 -9.330 10.783 6.600 1.00 0.00 C ATOM 142 O ILE A 9 -8.220 10.921 6.110 1.00 0.00 O ATOM 143 CB ILE A 9 -11.093 9.216 5.569 1.00 0.00 C ATOM 144 CG1 ILE A 9 -11.514 7.716 5.434 1.00 0.00 C ATOM 145 CG2 ILE A 9 -10.688 9.817 4.203 1.00 0.00 C ATOM 146 CD1 ILE A 9 -10.384 6.768 5.075 1.00 0.00 C ATOM 0 H ILE A 9 -11.520 8.902 7.971 1.00 0.00 H new ATOM 0 HA ILE A 9 -9.170 8.659 6.462 1.00 0.00 H new ATOM 0 HB ILE A 9 -11.956 9.790 5.907 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -11.957 7.391 6.376 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -12.291 7.638 4.673 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -11.500 9.679 3.489 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -10.485 10.881 4.320 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -9.793 9.315 3.836 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -10.771 5.751 5.003 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -9.954 7.061 4.117 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -9.615 6.810 5.846 1.00 0.00 H new ATOM 158 N LYS A 10 -10.021 11.807 7.120 1.00 0.00 N ATOM 159 CA LYS A 10 -9.562 13.218 7.023 1.00 0.00 C ATOM 160 C LYS A 10 -8.282 13.452 7.841 1.00 0.00 C ATOM 161 O LYS A 10 -7.394 14.200 7.412 1.00 0.00 O ATOM 162 CB LYS A 10 -10.680 14.204 7.466 1.00 0.00 C ATOM 163 CG LYS A 10 -11.828 14.342 6.445 1.00 0.00 C ATOM 164 CD LYS A 10 -12.895 15.373 6.880 1.00 0.00 C ATOM 165 CE LYS A 10 -14.003 15.550 5.828 1.00 0.00 C ATOM 166 NZ LYS A 10 -14.784 14.301 5.623 1.00 0.00 N ATOM 0 H LYS A 10 -10.905 11.693 7.616 1.00 0.00 H new ATOM 0 HA LYS A 10 -9.331 13.411 5.975 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -11.091 13.869 8.418 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -10.239 15.186 7.638 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -11.416 14.637 5.480 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -12.303 13.371 6.306 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -13.340 15.055 7.823 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -12.414 16.334 7.063 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -14.674 16.350 6.140 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -13.558 15.858 4.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.901 14.128 4.604 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.278 13.501 6.054 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -15.719 14.399 6.067 1.00 0.00 H new ATOM 180 N SER A 11 -8.208 12.795 9.011 1.00 0.00 N ATOM 181 CA SER A 11 -7.003 12.786 9.856 1.00 0.00 C ATOM 182 C SER A 11 -5.870 12.094 9.086 1.00 0.00 C ATOM 183 O SER A 11 -4.841 12.698 8.795 1.00 0.00 O ATOM 184 CB SER A 11 -7.288 12.040 11.185 1.00 0.00 C ATOM 185 OG SER A 11 -8.462 12.539 11.806 1.00 0.00 O ATOM 0 H SER A 11 -8.983 12.255 9.397 1.00 0.00 H new ATOM 0 HA SER A 11 -6.711 13.808 10.097 1.00 0.00 H new ATOM 0 HB2 SER A 11 -7.400 10.973 10.991 1.00 0.00 H new ATOM 0 HB3 SER A 11 -6.439 12.154 11.859 1.00 0.00 H new ATOM 0 HG SER A 11 -9.251 12.187 11.344 1.00 0.00 H new ATOM 191 N LEU A 12 -6.149 10.835 8.710 1.00 0.00 N ATOM 192 CA LEU A 12 -5.260 9.935 7.948 1.00 0.00 C ATOM 193 C LEU A 12 -4.625 10.577 6.707 1.00 0.00 C ATOM 194 O LEU A 12 -3.437 10.382 6.445 1.00 0.00 O ATOM 195 CB LEU A 12 -6.112 8.739 7.477 1.00 0.00 C ATOM 196 CG LEU A 12 -5.434 7.710 6.526 1.00 0.00 C ATOM 197 CD1 LEU A 12 -4.499 6.755 7.301 1.00 0.00 C ATOM 198 CD2 LEU A 12 -6.503 6.976 5.688 1.00 0.00 C ATOM 0 H LEU A 12 -7.040 10.395 8.938 1.00 0.00 H new ATOM 0 HA LEU A 12 -4.440 9.656 8.610 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -6.459 8.204 8.361 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -6.996 9.132 6.974 1.00 0.00 H new ATOM 0 HG LEU A 12 -4.791 8.242 5.825 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.042 6.050 6.606 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.719 7.333 7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -5.075 6.208 8.047 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -6.017 6.259 5.026 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -7.189 6.450 6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -7.059 7.700 5.093 1.00 0.00 H new ATOM 210 N ASN A 13 -5.450 11.298 5.932 1.00 0.00 N ATOM 211 CA ASN A 13 -5.042 11.861 4.636 1.00 0.00 C ATOM 212 C ASN A 13 -3.967 12.937 4.826 1.00 0.00 C ATOM 213 O ASN A 13 -3.171 13.156 3.928 1.00 0.00 O ATOM 214 CB ASN A 13 -6.270 12.412 3.845 1.00 0.00 C ATOM 215 CG ASN A 13 -7.074 11.338 3.081 1.00 0.00 C ATOM 216 OD1 ASN A 13 -7.265 10.151 3.651 1.00 0.00 O flip ATOM 217 ND2 ASN A 13 -7.559 11.596 1.975 1.00 0.00 N flip ATOM 0 H ASN A 13 -6.416 11.507 6.185 1.00 0.00 H new ATOM 0 HA ASN A 13 -4.609 11.058 4.040 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -6.937 12.920 4.542 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -5.922 13.161 3.134 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -7.404 12.511 1.551 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -8.115 10.895 1.486 1.00 0.00 H new ATOM 224 N ARG A 14 -3.952 13.585 6.006 1.00 0.00 N ATOM 225 CA ARG A 14 -2.900 14.554 6.378 1.00 0.00 C ATOM 226 C ARG A 14 -1.550 13.850 6.611 1.00 0.00 C ATOM 227 O ARG A 14 -0.500 14.418 6.309 1.00 0.00 O ATOM 228 CB ARG A 14 -3.314 15.352 7.639 1.00 0.00 C ATOM 229 CG ARG A 14 -4.630 16.144 7.488 1.00 0.00 C ATOM 230 CD ARG A 14 -4.988 16.966 8.741 1.00 0.00 C ATOM 231 NE ARG A 14 -4.035 18.074 8.975 1.00 0.00 N ATOM 232 CZ ARG A 14 -3.196 18.190 10.017 1.00 0.00 C ATOM 233 NH1 ARG A 14 -3.082 17.227 10.929 1.00 0.00 N ATOM 234 NH2 ARG A 14 -2.442 19.274 10.117 1.00 0.00 N ATOM 0 H ARG A 14 -4.663 13.454 6.725 1.00 0.00 H new ATOM 0 HA ARG A 14 -2.780 15.249 5.547 1.00 0.00 H new ATOM 0 HB2 ARG A 14 -3.414 14.660 8.475 1.00 0.00 H new ATOM 0 HB3 ARG A 14 -2.513 16.046 7.894 1.00 0.00 H new ATOM 0 HG2 ARG A 14 -4.548 16.814 6.632 1.00 0.00 H new ATOM 0 HG3 ARG A 14 -5.442 15.450 7.272 1.00 0.00 H new ATOM 0 HD2 ARG A 14 -5.994 17.371 8.632 1.00 0.00 H new ATOM 0 HD3 ARG A 14 -5.001 16.310 9.612 1.00 0.00 H new ATOM 0 HE ARG A 14 -4.014 18.820 8.279 1.00 0.00 H new ATOM 0 HH11 ARG A 14 -3.639 16.377 10.845 1.00 0.00 H new ATOM 0 HH12 ARG A 14 -2.437 17.339 11.711 1.00 0.00 H new ATOM 0 HH21 ARG A 14 -2.504 20.005 9.409 1.00 0.00 H new ATOM 0 HH22 ARG A 14 -1.799 19.378 10.902 1.00 0.00 H new ATOM 248 N MET A 15 -1.588 12.609 7.154 1.00 0.00 N ATOM 249 CA MET A 15 -0.375 11.787 7.358 1.00 0.00 C ATOM 250 C MET A 15 0.144 11.312 6.001 1.00 0.00 C ATOM 251 O MET A 15 1.238 11.677 5.594 1.00 0.00 O ATOM 252 CB MET A 15 -0.642 10.549 8.277 1.00 0.00 C ATOM 253 CG MET A 15 -0.957 10.867 9.742 1.00 0.00 C ATOM 254 SD MET A 15 -2.511 11.745 9.954 1.00 0.00 S ATOM 255 CE MET A 15 -2.652 11.845 11.734 1.00 0.00 C ATOM 0 H MET A 15 -2.450 12.156 7.459 1.00 0.00 H new ATOM 0 HA MET A 15 0.367 12.410 7.858 1.00 0.00 H new ATOM 0 HB2 MET A 15 -1.475 9.982 7.860 1.00 0.00 H new ATOM 0 HB3 MET A 15 0.233 9.900 8.245 1.00 0.00 H new ATOM 0 HG2 MET A 15 -0.991 9.937 10.310 1.00 0.00 H new ATOM 0 HG3 MET A 15 -0.148 11.466 10.160 1.00 0.00 H new ATOM 0 HE1 MET A 15 -3.572 12.367 11.997 1.00 0.00 H new ATOM 0 HE2 MET A 15 -2.672 10.840 12.154 1.00 0.00 H new ATOM 0 HE3 MET A 15 -1.798 12.390 12.137 1.00 0.00 H new ATOM 265 N GLN A 16 -0.720 10.557 5.293 1.00 0.00 N ATOM 266 CA GLN A 16 -0.393 9.893 4.024 1.00 0.00 C ATOM 267 C GLN A 16 0.060 10.881 2.948 1.00 0.00 C ATOM 268 O GLN A 16 1.074 10.667 2.309 1.00 0.00 O ATOM 269 CB GLN A 16 -1.612 9.119 3.493 1.00 0.00 C ATOM 270 CG GLN A 16 -1.967 7.847 4.273 1.00 0.00 C ATOM 271 CD GLN A 16 -2.933 6.958 3.498 1.00 0.00 C ATOM 272 OE1 GLN A 16 -3.622 6.045 4.165 1.00 0.00 O flip ATOM 273 NE2 GLN A 16 -2.995 7.040 2.281 1.00 0.00 N flip ATOM 0 H GLN A 16 -1.680 10.391 5.596 1.00 0.00 H new ATOM 0 HA GLN A 16 0.431 9.211 4.236 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -2.476 9.784 3.500 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -1.426 8.849 2.453 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -1.057 7.289 4.493 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -2.412 8.120 5.230 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -2.455 7.752 1.790 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -3.587 6.397 1.756 1.00 0.00 H new ATOM 282 N TYR A 17 -0.747 11.937 2.739 1.00 0.00 N ATOM 283 CA TYR A 17 -0.427 12.977 1.731 1.00 0.00 C ATOM 284 C TYR A 17 0.939 13.616 2.040 1.00 0.00 C ATOM 285 O TYR A 17 1.768 13.746 1.151 1.00 0.00 O ATOM 286 CB TYR A 17 -1.522 14.068 1.619 1.00 0.00 C ATOM 287 CG TYR A 17 -1.299 15.061 0.467 1.00 0.00 C ATOM 288 CD1 TYR A 17 -1.644 14.726 -0.848 1.00 0.00 C ATOM 289 CD2 TYR A 17 -0.738 16.326 0.687 1.00 0.00 C ATOM 290 CE1 TYR A 17 -1.440 15.606 -1.889 1.00 0.00 C ATOM 291 CE2 TYR A 17 -0.535 17.207 -0.355 1.00 0.00 C ATOM 292 CZ TYR A 17 -0.885 16.844 -1.637 1.00 0.00 C ATOM 293 OH TYR A 17 -0.682 17.728 -2.675 1.00 0.00 O ATOM 0 H TYR A 17 -1.618 12.097 3.246 1.00 0.00 H new ATOM 0 HA TYR A 17 -0.385 12.477 0.764 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -2.490 13.585 1.486 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.568 14.620 2.558 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -2.079 13.758 -1.051 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.460 16.616 1.689 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -1.713 15.328 -2.896 1.00 0.00 H new ATOM 0 HE2 TYR A 17 -0.103 18.179 -0.166 1.00 0.00 H new ATOM 0 HH TYR A 17 -0.285 18.554 -2.328 1.00 0.00 H new ATOM 303 N GLU A 18 1.176 13.956 3.317 1.00 0.00 N ATOM 304 CA GLU A 18 2.448 14.581 3.744 1.00 0.00 C ATOM 305 C GLU A 18 3.638 13.606 3.599 1.00 0.00 C ATOM 306 O GLU A 18 4.752 14.024 3.276 1.00 0.00 O ATOM 307 CB GLU A 18 2.337 15.062 5.207 1.00 0.00 C ATOM 308 CG GLU A 18 3.553 15.847 5.730 1.00 0.00 C ATOM 309 CD GLU A 18 3.407 16.259 7.202 1.00 0.00 C ATOM 310 OE1 GLU A 18 2.735 17.274 7.480 1.00 0.00 O ATOM 311 OE2 GLU A 18 3.954 15.566 8.085 1.00 0.00 O ATOM 0 H GLU A 18 0.508 13.811 4.074 1.00 0.00 H new ATOM 0 HA GLU A 18 2.634 15.435 3.093 1.00 0.00 H new ATOM 0 HB2 GLU A 18 1.451 15.690 5.300 1.00 0.00 H new ATOM 0 HB3 GLU A 18 2.181 14.194 5.848 1.00 0.00 H new ATOM 0 HG2 GLU A 18 4.450 15.238 5.615 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.693 16.739 5.120 1.00 0.00 H new ATOM 318 N VAL A 19 3.379 12.304 3.818 1.00 0.00 N ATOM 319 CA VAL A 19 4.419 11.267 3.797 1.00 0.00 C ATOM 320 C VAL A 19 4.766 10.903 2.342 1.00 0.00 C ATOM 321 O VAL A 19 5.868 11.171 1.894 1.00 0.00 O ATOM 322 CB VAL A 19 3.989 9.984 4.620 1.00 0.00 C ATOM 323 CG1 VAL A 19 4.906 8.782 4.328 1.00 0.00 C ATOM 324 CG2 VAL A 19 3.984 10.265 6.141 1.00 0.00 C ATOM 0 H VAL A 19 2.445 11.945 4.014 1.00 0.00 H new ATOM 0 HA VAL A 19 5.309 11.669 4.282 1.00 0.00 H new ATOM 0 HB VAL A 19 2.977 9.737 4.299 1.00 0.00 H new ATOM 0 HG11 VAL A 19 4.577 7.923 4.912 1.00 0.00 H new ATOM 0 HG12 VAL A 19 4.859 8.538 3.267 1.00 0.00 H new ATOM 0 HG13 VAL A 19 5.932 9.033 4.598 1.00 0.00 H new ATOM 0 HG21 VAL A 19 3.684 9.364 6.676 1.00 0.00 H new ATOM 0 HG22 VAL A 19 4.983 10.561 6.460 1.00 0.00 H new ATOM 0 HG23 VAL A 19 3.280 11.068 6.360 1.00 0.00 H new ATOM 334 N THR A 20 3.793 10.335 1.617 1.00 0.00 N ATOM 335 CA THR A 20 3.952 9.839 0.230 1.00 0.00 C ATOM 336 C THR A 20 4.480 10.920 -0.741 1.00 0.00 C ATOM 337 O THR A 20 5.253 10.619 -1.650 1.00 0.00 O ATOM 338 CB THR A 20 2.592 9.279 -0.309 1.00 0.00 C ATOM 339 OG1 THR A 20 1.997 8.419 0.677 1.00 0.00 O ATOM 340 CG2 THR A 20 2.770 8.502 -1.624 1.00 0.00 C ATOM 0 H THR A 20 2.849 10.201 1.981 1.00 0.00 H new ATOM 0 HA THR A 20 4.697 9.044 0.272 1.00 0.00 H new ATOM 0 HB THR A 20 1.941 10.131 -0.509 1.00 0.00 H new ATOM 0 HG1 THR A 20 2.485 7.570 0.708 1.00 0.00 H new ATOM 0 HG21 THR A 20 1.802 8.132 -1.962 1.00 0.00 H new ATOM 0 HG22 THR A 20 3.191 9.162 -2.383 1.00 0.00 H new ATOM 0 HG23 THR A 20 3.444 7.661 -1.461 1.00 0.00 H new ATOM 348 N GLN A 21 4.088 12.182 -0.514 1.00 0.00 N ATOM 349 CA GLN A 21 4.458 13.316 -1.395 1.00 0.00 C ATOM 350 C GLN A 21 5.883 13.811 -1.080 1.00 0.00 C ATOM 351 O GLN A 21 6.573 14.339 -1.957 1.00 0.00 O ATOM 352 CB GLN A 21 3.382 14.436 -1.266 1.00 0.00 C ATOM 353 CG GLN A 21 3.633 15.786 -1.996 1.00 0.00 C ATOM 354 CD GLN A 21 4.324 16.835 -1.123 1.00 0.00 C ATOM 355 OE1 GLN A 21 5.539 16.996 -1.148 1.00 0.00 O ATOM 356 NE2 GLN A 21 3.545 17.523 -0.309 1.00 0.00 N ATOM 0 H GLN A 21 3.508 12.452 0.280 1.00 0.00 H new ATOM 0 HA GLN A 21 4.476 12.991 -2.435 1.00 0.00 H new ATOM 0 HB2 GLN A 21 2.437 14.032 -1.629 1.00 0.00 H new ATOM 0 HB3 GLN A 21 3.251 14.651 -0.205 1.00 0.00 H new ATOM 0 HG2 GLN A 21 4.243 15.603 -2.881 1.00 0.00 H new ATOM 0 HG3 GLN A 21 2.680 16.185 -2.343 1.00 0.00 H new ATOM 0 HE21 GLN A 21 2.537 17.365 -0.313 1.00 0.00 H new ATOM 0 HE22 GLN A 21 3.951 18.212 0.324 1.00 0.00 H new ATOM 365 N ASN A 22 6.322 13.594 0.169 1.00 0.00 N ATOM 366 CA ASN A 22 7.691 13.935 0.627 1.00 0.00 C ATOM 367 C ASN A 22 8.613 12.689 0.561 1.00 0.00 C ATOM 368 O ASN A 22 9.823 12.811 0.765 1.00 0.00 O ATOM 369 CB ASN A 22 7.616 14.475 2.085 1.00 0.00 C ATOM 370 CG ASN A 22 8.960 14.976 2.646 1.00 0.00 C ATOM 371 OD1 ASN A 22 9.722 15.666 1.961 1.00 0.00 O ATOM 372 ND2 ASN A 22 9.263 14.607 3.883 1.00 0.00 N ATOM 0 H ASN A 22 5.742 13.177 0.897 1.00 0.00 H new ATOM 0 HA ASN A 22 8.111 14.700 -0.026 1.00 0.00 H new ATOM 0 HB2 ASN A 22 6.894 15.291 2.121 1.00 0.00 H new ATOM 0 HB3 ASN A 22 7.237 13.685 2.733 1.00 0.00 H new ATOM 0 HD21 ASN A 22 10.150 14.893 4.298 1.00 0.00 H new ATOM 0 HD22 ASN A 22 8.609 14.037 4.420 1.00 0.00 H new ATOM 379 N ASN A 23 8.002 11.498 0.274 1.00 0.00 N ATOM 380 CA ASN A 23 8.606 10.138 0.416 1.00 0.00 C ATOM 381 C ASN A 23 9.179 9.947 1.839 1.00 0.00 C ATOM 382 O ASN A 23 10.090 9.143 2.074 1.00 0.00 O ATOM 383 CB ASN A 23 9.632 9.773 -0.729 1.00 0.00 C ATOM 384 CG ASN A 23 11.030 10.409 -0.624 1.00 0.00 C ATOM 385 OD1 ASN A 23 11.939 9.855 -0.002 1.00 0.00 O ATOM 386 ND2 ASN A 23 11.217 11.566 -1.247 1.00 0.00 N ATOM 0 H ASN A 23 7.044 11.460 -0.074 1.00 0.00 H new ATOM 0 HA ASN A 23 7.802 9.413 0.284 1.00 0.00 H new ATOM 0 HB2 ASN A 23 9.750 8.690 -0.749 1.00 0.00 H new ATOM 0 HB3 ASN A 23 9.195 10.064 -1.684 1.00 0.00 H new ATOM 0 HD21 ASN A 23 12.131 12.019 -1.218 1.00 0.00 H new ATOM 0 HD22 ASN A 23 10.447 12.002 -1.754 1.00 0.00 H new ATOM 393 N GLY A 24 8.554 10.670 2.796 1.00 0.00 N ATOM 394 CA GLY A 24 8.968 10.698 4.184 1.00 0.00 C ATOM 395 C GLY A 24 8.607 9.420 4.910 1.00 0.00 C ATOM 396 O GLY A 24 8.021 8.502 4.327 1.00 0.00 O ATOM 0 H GLY A 24 7.739 11.252 2.605 1.00 0.00 H new ATOM 0 HA2 GLY A 24 10.046 10.853 4.238 1.00 0.00 H new ATOM 0 HA3 GLY A 24 8.499 11.544 4.685 1.00 0.00 H new ATOM 400 N THR A 25 8.981 9.356 6.178 1.00 0.00 N ATOM 401 CA THR A 25 8.629 8.231 7.050 1.00 0.00 C ATOM 402 C THR A 25 8.450 8.721 8.486 1.00 0.00 C ATOM 403 O THR A 25 9.110 9.673 8.923 1.00 0.00 O ATOM 404 CB THR A 25 9.681 7.066 6.977 1.00 0.00 C ATOM 405 OG1 THR A 25 9.279 5.970 7.823 1.00 0.00 O ATOM 406 CG2 THR A 25 11.102 7.526 7.359 1.00 0.00 C ATOM 0 H THR A 25 9.536 10.078 6.637 1.00 0.00 H new ATOM 0 HA THR A 25 7.685 7.818 6.694 1.00 0.00 H new ATOM 0 HB THR A 25 9.712 6.736 5.938 1.00 0.00 H new ATOM 0 HG1 THR A 25 9.943 5.252 7.765 1.00 0.00 H new ATOM 0 HG21 THR A 25 11.788 6.682 7.291 1.00 0.00 H new ATOM 0 HG22 THR A 25 11.426 8.312 6.677 1.00 0.00 H new ATOM 0 HG23 THR A 25 11.098 7.910 8.379 1.00 0.00 H new ATOM 414 N GLU A 26 7.520 8.076 9.192 1.00 0.00 N ATOM 415 CA GLU A 26 7.259 8.299 10.614 1.00 0.00 C ATOM 416 C GLU A 26 7.656 7.016 11.378 1.00 0.00 C ATOM 417 O GLU A 26 7.602 5.923 10.785 1.00 0.00 O ATOM 418 CB GLU A 26 5.758 8.636 10.817 1.00 0.00 C ATOM 419 CG GLU A 26 5.288 9.891 10.052 1.00 0.00 C ATOM 420 CD GLU A 26 3.862 10.321 10.426 1.00 0.00 C ATOM 421 OE1 GLU A 26 3.702 10.967 11.484 1.00 0.00 O ATOM 422 OE2 GLU A 26 2.904 10.016 9.676 1.00 0.00 O ATOM 0 H GLU A 26 6.913 7.367 8.780 1.00 0.00 H new ATOM 0 HA GLU A 26 7.842 9.138 10.994 1.00 0.00 H new ATOM 0 HB2 GLU A 26 5.158 7.783 10.499 1.00 0.00 H new ATOM 0 HB3 GLU A 26 5.569 8.779 11.881 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.975 10.713 10.256 1.00 0.00 H new ATOM 0 HG3 GLU A 26 5.334 9.695 8.981 1.00 0.00 H new ATOM 429 N PRO A 27 8.094 7.117 12.685 1.00 0.00 N ATOM 430 CA PRO A 27 8.371 5.923 13.530 1.00 0.00 C ATOM 431 C PRO A 27 7.119 5.010 13.614 1.00 0.00 C ATOM 432 O PRO A 27 6.002 5.534 13.641 1.00 0.00 O ATOM 433 CB PRO A 27 8.756 6.527 14.918 1.00 0.00 C ATOM 434 CG PRO A 27 8.262 7.946 14.876 1.00 0.00 C ATOM 435 CD PRO A 27 8.374 8.377 13.429 1.00 0.00 C ATOM 0 HA PRO A 27 9.162 5.287 13.132 1.00 0.00 H new ATOM 0 HB2 PRO A 27 8.291 5.971 15.733 1.00 0.00 H new ATOM 0 HB3 PRO A 27 9.833 6.489 15.080 1.00 0.00 H new ATOM 0 HG2 PRO A 27 7.232 8.012 15.225 1.00 0.00 H new ATOM 0 HG3 PRO A 27 8.860 8.588 15.523 1.00 0.00 H new ATOM 0 HD2 PRO A 27 7.656 9.159 13.184 1.00 0.00 H new ATOM 0 HD3 PRO A 27 9.364 8.770 13.200 1.00 0.00 H new ATOM 443 N PRO A 28 7.283 3.640 13.629 1.00 0.00 N ATOM 444 CA PRO A 28 6.146 2.678 13.516 1.00 0.00 C ATOM 445 C PRO A 28 5.114 2.808 14.666 1.00 0.00 C ATOM 446 O PRO A 28 5.199 2.109 15.680 1.00 0.00 O ATOM 447 CB PRO A 28 6.836 1.277 13.490 1.00 0.00 C ATOM 448 CG PRO A 28 8.274 1.564 13.159 1.00 0.00 C ATOM 449 CD PRO A 28 8.577 2.919 13.763 1.00 0.00 C ATOM 0 HA PRO A 28 5.548 2.866 12.625 1.00 0.00 H new ATOM 0 HB2 PRO A 28 6.744 0.773 14.452 1.00 0.00 H new ATOM 0 HB3 PRO A 28 6.381 0.625 12.744 1.00 0.00 H new ATOM 0 HG2 PRO A 28 8.930 0.797 13.571 1.00 0.00 H new ATOM 0 HG3 PRO A 28 8.432 1.573 12.081 1.00 0.00 H new ATOM 0 HD2 PRO A 28 8.887 2.837 14.805 1.00 0.00 H new ATOM 0 HD3 PRO A 28 9.380 3.428 13.230 1.00 0.00 H new ATOM 457 N PHE A 29 4.170 3.761 14.494 1.00 0.00 N ATOM 458 CA PHE A 29 3.061 4.012 15.434 1.00 0.00 C ATOM 459 C PHE A 29 2.043 2.865 15.383 1.00 0.00 C ATOM 460 O PHE A 29 1.408 2.546 16.389 1.00 0.00 O ATOM 461 CB PHE A 29 2.338 5.341 15.084 1.00 0.00 C ATOM 462 CG PHE A 29 3.200 6.599 15.186 1.00 0.00 C ATOM 463 CD1 PHE A 29 3.841 6.930 16.383 1.00 0.00 C ATOM 464 CD2 PHE A 29 3.339 7.468 14.101 1.00 0.00 C ATOM 465 CE1 PHE A 29 4.595 8.084 16.486 1.00 0.00 C ATOM 466 CE2 PHE A 29 4.098 8.616 14.207 1.00 0.00 C ATOM 467 CZ PHE A 29 4.722 8.925 15.397 1.00 0.00 C ATOM 0 H PHE A 29 4.160 4.384 13.687 1.00 0.00 H new ATOM 0 HA PHE A 29 3.483 4.081 16.437 1.00 0.00 H new ATOM 0 HB2 PHE A 29 1.950 5.268 14.068 1.00 0.00 H new ATOM 0 HB3 PHE A 29 1.479 5.454 15.746 1.00 0.00 H new ATOM 0 HD1 PHE A 29 3.746 6.276 17.238 1.00 0.00 H new ATOM 0 HD2 PHE A 29 2.846 7.239 13.168 1.00 0.00 H new ATOM 0 HE1 PHE A 29 5.085 8.328 17.417 1.00 0.00 H new ATOM 0 HE2 PHE A 29 4.203 9.273 13.356 1.00 0.00 H new ATOM 0 HZ PHE A 29 5.311 9.826 15.478 1.00 0.00 H new ATOM 477 N GLN A 30 1.893 2.283 14.174 1.00 0.00 N ATOM 478 CA GLN A 30 0.979 1.168 13.905 1.00 0.00 C ATOM 479 C GLN A 30 1.394 -0.082 14.714 1.00 0.00 C ATOM 480 O GLN A 30 0.660 -0.535 15.599 1.00 0.00 O ATOM 481 CB GLN A 30 0.987 0.877 12.378 1.00 0.00 C ATOM 482 CG GLN A 30 0.132 -0.319 11.928 1.00 0.00 C ATOM 483 CD GLN A 30 0.182 -0.575 10.417 1.00 0.00 C ATOM 484 OE1 GLN A 30 1.158 -0.244 9.743 1.00 0.00 O ATOM 485 NE2 GLN A 30 -0.857 -1.183 9.883 1.00 0.00 N ATOM 0 H GLN A 30 2.414 2.584 13.350 1.00 0.00 H new ATOM 0 HA GLN A 30 -0.032 1.434 14.215 1.00 0.00 H new ATOM 0 HB2 GLN A 30 0.639 1.767 11.854 1.00 0.00 H new ATOM 0 HB3 GLN A 30 2.016 0.704 12.064 1.00 0.00 H new ATOM 0 HG2 GLN A 30 0.470 -1.214 12.451 1.00 0.00 H new ATOM 0 HG3 GLN A 30 -0.903 -0.148 12.225 1.00 0.00 H new ATOM 0 HE21 GLN A 30 -1.651 -1.445 10.468 1.00 0.00 H new ATOM 0 HE22 GLN A 30 -0.868 -1.392 8.885 1.00 0.00 H new ATOM 494 N ASN A 31 2.595 -0.610 14.419 1.00 0.00 N ATOM 495 CA ASN A 31 3.136 -1.812 15.083 1.00 0.00 C ATOM 496 C ASN A 31 4.660 -1.847 14.906 1.00 0.00 C ATOM 497 O ASN A 31 5.166 -1.456 13.848 1.00 0.00 O ATOM 498 CB ASN A 31 2.453 -3.096 14.524 1.00 0.00 C ATOM 499 CG ASN A 31 2.742 -4.396 15.303 1.00 0.00 C ATOM 500 OD1 ASN A 31 2.647 -5.479 14.741 1.00 0.00 O ATOM 501 ND2 ASN A 31 3.057 -4.311 16.596 1.00 0.00 N ATOM 0 H ASN A 31 3.219 -0.217 13.714 1.00 0.00 H new ATOM 0 HA ASN A 31 2.919 -1.774 16.150 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.375 -2.935 14.508 1.00 0.00 H new ATOM 0 HB3 ASN A 31 2.770 -3.234 13.490 1.00 0.00 H new ATOM 0 HD21 ASN A 31 3.224 -5.159 17.137 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.131 -3.398 17.044 1.00 0.00 H new ATOM 508 N GLU A 32 5.355 -2.372 15.937 1.00 0.00 N ATOM 509 CA GLU A 32 6.812 -2.209 16.149 1.00 0.00 C ATOM 510 C GLU A 32 7.642 -2.651 14.932 1.00 0.00 C ATOM 511 O GLU A 32 8.352 -1.848 14.317 1.00 0.00 O ATOM 512 CB GLU A 32 7.238 -3.013 17.407 1.00 0.00 C ATOM 513 CG GLU A 32 6.444 -2.682 18.688 1.00 0.00 C ATOM 514 CD GLU A 32 6.647 -1.237 19.172 1.00 0.00 C ATOM 515 OE1 GLU A 32 7.660 -0.965 19.846 1.00 0.00 O ATOM 516 OE2 GLU A 32 5.793 -0.371 18.886 1.00 0.00 O ATOM 0 H GLU A 32 4.910 -2.934 16.663 1.00 0.00 H new ATOM 0 HA GLU A 32 7.009 -1.147 16.293 1.00 0.00 H new ATOM 0 HB2 GLU A 32 7.130 -4.077 17.195 1.00 0.00 H new ATOM 0 HB3 GLU A 32 8.296 -2.831 17.596 1.00 0.00 H new ATOM 0 HG2 GLU A 32 5.383 -2.850 18.503 1.00 0.00 H new ATOM 0 HG3 GLU A 32 6.743 -3.369 19.480 1.00 0.00 H new ATOM 523 N TYR A 33 7.524 -3.936 14.596 1.00 0.00 N ATOM 524 CA TYR A 33 8.191 -4.537 13.429 1.00 0.00 C ATOM 525 C TYR A 33 7.129 -5.045 12.445 1.00 0.00 C ATOM 526 O TYR A 33 7.451 -5.817 11.529 1.00 0.00 O ATOM 527 CB TYR A 33 9.100 -5.711 13.882 1.00 0.00 C ATOM 528 CG TYR A 33 10.127 -5.357 14.970 1.00 0.00 C ATOM 529 CD1 TYR A 33 11.387 -4.859 14.640 1.00 0.00 C ATOM 530 CD2 TYR A 33 9.836 -5.539 16.326 1.00 0.00 C ATOM 531 CE1 TYR A 33 12.314 -4.563 15.612 1.00 0.00 C ATOM 532 CE2 TYR A 33 10.763 -5.243 17.301 1.00 0.00 C ATOM 533 CZ TYR A 33 12.000 -4.758 16.940 1.00 0.00 C ATOM 534 OH TYR A 33 12.935 -4.473 17.911 1.00 0.00 O ATOM 0 H TYR A 33 6.959 -4.599 15.127 1.00 0.00 H new ATOM 0 HA TYR A 33 8.810 -3.786 12.939 1.00 0.00 H new ATOM 0 HB2 TYR A 33 8.468 -6.519 14.250 1.00 0.00 H new ATOM 0 HB3 TYR A 33 9.633 -6.094 13.012 1.00 0.00 H new ATOM 0 HD1 TYR A 33 11.640 -4.703 13.602 1.00 0.00 H new ATOM 0 HD2 TYR A 33 8.867 -5.919 16.614 1.00 0.00 H new ATOM 0 HE1 TYR A 33 13.285 -4.179 15.336 1.00 0.00 H new ATOM 0 HE2 TYR A 33 10.521 -5.391 18.343 1.00 0.00 H new ATOM 0 HH TYR A 33 12.557 -4.664 18.795 1.00 0.00 H new ATOM 544 N TRP A 34 5.868 -4.575 12.636 1.00 0.00 N ATOM 545 CA TRP A 34 4.677 -5.090 11.939 1.00 0.00 C ATOM 546 C TRP A 34 4.536 -6.589 12.242 1.00 0.00 C ATOM 547 O TRP A 34 4.301 -7.419 11.372 1.00 0.00 O ATOM 548 CB TRP A 34 4.712 -4.738 10.423 1.00 0.00 C ATOM 549 CG TRP A 34 4.674 -3.240 10.179 1.00 0.00 C ATOM 550 CD1 TRP A 34 3.562 -2.444 10.135 1.00 0.00 C ATOM 551 CD2 TRP A 34 5.797 -2.356 9.985 1.00 0.00 C ATOM 552 NE1 TRP A 34 3.921 -1.137 9.932 1.00 0.00 N ATOM 553 CE2 TRP A 34 5.283 -1.056 9.833 1.00 0.00 C ATOM 554 CE3 TRP A 34 7.185 -2.539 9.927 1.00 0.00 C ATOM 555 CZ2 TRP A 34 6.100 0.054 9.626 1.00 0.00 C ATOM 556 CZ3 TRP A 34 7.997 -1.440 9.718 1.00 0.00 C ATOM 557 CH2 TRP A 34 7.452 -0.155 9.571 1.00 0.00 C ATOM 0 H TRP A 34 5.656 -3.819 13.287 1.00 0.00 H new ATOM 0 HA TRP A 34 3.775 -4.602 12.309 1.00 0.00 H new ATOM 0 HB2 TRP A 34 5.615 -5.154 9.976 1.00 0.00 H new ATOM 0 HB3 TRP A 34 3.864 -5.207 9.924 1.00 0.00 H new ATOM 0 HD1 TRP A 34 2.547 -2.795 10.245 1.00 0.00 H new ATOM 0 HE1 TRP A 34 3.275 -0.350 9.865 1.00 0.00 H new ATOM 0 HE3 TRP A 34 7.614 -3.523 10.044 1.00 0.00 H new ATOM 0 HZ2 TRP A 34 5.682 1.043 9.513 1.00 0.00 H new ATOM 0 HZ3 TRP A 34 9.068 -1.572 9.667 1.00 0.00 H new ATOM 0 HH2 TRP A 34 8.112 0.685 9.411 1.00 0.00 H new ATOM 568 N ASP A 35 4.658 -6.880 13.549 1.00 0.00 N ATOM 569 CA ASP A 35 4.692 -8.234 14.133 1.00 0.00 C ATOM 570 C ASP A 35 3.391 -9.004 13.870 1.00 0.00 C ATOM 571 O ASP A 35 3.380 -10.246 13.852 1.00 0.00 O ATOM 572 CB ASP A 35 4.931 -8.126 15.659 1.00 0.00 C ATOM 573 CG ASP A 35 6.108 -7.207 16.014 1.00 0.00 C ATOM 574 OD1 ASP A 35 7.255 -7.687 16.089 1.00 0.00 O ATOM 575 OD2 ASP A 35 5.886 -5.987 16.199 1.00 0.00 O ATOM 0 H ASP A 35 4.739 -6.150 14.256 1.00 0.00 H new ATOM 0 HA ASP A 35 5.504 -8.785 13.659 1.00 0.00 H new ATOM 0 HB2 ASP A 35 4.026 -7.751 16.138 1.00 0.00 H new ATOM 0 HB3 ASP A 35 5.118 -9.121 16.064 1.00 0.00 H new ATOM 580 N HIS A 36 2.291 -8.244 13.689 1.00 0.00 N ATOM 581 CA HIS A 36 0.981 -8.790 13.313 1.00 0.00 C ATOM 582 C HIS A 36 1.002 -9.182 11.827 1.00 0.00 C ATOM 583 O HIS A 36 0.598 -8.421 10.941 1.00 0.00 O ATOM 584 CB HIS A 36 -0.157 -7.789 13.646 1.00 0.00 C ATOM 585 CG HIS A 36 -0.374 -7.574 15.126 1.00 0.00 C ATOM 586 ND1 HIS A 36 -0.126 -6.375 15.766 1.00 0.00 N ATOM 587 CD2 HIS A 36 -0.844 -8.410 16.085 1.00 0.00 C ATOM 588 CE1 HIS A 36 -0.435 -6.489 17.043 1.00 0.00 C ATOM 589 NE2 HIS A 36 -0.872 -7.711 17.264 1.00 0.00 N ATOM 0 H HIS A 36 2.292 -7.230 13.801 1.00 0.00 H new ATOM 0 HA HIS A 36 0.778 -9.687 13.897 1.00 0.00 H new ATOM 0 HB2 HIS A 36 0.069 -6.830 13.179 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -1.085 -8.149 13.202 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -1.142 -9.439 15.945 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -0.345 -5.709 17.785 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -1.181 -8.077 18.164 1.00 0.00 H new ATOM 598 N LYS A 37 1.546 -10.379 11.598 1.00 0.00 N ATOM 599 CA LYS A 37 1.764 -10.988 10.277 1.00 0.00 C ATOM 600 C LYS A 37 0.732 -12.122 10.122 1.00 0.00 C ATOM 601 O LYS A 37 1.026 -13.212 9.641 1.00 0.00 O ATOM 602 CB LYS A 37 3.234 -11.498 10.237 1.00 0.00 C ATOM 603 CG LYS A 37 3.736 -12.027 8.872 1.00 0.00 C ATOM 604 CD LYS A 37 5.208 -12.489 8.925 1.00 0.00 C ATOM 605 CE LYS A 37 5.450 -13.642 9.920 1.00 0.00 C ATOM 606 NZ LYS A 37 6.889 -13.965 10.042 1.00 0.00 N ATOM 0 H LYS A 37 1.862 -10.980 12.360 1.00 0.00 H new ATOM 0 HA LYS A 37 1.628 -10.292 9.449 1.00 0.00 H new ATOM 0 HB2 LYS A 37 3.888 -10.684 10.551 1.00 0.00 H new ATOM 0 HB3 LYS A 37 3.341 -12.294 10.973 1.00 0.00 H new ATOM 0 HG2 LYS A 37 3.108 -12.860 8.555 1.00 0.00 H new ATOM 0 HG3 LYS A 37 3.631 -11.244 8.121 1.00 0.00 H new ATOM 0 HD2 LYS A 37 5.518 -12.806 7.929 1.00 0.00 H new ATOM 0 HD3 LYS A 37 5.837 -11.643 9.200 1.00 0.00 H new ATOM 0 HE2 LYS A 37 5.054 -13.368 10.898 1.00 0.00 H new ATOM 0 HE3 LYS A 37 4.905 -14.527 9.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 7.014 -14.744 10.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 7.261 -14.250 9.114 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 7.405 -13.128 10.379 1.00 0.00 H new ATOM 620 N GLU A 38 -0.493 -11.824 10.550 1.00 0.00 N ATOM 621 CA GLU A 38 -1.539 -12.827 10.814 1.00 0.00 C ATOM 622 C GLU A 38 -2.327 -13.183 9.539 1.00 0.00 C ATOM 623 O GLU A 38 -1.913 -12.857 8.419 1.00 0.00 O ATOM 624 CB GLU A 38 -2.490 -12.277 11.925 1.00 0.00 C ATOM 625 CG GLU A 38 -1.768 -11.673 13.151 1.00 0.00 C ATOM 626 CD GLU A 38 -0.742 -12.624 13.799 1.00 0.00 C ATOM 627 OE1 GLU A 38 -1.157 -13.639 14.405 1.00 0.00 O ATOM 628 OE2 GLU A 38 0.481 -12.357 13.712 1.00 0.00 O ATOM 0 H GLU A 38 -0.798 -10.867 10.728 1.00 0.00 H new ATOM 0 HA GLU A 38 -1.067 -13.749 11.154 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -3.135 -11.515 11.488 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -3.137 -13.086 12.264 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -1.260 -10.758 12.847 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -2.511 -11.392 13.897 1.00 0.00 H new ATOM 635 N GLU A 39 -3.442 -13.912 9.724 1.00 0.00 N ATOM 636 CA GLU A 39 -4.498 -13.997 8.704 1.00 0.00 C ATOM 637 C GLU A 39 -5.090 -12.584 8.526 1.00 0.00 C ATOM 638 O GLU A 39 -5.641 -12.020 9.471 1.00 0.00 O ATOM 639 CB GLU A 39 -5.616 -15.013 9.114 1.00 0.00 C ATOM 640 CG GLU A 39 -6.146 -14.835 10.558 1.00 0.00 C ATOM 641 CD GLU A 39 -7.509 -15.485 10.805 1.00 0.00 C ATOM 642 OE1 GLU A 39 -7.561 -16.687 11.123 1.00 0.00 O ATOM 643 OE2 GLU A 39 -8.536 -14.784 10.702 1.00 0.00 O ATOM 0 H GLU A 39 -3.633 -14.449 10.570 1.00 0.00 H new ATOM 0 HA GLU A 39 -4.074 -14.359 7.767 1.00 0.00 H new ATOM 0 HB2 GLU A 39 -6.450 -14.916 8.419 1.00 0.00 H new ATOM 0 HB3 GLU A 39 -5.227 -16.025 9.005 1.00 0.00 H new ATOM 0 HG2 GLU A 39 -5.422 -15.258 11.255 1.00 0.00 H new ATOM 0 HG3 GLU A 39 -6.217 -13.770 10.779 1.00 0.00 H new ATOM 650 N GLY A 40 -4.897 -11.996 7.346 1.00 0.00 N ATOM 651 CA GLY A 40 -5.442 -10.676 7.034 1.00 0.00 C ATOM 652 C GLY A 40 -4.794 -10.061 5.817 1.00 0.00 C ATOM 653 O GLY A 40 -4.143 -10.762 5.027 1.00 0.00 O ATOM 0 H GLY A 40 -4.363 -12.417 6.586 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -6.516 -10.759 6.868 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -5.302 -10.016 7.890 1.00 0.00 H new ATOM 657 N LEU A 41 -4.938 -8.741 5.669 1.00 0.00 N ATOM 658 CA LEU A 41 -4.455 -8.010 4.493 1.00 0.00 C ATOM 659 C LEU A 41 -3.664 -6.771 4.883 1.00 0.00 C ATOM 660 O LEU A 41 -3.892 -6.156 5.918 1.00 0.00 O ATOM 661 CB LEU A 41 -5.636 -7.612 3.578 1.00 0.00 C ATOM 662 CG LEU A 41 -6.209 -8.750 2.685 1.00 0.00 C ATOM 663 CD1 LEU A 41 -7.536 -8.324 2.082 1.00 0.00 C ATOM 664 CD2 LEU A 41 -5.208 -9.152 1.574 1.00 0.00 C ATOM 0 H LEU A 41 -5.394 -8.148 6.362 1.00 0.00 H new ATOM 0 HA LEU A 41 -3.787 -8.678 3.949 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -6.441 -7.224 4.202 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -5.312 -6.796 2.932 1.00 0.00 H new ATOM 0 HG LEU A 41 -6.373 -9.625 3.314 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -7.927 -9.128 1.459 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -8.245 -8.106 2.880 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -7.389 -7.432 1.473 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -5.638 -9.949 0.968 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -4.999 -8.288 0.943 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -4.281 -9.502 2.029 1.00 0.00 H new ATOM 676 N TYR A 42 -2.756 -6.437 3.986 1.00 0.00 N ATOM 677 CA TYR A 42 -1.945 -5.223 3.987 1.00 0.00 C ATOM 678 C TYR A 42 -2.653 -4.258 3.023 1.00 0.00 C ATOM 679 O TYR A 42 -2.691 -4.527 1.823 1.00 0.00 O ATOM 680 CB TYR A 42 -0.529 -5.650 3.495 1.00 0.00 C ATOM 681 CG TYR A 42 0.508 -4.559 3.173 1.00 0.00 C ATOM 682 CD1 TYR A 42 0.447 -3.820 1.982 1.00 0.00 C ATOM 683 CD2 TYR A 42 1.593 -4.345 4.008 1.00 0.00 C ATOM 684 CE1 TYR A 42 1.421 -2.906 1.658 1.00 0.00 C ATOM 685 CE2 TYR A 42 2.570 -3.446 3.684 1.00 0.00 C ATOM 686 CZ TYR A 42 2.484 -2.732 2.509 1.00 0.00 C ATOM 687 OH TYR A 42 3.464 -1.827 2.209 1.00 0.00 O ATOM 0 H TYR A 42 -2.549 -7.038 3.188 1.00 0.00 H new ATOM 0 HA TYR A 42 -1.835 -4.733 4.955 1.00 0.00 H new ATOM 0 HB2 TYR A 42 -0.098 -6.300 4.257 1.00 0.00 H new ATOM 0 HB3 TYR A 42 -0.661 -6.254 2.598 1.00 0.00 H new ATOM 0 HD1 TYR A 42 -0.382 -3.972 1.306 1.00 0.00 H new ATOM 0 HD2 TYR A 42 1.668 -4.899 4.932 1.00 0.00 H new ATOM 0 HE1 TYR A 42 1.351 -2.332 0.746 1.00 0.00 H new ATOM 0 HE2 TYR A 42 3.408 -3.296 4.348 1.00 0.00 H new ATOM 0 HH TYR A 42 3.894 -2.078 1.365 1.00 0.00 H new ATOM 697 N VAL A 43 -3.249 -3.165 3.547 1.00 0.00 N ATOM 698 CA VAL A 43 -4.146 -2.279 2.752 1.00 0.00 C ATOM 699 C VAL A 43 -3.749 -0.800 2.893 1.00 0.00 C ATOM 700 O VAL A 43 -2.966 -0.435 3.773 1.00 0.00 O ATOM 701 CB VAL A 43 -5.681 -2.456 3.146 1.00 0.00 C ATOM 702 CG1 VAL A 43 -6.103 -3.948 3.154 1.00 0.00 C ATOM 703 CG2 VAL A 43 -6.025 -1.766 4.493 1.00 0.00 C ATOM 0 H VAL A 43 -3.129 -2.870 4.516 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.024 -2.584 1.713 1.00 0.00 H new ATOM 0 HB VAL A 43 -6.261 -1.953 2.372 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -7.155 -4.027 3.427 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -5.953 -4.374 2.162 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.498 -4.493 3.879 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -7.081 -1.914 4.718 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -5.420 -2.200 5.289 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -5.816 -0.699 4.419 1.00 0.00 H new ATOM 713 N ASP A 44 -4.320 0.034 2.005 1.00 0.00 N ATOM 714 CA ASP A 44 -4.234 1.495 2.079 1.00 0.00 C ATOM 715 C ASP A 44 -5.599 2.017 2.546 1.00 0.00 C ATOM 716 O ASP A 44 -6.598 1.955 1.806 1.00 0.00 O ATOM 717 CB ASP A 44 -3.825 2.095 0.713 1.00 0.00 C ATOM 718 CG ASP A 44 -3.630 3.619 0.689 1.00 0.00 C ATOM 719 OD1 ASP A 44 -3.488 4.238 1.760 1.00 0.00 O ATOM 720 OD2 ASP A 44 -3.655 4.211 -0.423 1.00 0.00 O ATOM 0 H ASP A 44 -4.861 -0.298 1.206 1.00 0.00 H new ATOM 0 HA ASP A 44 -3.463 1.798 2.788 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -2.896 1.623 0.392 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -4.586 1.832 -0.022 1.00 0.00 H new ATOM 725 N ILE A 45 -5.605 2.489 3.794 1.00 0.00 N ATOM 726 CA ILE A 45 -6.821 2.838 4.578 1.00 0.00 C ATOM 727 C ILE A 45 -7.785 3.812 3.849 1.00 0.00 C ATOM 728 O ILE A 45 -8.998 3.715 4.043 1.00 0.00 O ATOM 729 CB ILE A 45 -6.422 3.453 5.971 1.00 0.00 C ATOM 730 CG1 ILE A 45 -5.420 2.538 6.715 1.00 0.00 C ATOM 731 CG2 ILE A 45 -7.666 3.749 6.863 1.00 0.00 C ATOM 732 CD1 ILE A 45 -4.788 3.147 7.953 1.00 0.00 C ATOM 0 H ILE A 45 -4.743 2.649 4.315 1.00 0.00 H new ATOM 0 HA ILE A 45 -7.359 1.900 4.711 1.00 0.00 H new ATOM 0 HB ILE A 45 -5.935 4.407 5.769 1.00 0.00 H new ATOM 0 HG12 ILE A 45 -5.934 1.621 7.002 1.00 0.00 H new ATOM 0 HG13 ILE A 45 -4.627 2.256 6.023 1.00 0.00 H new ATOM 0 HG21 ILE A 45 -7.340 4.172 7.813 1.00 0.00 H new ATOM 0 HG22 ILE A 45 -8.318 4.459 6.354 1.00 0.00 H new ATOM 0 HG23 ILE A 45 -8.211 2.823 7.046 1.00 0.00 H new ATOM 0 HD11 ILE A 45 -4.102 2.429 8.402 1.00 0.00 H new ATOM 0 HD12 ILE A 45 -4.240 4.048 7.676 1.00 0.00 H new ATOM 0 HD13 ILE A 45 -5.567 3.403 8.671 1.00 0.00 H new ATOM 744 N VAL A 46 -7.231 4.716 3.000 1.00 0.00 N ATOM 745 CA VAL A 46 -8.004 5.773 2.264 1.00 0.00 C ATOM 746 C VAL A 46 -9.239 5.229 1.505 1.00 0.00 C ATOM 747 O VAL A 46 -10.210 5.964 1.288 1.00 0.00 O ATOM 748 CB VAL A 46 -7.089 6.566 1.255 1.00 0.00 C ATOM 749 CG1 VAL A 46 -6.063 7.452 2.002 1.00 0.00 C ATOM 750 CG2 VAL A 46 -6.402 5.600 0.251 1.00 0.00 C ATOM 0 H VAL A 46 -6.231 4.739 2.800 1.00 0.00 H new ATOM 0 HA VAL A 46 -8.366 6.444 3.043 1.00 0.00 H new ATOM 0 HB VAL A 46 -7.725 7.236 0.677 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -5.447 7.985 1.278 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -6.591 8.171 2.629 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -5.427 6.825 2.626 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -5.776 6.172 -0.434 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -5.784 4.887 0.797 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -7.163 5.062 -0.315 1.00 0.00 H new ATOM 760 N SER A 47 -9.172 3.953 1.104 1.00 0.00 N ATOM 761 CA SER A 47 -10.292 3.242 0.466 1.00 0.00 C ATOM 762 C SER A 47 -10.294 1.756 0.869 1.00 0.00 C ATOM 763 O SER A 47 -11.078 0.972 0.328 1.00 0.00 O ATOM 764 CB SER A 47 -10.222 3.429 -1.071 1.00 0.00 C ATOM 765 OG SER A 47 -8.903 3.233 -1.561 1.00 0.00 O ATOM 0 H SER A 47 -8.335 3.380 1.213 1.00 0.00 H new ATOM 0 HA SER A 47 -11.234 3.665 0.813 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.899 2.725 -1.555 1.00 0.00 H new ATOM 0 HB3 SER A 47 -10.563 4.431 -1.332 1.00 0.00 H new ATOM 0 HG SER A 47 -8.526 4.094 -1.838 1.00 0.00 H new ATOM 771 N GLY A 48 -9.435 1.386 1.854 1.00 0.00 N ATOM 772 CA GLY A 48 -9.334 0.003 2.351 1.00 0.00 C ATOM 773 C GLY A 48 -8.929 -0.983 1.270 1.00 0.00 C ATOM 774 O GLY A 48 -9.357 -2.137 1.273 1.00 0.00 O ATOM 0 H GLY A 48 -8.801 2.037 2.318 1.00 0.00 H new ATOM 0 HA2 GLY A 48 -8.606 -0.035 3.162 1.00 0.00 H new ATOM 0 HA3 GLY A 48 -10.294 -0.299 2.770 1.00 0.00 H new ATOM 778 N LYS A 49 -8.084 -0.502 0.357 1.00 0.00 N ATOM 779 CA LYS A 49 -7.726 -1.215 -0.875 1.00 0.00 C ATOM 780 C LYS A 49 -6.522 -2.158 -0.613 1.00 0.00 C ATOM 781 O LYS A 49 -5.433 -1.680 -0.267 1.00 0.00 O ATOM 782 CB LYS A 49 -7.455 -0.182 -2.006 1.00 0.00 C ATOM 783 CG LYS A 49 -6.401 0.900 -1.686 1.00 0.00 C ATOM 784 CD LYS A 49 -6.233 1.965 -2.800 1.00 0.00 C ATOM 785 CE LYS A 49 -5.645 1.419 -4.122 1.00 0.00 C ATOM 786 NZ LYS A 49 -6.600 0.609 -4.907 1.00 0.00 N ATOM 0 H LYS A 49 -7.623 0.403 0.451 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.551 -1.848 -1.203 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -7.135 -0.722 -2.897 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -8.394 0.313 -2.253 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -6.679 1.400 -0.758 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -5.440 0.416 -1.512 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -7.205 2.414 -3.007 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -5.587 2.761 -2.430 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.305 2.256 -4.732 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.768 0.813 -3.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -6.118 -0.236 -5.275 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -7.392 0.319 -4.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -6.963 1.174 -5.701 1.00 0.00 H new ATOM 800 N PRO A 50 -6.708 -3.521 -0.718 1.00 0.00 N ATOM 801 CA PRO A 50 -5.624 -4.506 -0.454 1.00 0.00 C ATOM 802 C PRO A 50 -4.466 -4.402 -1.470 1.00 0.00 C ATOM 803 O PRO A 50 -4.658 -4.602 -2.665 1.00 0.00 O ATOM 804 CB PRO A 50 -6.348 -5.887 -0.535 1.00 0.00 C ATOM 805 CG PRO A 50 -7.815 -5.563 -0.411 1.00 0.00 C ATOM 806 CD PRO A 50 -7.984 -4.212 -1.060 1.00 0.00 C ATOM 0 HA PRO A 50 -5.144 -4.337 0.510 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -6.133 -6.391 -1.477 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -6.021 -6.552 0.264 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -8.427 -6.316 -0.907 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -8.125 -5.538 0.634 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -8.123 -4.295 -2.138 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -8.850 -3.680 -0.667 1.00 0.00 H new ATOM 814 N LEU A 51 -3.257 -4.134 -0.965 1.00 0.00 N ATOM 815 CA LEU A 51 -2.052 -3.884 -1.782 1.00 0.00 C ATOM 816 C LEU A 51 -1.098 -5.073 -1.720 1.00 0.00 C ATOM 817 O LEU A 51 -0.200 -5.197 -2.561 1.00 0.00 O ATOM 818 CB LEU A 51 -1.326 -2.626 -1.266 1.00 0.00 C ATOM 819 CG LEU A 51 -2.191 -1.347 -1.171 1.00 0.00 C ATOM 820 CD1 LEU A 51 -1.343 -0.162 -0.671 1.00 0.00 C ATOM 821 CD2 LEU A 51 -2.911 -1.054 -2.518 1.00 0.00 C ATOM 0 H LEU A 51 -3.079 -4.083 0.038 1.00 0.00 H new ATOM 0 HA LEU A 51 -2.364 -3.737 -2.816 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -0.920 -2.842 -0.278 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -0.479 -2.423 -1.921 1.00 0.00 H new ATOM 0 HG LEU A 51 -2.980 -1.507 -0.436 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -1.966 0.731 -0.609 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -0.941 -0.393 0.316 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -0.521 0.016 -1.365 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -3.511 -0.149 -2.420 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -2.169 -0.914 -3.304 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -3.558 -1.893 -2.775 1.00 0.00 H new ATOM 833 N PHE A 52 -1.293 -5.911 -0.698 1.00 0.00 N ATOM 834 CA PHE A 52 -0.469 -7.102 -0.444 1.00 0.00 C ATOM 835 C PHE A 52 -1.211 -7.960 0.594 1.00 0.00 C ATOM 836 O PHE A 52 -2.089 -7.444 1.303 1.00 0.00 O ATOM 837 CB PHE A 52 0.928 -6.649 0.058 1.00 0.00 C ATOM 838 CG PHE A 52 2.013 -7.711 0.128 1.00 0.00 C ATOM 839 CD1 PHE A 52 2.371 -8.442 -1.001 1.00 0.00 C ATOM 840 CD2 PHE A 52 2.719 -7.931 1.309 1.00 0.00 C ATOM 841 CE1 PHE A 52 3.398 -9.361 -0.949 1.00 0.00 C ATOM 842 CE2 PHE A 52 3.735 -8.849 1.356 1.00 0.00 C ATOM 843 CZ PHE A 52 4.079 -9.561 0.224 1.00 0.00 C ATOM 0 H PHE A 52 -2.037 -5.782 -0.013 1.00 0.00 H new ATOM 0 HA PHE A 52 -0.313 -7.695 -1.345 1.00 0.00 H new ATOM 0 HB2 PHE A 52 1.279 -5.848 -0.593 1.00 0.00 H new ATOM 0 HB3 PHE A 52 0.808 -6.221 1.053 1.00 0.00 H new ATOM 0 HD1 PHE A 52 1.839 -8.288 -1.928 1.00 0.00 H new ATOM 0 HD2 PHE A 52 2.463 -7.372 2.197 1.00 0.00 H new ATOM 0 HE1 PHE A 52 3.666 -9.923 -1.832 1.00 0.00 H new ATOM 0 HE2 PHE A 52 4.268 -9.016 2.280 1.00 0.00 H new ATOM 0 HZ PHE A 52 4.886 -10.277 0.263 1.00 0.00 H new ATOM 853 N THR A 53 -0.924 -9.261 0.651 1.00 0.00 N ATOM 854 CA THR A 53 -1.537 -10.146 1.657 1.00 0.00 C ATOM 855 C THR A 53 -0.619 -10.277 2.896 1.00 0.00 C ATOM 856 O THR A 53 0.610 -10.256 2.770 1.00 0.00 O ATOM 857 CB THR A 53 -1.844 -11.539 1.022 1.00 0.00 C ATOM 858 OG1 THR A 53 -2.540 -11.355 -0.226 1.00 0.00 O ATOM 859 CG2 THR A 53 -2.710 -12.409 1.934 1.00 0.00 C ATOM 0 H THR A 53 -0.275 -9.729 0.018 1.00 0.00 H new ATOM 0 HA THR A 53 -2.478 -9.710 1.992 1.00 0.00 H new ATOM 0 HB THR A 53 -0.890 -12.044 0.869 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.732 -12.229 -0.626 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.898 -13.368 1.451 1.00 0.00 H new ATOM 0 HG22 THR A 53 -2.192 -12.574 2.879 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.658 -11.906 2.123 1.00 0.00 H new ATOM 867 N SER A 54 -1.234 -10.422 4.100 1.00 0.00 N ATOM 868 CA SER A 54 -0.491 -10.554 5.371 1.00 0.00 C ATOM 869 C SER A 54 0.111 -11.970 5.530 1.00 0.00 C ATOM 870 O SER A 54 1.054 -12.169 6.305 1.00 0.00 O ATOM 871 CB SER A 54 -1.376 -10.181 6.577 1.00 0.00 C ATOM 872 OG SER A 54 -0.637 -10.125 7.786 1.00 0.00 O ATOM 0 H SER A 54 -2.248 -10.450 4.211 1.00 0.00 H new ATOM 0 HA SER A 54 0.339 -9.849 5.341 1.00 0.00 H new ATOM 0 HB2 SER A 54 -1.846 -9.215 6.395 1.00 0.00 H new ATOM 0 HB3 SER A 54 -2.178 -10.912 6.677 1.00 0.00 H new ATOM 0 HG SER A 54 -1.235 -9.884 8.524 1.00 0.00 H new ATOM 878 N LYS A 55 -0.471 -12.944 4.805 1.00 0.00 N ATOM 879 CA LYS A 55 0.122 -14.289 4.605 1.00 0.00 C ATOM 880 C LYS A 55 1.552 -14.195 4.038 1.00 0.00 C ATOM 881 O LYS A 55 2.448 -14.958 4.423 1.00 0.00 O ATOM 882 CB LYS A 55 -0.754 -15.100 3.620 1.00 0.00 C ATOM 883 CG LYS A 55 -2.159 -15.472 4.139 1.00 0.00 C ATOM 884 CD LYS A 55 -3.145 -15.816 2.993 1.00 0.00 C ATOM 885 CE LYS A 55 -2.627 -16.878 2.011 1.00 0.00 C ATOM 886 NZ LYS A 55 -3.558 -17.063 0.872 1.00 0.00 N ATOM 0 H LYS A 55 -1.370 -12.824 4.338 1.00 0.00 H new ATOM 0 HA LYS A 55 0.164 -14.784 5.575 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -0.865 -14.525 2.700 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -0.226 -16.018 3.361 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -2.079 -16.325 4.813 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -2.559 -14.642 4.721 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -4.081 -16.166 3.428 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -3.372 -14.905 2.439 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -1.647 -16.582 1.637 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -2.496 -17.826 2.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -3.112 -17.669 0.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -4.434 -17.512 1.209 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -3.782 -16.138 0.453 1.00 0.00 H new ATOM 900 N ASP A 56 1.730 -13.235 3.122 1.00 0.00 N ATOM 901 CA ASP A 56 2.963 -13.052 2.343 1.00 0.00 C ATOM 902 C ASP A 56 3.887 -11.984 2.962 1.00 0.00 C ATOM 903 O ASP A 56 4.910 -11.641 2.368 1.00 0.00 O ATOM 904 CB ASP A 56 2.582 -12.672 0.888 1.00 0.00 C ATOM 905 CG ASP A 56 1.909 -13.821 0.120 1.00 0.00 C ATOM 906 OD1 ASP A 56 0.663 -13.947 0.172 1.00 0.00 O ATOM 907 OD2 ASP A 56 2.625 -14.615 -0.528 1.00 0.00 O ATOM 0 H ASP A 56 1.008 -12.550 2.897 1.00 0.00 H new ATOM 0 HA ASP A 56 3.522 -13.988 2.350 1.00 0.00 H new ATOM 0 HB2 ASP A 56 1.910 -11.814 0.907 1.00 0.00 H new ATOM 0 HB3 ASP A 56 3.480 -12.362 0.353 1.00 0.00 H new ATOM 912 N LYS A 57 3.568 -11.509 4.178 1.00 0.00 N ATOM 913 CA LYS A 57 4.324 -10.400 4.810 1.00 0.00 C ATOM 914 C LYS A 57 5.675 -10.920 5.329 1.00 0.00 C ATOM 915 O LYS A 57 5.760 -12.051 5.814 1.00 0.00 O ATOM 916 CB LYS A 57 3.512 -9.740 5.963 1.00 0.00 C ATOM 917 CG LYS A 57 2.496 -8.665 5.526 1.00 0.00 C ATOM 918 CD LYS A 57 3.137 -7.365 4.986 1.00 0.00 C ATOM 919 CE LYS A 57 3.896 -6.530 6.044 1.00 0.00 C ATOM 920 NZ LYS A 57 5.219 -7.105 6.409 1.00 0.00 N ATOM 0 H LYS A 57 2.799 -11.868 4.744 1.00 0.00 H new ATOM 0 HA LYS A 57 4.501 -9.634 4.055 1.00 0.00 H new ATOM 0 HB2 LYS A 57 2.978 -10.522 6.502 1.00 0.00 H new ATOM 0 HB3 LYS A 57 4.212 -9.289 6.666 1.00 0.00 H new ATOM 0 HG2 LYS A 57 1.850 -9.085 4.755 1.00 0.00 H new ATOM 0 HG3 LYS A 57 1.860 -8.417 6.375 1.00 0.00 H new ATOM 0 HD2 LYS A 57 3.828 -7.623 4.183 1.00 0.00 H new ATOM 0 HD3 LYS A 57 2.355 -6.746 4.547 1.00 0.00 H new ATOM 0 HE2 LYS A 57 4.040 -5.519 5.664 1.00 0.00 H new ATOM 0 HE3 LYS A 57 3.283 -6.449 6.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 5.932 -6.348 6.432 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 5.157 -7.551 7.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 5.494 -7.818 5.704 1.00 0.00 H new ATOM 934 N PHE A 58 6.727 -10.097 5.206 1.00 0.00 N ATOM 935 CA PHE A 58 8.076 -10.442 5.692 1.00 0.00 C ATOM 936 C PHE A 58 8.773 -9.178 6.233 1.00 0.00 C ATOM 937 O PHE A 58 8.247 -8.058 6.091 1.00 0.00 O ATOM 938 CB PHE A 58 8.901 -11.121 4.552 1.00 0.00 C ATOM 939 CG PHE A 58 10.082 -11.967 5.043 1.00 0.00 C ATOM 940 CD1 PHE A 58 9.867 -13.256 5.532 1.00 0.00 C ATOM 941 CD2 PHE A 58 11.390 -11.472 5.044 1.00 0.00 C ATOM 942 CE1 PHE A 58 10.918 -14.023 6.001 1.00 0.00 C ATOM 943 CE2 PHE A 58 12.436 -12.239 5.518 1.00 0.00 C ATOM 944 CZ PHE A 58 12.200 -13.511 5.995 1.00 0.00 C ATOM 0 H PHE A 58 6.670 -9.177 4.769 1.00 0.00 H new ATOM 0 HA PHE A 58 8.000 -11.158 6.511 1.00 0.00 H new ATOM 0 HB2 PHE A 58 8.235 -11.754 3.966 1.00 0.00 H new ATOM 0 HB3 PHE A 58 9.277 -10.348 3.882 1.00 0.00 H new ATOM 0 HD1 PHE A 58 8.866 -13.661 5.544 1.00 0.00 H new ATOM 0 HD2 PHE A 58 11.584 -10.478 4.670 1.00 0.00 H new ATOM 0 HE1 PHE A 58 10.736 -15.021 6.371 1.00 0.00 H new ATOM 0 HE2 PHE A 58 13.440 -11.842 5.515 1.00 0.00 H new ATOM 0 HZ PHE A 58 13.020 -14.108 6.365 1.00 0.00 H new ATOM 954 N ASP A 59 9.932 -9.396 6.890 1.00 0.00 N ATOM 955 CA ASP A 59 10.806 -8.332 7.426 1.00 0.00 C ATOM 956 C ASP A 59 11.162 -7.290 6.344 1.00 0.00 C ATOM 957 O ASP A 59 11.682 -7.640 5.277 1.00 0.00 O ATOM 958 CB ASP A 59 12.114 -8.954 7.996 1.00 0.00 C ATOM 959 CG ASP A 59 13.144 -7.900 8.469 1.00 0.00 C ATOM 960 OD1 ASP A 59 12.997 -7.381 9.588 1.00 0.00 O ATOM 961 OD2 ASP A 59 14.099 -7.583 7.717 1.00 0.00 O ATOM 0 H ASP A 59 10.293 -10.334 7.066 1.00 0.00 H new ATOM 0 HA ASP A 59 10.259 -7.825 8.221 1.00 0.00 H new ATOM 0 HB2 ASP A 59 11.862 -9.606 8.833 1.00 0.00 H new ATOM 0 HB3 ASP A 59 12.572 -9.581 7.231 1.00 0.00 H new ATOM 966 N SER A 60 10.875 -6.020 6.650 1.00 0.00 N ATOM 967 CA SER A 60 11.175 -4.875 5.787 1.00 0.00 C ATOM 968 C SER A 60 12.318 -4.060 6.412 1.00 0.00 C ATOM 969 O SER A 60 12.129 -3.415 7.446 1.00 0.00 O ATOM 970 CB SER A 60 9.896 -4.023 5.627 1.00 0.00 C ATOM 971 OG SER A 60 8.809 -4.817 5.150 1.00 0.00 O ATOM 0 H SER A 60 10.418 -5.755 7.523 1.00 0.00 H new ATOM 0 HA SER A 60 11.495 -5.207 4.799 1.00 0.00 H new ATOM 0 HB2 SER A 60 9.631 -3.575 6.585 1.00 0.00 H new ATOM 0 HB3 SER A 60 10.085 -3.204 4.933 1.00 0.00 H new ATOM 0 HG SER A 60 7.965 -4.455 5.491 1.00 0.00 H new ATOM 977 N GLN A 61 13.512 -4.137 5.795 1.00 0.00 N ATOM 978 CA GLN A 61 14.730 -3.440 6.271 1.00 0.00 C ATOM 979 C GLN A 61 14.862 -2.029 5.654 1.00 0.00 C ATOM 980 O GLN A 61 15.782 -1.274 5.999 1.00 0.00 O ATOM 981 CB GLN A 61 15.992 -4.294 5.958 1.00 0.00 C ATOM 982 CG GLN A 61 16.209 -4.605 4.459 1.00 0.00 C ATOM 983 CD GLN A 61 17.530 -5.314 4.179 1.00 0.00 C ATOM 984 OE1 GLN A 61 17.611 -6.547 4.179 1.00 0.00 O ATOM 985 NE2 GLN A 61 18.578 -4.542 3.945 1.00 0.00 N ATOM 0 H GLN A 61 13.664 -4.686 4.949 1.00 0.00 H new ATOM 0 HA GLN A 61 14.642 -3.315 7.350 1.00 0.00 H new ATOM 0 HB2 GLN A 61 16.870 -3.771 6.337 1.00 0.00 H new ATOM 0 HB3 GLN A 61 15.921 -5.235 6.503 1.00 0.00 H new ATOM 0 HG2 GLN A 61 15.388 -5.225 4.100 1.00 0.00 H new ATOM 0 HG3 GLN A 61 16.176 -3.674 3.893 1.00 0.00 H new ATOM 0 HE21 GLN A 61 18.476 -3.527 3.953 1.00 0.00 H new ATOM 0 HE22 GLN A 61 19.489 -4.961 3.757 1.00 0.00 H new ATOM 994 N CYS A 62 13.937 -1.686 4.736 1.00 0.00 N ATOM 995 CA CYS A 62 13.915 -0.382 4.044 1.00 0.00 C ATOM 996 C CYS A 62 13.095 0.666 4.832 1.00 0.00 C ATOM 997 O CYS A 62 13.022 1.825 4.421 1.00 0.00 O ATOM 998 CB CYS A 62 13.332 -0.569 2.623 1.00 0.00 C ATOM 999 SG CYS A 62 13.343 0.918 1.585 1.00 0.00 S ATOM 0 H CYS A 62 13.181 -2.309 4.452 1.00 0.00 H new ATOM 0 HA CYS A 62 14.937 -0.008 3.975 1.00 0.00 H new ATOM 0 HB2 CYS A 62 13.896 -1.351 2.116 1.00 0.00 H new ATOM 0 HB3 CYS A 62 12.305 -0.923 2.712 1.00 0.00 H new ATOM 0 HG CYS A 62 13.465 1.971 2.337 1.00 0.00 H new ATOM 1005 N GLY A 63 12.499 0.262 5.979 1.00 0.00 N ATOM 1006 CA GLY A 63 11.585 1.130 6.739 1.00 0.00 C ATOM 1007 C GLY A 63 10.172 1.053 6.176 1.00 0.00 C ATOM 1008 O GLY A 63 9.239 0.614 6.853 1.00 0.00 O ATOM 0 H GLY A 63 12.638 -0.660 6.393 1.00 0.00 H new ATOM 0 HA2 GLY A 63 11.580 0.831 7.787 1.00 0.00 H new ATOM 0 HA3 GLY A 63 11.940 2.160 6.703 1.00 0.00 H new ATOM 1012 N TRP A 64 10.036 1.483 4.911 1.00 0.00 N ATOM 1013 CA TRP A 64 8.833 1.250 4.104 1.00 0.00 C ATOM 1014 C TRP A 64 8.847 -0.223 3.664 1.00 0.00 C ATOM 1015 O TRP A 64 9.905 -0.699 3.210 1.00 0.00 O ATOM 1016 CB TRP A 64 8.826 2.175 2.853 1.00 0.00 C ATOM 1017 CG TRP A 64 9.090 3.620 3.176 1.00 0.00 C ATOM 1018 CD1 TRP A 64 8.200 4.537 3.652 1.00 0.00 C ATOM 1019 CD2 TRP A 64 10.347 4.301 3.071 1.00 0.00 C ATOM 1020 NE1 TRP A 64 8.825 5.737 3.840 1.00 0.00 N ATOM 1021 CE2 TRP A 64 10.142 5.616 3.497 1.00 0.00 C ATOM 1022 CE3 TRP A 64 11.622 3.915 2.649 1.00 0.00 C ATOM 1023 CZ2 TRP A 64 11.165 6.550 3.532 1.00 0.00 C ATOM 1024 CZ3 TRP A 64 12.640 4.842 2.681 1.00 0.00 C ATOM 1025 CH2 TRP A 64 12.406 6.154 3.125 1.00 0.00 C ATOM 0 H TRP A 64 10.762 2.004 4.420 1.00 0.00 H new ATOM 0 HA TRP A 64 7.940 1.472 4.689 1.00 0.00 H new ATOM 0 HB2 TRP A 64 9.579 1.825 2.147 1.00 0.00 H new ATOM 0 HB3 TRP A 64 7.860 2.093 2.355 1.00 0.00 H new ATOM 0 HD1 TRP A 64 7.156 4.343 3.851 1.00 0.00 H new ATOM 0 HE1 TRP A 64 8.379 6.588 4.182 1.00 0.00 H new ATOM 0 HE3 TRP A 64 11.806 2.908 2.304 1.00 0.00 H new ATOM 0 HZ2 TRP A 64 10.986 7.560 3.871 1.00 0.00 H new ATOM 0 HZ3 TRP A 64 13.631 4.557 2.361 1.00 0.00 H new ATOM 0 HH2 TRP A 64 13.222 6.861 3.145 1.00 0.00 H new ATOM 1036 N PRO A 65 7.718 -0.985 3.836 1.00 0.00 N ATOM 1037 CA PRO A 65 7.618 -2.369 3.317 1.00 0.00 C ATOM 1038 C PRO A 65 7.955 -2.440 1.819 1.00 0.00 C ATOM 1039 O PRO A 65 7.280 -1.819 0.988 1.00 0.00 O ATOM 1040 CB PRO A 65 6.155 -2.765 3.607 1.00 0.00 C ATOM 1041 CG PRO A 65 5.771 -1.910 4.780 1.00 0.00 C ATOM 1042 CD PRO A 65 6.484 -0.592 4.577 1.00 0.00 C ATOM 0 HA PRO A 65 8.330 -3.048 3.786 1.00 0.00 H new ATOM 0 HB2 PRO A 65 5.512 -2.575 2.747 1.00 0.00 H new ATOM 0 HB3 PRO A 65 6.068 -3.826 3.841 1.00 0.00 H new ATOM 0 HG2 PRO A 65 4.691 -1.768 4.824 1.00 0.00 H new ATOM 0 HG3 PRO A 65 6.070 -2.376 5.719 1.00 0.00 H new ATOM 0 HD2 PRO A 65 5.877 0.111 4.006 1.00 0.00 H new ATOM 0 HD3 PRO A 65 6.720 -0.111 5.526 1.00 0.00 H new ATOM 1050 N SER A 66 9.045 -3.164 1.510 1.00 0.00 N ATOM 1051 CA SER A 66 9.599 -3.264 0.155 1.00 0.00 C ATOM 1052 C SER A 66 9.720 -4.731 -0.273 1.00 0.00 C ATOM 1053 O SER A 66 10.514 -5.493 0.291 1.00 0.00 O ATOM 1054 CB SER A 66 10.966 -2.544 0.079 1.00 0.00 C ATOM 1055 OG SER A 66 10.843 -1.160 0.387 1.00 0.00 O ATOM 0 H SER A 66 9.568 -3.700 2.202 1.00 0.00 H new ATOM 0 HA SER A 66 8.918 -2.771 -0.538 1.00 0.00 H new ATOM 0 HB2 SER A 66 11.664 -3.012 0.773 1.00 0.00 H new ATOM 0 HB3 SER A 66 11.385 -2.660 -0.921 1.00 0.00 H new ATOM 0 HG SER A 66 10.535 -1.057 1.312 1.00 0.00 H new ATOM 1061 N PHE A 67 8.913 -5.106 -1.273 1.00 0.00 N ATOM 1062 CA PHE A 67 8.920 -6.440 -1.890 1.00 0.00 C ATOM 1063 C PHE A 67 8.606 -6.260 -3.395 1.00 0.00 C ATOM 1064 O PHE A 67 8.177 -5.178 -3.816 1.00 0.00 O ATOM 1065 CB PHE A 67 7.893 -7.357 -1.151 1.00 0.00 C ATOM 1066 CG PHE A 67 7.984 -8.853 -1.459 1.00 0.00 C ATOM 1067 CD1 PHE A 67 9.016 -9.624 -0.927 1.00 0.00 C ATOM 1068 CD2 PHE A 67 7.044 -9.486 -2.272 1.00 0.00 C ATOM 1069 CE1 PHE A 67 9.104 -10.974 -1.196 1.00 0.00 C ATOM 1070 CE2 PHE A 67 7.136 -10.836 -2.538 1.00 0.00 C ATOM 1071 CZ PHE A 67 8.166 -11.581 -2.002 1.00 0.00 C ATOM 0 H PHE A 67 8.222 -4.478 -1.685 1.00 0.00 H new ATOM 0 HA PHE A 67 9.890 -6.930 -1.801 1.00 0.00 H new ATOM 0 HB2 PHE A 67 8.020 -7.219 -0.077 1.00 0.00 H new ATOM 0 HB3 PHE A 67 6.888 -7.016 -1.399 1.00 0.00 H new ATOM 0 HD1 PHE A 67 9.757 -9.158 -0.295 1.00 0.00 H new ATOM 0 HD2 PHE A 67 6.234 -8.912 -2.698 1.00 0.00 H new ATOM 0 HE1 PHE A 67 9.910 -11.556 -0.774 1.00 0.00 H new ATOM 0 HE2 PHE A 67 6.399 -11.312 -3.168 1.00 0.00 H new ATOM 0 HZ PHE A 67 8.237 -12.638 -2.214 1.00 0.00 H new ATOM 1081 N THR A 68 8.804 -7.309 -4.200 1.00 0.00 N ATOM 1082 CA THR A 68 8.763 -7.209 -5.679 1.00 0.00 C ATOM 1083 C THR A 68 7.425 -7.703 -6.274 1.00 0.00 C ATOM 1084 O THR A 68 7.230 -7.682 -7.502 1.00 0.00 O ATOM 1085 CB THR A 68 9.953 -7.998 -6.290 1.00 0.00 C ATOM 1086 OG1 THR A 68 9.975 -9.326 -5.750 1.00 0.00 O ATOM 1087 CG2 THR A 68 11.299 -7.312 -6.010 1.00 0.00 C ATOM 0 H THR A 68 8.997 -8.250 -3.856 1.00 0.00 H new ATOM 0 HA THR A 68 8.848 -6.153 -5.937 1.00 0.00 H new ATOM 0 HB THR A 68 9.811 -8.030 -7.370 1.00 0.00 H new ATOM 0 HG1 THR A 68 10.725 -9.824 -6.137 1.00 0.00 H new ATOM 0 HG21 THR A 68 12.105 -7.896 -6.455 1.00 0.00 H new ATOM 0 HG22 THR A 68 11.295 -6.312 -6.443 1.00 0.00 H new ATOM 0 HG23 THR A 68 11.454 -7.241 -4.933 1.00 0.00 H new ATOM 1095 N LYS A 69 6.517 -8.147 -5.398 1.00 0.00 N ATOM 1096 CA LYS A 69 5.215 -8.710 -5.776 1.00 0.00 C ATOM 1097 C LYS A 69 4.106 -8.041 -4.932 1.00 0.00 C ATOM 1098 O LYS A 69 3.882 -8.432 -3.793 1.00 0.00 O ATOM 1099 CB LYS A 69 5.257 -10.253 -5.585 1.00 0.00 C ATOM 1100 CG LYS A 69 3.907 -11.008 -5.671 1.00 0.00 C ATOM 1101 CD LYS A 69 4.082 -12.539 -5.477 1.00 0.00 C ATOM 1102 CE LYS A 69 2.761 -13.262 -5.130 1.00 0.00 C ATOM 1103 NZ LYS A 69 1.694 -13.034 -6.138 1.00 0.00 N ATOM 0 H LYS A 69 6.668 -8.125 -4.390 1.00 0.00 H new ATOM 0 HA LYS A 69 4.993 -8.511 -6.824 1.00 0.00 H new ATOM 0 HB2 LYS A 69 5.927 -10.670 -6.337 1.00 0.00 H new ATOM 0 HB3 LYS A 69 5.701 -10.462 -4.612 1.00 0.00 H new ATOM 0 HG2 LYS A 69 3.227 -10.622 -4.912 1.00 0.00 H new ATOM 0 HG3 LYS A 69 3.445 -10.816 -6.640 1.00 0.00 H new ATOM 0 HD2 LYS A 69 4.496 -12.970 -6.389 1.00 0.00 H new ATOM 0 HD3 LYS A 69 4.806 -12.718 -4.683 1.00 0.00 H new ATOM 0 HE2 LYS A 69 2.950 -14.332 -5.045 1.00 0.00 H new ATOM 0 HE3 LYS A 69 2.412 -12.921 -4.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 0.844 -13.570 -5.871 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 1.466 -12.020 -6.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 2.024 -13.352 -7.071 1.00 0.00 H new ATOM 1117 N PRO A 70 3.483 -6.933 -5.445 1.00 0.00 N ATOM 1118 CA PRO A 70 2.226 -6.375 -4.893 1.00 0.00 C ATOM 1119 C PRO A 70 0.993 -7.126 -5.442 1.00 0.00 C ATOM 1120 O PRO A 70 1.121 -8.115 -6.172 1.00 0.00 O ATOM 1121 CB PRO A 70 2.261 -4.906 -5.386 1.00 0.00 C ATOM 1122 CG PRO A 70 2.930 -5.001 -6.730 1.00 0.00 C ATOM 1123 CD PRO A 70 3.987 -6.094 -6.579 1.00 0.00 C ATOM 0 HA PRO A 70 2.151 -6.463 -3.809 1.00 0.00 H new ATOM 0 HB2 PRO A 70 1.258 -4.486 -5.466 1.00 0.00 H new ATOM 0 HB3 PRO A 70 2.821 -4.267 -4.703 1.00 0.00 H new ATOM 0 HG2 PRO A 70 2.212 -5.254 -7.510 1.00 0.00 H new ATOM 0 HG3 PRO A 70 3.384 -4.051 -7.011 1.00 0.00 H new ATOM 0 HD2 PRO A 70 4.090 -6.679 -7.493 1.00 0.00 H new ATOM 0 HD3 PRO A 70 4.968 -5.673 -6.358 1.00 0.00 H new ATOM 1131 N ILE A 71 -0.197 -6.650 -5.061 1.00 0.00 N ATOM 1132 CA ILE A 71 -1.453 -7.095 -5.666 1.00 0.00 C ATOM 1133 C ILE A 71 -1.645 -6.252 -6.931 1.00 0.00 C ATOM 1134 O ILE A 71 -2.038 -5.095 -6.854 1.00 0.00 O ATOM 1135 CB ILE A 71 -2.690 -6.965 -4.691 1.00 0.00 C ATOM 1136 CG1 ILE A 71 -2.495 -7.894 -3.451 1.00 0.00 C ATOM 1137 CG2 ILE A 71 -4.027 -7.282 -5.418 1.00 0.00 C ATOM 1138 CD1 ILE A 71 -3.618 -7.861 -2.419 1.00 0.00 C ATOM 0 H ILE A 71 -0.315 -5.950 -4.329 1.00 0.00 H new ATOM 0 HA ILE A 71 -1.397 -8.158 -5.898 1.00 0.00 H new ATOM 0 HB ILE A 71 -2.746 -5.931 -4.350 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -2.379 -8.919 -3.802 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.563 -7.619 -2.957 1.00 0.00 H new ATOM 0 HG21 ILE A 71 -4.855 -7.182 -4.716 1.00 0.00 H new ATOM 0 HG22 ILE A 71 -4.166 -6.585 -6.245 1.00 0.00 H new ATOM 0 HG23 ILE A 71 -3.999 -8.301 -5.804 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -3.381 -8.542 -1.601 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -3.724 -6.849 -2.029 1.00 0.00 H new ATOM 0 HD13 ILE A 71 -4.552 -8.169 -2.888 1.00 0.00 H new ATOM 1150 N GLU A 72 -1.368 -6.865 -8.097 1.00 0.00 N ATOM 1151 CA GLU A 72 -1.325 -6.161 -9.402 1.00 0.00 C ATOM 1152 C GLU A 72 -2.754 -5.710 -9.816 1.00 0.00 C ATOM 1153 O GLU A 72 -2.937 -4.817 -10.650 1.00 0.00 O ATOM 1154 CB GLU A 72 -0.705 -7.105 -10.470 1.00 0.00 C ATOM 1155 CG GLU A 72 -0.449 -6.467 -11.849 1.00 0.00 C ATOM 1156 CD GLU A 72 0.080 -7.478 -12.878 1.00 0.00 C ATOM 1157 OE1 GLU A 72 -0.737 -8.124 -13.576 1.00 0.00 O ATOM 1158 OE2 GLU A 72 1.313 -7.640 -12.996 1.00 0.00 O ATOM 0 H GLU A 72 -1.167 -7.863 -8.166 1.00 0.00 H new ATOM 0 HA GLU A 72 -0.705 -5.268 -9.319 1.00 0.00 H new ATOM 0 HB2 GLU A 72 0.240 -7.489 -10.086 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -1.367 -7.961 -10.602 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -1.375 -6.028 -12.220 1.00 0.00 H new ATOM 0 HG3 GLU A 72 0.269 -5.654 -11.742 1.00 0.00 H new ATOM 1165 N GLU A 73 -3.752 -6.346 -9.177 1.00 0.00 N ATOM 1166 CA GLU A 73 -5.180 -6.118 -9.408 1.00 0.00 C ATOM 1167 C GLU A 73 -5.648 -4.799 -8.763 1.00 0.00 C ATOM 1168 O GLU A 73 -6.387 -4.033 -9.390 1.00 0.00 O ATOM 1169 CB GLU A 73 -5.964 -7.337 -8.850 1.00 0.00 C ATOM 1170 CG GLU A 73 -5.569 -8.675 -9.511 1.00 0.00 C ATOM 1171 CD GLU A 73 -6.073 -9.905 -8.748 1.00 0.00 C ATOM 1172 OE1 GLU A 73 -5.345 -10.394 -7.858 1.00 0.00 O ATOM 1173 OE2 GLU A 73 -7.200 -10.376 -9.017 1.00 0.00 O ATOM 0 H GLU A 73 -3.576 -7.054 -8.464 1.00 0.00 H new ATOM 0 HA GLU A 73 -5.370 -6.021 -10.477 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -5.795 -7.407 -7.775 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -7.031 -7.170 -8.994 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -5.964 -8.700 -10.527 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -4.483 -8.726 -9.590 1.00 0.00 H new ATOM 1180 N GLU A 74 -5.212 -4.524 -7.512 1.00 0.00 N ATOM 1181 CA GLU A 74 -5.718 -3.373 -6.745 1.00 0.00 C ATOM 1182 C GLU A 74 -4.730 -2.192 -6.784 1.00 0.00 C ATOM 1183 O GLU A 74 -5.130 -1.032 -6.665 1.00 0.00 O ATOM 1184 CB GLU A 74 -6.012 -3.823 -5.301 1.00 0.00 C ATOM 1185 CG GLU A 74 -6.846 -2.835 -4.469 1.00 0.00 C ATOM 1186 CD GLU A 74 -8.230 -2.544 -5.075 1.00 0.00 C ATOM 1187 OE1 GLU A 74 -9.024 -3.495 -5.242 1.00 0.00 O ATOM 1188 OE2 GLU A 74 -8.537 -1.366 -5.380 1.00 0.00 O ATOM 0 H GLU A 74 -4.515 -5.082 -7.019 1.00 0.00 H new ATOM 0 HA GLU A 74 -6.642 -3.016 -7.200 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -6.535 -4.779 -5.334 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -5.065 -3.995 -4.790 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -6.975 -3.236 -3.464 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -6.296 -1.899 -4.371 1.00 0.00 H new ATOM 1195 N VAL A 75 -3.444 -2.512 -6.952 1.00 0.00 N ATOM 1196 CA VAL A 75 -2.377 -1.521 -7.142 1.00 0.00 C ATOM 1197 C VAL A 75 -2.384 -1.053 -8.612 1.00 0.00 C ATOM 1198 O VAL A 75 -2.593 -1.862 -9.520 1.00 0.00 O ATOM 1199 CB VAL A 75 -0.974 -2.138 -6.766 1.00 0.00 C ATOM 1200 CG1 VAL A 75 0.184 -1.192 -7.121 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -0.918 -2.526 -5.271 1.00 0.00 C ATOM 0 H VAL A 75 -3.109 -3.475 -6.960 1.00 0.00 H new ATOM 0 HA VAL A 75 -2.554 -0.668 -6.487 1.00 0.00 H new ATOM 0 HB VAL A 75 -0.855 -3.043 -7.362 1.00 0.00 H new ATOM 0 HG11 VAL A 75 1.131 -1.656 -6.845 1.00 0.00 H new ATOM 0 HG12 VAL A 75 0.176 -0.993 -8.193 1.00 0.00 H new ATOM 0 HG13 VAL A 75 0.068 -0.255 -6.577 1.00 0.00 H new ATOM 0 HG21 VAL A 75 0.060 -2.948 -5.041 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -1.084 -1.640 -4.659 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -1.691 -3.264 -5.057 1.00 0.00 H new ATOM 1211 N GLU A 76 -2.163 0.254 -8.830 1.00 0.00 N ATOM 1212 CA GLU A 76 -2.140 0.878 -10.161 1.00 0.00 C ATOM 1213 C GLU A 76 -0.838 1.669 -10.289 1.00 0.00 C ATOM 1214 O GLU A 76 -0.499 2.416 -9.388 1.00 0.00 O ATOM 1215 CB GLU A 76 -3.392 1.784 -10.304 1.00 0.00 C ATOM 1216 CG GLU A 76 -3.483 2.648 -11.580 1.00 0.00 C ATOM 1217 CD GLU A 76 -3.464 1.846 -12.891 1.00 0.00 C ATOM 1218 OE1 GLU A 76 -4.423 1.085 -13.145 1.00 0.00 O ATOM 1219 OE2 GLU A 76 -2.491 1.966 -13.667 1.00 0.00 O ATOM 0 H GLU A 76 -1.993 0.916 -8.073 1.00 0.00 H new ATOM 0 HA GLU A 76 -2.172 0.137 -10.960 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -4.277 1.150 -10.259 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.431 2.448 -9.440 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.400 3.237 -11.541 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -2.652 3.353 -11.587 1.00 0.00 H new ATOM 1226 N GLU A 77 -0.107 1.483 -11.393 1.00 0.00 N ATOM 1227 CA GLU A 77 1.221 2.115 -11.603 1.00 0.00 C ATOM 1228 C GLU A 77 1.123 3.263 -12.625 1.00 0.00 C ATOM 1229 O GLU A 77 0.170 3.331 -13.407 1.00 0.00 O ATOM 1230 CB GLU A 77 2.300 1.061 -12.028 1.00 0.00 C ATOM 1231 CG GLU A 77 2.163 0.456 -13.456 1.00 0.00 C ATOM 1232 CD GLU A 77 0.822 -0.256 -13.719 1.00 0.00 C ATOM 1233 OE1 GLU A 77 0.541 -1.287 -13.068 1.00 0.00 O ATOM 1234 OE2 GLU A 77 0.022 0.234 -14.545 1.00 0.00 O ATOM 0 H GLU A 77 -0.408 0.894 -12.170 1.00 0.00 H new ATOM 0 HA GLU A 77 1.544 2.538 -10.652 1.00 0.00 H new ATOM 0 HB2 GLU A 77 3.282 1.528 -11.949 1.00 0.00 H new ATOM 0 HB3 GLU A 77 2.278 0.243 -11.308 1.00 0.00 H new ATOM 0 HG2 GLU A 77 2.287 1.253 -14.189 1.00 0.00 H new ATOM 0 HG3 GLU A 77 2.975 -0.253 -13.616 1.00 0.00 H new ATOM 1241 N LYS A 78 2.090 4.197 -12.561 1.00 0.00 N ATOM 1242 CA LYS A 78 2.154 5.363 -13.463 1.00 0.00 C ATOM 1243 C LYS A 78 3.611 5.788 -13.672 1.00 0.00 C ATOM 1244 O LYS A 78 4.230 6.326 -12.755 1.00 0.00 O ATOM 1245 CB LYS A 78 1.339 6.543 -12.870 1.00 0.00 C ATOM 1246 CG LYS A 78 1.335 7.829 -13.737 1.00 0.00 C ATOM 1247 CD LYS A 78 0.584 9.005 -13.075 1.00 0.00 C ATOM 1248 CE LYS A 78 1.229 9.471 -11.753 1.00 0.00 C ATOM 1249 NZ LYS A 78 2.644 9.918 -11.921 1.00 0.00 N ATOM 0 H LYS A 78 2.850 4.165 -11.882 1.00 0.00 H new ATOM 0 HA LYS A 78 1.724 5.085 -14.425 1.00 0.00 H new ATOM 0 HB2 LYS A 78 0.309 6.218 -12.723 1.00 0.00 H new ATOM 0 HB3 LYS A 78 1.741 6.786 -11.886 1.00 0.00 H new ATOM 0 HG2 LYS A 78 2.364 8.129 -13.936 1.00 0.00 H new ATOM 0 HG3 LYS A 78 0.875 7.609 -14.700 1.00 0.00 H new ATOM 0 HD2 LYS A 78 0.550 9.844 -13.771 1.00 0.00 H new ATOM 0 HD3 LYS A 78 -0.447 8.708 -12.884 1.00 0.00 H new ATOM 0 HE2 LYS A 78 0.642 10.290 -11.337 1.00 0.00 H new ATOM 0 HE3 LYS A 78 1.195 8.655 -11.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 78 3.280 9.239 -11.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 78 2.874 9.970 -12.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 78 2.765 10.857 -11.490 1.00 0.00 H new ATOM 1263 N LEU A 79 4.152 5.568 -14.881 1.00 0.00 N ATOM 1264 CA LEU A 79 5.506 6.012 -15.231 1.00 0.00 C ATOM 1265 C LEU A 79 5.506 7.548 -15.345 1.00 0.00 C ATOM 1266 O LEU A 79 4.714 8.120 -16.104 1.00 0.00 O ATOM 1267 CB LEU A 79 5.975 5.353 -16.550 1.00 0.00 C ATOM 1268 CG LEU A 79 7.455 5.649 -16.959 1.00 0.00 C ATOM 1269 CD1 LEU A 79 8.450 5.177 -15.878 1.00 0.00 C ATOM 1270 CD2 LEU A 79 7.786 5.020 -18.315 1.00 0.00 C ATOM 0 H LEU A 79 3.667 5.082 -15.635 1.00 0.00 H new ATOM 0 HA LEU A 79 6.207 5.708 -14.453 1.00 0.00 H new ATOM 0 HB2 LEU A 79 5.849 4.274 -16.462 1.00 0.00 H new ATOM 0 HB3 LEU A 79 5.320 5.685 -17.355 1.00 0.00 H new ATOM 0 HG LEU A 79 7.557 6.730 -17.050 1.00 0.00 H new ATOM 0 HD11 LEU A 79 9.468 5.400 -16.198 1.00 0.00 H new ATOM 0 HD12 LEU A 79 8.243 5.695 -14.942 1.00 0.00 H new ATOM 0 HD13 LEU A 79 8.343 4.102 -15.730 1.00 0.00 H new ATOM 0 HD21 LEU A 79 8.821 5.241 -18.576 1.00 0.00 H new ATOM 0 HD22 LEU A 79 7.649 3.940 -18.258 1.00 0.00 H new ATOM 0 HD23 LEU A 79 7.124 5.430 -19.078 1.00 0.00 H new ATOM 1282 N ASP A 80 6.397 8.195 -14.585 1.00 0.00 N ATOM 1283 CA ASP A 80 6.353 9.642 -14.332 1.00 0.00 C ATOM 1284 C ASP A 80 7.710 10.281 -14.653 1.00 0.00 C ATOM 1285 O ASP A 80 8.758 9.631 -14.549 1.00 0.00 O ATOM 1286 CB ASP A 80 5.965 9.891 -12.850 1.00 0.00 C ATOM 1287 CG ASP A 80 5.809 11.381 -12.494 1.00 0.00 C ATOM 1288 OD1 ASP A 80 4.715 11.942 -12.722 1.00 0.00 O ATOM 1289 OD2 ASP A 80 6.776 11.995 -12.005 1.00 0.00 O ATOM 0 H ASP A 80 7.176 7.726 -14.124 1.00 0.00 H new ATOM 0 HA ASP A 80 5.604 10.101 -14.978 1.00 0.00 H new ATOM 0 HB2 ASP A 80 5.028 9.376 -12.637 1.00 0.00 H new ATOM 0 HB3 ASP A 80 6.725 9.450 -12.205 1.00 0.00 H new ATOM 1294 N THR A 81 7.660 11.555 -15.052 1.00 0.00 N ATOM 1295 CA THR A 81 8.844 12.387 -15.312 1.00 0.00 C ATOM 1296 C THR A 81 8.642 13.811 -14.742 1.00 0.00 C ATOM 1297 O THR A 81 9.543 14.655 -14.830 1.00 0.00 O ATOM 1298 CB THR A 81 9.169 12.418 -16.845 1.00 0.00 C ATOM 1299 OG1 THR A 81 10.271 13.296 -17.136 1.00 0.00 O ATOM 1300 CG2 THR A 81 7.952 12.809 -17.703 1.00 0.00 C ATOM 0 H THR A 81 6.781 12.048 -15.207 1.00 0.00 H new ATOM 0 HA THR A 81 9.701 11.947 -14.803 1.00 0.00 H new ATOM 0 HB THR A 81 9.449 11.398 -17.109 1.00 0.00 H new ATOM 0 HG1 THR A 81 10.347 13.971 -16.429 1.00 0.00 H new ATOM 0 HG21 THR A 81 8.235 12.814 -18.755 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.150 12.088 -17.547 1.00 0.00 H new ATOM 0 HG23 THR A 81 7.608 13.802 -17.415 1.00 0.00 H new ATOM 1308 N SER A 82 7.472 14.048 -14.110 1.00 0.00 N ATOM 1309 CA SER A 82 7.139 15.343 -13.475 1.00 0.00 C ATOM 1310 C SER A 82 7.938 15.540 -12.159 1.00 0.00 C ATOM 1311 O SER A 82 8.050 16.659 -11.653 1.00 0.00 O ATOM 1312 CB SER A 82 5.617 15.434 -13.211 1.00 0.00 C ATOM 1313 OG SER A 82 5.229 16.717 -12.727 1.00 0.00 O ATOM 0 H SER A 82 6.733 13.350 -14.025 1.00 0.00 H new ATOM 0 HA SER A 82 7.422 16.143 -14.159 1.00 0.00 H new ATOM 0 HB2 SER A 82 5.077 15.217 -14.132 1.00 0.00 H new ATOM 0 HB3 SER A 82 5.330 14.672 -12.486 1.00 0.00 H new ATOM 0 HG SER A 82 4.261 16.730 -12.575 1.00 0.00 H new ATOM 1319 N HIS A 83 8.472 14.429 -11.615 1.00 0.00 N ATOM 1320 CA HIS A 83 9.372 14.427 -10.442 1.00 0.00 C ATOM 1321 C HIS A 83 10.850 14.570 -10.866 1.00 0.00 C ATOM 1322 O HIS A 83 11.751 14.428 -10.030 1.00 0.00 O ATOM 1323 CB HIS A 83 9.143 13.125 -9.614 1.00 0.00 C ATOM 1324 CG HIS A 83 7.850 13.125 -8.838 1.00 0.00 C ATOM 1325 ND1 HIS A 83 6.762 12.331 -9.145 1.00 0.00 N ATOM 1326 CD2 HIS A 83 7.489 13.833 -7.747 1.00 0.00 C ATOM 1327 CE1 HIS A 83 5.795 12.559 -8.278 1.00 0.00 C ATOM 1328 NE2 HIS A 83 6.209 13.469 -7.427 1.00 0.00 N ATOM 0 H HIS A 83 8.289 13.495 -11.982 1.00 0.00 H new ATOM 0 HA HIS A 83 9.138 15.289 -9.817 1.00 0.00 H new ATOM 0 HB2 HIS A 83 9.153 12.269 -10.288 1.00 0.00 H new ATOM 0 HB3 HIS A 83 9.974 12.994 -8.921 1.00 0.00 H new ATOM 0 HD1 HIS A 83 6.714 11.671 -9.921 1.00 0.00 H new ATOM 0 HD2 HIS A 83 8.098 14.554 -7.223 1.00 0.00 H new ATOM 0 HE1 HIS A 83 4.828 12.079 -8.269 1.00 0.00 H new ATOM 1337 N GLY A 84 11.086 14.839 -12.170 1.00 0.00 N ATOM 1338 CA GLY A 84 12.435 15.092 -12.696 1.00 0.00 C ATOM 1339 C GLY A 84 13.284 13.838 -12.867 1.00 0.00 C ATOM 1340 O GLY A 84 14.459 13.933 -13.235 1.00 0.00 O ATOM 0 H GLY A 84 10.351 14.885 -12.876 1.00 0.00 H new ATOM 0 HA2 GLY A 84 12.349 15.593 -13.660 1.00 0.00 H new ATOM 0 HA3 GLY A 84 12.952 15.778 -12.025 1.00 0.00 H new ATOM 1344 N MET A 85 12.686 12.661 -12.602 1.00 0.00 N ATOM 1345 CA MET A 85 13.348 11.350 -12.734 1.00 0.00 C ATOM 1346 C MET A 85 12.346 10.338 -13.305 1.00 0.00 C ATOM 1347 O MET A 85 11.167 10.349 -12.922 1.00 0.00 O ATOM 1348 CB MET A 85 13.898 10.846 -11.362 1.00 0.00 C ATOM 1349 CG MET A 85 15.140 11.598 -10.852 1.00 0.00 C ATOM 1350 SD MET A 85 16.529 11.468 -12.007 1.00 0.00 S ATOM 1351 CE MET A 85 17.802 12.438 -11.199 1.00 0.00 C ATOM 0 H MET A 85 11.718 12.593 -12.287 1.00 0.00 H new ATOM 0 HA MET A 85 14.197 11.456 -13.409 1.00 0.00 H new ATOM 0 HB2 MET A 85 13.108 10.930 -10.616 1.00 0.00 H new ATOM 0 HB3 MET A 85 14.142 9.787 -11.450 1.00 0.00 H new ATOM 0 HG2 MET A 85 14.891 12.648 -10.700 1.00 0.00 H new ATOM 0 HG3 MET A 85 15.435 11.196 -9.883 1.00 0.00 H new ATOM 0 HE1 MET A 85 18.705 12.435 -11.810 1.00 0.00 H new ATOM 0 HE2 MET A 85 17.453 13.463 -11.072 1.00 0.00 H new ATOM 0 HE3 MET A 85 18.023 12.007 -10.223 1.00 0.00 H new ATOM 1361 N ILE A 86 12.822 9.466 -14.214 1.00 0.00 N ATOM 1362 CA ILE A 86 11.990 8.418 -14.831 1.00 0.00 C ATOM 1363 C ILE A 86 11.820 7.259 -13.833 1.00 0.00 C ATOM 1364 O ILE A 86 12.776 6.519 -13.556 1.00 0.00 O ATOM 1365 CB ILE A 86 12.629 7.894 -16.176 1.00 0.00 C ATOM 1366 CG1 ILE A 86 12.883 9.077 -17.163 1.00 0.00 C ATOM 1367 CG2 ILE A 86 11.765 6.789 -16.845 1.00 0.00 C ATOM 1368 CD1 ILE A 86 11.656 9.875 -17.564 1.00 0.00 C ATOM 0 H ILE A 86 13.789 9.469 -14.539 1.00 0.00 H new ATOM 0 HA ILE A 86 11.016 8.842 -15.075 1.00 0.00 H new ATOM 0 HB ILE A 86 13.587 7.440 -15.923 1.00 0.00 H new ATOM 0 HG12 ILE A 86 13.603 9.757 -16.708 1.00 0.00 H new ATOM 0 HG13 ILE A 86 13.346 8.679 -18.066 1.00 0.00 H new ATOM 0 HG21 ILE A 86 12.245 6.460 -17.767 1.00 0.00 H new ATOM 0 HG22 ILE A 86 11.666 5.943 -16.165 1.00 0.00 H new ATOM 0 HG23 ILE A 86 10.777 7.188 -17.073 1.00 0.00 H new ATOM 0 HD11 ILE A 86 11.947 10.670 -18.250 1.00 0.00 H new ATOM 0 HD12 ILE A 86 10.938 9.217 -18.054 1.00 0.00 H new ATOM 0 HD13 ILE A 86 11.200 10.312 -16.676 1.00 0.00 H new ATOM 1380 N ARG A 87 10.600 7.115 -13.311 1.00 0.00 N ATOM 1381 CA ARG A 87 10.275 6.145 -12.256 1.00 0.00 C ATOM 1382 C ARG A 87 8.765 5.910 -12.239 1.00 0.00 C ATOM 1383 O ARG A 87 7.994 6.746 -12.717 1.00 0.00 O ATOM 1384 CB ARG A 87 10.763 6.648 -10.863 1.00 0.00 C ATOM 1385 CG ARG A 87 10.063 7.932 -10.365 1.00 0.00 C ATOM 1386 CD ARG A 87 10.574 8.409 -8.996 1.00 0.00 C ATOM 1387 NE ARG A 87 9.647 9.379 -8.385 1.00 0.00 N ATOM 1388 CZ ARG A 87 9.894 10.133 -7.312 1.00 0.00 C ATOM 1389 NH1 ARG A 87 11.096 10.169 -6.753 1.00 0.00 N ATOM 1390 NH2 ARG A 87 8.909 10.854 -6.794 1.00 0.00 N ATOM 0 H ARG A 87 9.800 7.673 -13.610 1.00 0.00 H new ATOM 0 HA ARG A 87 10.789 5.207 -12.467 1.00 0.00 H new ATOM 0 HB2 ARG A 87 10.607 5.857 -10.130 1.00 0.00 H new ATOM 0 HB3 ARG A 87 11.837 6.830 -10.912 1.00 0.00 H new ATOM 0 HG2 ARG A 87 10.211 8.726 -11.097 1.00 0.00 H new ATOM 0 HG3 ARG A 87 8.990 7.752 -10.302 1.00 0.00 H new ATOM 0 HD2 ARG A 87 10.696 7.553 -8.333 1.00 0.00 H new ATOM 0 HD3 ARG A 87 11.557 8.866 -9.112 1.00 0.00 H new ATOM 0 HE ARG A 87 8.732 9.483 -8.823 1.00 0.00 H new ATOM 0 HH11 ARG A 87 11.857 9.612 -7.143 1.00 0.00 H new ATOM 0 HH12 ARG A 87 11.260 10.753 -5.933 1.00 0.00 H new ATOM 0 HH21 ARG A 87 7.981 10.827 -7.216 1.00 0.00 H new ATOM 0 HH22 ARG A 87 9.080 11.436 -5.974 1.00 0.00 H new ATOM 1404 N THR A 88 8.349 4.778 -11.673 1.00 0.00 N ATOM 1405 CA THR A 88 6.952 4.365 -11.654 1.00 0.00 C ATOM 1406 C THR A 88 6.363 4.643 -10.265 1.00 0.00 C ATOM 1407 O THR A 88 6.908 4.232 -9.262 1.00 0.00 O ATOM 1408 CB THR A 88 6.822 2.856 -12.060 1.00 0.00 C ATOM 1409 OG1 THR A 88 7.924 2.099 -11.515 1.00 0.00 O ATOM 1410 CG2 THR A 88 6.775 2.661 -13.588 1.00 0.00 C ATOM 0 H THR A 88 8.978 4.120 -11.213 1.00 0.00 H new ATOM 0 HA THR A 88 6.384 4.940 -12.385 1.00 0.00 H new ATOM 0 HB THR A 88 5.879 2.496 -11.649 1.00 0.00 H new ATOM 0 HG1 THR A 88 8.211 2.502 -10.669 1.00 0.00 H new ATOM 0 HG21 THR A 88 6.685 1.599 -13.817 1.00 0.00 H new ATOM 0 HG22 THR A 88 5.917 3.194 -13.997 1.00 0.00 H new ATOM 0 HG23 THR A 88 7.690 3.051 -14.033 1.00 0.00 H new ATOM 1418 N GLU A 89 5.273 5.393 -10.241 1.00 0.00 N ATOM 1419 CA GLU A 89 4.565 5.817 -9.035 1.00 0.00 C ATOM 1420 C GLU A 89 3.303 4.979 -8.919 1.00 0.00 C ATOM 1421 O GLU A 89 2.531 4.922 -9.889 1.00 0.00 O ATOM 1422 CB GLU A 89 4.185 7.323 -9.182 1.00 0.00 C ATOM 1423 CG GLU A 89 5.329 8.243 -9.669 1.00 0.00 C ATOM 1424 CD GLU A 89 6.453 8.437 -8.641 1.00 0.00 C ATOM 1425 OE1 GLU A 89 7.253 7.507 -8.414 1.00 0.00 O ATOM 1426 OE2 GLU A 89 6.553 9.532 -8.050 1.00 0.00 O ATOM 0 H GLU A 89 4.836 5.740 -11.095 1.00 0.00 H new ATOM 0 HA GLU A 89 5.185 5.687 -8.148 1.00 0.00 H new ATOM 0 HB2 GLU A 89 3.351 7.405 -9.880 1.00 0.00 H new ATOM 0 HB3 GLU A 89 3.831 7.688 -8.218 1.00 0.00 H new ATOM 0 HG2 GLU A 89 5.753 7.826 -10.582 1.00 0.00 H new ATOM 0 HG3 GLU A 89 4.914 9.217 -9.927 1.00 0.00 H new ATOM 1433 N VAL A 90 3.056 4.338 -7.771 1.00 0.00 N ATOM 1434 CA VAL A 90 1.797 3.606 -7.587 1.00 0.00 C ATOM 1435 C VAL A 90 0.770 4.536 -6.943 1.00 0.00 C ATOM 1436 O VAL A 90 0.942 5.037 -5.826 1.00 0.00 O ATOM 1437 CB VAL A 90 1.947 2.235 -6.841 1.00 0.00 C ATOM 1438 CG1 VAL A 90 2.598 1.203 -7.790 1.00 0.00 C ATOM 1439 CG2 VAL A 90 2.736 2.363 -5.524 1.00 0.00 C ATOM 0 H VAL A 90 3.692 4.310 -6.974 1.00 0.00 H new ATOM 0 HA VAL A 90 1.438 3.309 -8.572 1.00 0.00 H new ATOM 0 HB VAL A 90 0.951 1.890 -6.562 1.00 0.00 H new ATOM 0 HG11 VAL A 90 2.703 0.249 -7.273 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.969 1.071 -8.671 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.581 1.560 -8.096 1.00 0.00 H new ATOM 0 HG21 VAL A 90 2.811 1.385 -5.048 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.736 2.741 -5.734 1.00 0.00 H new ATOM 0 HG23 VAL A 90 2.220 3.053 -4.856 1.00 0.00 H new ATOM 1449 N ARG A 91 -0.308 4.731 -7.698 1.00 0.00 N ATOM 1450 CA ARG A 91 -1.282 5.799 -7.522 1.00 0.00 C ATOM 1451 C ARG A 91 -2.583 5.201 -6.995 1.00 0.00 C ATOM 1452 O ARG A 91 -3.166 4.315 -7.636 1.00 0.00 O ATOM 1453 CB ARG A 91 -1.489 6.538 -8.887 1.00 0.00 C ATOM 1454 CG ARG A 91 -1.676 5.605 -10.108 1.00 0.00 C ATOM 1455 CD ARG A 91 -2.027 6.346 -11.409 1.00 0.00 C ATOM 1456 NE ARG A 91 -2.040 5.422 -12.564 1.00 0.00 N ATOM 1457 CZ ARG A 91 -2.509 5.703 -13.790 1.00 0.00 C ATOM 1458 NH1 ARG A 91 -2.955 6.916 -14.102 1.00 0.00 N ATOM 1459 NH2 ARG A 91 -2.501 4.751 -14.709 1.00 0.00 N ATOM 0 H ARG A 91 -0.534 4.121 -8.483 1.00 0.00 H new ATOM 0 HA ARG A 91 -0.928 6.531 -6.797 1.00 0.00 H new ATOM 0 HB2 ARG A 91 -2.362 7.185 -8.805 1.00 0.00 H new ATOM 0 HB3 ARG A 91 -0.630 7.183 -9.069 1.00 0.00 H new ATOM 0 HG2 ARG A 91 -0.759 5.035 -10.262 1.00 0.00 H new ATOM 0 HG3 ARG A 91 -2.465 4.886 -9.886 1.00 0.00 H new ATOM 0 HD2 ARG A 91 -3.003 6.820 -11.308 1.00 0.00 H new ATOM 0 HD3 ARG A 91 -1.303 7.141 -11.584 1.00 0.00 H new ATOM 0 HE ARG A 91 -1.658 4.488 -12.416 1.00 0.00 H new ATOM 0 HH11 ARG A 91 -2.946 7.658 -13.403 1.00 0.00 H new ATOM 0 HH12 ARG A 91 -3.306 7.104 -15.041 1.00 0.00 H new ATOM 0 HH21 ARG A 91 -2.143 3.824 -14.480 1.00 0.00 H new ATOM 0 HH22 ARG A 91 -2.853 4.944 -15.647 1.00 0.00 H new ATOM 1473 N SER A 92 -3.010 5.648 -5.800 1.00 0.00 N ATOM 1474 CA SER A 92 -4.248 5.173 -5.186 1.00 0.00 C ATOM 1475 C SER A 92 -5.450 5.683 -5.984 1.00 0.00 C ATOM 1476 O SER A 92 -5.445 6.832 -6.448 1.00 0.00 O ATOM 1477 CB SER A 92 -4.319 5.675 -3.731 1.00 0.00 C ATOM 1478 OG SER A 92 -5.447 5.170 -3.046 1.00 0.00 O ATOM 0 H SER A 92 -2.508 6.340 -5.244 1.00 0.00 H new ATOM 0 HA SER A 92 -4.265 4.083 -5.189 1.00 0.00 H new ATOM 0 HB2 SER A 92 -3.413 5.380 -3.202 1.00 0.00 H new ATOM 0 HB3 SER A 92 -4.351 6.765 -3.726 1.00 0.00 H new ATOM 0 HG SER A 92 -5.922 5.908 -2.609 1.00 0.00 H new ATOM 1484 N ARG A 93 -6.471 4.820 -6.117 1.00 0.00 N ATOM 1485 CA ARG A 93 -7.738 5.170 -6.783 1.00 0.00 C ATOM 1486 C ARG A 93 -8.399 6.412 -6.154 1.00 0.00 C ATOM 1487 O ARG A 93 -9.100 7.161 -6.852 1.00 0.00 O ATOM 1488 CB ARG A 93 -8.726 3.973 -6.765 1.00 0.00 C ATOM 1489 CG ARG A 93 -8.981 3.339 -5.367 1.00 0.00 C ATOM 1490 CD ARG A 93 -10.206 2.397 -5.351 1.00 0.00 C ATOM 1491 NE ARG A 93 -10.176 1.401 -6.441 1.00 0.00 N ATOM 1492 CZ ARG A 93 -11.185 0.580 -6.771 1.00 0.00 C ATOM 1493 NH1 ARG A 93 -12.298 0.528 -6.046 1.00 0.00 N ATOM 1494 NH2 ARG A 93 -11.068 -0.199 -7.836 1.00 0.00 N ATOM 0 H ARG A 93 -6.442 3.862 -5.767 1.00 0.00 H new ATOM 0 HA ARG A 93 -7.494 5.411 -7.818 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -9.680 4.305 -7.174 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.345 3.199 -7.432 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -8.096 2.782 -5.059 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -9.129 4.133 -4.635 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.248 1.879 -4.393 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -11.116 2.991 -5.432 1.00 0.00 H new ATOM 0 HE ARG A 93 -9.318 1.331 -6.988 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -12.397 1.119 -5.221 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -13.053 -0.103 -6.315 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -10.217 -0.171 -8.397 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.829 -0.826 -8.095 1.00 0.00 H new ATOM 1508 N THR A 94 -8.201 6.588 -4.832 1.00 0.00 N ATOM 1509 CA THR A 94 -8.764 7.720 -4.085 1.00 0.00 C ATOM 1510 C THR A 94 -8.398 9.111 -4.677 1.00 0.00 C ATOM 1511 O THR A 94 -9.268 9.738 -5.298 1.00 0.00 O ATOM 1512 CB THR A 94 -8.300 7.627 -2.596 1.00 0.00 C ATOM 1513 OG1 THR A 94 -8.654 6.339 -2.057 1.00 0.00 O ATOM 1514 CG2 THR A 94 -8.899 8.738 -1.717 1.00 0.00 C ATOM 0 H THR A 94 -7.649 5.950 -4.259 1.00 0.00 H new ATOM 0 HA THR A 94 -9.849 7.644 -4.160 1.00 0.00 H new ATOM 0 HB THR A 94 -7.218 7.757 -2.587 1.00 0.00 H new ATOM 0 HG1 THR A 94 -8.817 6.421 -1.094 1.00 0.00 H new ATOM 0 HG21 THR A 94 -8.543 8.624 -0.693 1.00 0.00 H new ATOM 0 HG22 THR A 94 -8.593 9.711 -2.102 1.00 0.00 H new ATOM 0 HG23 THR A 94 -9.987 8.668 -1.732 1.00 0.00 H new ATOM 1522 N ALA A 95 -7.137 9.613 -4.512 1.00 0.00 N ATOM 1523 CA ALA A 95 -6.753 10.891 -5.181 1.00 0.00 C ATOM 1524 C ALA A 95 -5.448 10.849 -6.010 1.00 0.00 C ATOM 1525 O ALA A 95 -5.504 10.835 -7.248 1.00 0.00 O ATOM 1526 CB ALA A 95 -6.674 12.005 -4.117 1.00 0.00 C ATOM 0 H ALA A 95 -6.404 9.178 -3.951 1.00 0.00 H new ATOM 0 HA ALA A 95 -7.533 11.088 -5.917 1.00 0.00 H new ATOM 0 HB1 ALA A 95 -6.394 12.944 -4.594 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -7.645 12.118 -3.636 1.00 0.00 H new ATOM 0 HB3 ALA A 95 -5.927 11.741 -3.369 1.00 0.00 H new ATOM 1532 N ASP A 96 -4.269 10.786 -5.332 1.00 0.00 N ATOM 1533 CA ASP A 96 -2.974 11.015 -6.027 1.00 0.00 C ATOM 1534 C ASP A 96 -2.090 9.766 -6.116 1.00 0.00 C ATOM 1535 O ASP A 96 -2.015 9.115 -7.153 1.00 0.00 O ATOM 1536 CB ASP A 96 -2.196 12.176 -5.339 1.00 0.00 C ATOM 1537 CG ASP A 96 -2.941 13.519 -5.400 1.00 0.00 C ATOM 1538 OD1 ASP A 96 -3.050 14.099 -6.505 1.00 0.00 O ATOM 1539 OD2 ASP A 96 -3.419 14.006 -4.356 1.00 0.00 O ATOM 0 H ASP A 96 -4.189 10.585 -4.335 1.00 0.00 H new ATOM 0 HA ASP A 96 -3.222 11.285 -7.054 1.00 0.00 H new ATOM 0 HB2 ASP A 96 -2.013 11.916 -4.296 1.00 0.00 H new ATOM 0 HB3 ASP A 96 -1.222 12.285 -5.816 1.00 0.00 H new ATOM 1544 N SER A 97 -1.463 9.422 -4.980 1.00 0.00 N ATOM 1545 CA SER A 97 -0.369 8.432 -4.940 1.00 0.00 C ATOM 1546 C SER A 97 -0.336 7.673 -3.616 1.00 0.00 C ATOM 1547 O SER A 97 0.632 6.958 -3.378 1.00 0.00 O ATOM 1548 CB SER A 97 0.978 9.150 -5.208 1.00 0.00 C ATOM 1549 OG SER A 97 1.179 10.212 -4.282 1.00 0.00 O ATOM 0 H SER A 97 -1.696 9.817 -4.069 1.00 0.00 H new ATOM 0 HA SER A 97 -0.543 7.689 -5.718 1.00 0.00 H new ATOM 0 HB2 SER A 97 1.797 8.435 -5.132 1.00 0.00 H new ATOM 0 HB3 SER A 97 0.990 9.542 -6.225 1.00 0.00 H new ATOM 0 HG SER A 97 2.036 10.650 -4.468 1.00 0.00 H new ATOM 1555 N HIS A 98 -1.432 7.800 -2.818 1.00 0.00 N ATOM 1556 CA HIS A 98 -1.479 7.452 -1.353 1.00 0.00 C ATOM 1557 C HIS A 98 -0.714 6.154 -0.973 1.00 0.00 C ATOM 1558 O HIS A 98 -0.174 6.059 0.135 1.00 0.00 O ATOM 1559 CB HIS A 98 -2.949 7.357 -0.854 1.00 0.00 C ATOM 1560 CG HIS A 98 -3.644 8.670 -0.619 1.00 0.00 C ATOM 1561 ND1 HIS A 98 -3.464 9.410 0.530 1.00 0.00 N ATOM 1562 CD2 HIS A 98 -4.564 9.345 -1.353 1.00 0.00 C ATOM 1563 CE1 HIS A 98 -4.235 10.474 0.500 1.00 0.00 C ATOM 1564 NE2 HIS A 98 -4.915 10.464 -0.630 1.00 0.00 N ATOM 0 H HIS A 98 -2.323 8.150 -3.170 1.00 0.00 H new ATOM 0 HA HIS A 98 -0.961 8.270 -0.853 1.00 0.00 H new ATOM 0 HB2 HIS A 98 -3.525 6.788 -1.583 1.00 0.00 H new ATOM 0 HB3 HIS A 98 -2.962 6.789 0.076 1.00 0.00 H new ATOM 0 HD2 HIS A 98 -4.948 9.059 -2.321 1.00 0.00 H new ATOM 0 HE1 HIS A 98 -4.301 11.228 1.270 1.00 0.00 H new ATOM 0 HE2 HIS A 98 -5.591 11.170 -0.921 1.00 0.00 H new ATOM 1573 N LEU A 99 -0.681 5.188 -1.915 1.00 0.00 N ATOM 1574 CA LEU A 99 0.133 3.956 -1.816 1.00 0.00 C ATOM 1575 C LEU A 99 1.639 4.282 -1.567 1.00 0.00 C ATOM 1576 O LEU A 99 2.129 4.171 -0.441 1.00 0.00 O ATOM 1577 CB LEU A 99 -0.009 3.119 -3.132 1.00 0.00 C ATOM 1578 CG LEU A 99 -1.429 3.039 -3.774 1.00 0.00 C ATOM 1579 CD1 LEU A 99 -1.432 2.251 -5.099 1.00 0.00 C ATOM 1580 CD2 LEU A 99 -2.450 2.468 -2.800 1.00 0.00 C ATOM 0 H LEU A 99 -1.225 5.241 -2.776 1.00 0.00 H new ATOM 0 HA LEU A 99 -0.235 3.380 -0.967 1.00 0.00 H new ATOM 0 HB2 LEU A 99 0.674 3.535 -3.873 1.00 0.00 H new ATOM 0 HB3 LEU A 99 0.326 2.103 -2.924 1.00 0.00 H new ATOM 0 HG LEU A 99 -1.720 4.063 -4.009 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -2.443 2.225 -5.504 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -0.767 2.737 -5.813 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -1.087 1.233 -4.918 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -3.428 2.427 -3.280 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -2.148 1.463 -2.504 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -2.506 3.105 -1.917 1.00 0.00 H new ATOM 1592 N GLY A 100 2.344 4.747 -2.624 1.00 0.00 N ATOM 1593 CA GLY A 100 3.797 4.937 -2.564 1.00 0.00 C ATOM 1594 C GLY A 100 4.439 5.067 -3.941 1.00 0.00 C ATOM 1595 O GLY A 100 3.772 5.417 -4.921 1.00 0.00 O ATOM 0 H GLY A 100 1.925 4.994 -3.521 1.00 0.00 H new ATOM 0 HA2 GLY A 100 4.017 5.831 -1.981 1.00 0.00 H new ATOM 0 HA3 GLY A 100 4.246 4.095 -2.038 1.00 0.00 H new ATOM 1599 N HIS A 101 5.756 4.824 -3.990 1.00 0.00 N ATOM 1600 CA HIS A 101 6.579 4.853 -5.220 1.00 0.00 C ATOM 1601 C HIS A 101 7.142 3.449 -5.447 1.00 0.00 C ATOM 1602 O HIS A 101 7.343 2.710 -4.480 1.00 0.00 O ATOM 1603 CB HIS A 101 7.757 5.858 -5.053 1.00 0.00 C ATOM 1604 CG HIS A 101 7.340 7.239 -4.627 1.00 0.00 C ATOM 1605 ND1 HIS A 101 7.336 8.315 -5.475 1.00 0.00 N ATOM 1606 CD2 HIS A 101 6.939 7.720 -3.422 1.00 0.00 C ATOM 1607 CE1 HIS A 101 6.945 9.383 -4.822 1.00 0.00 C ATOM 1608 NE2 HIS A 101 6.700 9.056 -3.577 1.00 0.00 N ATOM 0 H HIS A 101 6.298 4.595 -3.157 1.00 0.00 H new ATOM 0 HA HIS A 101 5.969 5.166 -6.067 1.00 0.00 H new ATOM 0 HB2 HIS A 101 8.457 5.460 -4.318 1.00 0.00 H new ATOM 0 HB3 HIS A 101 8.294 5.929 -5.999 1.00 0.00 H new ATOM 0 HD2 HIS A 101 6.829 7.152 -2.510 1.00 0.00 H new ATOM 0 HE1 HIS A 101 6.842 10.372 -5.243 1.00 0.00 H new ATOM 0 HE2 HIS A 101 6.384 9.693 -2.846 1.00 0.00 H new ATOM 1617 N VAL A 102 7.414 3.067 -6.712 1.00 0.00 N ATOM 1618 CA VAL A 102 7.967 1.728 -7.034 1.00 0.00 C ATOM 1619 C VAL A 102 9.127 1.862 -8.022 1.00 0.00 C ATOM 1620 O VAL A 102 9.149 2.764 -8.864 1.00 0.00 O ATOM 1621 CB VAL A 102 6.885 0.707 -7.580 1.00 0.00 C ATOM 1622 CG1 VAL A 102 5.697 0.584 -6.619 1.00 0.00 C ATOM 1623 CG2 VAL A 102 6.384 1.062 -8.983 1.00 0.00 C ATOM 0 H VAL A 102 7.262 3.662 -7.527 1.00 0.00 H new ATOM 0 HA VAL A 102 8.328 1.308 -6.095 1.00 0.00 H new ATOM 0 HB VAL A 102 7.392 -0.256 -7.647 1.00 0.00 H new ATOM 0 HG11 VAL A 102 4.974 -0.124 -7.024 1.00 0.00 H new ATOM 0 HG12 VAL A 102 6.048 0.230 -5.650 1.00 0.00 H new ATOM 0 HG13 VAL A 102 5.223 1.558 -6.499 1.00 0.00 H new ATOM 0 HG21 VAL A 102 5.645 0.327 -9.302 1.00 0.00 H new ATOM 0 HG22 VAL A 102 5.927 2.052 -8.967 1.00 0.00 H new ATOM 0 HG23 VAL A 102 7.222 1.061 -9.680 1.00 0.00 H new ATOM 1633 N PHE A 103 10.127 0.985 -7.884 1.00 0.00 N ATOM 1634 CA PHE A 103 11.323 1.007 -8.737 1.00 0.00 C ATOM 1635 C PHE A 103 11.556 -0.373 -9.357 1.00 0.00 C ATOM 1636 O PHE A 103 11.488 -1.390 -8.671 1.00 0.00 O ATOM 1637 CB PHE A 103 12.554 1.472 -7.907 1.00 0.00 C ATOM 1638 CG PHE A 103 12.325 2.819 -7.207 1.00 0.00 C ATOM 1639 CD1 PHE A 103 12.317 4.010 -7.932 1.00 0.00 C ATOM 1640 CD2 PHE A 103 12.076 2.884 -5.834 1.00 0.00 C ATOM 1641 CE1 PHE A 103 12.076 5.221 -7.309 1.00 0.00 C ATOM 1642 CE2 PHE A 103 11.841 4.097 -5.213 1.00 0.00 C ATOM 1643 CZ PHE A 103 11.837 5.265 -5.950 1.00 0.00 C ATOM 0 H PHE A 103 10.132 0.244 -7.183 1.00 0.00 H new ATOM 0 HA PHE A 103 11.174 1.716 -9.551 1.00 0.00 H new ATOM 0 HB2 PHE A 103 12.789 0.715 -7.159 1.00 0.00 H new ATOM 0 HB3 PHE A 103 13.420 1.552 -8.564 1.00 0.00 H new ATOM 0 HD1 PHE A 103 12.502 3.986 -8.996 1.00 0.00 H new ATOM 0 HD2 PHE A 103 12.067 1.975 -5.250 1.00 0.00 H new ATOM 0 HE1 PHE A 103 12.075 6.134 -7.887 1.00 0.00 H new ATOM 0 HE2 PHE A 103 11.660 4.131 -4.149 1.00 0.00 H new ATOM 0 HZ PHE A 103 11.647 6.211 -5.464 1.00 0.00 H new ATOM 1653 N ASN A 104 11.854 -0.385 -10.665 1.00 0.00 N ATOM 1654 CA ASN A 104 12.140 -1.613 -11.439 1.00 0.00 C ATOM 1655 C ASN A 104 13.636 -2.003 -11.360 1.00 0.00 C ATOM 1656 O ASN A 104 14.199 -2.594 -12.288 1.00 0.00 O ATOM 1657 CB ASN A 104 11.651 -1.449 -12.917 1.00 0.00 C ATOM 1658 CG ASN A 104 11.984 -0.102 -13.569 1.00 0.00 C ATOM 1659 OD1 ASN A 104 13.043 0.487 -13.333 1.00 0.00 O ATOM 1660 ND2 ASN A 104 11.056 0.410 -14.371 1.00 0.00 N ATOM 0 H ASN A 104 11.905 0.465 -11.226 1.00 0.00 H new ATOM 0 HA ASN A 104 11.584 -2.437 -10.992 1.00 0.00 H new ATOM 0 HB2 ASN A 104 12.091 -2.244 -13.519 1.00 0.00 H new ATOM 0 HB3 ASN A 104 10.570 -1.590 -12.943 1.00 0.00 H new ATOM 0 HD21 ASN A 104 11.208 1.317 -14.813 1.00 0.00 H new ATOM 0 HD22 ASN A 104 10.192 -0.104 -14.544 1.00 0.00 H new ATOM 1667 N ASP A 105 14.251 -1.688 -10.207 1.00 0.00 N ATOM 1668 CA ASP A 105 15.606 -2.136 -9.834 1.00 0.00 C ATOM 1669 C ASP A 105 15.498 -3.354 -8.885 1.00 0.00 C ATOM 1670 O ASP A 105 16.488 -3.771 -8.260 1.00 0.00 O ATOM 1671 CB ASP A 105 16.374 -0.969 -9.160 1.00 0.00 C ATOM 1672 CG ASP A 105 16.454 0.288 -10.052 1.00 0.00 C ATOM 1673 OD1 ASP A 105 17.296 0.319 -10.975 1.00 0.00 O ATOM 1674 OD2 ASP A 105 15.663 1.240 -9.838 1.00 0.00 O ATOM 0 H ASP A 105 13.813 -1.104 -9.494 1.00 0.00 H new ATOM 0 HA ASP A 105 16.158 -2.437 -10.724 1.00 0.00 H new ATOM 0 HB2 ASP A 105 15.884 -0.712 -8.221 1.00 0.00 H new ATOM 0 HB3 ASP A 105 17.383 -1.299 -8.913 1.00 0.00 H new ATOM 1679 N GLY A 106 14.281 -3.932 -8.820 1.00 0.00 N ATOM 1680 CA GLY A 106 13.985 -5.092 -7.991 1.00 0.00 C ATOM 1681 C GLY A 106 13.430 -6.236 -8.843 1.00 0.00 C ATOM 1682 O GLY A 106 12.295 -6.122 -9.326 1.00 0.00 O ATOM 0 H GLY A 106 13.477 -3.595 -9.350 1.00 0.00 H new ATOM 0 HA2 GLY A 106 14.889 -5.419 -7.478 1.00 0.00 H new ATOM 0 HA3 GLY A 106 13.262 -4.821 -7.221 1.00 0.00 H new ATOM 1686 N PRO A 107 14.215 -7.341 -9.087 1.00 0.00 N ATOM 1687 CA PRO A 107 13.753 -8.500 -9.900 1.00 0.00 C ATOM 1688 C PRO A 107 12.604 -9.250 -9.192 1.00 0.00 C ATOM 1689 O PRO A 107 12.724 -9.600 -8.011 1.00 0.00 O ATOM 1690 CB PRO A 107 15.032 -9.379 -10.039 1.00 0.00 C ATOM 1691 CG PRO A 107 15.875 -9.012 -8.847 1.00 0.00 C ATOM 1692 CD PRO A 107 15.609 -7.539 -8.596 1.00 0.00 C ATOM 0 HA PRO A 107 13.344 -8.213 -10.868 1.00 0.00 H new ATOM 0 HB2 PRO A 107 14.786 -10.441 -10.039 1.00 0.00 H new ATOM 0 HB3 PRO A 107 15.555 -9.173 -10.973 1.00 0.00 H new ATOM 0 HG2 PRO A 107 15.607 -9.612 -7.978 1.00 0.00 H new ATOM 0 HG3 PRO A 107 16.932 -9.191 -9.044 1.00 0.00 H new ATOM 0 HD2 PRO A 107 15.700 -7.291 -7.539 1.00 0.00 H new ATOM 0 HD3 PRO A 107 16.316 -6.907 -9.134 1.00 0.00 H new ATOM 1700 N GLY A 108 11.506 -9.509 -9.915 1.00 0.00 N ATOM 1701 CA GLY A 108 10.314 -10.081 -9.306 1.00 0.00 C ATOM 1702 C GLY A 108 9.229 -10.422 -10.308 1.00 0.00 C ATOM 1703 O GLY A 108 9.401 -10.170 -11.511 1.00 0.00 O ATOM 0 H GLY A 108 11.426 -9.330 -10.916 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.591 -10.983 -8.761 1.00 0.00 H new ATOM 0 HA3 GLY A 108 9.915 -9.377 -8.575 1.00 0.00 H new ATOM 1707 N PRO A 109 8.063 -10.975 -9.822 1.00 0.00 N ATOM 1708 CA PRO A 109 6.915 -11.387 -10.679 1.00 0.00 C ATOM 1709 C PRO A 109 6.266 -10.203 -11.419 1.00 0.00 C ATOM 1710 O PRO A 109 5.760 -10.356 -12.535 1.00 0.00 O ATOM 1711 CB PRO A 109 5.910 -12.037 -9.674 1.00 0.00 C ATOM 1712 CG PRO A 109 6.732 -12.343 -8.458 1.00 0.00 C ATOM 1713 CD PRO A 109 7.773 -11.247 -8.385 1.00 0.00 C ATOM 0 HA PRO A 109 7.232 -12.064 -11.472 1.00 0.00 H new ATOM 0 HB2 PRO A 109 5.091 -11.358 -9.438 1.00 0.00 H new ATOM 0 HB3 PRO A 109 5.464 -12.941 -10.089 1.00 0.00 H new ATOM 0 HG2 PRO A 109 6.114 -12.357 -7.560 1.00 0.00 H new ATOM 0 HG3 PRO A 109 7.200 -13.324 -8.538 1.00 0.00 H new ATOM 0 HD2 PRO A 109 7.394 -10.362 -7.874 1.00 0.00 H new ATOM 0 HD3 PRO A 109 8.664 -11.570 -7.846 1.00 0.00 H new ATOM 1721 N ASN A 110 6.290 -9.030 -10.768 1.00 0.00 N ATOM 1722 CA ASN A 110 5.694 -7.797 -11.303 1.00 0.00 C ATOM 1723 C ASN A 110 6.735 -7.025 -12.152 1.00 0.00 C ATOM 1724 O ASN A 110 6.377 -6.256 -13.045 1.00 0.00 O ATOM 1725 CB ASN A 110 5.186 -6.921 -10.119 1.00 0.00 C ATOM 1726 CG ASN A 110 4.201 -5.831 -10.551 1.00 0.00 C ATOM 1727 OD1 ASN A 110 4.712 -4.700 -10.988 1.00 0.00 O flip ATOM 1728 ND2 ASN A 110 2.986 -6.020 -10.507 1.00 0.00 N flip ATOM 0 H ASN A 110 6.725 -8.910 -9.853 1.00 0.00 H new ATOM 0 HA ASN A 110 4.852 -8.046 -11.949 1.00 0.00 H new ATOM 0 HB2 ASN A 110 4.706 -7.563 -9.381 1.00 0.00 H new ATOM 0 HB3 ASN A 110 6.040 -6.455 -9.628 1.00 0.00 H new ATOM 0 HD21 ASN A 110 2.620 -6.908 -10.163 1.00 0.00 H new ATOM 0 HD22 ASN A 110 2.345 -5.289 -10.814 1.00 0.00 H new ATOM 1735 N GLY A 111 8.033 -7.244 -11.842 1.00 0.00 N ATOM 1736 CA GLY A 111 9.147 -6.505 -12.461 1.00 0.00 C ATOM 1737 C GLY A 111 9.452 -5.189 -11.734 1.00 0.00 C ATOM 1738 O GLY A 111 10.449 -4.523 -12.022 1.00 0.00 O ATOM 0 H GLY A 111 8.333 -7.937 -11.157 1.00 0.00 H new ATOM 0 HA2 GLY A 111 10.039 -7.132 -12.462 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.905 -6.294 -13.503 1.00 0.00 H new ATOM 1742 N LEU A 112 8.584 -4.843 -10.769 1.00 0.00 N ATOM 1743 CA LEU A 112 8.669 -3.612 -9.962 1.00 0.00 C ATOM 1744 C LEU A 112 8.963 -4.008 -8.510 1.00 0.00 C ATOM 1745 O LEU A 112 8.864 -5.185 -8.162 1.00 0.00 O ATOM 1746 CB LEU A 112 7.339 -2.801 -10.078 1.00 0.00 C ATOM 1747 CG LEU A 112 7.035 -2.203 -11.500 1.00 0.00 C ATOM 1748 CD1 LEU A 112 5.646 -1.533 -11.564 1.00 0.00 C ATOM 1749 CD2 LEU A 112 8.141 -1.219 -11.928 1.00 0.00 C ATOM 0 H LEU A 112 7.784 -5.425 -10.522 1.00 0.00 H new ATOM 0 HA LEU A 112 9.471 -2.970 -10.326 1.00 0.00 H new ATOM 0 HB2 LEU A 112 6.512 -3.450 -9.791 1.00 0.00 H new ATOM 0 HB3 LEU A 112 7.368 -1.984 -9.357 1.00 0.00 H new ATOM 0 HG LEU A 112 7.022 -3.035 -12.204 1.00 0.00 H new ATOM 0 HD11 LEU A 112 5.480 -1.135 -12.565 1.00 0.00 H new ATOM 0 HD12 LEU A 112 4.876 -2.269 -11.334 1.00 0.00 H new ATOM 0 HD13 LEU A 112 5.600 -0.721 -10.838 1.00 0.00 H new ATOM 0 HD21 LEU A 112 7.909 -0.818 -12.915 1.00 0.00 H new ATOM 0 HD22 LEU A 112 8.199 -0.402 -11.209 1.00 0.00 H new ATOM 0 HD23 LEU A 112 9.098 -1.740 -11.964 1.00 0.00 H new ATOM 1761 N ARG A 113 9.304 -3.025 -7.678 1.00 0.00 N ATOM 1762 CA ARG A 113 9.548 -3.243 -6.243 1.00 0.00 C ATOM 1763 C ARG A 113 8.865 -2.117 -5.475 1.00 0.00 C ATOM 1764 O ARG A 113 9.320 -0.962 -5.541 1.00 0.00 O ATOM 1765 CB ARG A 113 11.071 -3.266 -5.943 1.00 0.00 C ATOM 1766 CG ARG A 113 11.440 -3.686 -4.496 1.00 0.00 C ATOM 1767 CD ARG A 113 12.943 -3.541 -4.208 1.00 0.00 C ATOM 1768 NE ARG A 113 13.358 -2.124 -4.153 1.00 0.00 N ATOM 1769 CZ ARG A 113 14.407 -1.585 -4.789 1.00 0.00 C ATOM 1770 NH1 ARG A 113 15.153 -2.304 -5.627 1.00 0.00 N ATOM 1771 NH2 ARG A 113 14.685 -0.309 -4.594 1.00 0.00 N ATOM 0 H ARG A 113 9.420 -2.056 -7.973 1.00 0.00 H new ATOM 0 HA ARG A 113 9.142 -4.207 -5.936 1.00 0.00 H new ATOM 0 HB2 ARG A 113 11.555 -3.950 -6.640 1.00 0.00 H new ATOM 0 HB3 ARG A 113 11.480 -2.274 -6.135 1.00 0.00 H new ATOM 0 HG2 ARG A 113 10.877 -3.076 -3.789 1.00 0.00 H new ATOM 0 HG3 ARG A 113 11.140 -4.721 -4.334 1.00 0.00 H new ATOM 0 HD2 ARG A 113 13.180 -4.026 -3.261 1.00 0.00 H new ATOM 0 HD3 ARG A 113 13.512 -4.057 -4.981 1.00 0.00 H new ATOM 0 HE ARG A 113 12.794 -1.498 -3.578 1.00 0.00 H new ATOM 0 HH11 ARG A 113 14.930 -3.285 -5.795 1.00 0.00 H new ATOM 0 HH12 ARG A 113 15.947 -1.873 -6.101 1.00 0.00 H new ATOM 0 HH21 ARG A 113 14.105 0.249 -3.968 1.00 0.00 H new ATOM 0 HH22 ARG A 113 15.480 0.118 -5.070 1.00 0.00 H new ATOM 1785 N TYR A 114 7.767 -2.443 -4.766 1.00 0.00 N ATOM 1786 CA TYR A 114 6.944 -1.430 -4.094 1.00 0.00 C ATOM 1787 C TYR A 114 7.631 -0.892 -2.839 1.00 0.00 C ATOM 1788 O TYR A 114 8.221 -1.650 -2.083 1.00 0.00 O ATOM 1789 CB TYR A 114 5.493 -1.939 -3.789 1.00 0.00 C ATOM 1790 CG TYR A 114 5.355 -3.108 -2.789 1.00 0.00 C ATOM 1791 CD1 TYR A 114 5.370 -2.888 -1.404 1.00 0.00 C ATOM 1792 CD2 TYR A 114 5.184 -4.423 -3.224 1.00 0.00 C ATOM 1793 CE1 TYR A 114 5.224 -3.922 -0.508 1.00 0.00 C ATOM 1794 CE2 TYR A 114 5.034 -5.461 -2.325 1.00 0.00 C ATOM 1795 CZ TYR A 114 5.058 -5.202 -0.971 1.00 0.00 C ATOM 1796 OH TYR A 114 4.928 -6.233 -0.074 1.00 0.00 O ATOM 0 H TYR A 114 7.433 -3.399 -4.646 1.00 0.00 H new ATOM 0 HA TYR A 114 6.838 -0.600 -4.793 1.00 0.00 H new ATOM 0 HB2 TYR A 114 4.912 -1.098 -3.410 1.00 0.00 H new ATOM 0 HB3 TYR A 114 5.036 -2.243 -4.731 1.00 0.00 H new ATOM 0 HD1 TYR A 114 5.499 -1.883 -1.032 1.00 0.00 H new ATOM 0 HD2 TYR A 114 5.169 -4.633 -4.283 1.00 0.00 H new ATOM 0 HE1 TYR A 114 5.240 -3.727 0.554 1.00 0.00 H new ATOM 0 HE2 TYR A 114 4.898 -6.471 -2.681 1.00 0.00 H new ATOM 0 HH TYR A 114 3.999 -6.543 -0.065 1.00 0.00 H new ATOM 1806 N CYS A 115 7.598 0.432 -2.679 1.00 0.00 N ATOM 1807 CA CYS A 115 7.945 1.098 -1.429 1.00 0.00 C ATOM 1808 C CYS A 115 6.696 1.875 -1.003 1.00 0.00 C ATOM 1809 O CYS A 115 6.441 2.991 -1.483 1.00 0.00 O ATOM 1810 CB CYS A 115 9.164 2.034 -1.637 1.00 0.00 C ATOM 1811 SG CYS A 115 10.587 1.208 -2.390 1.00 0.00 S ATOM 0 H CYS A 115 7.327 1.075 -3.422 1.00 0.00 H new ATOM 0 HA CYS A 115 8.235 0.388 -0.655 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.865 2.872 -2.267 1.00 0.00 H new ATOM 0 HB3 CYS A 115 9.462 2.449 -0.674 1.00 0.00 H new ATOM 0 HG CYS A 115 11.559 2.060 -2.530 1.00 0.00 H new ATOM 1817 N ILE A 116 5.892 1.243 -0.140 1.00 0.00 N ATOM 1818 CA ILE A 116 4.606 1.785 0.326 1.00 0.00 C ATOM 1819 C ILE A 116 4.814 2.310 1.746 1.00 0.00 C ATOM 1820 O ILE A 116 5.475 1.653 2.549 1.00 0.00 O ATOM 1821 CB ILE A 116 3.478 0.690 0.298 1.00 0.00 C ATOM 1822 CG1 ILE A 116 3.368 0.007 -1.101 1.00 0.00 C ATOM 1823 CG2 ILE A 116 2.107 1.270 0.734 1.00 0.00 C ATOM 1824 CD1 ILE A 116 3.030 0.929 -2.248 1.00 0.00 C ATOM 0 H ILE A 116 6.116 0.332 0.260 1.00 0.00 H new ATOM 0 HA ILE A 116 4.280 2.588 -0.336 1.00 0.00 H new ATOM 0 HB ILE A 116 3.764 -0.075 1.020 1.00 0.00 H new ATOM 0 HG12 ILE A 116 4.315 -0.486 -1.321 1.00 0.00 H new ATOM 0 HG13 ILE A 116 2.607 -0.772 -1.047 1.00 0.00 H new ATOM 0 HG21 ILE A 116 1.353 0.484 0.702 1.00 0.00 H new ATOM 0 HG22 ILE A 116 2.183 1.659 1.749 1.00 0.00 H new ATOM 0 HG23 ILE A 116 1.821 2.075 0.057 1.00 0.00 H new ATOM 0 HD11 ILE A 116 2.978 0.355 -3.173 1.00 0.00 H new ATOM 0 HD12 ILE A 116 2.067 1.404 -2.061 1.00 0.00 H new ATOM 0 HD13 ILE A 116 3.801 1.694 -2.339 1.00 0.00 H new ATOM 1836 N ASN A 117 4.248 3.481 2.057 1.00 0.00 N ATOM 1837 CA ASN A 117 4.584 4.220 3.277 1.00 0.00 C ATOM 1838 C ASN A 117 3.845 3.661 4.504 1.00 0.00 C ATOM 1839 O ASN A 117 2.716 3.183 4.382 1.00 0.00 O ATOM 1840 CB ASN A 117 4.302 5.719 3.063 1.00 0.00 C ATOM 1841 CG ASN A 117 2.819 6.085 3.006 1.00 0.00 C ATOM 1842 OD1 ASN A 117 2.200 5.930 1.847 1.00 0.00 O flip ATOM 1843 ND2 ASN A 117 2.228 6.478 4.012 1.00 0.00 N flip ATOM 0 H ASN A 117 3.548 3.940 1.474 1.00 0.00 H new ATOM 0 HA ASN A 117 5.647 4.095 3.483 1.00 0.00 H new ATOM 0 HB2 ASN A 117 4.771 6.282 3.870 1.00 0.00 H new ATOM 0 HB3 ASN A 117 4.777 6.036 2.135 1.00 0.00 H new ATOM 0 HD21 ASN A 117 2.734 6.587 4.891 1.00 0.00 H new ATOM 0 HD22 ASN A 117 1.232 6.694 3.967 1.00 0.00 H new ATOM 1850 N SER A 118 4.499 3.749 5.680 1.00 0.00 N ATOM 1851 CA SER A 118 4.007 3.176 6.953 1.00 0.00 C ATOM 1852 C SER A 118 2.684 3.831 7.422 1.00 0.00 C ATOM 1853 O SER A 118 1.836 3.162 8.026 1.00 0.00 O ATOM 1854 CB SER A 118 5.118 3.325 8.025 1.00 0.00 C ATOM 1855 OG SER A 118 5.574 4.669 8.125 1.00 0.00 O ATOM 0 H SER A 118 5.396 4.226 5.775 1.00 0.00 H new ATOM 0 HA SER A 118 3.780 2.121 6.797 1.00 0.00 H new ATOM 0 HB2 SER A 118 4.737 2.997 8.992 1.00 0.00 H new ATOM 0 HB3 SER A 118 5.956 2.674 7.774 1.00 0.00 H new ATOM 0 HG SER A 118 6.272 4.727 8.810 1.00 0.00 H new ATOM 1861 N ALA A 119 2.527 5.132 7.112 1.00 0.00 N ATOM 1862 CA ALA A 119 1.335 5.922 7.491 1.00 0.00 C ATOM 1863 C ALA A 119 0.080 5.495 6.696 1.00 0.00 C ATOM 1864 O ALA A 119 -1.049 5.676 7.166 1.00 0.00 O ATOM 1865 CB ALA A 119 1.617 7.423 7.298 1.00 0.00 C ATOM 0 H ALA A 119 3.222 5.667 6.592 1.00 0.00 H new ATOM 0 HA ALA A 119 1.127 5.728 8.543 1.00 0.00 H new ATOM 0 HB1 ALA A 119 0.735 7.998 7.579 1.00 0.00 H new ATOM 0 HB2 ALA A 119 2.458 7.719 7.925 1.00 0.00 H new ATOM 0 HB3 ALA A 119 1.858 7.616 6.253 1.00 0.00 H new ATOM 1871 N ALA A 120 0.303 4.937 5.491 1.00 0.00 N ATOM 1872 CA ALA A 120 -0.785 4.463 4.601 1.00 0.00 C ATOM 1873 C ALA A 120 -1.504 3.219 5.127 1.00 0.00 C ATOM 1874 O ALA A 120 -2.701 3.019 4.868 1.00 0.00 O ATOM 1875 CB ALA A 120 -0.256 4.190 3.178 1.00 0.00 C ATOM 0 H ALA A 120 1.237 4.800 5.104 1.00 0.00 H new ATOM 0 HA ALA A 120 -1.516 5.271 4.575 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.074 3.844 2.546 1.00 0.00 H new ATOM 0 HB2 ALA A 120 0.160 5.108 2.762 1.00 0.00 H new ATOM 0 HB3 ALA A 120 0.520 3.425 3.219 1.00 0.00 H new ATOM 1881 N LEU A 121 -0.774 2.409 5.883 1.00 0.00 N ATOM 1882 CA LEU A 121 -1.074 0.988 6.039 1.00 0.00 C ATOM 1883 C LEU A 121 -1.974 0.644 7.210 1.00 0.00 C ATOM 1884 O LEU A 121 -1.986 1.314 8.245 1.00 0.00 O ATOM 1885 CB LEU A 121 0.250 0.226 6.168 1.00 0.00 C ATOM 1886 CG LEU A 121 1.202 0.433 4.970 1.00 0.00 C ATOM 1887 CD1 LEU A 121 2.533 -0.275 5.189 1.00 0.00 C ATOM 1888 CD2 LEU A 121 0.522 0.015 3.648 1.00 0.00 C ATOM 0 H LEU A 121 0.045 2.718 6.407 1.00 0.00 H new ATOM 0 HA LEU A 121 -1.636 0.694 5.153 1.00 0.00 H new ATOM 0 HB2 LEU A 121 0.754 0.543 7.081 1.00 0.00 H new ATOM 0 HB3 LEU A 121 0.038 -0.838 6.273 1.00 0.00 H new ATOM 0 HG LEU A 121 1.426 1.497 4.892 1.00 0.00 H new ATOM 0 HD11 LEU A 121 3.179 -0.109 4.327 1.00 0.00 H new ATOM 0 HD12 LEU A 121 3.013 0.121 6.084 1.00 0.00 H new ATOM 0 HD13 LEU A 121 2.360 -1.344 5.313 1.00 0.00 H new ATOM 0 HD21 LEU A 121 1.212 0.170 2.819 1.00 0.00 H new ATOM 0 HD22 LEU A 121 0.246 -1.038 3.698 1.00 0.00 H new ATOM 0 HD23 LEU A 121 -0.373 0.618 3.493 1.00 0.00 H new ATOM 1900 N ARG A 122 -2.705 -0.451 7.005 1.00 0.00 N ATOM 1901 CA ARG A 122 -3.450 -1.153 8.043 1.00 0.00 C ATOM 1902 C ARG A 122 -3.415 -2.649 7.749 1.00 0.00 C ATOM 1903 O ARG A 122 -3.745 -3.074 6.631 1.00 0.00 O ATOM 1904 CB ARG A 122 -4.909 -0.648 8.121 1.00 0.00 C ATOM 1905 CG ARG A 122 -5.786 -1.308 9.210 1.00 0.00 C ATOM 1906 CD ARG A 122 -7.173 -0.652 9.330 1.00 0.00 C ATOM 1907 NE ARG A 122 -7.065 0.760 9.728 1.00 0.00 N ATOM 1908 CZ ARG A 122 -8.058 1.654 9.734 1.00 0.00 C ATOM 1909 NH1 ARG A 122 -9.275 1.336 9.309 1.00 0.00 N ATOM 1910 NH2 ARG A 122 -7.809 2.888 10.141 1.00 0.00 N ATOM 0 H ARG A 122 -2.796 -0.884 6.086 1.00 0.00 H new ATOM 0 HA ARG A 122 -2.986 -0.957 9.010 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -4.894 0.428 8.295 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -5.382 -0.808 7.152 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -5.907 -2.367 8.981 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -5.274 -1.246 10.170 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -7.695 -0.724 8.376 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -7.771 -1.194 10.063 1.00 0.00 H new ATOM 0 HE ARG A 122 -6.146 1.087 10.027 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -9.466 0.394 8.969 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -10.018 2.034 9.322 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -6.870 3.145 10.444 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -8.556 3.582 10.151 1.00 0.00 H new ATOM 1924 N PHE A 123 -2.956 -3.435 8.732 1.00 0.00 N ATOM 1925 CA PHE A 123 -3.195 -4.876 8.744 1.00 0.00 C ATOM 1926 C PHE A 123 -4.648 -5.071 9.202 1.00 0.00 C ATOM 1927 O PHE A 123 -5.034 -4.574 10.258 1.00 0.00 O ATOM 1928 CB PHE A 123 -2.167 -5.650 9.640 1.00 0.00 C ATOM 1929 CG PHE A 123 -2.047 -5.176 11.104 1.00 0.00 C ATOM 1930 CD1 PHE A 123 -2.904 -5.668 12.102 1.00 0.00 C ATOM 1931 CD2 PHE A 123 -1.082 -4.235 11.482 1.00 0.00 C ATOM 1932 CE1 PHE A 123 -2.803 -5.232 13.410 1.00 0.00 C ATOM 1933 CE2 PHE A 123 -0.986 -3.803 12.797 1.00 0.00 C ATOM 1934 CZ PHE A 123 -1.846 -4.302 13.754 1.00 0.00 C ATOM 0 H PHE A 123 -2.417 -3.093 9.528 1.00 0.00 H new ATOM 0 HA PHE A 123 -3.049 -5.298 7.750 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -2.441 -6.705 9.643 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -1.184 -5.577 9.175 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -3.655 -6.400 11.843 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -0.403 -3.840 10.740 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -3.474 -5.620 14.162 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -0.237 -3.075 13.072 1.00 0.00 H new ATOM 0 HZ PHE A 123 -1.769 -3.962 14.776 1.00 0.00 H new ATOM 1944 N VAL A 124 -5.474 -5.701 8.364 1.00 0.00 N ATOM 1945 CA VAL A 124 -6.894 -5.941 8.665 1.00 0.00 C ATOM 1946 C VAL A 124 -7.094 -7.456 8.719 1.00 0.00 C ATOM 1947 O VAL A 124 -7.118 -8.084 7.657 1.00 0.00 O ATOM 1948 CB VAL A 124 -7.866 -5.306 7.592 1.00 0.00 C ATOM 1949 CG1 VAL A 124 -9.332 -5.287 8.116 1.00 0.00 C ATOM 1950 CG2 VAL A 124 -7.402 -3.893 7.167 1.00 0.00 C ATOM 0 H VAL A 124 -5.181 -6.061 7.456 1.00 0.00 H new ATOM 0 HA VAL A 124 -7.140 -5.464 9.614 1.00 0.00 H new ATOM 0 HB VAL A 124 -7.834 -5.935 6.703 1.00 0.00 H new ATOM 0 HG11 VAL A 124 -9.983 -4.846 7.361 1.00 0.00 H new ATOM 0 HG12 VAL A 124 -9.657 -6.306 8.324 1.00 0.00 H new ATOM 0 HG13 VAL A 124 -9.384 -4.696 9.030 1.00 0.00 H new ATOM 0 HG21 VAL A 124 -8.095 -3.489 6.429 1.00 0.00 H new ATOM 0 HG22 VAL A 124 -7.380 -3.240 8.039 1.00 0.00 H new ATOM 0 HG23 VAL A 124 -6.404 -3.953 6.733 1.00 0.00 H new ATOM 1960 N PRO A 125 -7.166 -8.079 9.946 1.00 0.00 N ATOM 1961 CA PRO A 125 -7.320 -9.547 10.092 1.00 0.00 C ATOM 1962 C PRO A 125 -8.572 -10.098 9.377 1.00 0.00 C ATOM 1963 O PRO A 125 -9.551 -9.380 9.220 1.00 0.00 O ATOM 1964 CB PRO A 125 -7.369 -9.783 11.626 1.00 0.00 C ATOM 1965 CG PRO A 125 -7.663 -8.432 12.217 1.00 0.00 C ATOM 1966 CD PRO A 125 -7.054 -7.414 11.274 1.00 0.00 C ATOM 0 HA PRO A 125 -6.497 -10.082 9.618 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -8.141 -10.506 11.890 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -6.423 -10.178 11.995 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -8.737 -8.276 12.316 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -7.234 -8.343 13.215 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -7.594 -6.468 11.298 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -6.017 -7.196 11.530 1.00 0.00 H new ATOM 1974 N LYS A 126 -8.507 -11.372 8.932 1.00 0.00 N ATOM 1975 CA LYS A 126 -9.573 -12.016 8.128 1.00 0.00 C ATOM 1976 C LYS A 126 -10.944 -12.052 8.848 1.00 0.00 C ATOM 1977 O LYS A 126 -11.996 -12.132 8.194 1.00 0.00 O ATOM 1978 CB LYS A 126 -9.139 -13.432 7.678 1.00 0.00 C ATOM 1979 CG LYS A 126 -10.064 -14.083 6.627 1.00 0.00 C ATOM 1980 CD LYS A 126 -9.634 -15.520 6.269 1.00 0.00 C ATOM 1981 CE LYS A 126 -10.458 -16.098 5.114 1.00 0.00 C ATOM 1982 NZ LYS A 126 -9.959 -17.420 4.670 1.00 0.00 N ATOM 0 H LYS A 126 -7.714 -11.985 9.120 1.00 0.00 H new ATOM 0 HA LYS A 126 -9.714 -11.394 7.244 1.00 0.00 H new ATOM 0 HB2 LYS A 126 -8.130 -13.376 7.270 1.00 0.00 H new ATOM 0 HB3 LYS A 126 -9.093 -14.079 8.554 1.00 0.00 H new ATOM 0 HG2 LYS A 126 -11.086 -14.097 7.006 1.00 0.00 H new ATOM 0 HG3 LYS A 126 -10.068 -13.473 5.724 1.00 0.00 H new ATOM 0 HD2 LYS A 126 -8.578 -15.525 5.998 1.00 0.00 H new ATOM 0 HD3 LYS A 126 -9.741 -16.159 7.146 1.00 0.00 H new ATOM 0 HE2 LYS A 126 -11.499 -16.191 5.425 1.00 0.00 H new ATOM 0 HE3 LYS A 126 -10.437 -15.404 4.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 -10.261 -17.594 3.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 -8.920 -17.434 4.720 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 -10.345 -18.162 5.288 1.00 0.00 H new ATOM 1996 N HIS A 127 -10.924 -11.957 10.187 1.00 0.00 N ATOM 1997 CA HIS A 127 -12.149 -11.837 11.002 1.00 0.00 C ATOM 1998 C HIS A 127 -12.801 -10.464 10.763 1.00 0.00 C ATOM 1999 O HIS A 127 -14.025 -10.353 10.669 1.00 0.00 O ATOM 2000 CB HIS A 127 -11.842 -12.040 12.517 1.00 0.00 C ATOM 2001 CG HIS A 127 -11.733 -13.480 12.944 1.00 0.00 C ATOM 2002 ND1 HIS A 127 -10.658 -14.281 12.646 1.00 0.00 N ATOM 2003 CD2 HIS A 127 -12.595 -14.265 13.636 1.00 0.00 C ATOM 2004 CE1 HIS A 127 -10.862 -15.490 13.130 1.00 0.00 C ATOM 2005 NE2 HIS A 127 -12.026 -15.510 13.739 1.00 0.00 N ATOM 0 H HIS A 127 -10.064 -11.961 10.735 1.00 0.00 H new ATOM 0 HA HIS A 127 -12.843 -12.621 10.698 1.00 0.00 H new ATOM 0 HB2 HIS A 127 -10.908 -11.531 12.757 1.00 0.00 H new ATOM 0 HB3 HIS A 127 -12.626 -11.559 13.101 1.00 0.00 H new ATOM 0 HD1 HIS A 127 -9.829 -13.986 12.130 1.00 0.00 H new ATOM 0 HD2 HIS A 127 -13.554 -13.966 14.033 1.00 0.00 H new ATOM 0 HE1 HIS A 127 -10.184 -16.326 13.041 1.00 0.00 H new ATOM 2014 N LYS A 128 -11.960 -9.429 10.616 1.00 0.00 N ATOM 2015 CA LYS A 128 -12.409 -8.037 10.449 1.00 0.00 C ATOM 2016 C LYS A 128 -12.773 -7.765 8.990 1.00 0.00 C ATOM 2017 O LYS A 128 -13.604 -6.899 8.722 1.00 0.00 O ATOM 2018 CB LYS A 128 -11.325 -7.032 10.926 1.00 0.00 C ATOM 2019 CG LYS A 128 -11.039 -7.049 12.443 1.00 0.00 C ATOM 2020 CD LYS A 128 -12.297 -6.789 13.311 1.00 0.00 C ATOM 2021 CE LYS A 128 -11.958 -6.530 14.789 1.00 0.00 C ATOM 2022 NZ LYS A 128 -11.269 -5.227 14.988 1.00 0.00 N ATOM 0 H LYS A 128 -10.945 -9.534 10.609 1.00 0.00 H new ATOM 0 HA LYS A 128 -13.295 -7.897 11.068 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -10.397 -7.243 10.395 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -11.634 -6.026 10.641 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -10.613 -8.015 12.714 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -10.287 -6.294 12.672 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -12.838 -5.931 12.911 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -12.965 -7.648 13.241 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -12.875 -6.548 15.379 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -11.324 -7.335 15.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -11.212 -5.016 16.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -10.309 -5.277 14.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -11.804 -4.475 14.508 1.00 0.00 H new ATOM 2036 N LEU A 129 -12.147 -8.516 8.053 1.00 0.00 N ATOM 2037 CA LEU A 129 -12.371 -8.352 6.612 1.00 0.00 C ATOM 2038 C LEU A 129 -13.822 -8.643 6.219 1.00 0.00 C ATOM 2039 O LEU A 129 -14.364 -7.976 5.346 1.00 0.00 O ATOM 2040 CB LEU A 129 -11.433 -9.281 5.824 1.00 0.00 C ATOM 2041 CG LEU A 129 -9.914 -8.981 5.883 1.00 0.00 C ATOM 2042 CD1 LEU A 129 -9.114 -10.057 5.115 1.00 0.00 C ATOM 2043 CD2 LEU A 129 -9.618 -7.575 5.350 1.00 0.00 C ATOM 0 H LEU A 129 -11.476 -9.249 8.282 1.00 0.00 H new ATOM 0 HA LEU A 129 -12.159 -7.311 6.368 1.00 0.00 H new ATOM 0 HB2 LEU A 129 -11.589 -10.299 6.182 1.00 0.00 H new ATOM 0 HB3 LEU A 129 -11.740 -9.260 4.778 1.00 0.00 H new ATOM 0 HG LEU A 129 -9.596 -9.013 6.925 1.00 0.00 H new ATOM 0 HD11 LEU A 129 -8.050 -9.827 5.169 1.00 0.00 H new ATOM 0 HD12 LEU A 129 -9.297 -11.034 5.561 1.00 0.00 H new ATOM 0 HD13 LEU A 129 -9.430 -10.070 4.072 1.00 0.00 H new ATOM 0 HD21 LEU A 129 -8.546 -7.385 5.400 1.00 0.00 H new ATOM 0 HD22 LEU A 129 -9.951 -7.501 4.315 1.00 0.00 H new ATOM 0 HD23 LEU A 129 -10.146 -6.838 5.955 1.00 0.00 H new ATOM 2055 N LYS A 130 -14.433 -9.645 6.873 1.00 0.00 N ATOM 2056 CA LYS A 130 -15.844 -10.022 6.626 1.00 0.00 C ATOM 2057 C LYS A 130 -16.795 -8.923 7.104 1.00 0.00 C ATOM 2058 O LYS A 130 -17.876 -8.732 6.535 1.00 0.00 O ATOM 2059 CB LYS A 130 -16.183 -11.373 7.290 1.00 0.00 C ATOM 2060 CG LYS A 130 -15.197 -12.506 6.931 1.00 0.00 C ATOM 2061 CD LYS A 130 -15.705 -13.907 7.359 1.00 0.00 C ATOM 2062 CE LYS A 130 -14.589 -14.958 7.411 1.00 0.00 C ATOM 2063 NZ LYS A 130 -13.614 -14.655 8.485 1.00 0.00 N ATOM 0 H LYS A 130 -13.972 -10.215 7.582 1.00 0.00 H new ATOM 0 HA LYS A 130 -15.976 -10.137 5.550 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -16.195 -11.243 8.372 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -17.189 -11.671 6.994 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -15.023 -12.502 5.855 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -14.238 -12.311 7.410 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -16.174 -13.833 8.340 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -16.475 -14.237 6.662 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -15.023 -15.944 7.578 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -14.075 -14.994 6.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -13.026 -15.493 8.667 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -13.007 -13.864 8.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -14.124 -14.395 9.353 1.00 0.00 H new ATOM 2077 N GLU A 131 -16.364 -8.199 8.148 1.00 0.00 N ATOM 2078 CA GLU A 131 -17.064 -7.004 8.635 1.00 0.00 C ATOM 2079 C GLU A 131 -16.907 -5.860 7.616 1.00 0.00 C ATOM 2080 O GLU A 131 -17.841 -5.085 7.399 1.00 0.00 O ATOM 2081 CB GLU A 131 -16.544 -6.584 10.032 1.00 0.00 C ATOM 2082 CG GLU A 131 -17.268 -5.365 10.660 1.00 0.00 C ATOM 2083 CD GLU A 131 -18.769 -5.603 10.936 1.00 0.00 C ATOM 2084 OE1 GLU A 131 -19.107 -6.087 12.041 1.00 0.00 O ATOM 2085 OE2 GLU A 131 -19.613 -5.296 10.064 1.00 0.00 O ATOM 0 H GLU A 131 -15.522 -8.426 8.677 1.00 0.00 H new ATOM 0 HA GLU A 131 -18.124 -7.236 8.741 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.639 -7.433 10.709 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -15.481 -6.356 9.954 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -16.774 -5.103 11.596 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.162 -4.509 9.993 1.00 0.00 H new ATOM 2092 N GLU A 132 -15.720 -5.788 6.965 1.00 0.00 N ATOM 2093 CA GLU A 132 -15.445 -4.820 5.883 1.00 0.00 C ATOM 2094 C GLU A 132 -16.175 -5.198 4.566 1.00 0.00 C ATOM 2095 O GLU A 132 -16.113 -4.440 3.589 1.00 0.00 O ATOM 2096 CB GLU A 132 -13.910 -4.723 5.640 1.00 0.00 C ATOM 2097 CG GLU A 132 -13.071 -4.296 6.861 1.00 0.00 C ATOM 2098 CD GLU A 132 -13.496 -2.942 7.445 1.00 0.00 C ATOM 2099 OE1 GLU A 132 -13.170 -1.903 6.840 1.00 0.00 O ATOM 2100 OE2 GLU A 132 -14.178 -2.905 8.489 1.00 0.00 O ATOM 0 H GLU A 132 -14.931 -6.399 7.177 1.00 0.00 H new ATOM 0 HA GLU A 132 -15.827 -3.849 6.199 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -13.552 -5.694 5.296 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -13.732 -4.013 4.832 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.153 -5.060 7.635 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -12.021 -4.246 6.572 1.00 0.00 H new ATOM 2107 N GLY A 133 -16.839 -6.375 4.536 1.00 0.00 N ATOM 2108 CA GLY A 133 -17.678 -6.799 3.410 1.00 0.00 C ATOM 2109 C GLY A 133 -17.101 -7.988 2.637 1.00 0.00 C ATOM 2110 O GLY A 133 -17.798 -8.544 1.786 1.00 0.00 O ATOM 0 H GLY A 133 -16.803 -7.054 5.297 1.00 0.00 H new ATOM 0 HA2 GLY A 133 -18.668 -7.063 3.783 1.00 0.00 H new ATOM 0 HA3 GLY A 133 -17.808 -5.960 2.727 1.00 0.00 H new ATOM 2114 N TYR A 134 -15.850 -8.408 2.996 1.00 0.00 N ATOM 2115 CA TYR A 134 -15.076 -9.605 2.466 1.00 0.00 C ATOM 2116 C TYR A 134 -14.928 -9.778 0.918 1.00 0.00 C ATOM 2117 O TYR A 134 -14.056 -10.535 0.476 1.00 0.00 O ATOM 2118 CB TYR A 134 -15.551 -10.948 3.103 1.00 0.00 C ATOM 2119 CG TYR A 134 -16.972 -11.444 2.754 1.00 0.00 C ATOM 2120 CD1 TYR A 134 -17.216 -12.188 1.589 1.00 0.00 C ATOM 2121 CD2 TYR A 134 -18.064 -11.179 3.592 1.00 0.00 C ATOM 2122 CE1 TYR A 134 -18.485 -12.636 1.279 1.00 0.00 C ATOM 2123 CE2 TYR A 134 -19.334 -11.626 3.280 1.00 0.00 C ATOM 2124 CZ TYR A 134 -19.539 -12.352 2.126 1.00 0.00 C ATOM 2125 OH TYR A 134 -20.806 -12.794 1.816 1.00 0.00 O ATOM 0 H TYR A 134 -15.314 -7.902 3.701 1.00 0.00 H new ATOM 0 HA TYR A 134 -14.068 -9.347 2.792 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -14.844 -11.725 2.814 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -15.488 -10.847 4.186 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -16.396 -12.414 0.923 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -17.910 -10.614 4.500 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -18.653 -13.206 0.377 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -20.162 -11.407 3.937 1.00 0.00 H new ATOM 0 HH TYR A 134 -21.431 -12.511 2.515 1.00 0.00 H new ATOM 2135 N GLU A 135 -15.767 -9.100 0.144 1.00 0.00 N ATOM 2136 CA GLU A 135 -15.982 -9.322 -1.315 1.00 0.00 C ATOM 2137 C GLU A 135 -14.668 -9.342 -2.127 1.00 0.00 C ATOM 2138 O GLU A 135 -14.313 -10.378 -2.718 1.00 0.00 O ATOM 2139 CB GLU A 135 -16.986 -8.229 -1.829 1.00 0.00 C ATOM 2140 CG GLU A 135 -17.598 -8.438 -3.244 1.00 0.00 C ATOM 2141 CD GLU A 135 -16.700 -7.980 -4.418 1.00 0.00 C ATOM 2142 OE1 GLU A 135 -16.652 -6.765 -4.706 1.00 0.00 O ATOM 2143 OE2 GLU A 135 -16.057 -8.839 -5.065 1.00 0.00 O ATOM 0 H GLU A 135 -16.348 -8.347 0.512 1.00 0.00 H new ATOM 0 HA GLU A 135 -16.406 -10.315 -1.465 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -17.805 -8.159 -1.113 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.472 -7.268 -1.821 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -17.826 -9.496 -3.372 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -18.544 -7.899 -3.298 1.00 0.00 H new ATOM 2150 N SER A 136 -13.939 -8.220 -2.133 1.00 0.00 N ATOM 2151 CA SER A 136 -12.618 -8.125 -2.768 1.00 0.00 C ATOM 2152 C SER A 136 -11.516 -8.571 -1.806 1.00 0.00 C ATOM 2153 O SER A 136 -10.447 -8.987 -2.249 1.00 0.00 O ATOM 2154 CB SER A 136 -12.370 -6.661 -3.215 1.00 0.00 C ATOM 2155 OG SER A 136 -11.090 -6.492 -3.804 1.00 0.00 O ATOM 0 H SER A 136 -14.248 -7.351 -1.697 1.00 0.00 H new ATOM 0 HA SER A 136 -12.597 -8.785 -3.636 1.00 0.00 H new ATOM 0 HB2 SER A 136 -13.139 -6.365 -3.929 1.00 0.00 H new ATOM 0 HB3 SER A 136 -12.463 -5.999 -2.354 1.00 0.00 H new ATOM 0 HG SER A 136 -10.975 -5.557 -4.073 1.00 0.00 H new ATOM 2161 N TYR A 137 -11.806 -8.525 -0.491 1.00 0.00 N ATOM 2162 CA TYR A 137 -10.794 -8.713 0.545 1.00 0.00 C ATOM 2163 C TYR A 137 -10.270 -10.155 0.528 1.00 0.00 C ATOM 2164 O TYR A 137 -9.114 -10.389 0.211 1.00 0.00 O ATOM 2165 CB TYR A 137 -11.369 -8.334 1.932 1.00 0.00 C ATOM 2166 CG TYR A 137 -11.635 -6.831 2.105 1.00 0.00 C ATOM 2167 CD1 TYR A 137 -10.583 -5.944 2.373 1.00 0.00 C ATOM 2168 CD2 TYR A 137 -12.924 -6.299 2.012 1.00 0.00 C ATOM 2169 CE1 TYR A 137 -10.807 -4.598 2.550 1.00 0.00 C ATOM 2170 CE2 TYR A 137 -13.148 -4.947 2.182 1.00 0.00 C ATOM 2171 CZ TYR A 137 -12.090 -4.102 2.455 1.00 0.00 C ATOM 2172 OH TYR A 137 -12.315 -2.752 2.639 1.00 0.00 O ATOM 0 H TYR A 137 -12.744 -8.357 -0.128 1.00 0.00 H new ATOM 0 HA TYR A 137 -9.951 -8.053 0.341 1.00 0.00 H new ATOM 0 HB2 TYR A 137 -12.300 -8.878 2.090 1.00 0.00 H new ATOM 0 HB3 TYR A 137 -10.673 -8.661 2.705 1.00 0.00 H new ATOM 0 HD1 TYR A 137 -9.575 -6.325 2.442 1.00 0.00 H new ATOM 0 HD2 TYR A 137 -13.757 -6.955 1.804 1.00 0.00 H new ATOM 0 HE1 TYR A 137 -9.982 -3.934 2.762 1.00 0.00 H new ATOM 0 HE2 TYR A 137 -14.149 -4.551 2.102 1.00 0.00 H new ATOM 0 HH TYR A 137 -13.271 -2.563 2.538 1.00 0.00 H new ATOM 2182 N LEU A 138 -11.169 -11.103 0.795 1.00 0.00 N ATOM 2183 CA LEU A 138 -10.849 -12.543 0.913 1.00 0.00 C ATOM 2184 C LEU A 138 -10.451 -13.158 -0.447 1.00 0.00 C ATOM 2185 O LEU A 138 -9.776 -14.198 -0.487 1.00 0.00 O ATOM 2186 CB LEU A 138 -12.034 -13.300 1.603 1.00 0.00 C ATOM 2187 CG LEU A 138 -12.084 -13.171 3.169 1.00 0.00 C ATOM 2188 CD1 LEU A 138 -11.990 -11.721 3.623 1.00 0.00 C ATOM 2189 CD2 LEU A 138 -13.341 -13.794 3.778 1.00 0.00 C ATOM 0 H LEU A 138 -12.158 -10.898 0.939 1.00 0.00 H new ATOM 0 HA LEU A 138 -9.972 -12.655 1.550 1.00 0.00 H new ATOM 0 HB2 LEU A 138 -12.972 -12.926 1.193 1.00 0.00 H new ATOM 0 HB3 LEU A 138 -11.971 -14.357 1.343 1.00 0.00 H new ATOM 0 HG LEU A 138 -11.215 -13.723 3.527 1.00 0.00 H new ATOM 0 HD11 LEU A 138 -12.028 -11.677 4.711 1.00 0.00 H new ATOM 0 HD12 LEU A 138 -11.051 -11.291 3.275 1.00 0.00 H new ATOM 0 HD13 LEU A 138 -12.824 -11.155 3.208 1.00 0.00 H new ATOM 0 HD21 LEU A 138 -13.319 -13.674 4.861 1.00 0.00 H new ATOM 0 HD22 LEU A 138 -14.224 -13.298 3.376 1.00 0.00 H new ATOM 0 HD23 LEU A 138 -13.377 -14.855 3.531 1.00 0.00 H new ATOM 2201 N HIS A 139 -10.864 -12.496 -1.543 1.00 0.00 N ATOM 2202 CA HIS A 139 -10.484 -12.883 -2.916 1.00 0.00 C ATOM 2203 C HIS A 139 -8.978 -12.621 -3.155 1.00 0.00 C ATOM 2204 O HIS A 139 -8.244 -13.534 -3.538 1.00 0.00 O ATOM 2205 CB HIS A 139 -11.355 -12.115 -3.946 1.00 0.00 C ATOM 2206 CG HIS A 139 -11.115 -12.506 -5.387 1.00 0.00 C ATOM 2207 ND1 HIS A 139 -11.853 -13.477 -6.032 1.00 0.00 N ATOM 2208 CD2 HIS A 139 -10.226 -12.046 -6.307 1.00 0.00 C ATOM 2209 CE1 HIS A 139 -11.432 -13.591 -7.275 1.00 0.00 C ATOM 2210 NE2 HIS A 139 -10.450 -12.736 -7.468 1.00 0.00 N ATOM 0 H HIS A 139 -11.471 -11.677 -1.503 1.00 0.00 H new ATOM 0 HA HIS A 139 -10.662 -13.951 -3.045 1.00 0.00 H new ATOM 0 HB2 HIS A 139 -12.406 -12.280 -3.708 1.00 0.00 H new ATOM 0 HB3 HIS A 139 -11.167 -11.047 -3.837 1.00 0.00 H new ATOM 0 HD2 HIS A 139 -9.482 -11.279 -6.151 1.00 0.00 H new ATOM 0 HE1 HIS A 139 -11.827 -14.273 -8.013 1.00 0.00 H new ATOM 0 HE2 HIS A 139 -9.939 -12.608 -8.341 1.00 0.00 H new ATOM 2219 N LEU A 140 -8.535 -11.367 -2.912 1.00 0.00 N ATOM 2220 CA LEU A 140 -7.112 -10.958 -3.070 1.00 0.00 C ATOM 2221 C LEU A 140 -6.220 -11.618 -2.002 1.00 0.00 C ATOM 2222 O LEU A 140 -5.047 -11.887 -2.233 1.00 0.00 O ATOM 2223 CB LEU A 140 -6.999 -9.420 -2.976 1.00 0.00 C ATOM 2224 CG LEU A 140 -7.797 -8.610 -4.047 1.00 0.00 C ATOM 2225 CD1 LEU A 140 -7.685 -7.102 -3.789 1.00 0.00 C ATOM 2226 CD2 LEU A 140 -7.342 -8.971 -5.470 1.00 0.00 C ATOM 0 H LEU A 140 -9.146 -10.611 -2.603 1.00 0.00 H new ATOM 0 HA LEU A 140 -6.767 -11.291 -4.049 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -7.338 -9.110 -1.987 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -5.946 -9.147 -3.052 1.00 0.00 H new ATOM 0 HG LEU A 140 -8.848 -8.884 -3.961 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -8.249 -6.560 -4.548 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -8.088 -6.871 -2.803 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -6.638 -6.802 -3.832 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -7.915 -8.391 -6.193 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -6.282 -8.744 -5.582 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -7.506 -10.034 -5.646 1.00 0.00 H new ATOM 2238 N PHE A 141 -6.819 -11.838 -0.830 1.00 0.00 N ATOM 2239 CA PHE A 141 -6.229 -12.613 0.283 1.00 0.00 C ATOM 2240 C PHE A 141 -5.938 -14.069 -0.149 1.00 0.00 C ATOM 2241 O PHE A 141 -4.969 -14.679 0.323 1.00 0.00 O ATOM 2242 CB PHE A 141 -7.215 -12.577 1.481 1.00 0.00 C ATOM 2243 CG PHE A 141 -6.807 -13.395 2.700 1.00 0.00 C ATOM 2244 CD1 PHE A 141 -5.935 -12.878 3.647 1.00 0.00 C ATOM 2245 CD2 PHE A 141 -7.291 -14.687 2.897 1.00 0.00 C ATOM 2246 CE1 PHE A 141 -5.570 -13.619 4.742 1.00 0.00 C ATOM 2247 CE2 PHE A 141 -6.915 -15.420 3.995 1.00 0.00 C ATOM 2248 CZ PHE A 141 -6.056 -14.886 4.917 1.00 0.00 C ATOM 0 H PHE A 141 -7.749 -11.478 -0.615 1.00 0.00 H new ATOM 0 HA PHE A 141 -5.277 -12.169 0.575 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -7.344 -11.540 1.790 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -8.187 -12.931 1.138 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -5.539 -11.881 3.521 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -7.971 -15.117 2.176 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -4.894 -13.199 5.472 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -7.298 -16.421 4.132 1.00 0.00 H new ATOM 0 HZ PHE A 141 -5.762 -15.464 5.781 1.00 0.00 H new ATOM 2258 N ASN A 142 -6.813 -14.588 -1.038 1.00 0.00 N ATOM 2259 CA ASN A 142 -6.795 -15.967 -1.573 1.00 0.00 C ATOM 2260 C ASN A 142 -7.348 -16.965 -0.538 1.00 0.00 C ATOM 2261 O ASN A 142 -6.799 -17.110 0.564 1.00 0.00 O ATOM 2262 CB ASN A 142 -5.393 -16.420 -2.087 1.00 0.00 C ATOM 2263 CG ASN A 142 -5.428 -17.772 -2.800 1.00 0.00 C ATOM 2264 OD1 ASN A 142 -5.362 -18.826 -2.172 1.00 0.00 O ATOM 2265 ND2 ASN A 142 -5.510 -17.755 -4.118 1.00 0.00 N ATOM 0 H ASN A 142 -7.582 -14.036 -1.418 1.00 0.00 H new ATOM 0 HA ASN A 142 -7.448 -15.960 -2.445 1.00 0.00 H new ATOM 0 HB2 ASN A 142 -5.001 -15.666 -2.769 1.00 0.00 H new ATOM 0 HB3 ASN A 142 -4.704 -16.477 -1.244 1.00 0.00 H new ATOM 0 HD21 ASN A 142 -5.520 -18.631 -4.640 1.00 0.00 H new ATOM 0 HD22 ASN A 142 -5.564 -16.865 -4.614 1.00 0.00 H new ATOM 2272 N LYS A 143 -8.436 -17.656 -0.922 1.00 0.00 N ATOM 2273 CA LYS A 143 -9.091 -18.679 -0.089 1.00 0.00 C ATOM 2274 C LYS A 143 -8.357 -20.023 -0.232 1.00 0.00 C ATOM 2275 O LYS A 143 -8.132 -20.498 -1.350 1.00 0.00 O ATOM 2276 CB LYS A 143 -10.582 -18.832 -0.496 1.00 0.00 C ATOM 2277 CG LYS A 143 -11.390 -19.806 0.397 1.00 0.00 C ATOM 2278 CD LYS A 143 -12.863 -19.973 -0.045 1.00 0.00 C ATOM 2279 CE LYS A 143 -13.005 -20.561 -1.464 1.00 0.00 C ATOM 2280 NZ LYS A 143 -14.414 -20.861 -1.804 1.00 0.00 N ATOM 0 H LYS A 143 -8.888 -17.519 -1.826 1.00 0.00 H new ATOM 0 HA LYS A 143 -9.048 -18.364 0.954 1.00 0.00 H new ATOM 0 HB2 LYS A 143 -11.057 -17.851 -0.466 1.00 0.00 H new ATOM 0 HB3 LYS A 143 -10.631 -19.179 -1.528 1.00 0.00 H new ATOM 0 HG2 LYS A 143 -10.904 -20.782 0.389 1.00 0.00 H new ATOM 0 HG3 LYS A 143 -11.366 -19.447 1.426 1.00 0.00 H new ATOM 0 HD2 LYS A 143 -13.378 -20.622 0.664 1.00 0.00 H new ATOM 0 HD3 LYS A 143 -13.359 -19.003 -0.008 1.00 0.00 H new ATOM 0 HE2 LYS A 143 -12.599 -19.856 -2.190 1.00 0.00 H new ATOM 0 HE3 LYS A 143 -12.412 -21.473 -1.539 1.00 0.00 H new ATOM 0 HZ1 LYS A 143 -14.480 -21.125 -2.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 143 -14.753 -21.649 -1.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 143 -15.000 -20.020 -1.628 1.00 0.00 H new ATOM 2294 N LEU A 144 -7.979 -20.623 0.909 1.00 0.00 N ATOM 2295 CA LEU A 144 -7.368 -21.967 0.968 1.00 0.00 C ATOM 2296 C LEU A 144 -8.403 -22.959 1.519 1.00 0.00 C ATOM 2297 O LEU A 144 -8.255 -23.505 2.624 1.00 0.00 O ATOM 2298 CB LEU A 144 -6.050 -21.969 1.817 1.00 0.00 C ATOM 2299 CG LEU A 144 -4.758 -21.433 1.123 1.00 0.00 C ATOM 2300 CD1 LEU A 144 -4.426 -22.229 -0.152 1.00 0.00 C ATOM 2301 CD2 LEU A 144 -4.848 -19.928 0.834 1.00 0.00 C ATOM 0 H LEU A 144 -8.089 -20.188 1.825 1.00 0.00 H new ATOM 0 HA LEU A 144 -7.080 -22.274 -0.037 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -6.224 -21.375 2.714 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -5.859 -22.991 2.144 1.00 0.00 H new ATOM 0 HG LEU A 144 -3.936 -21.580 1.824 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -3.521 -21.827 -0.607 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -4.269 -23.277 0.104 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -5.253 -22.148 -0.857 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -3.929 -19.595 0.351 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -5.695 -19.734 0.176 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -4.984 -19.385 1.770 1.00 0.00 H new ATOM 2313 N GLU A 145 -9.466 -23.148 0.727 1.00 0.00 N ATOM 2314 CA GLU A 145 -10.551 -24.094 1.006 1.00 0.00 C ATOM 2315 C GLU A 145 -10.058 -25.529 0.745 1.00 0.00 C ATOM 2316 O GLU A 145 -9.395 -25.772 -0.274 1.00 0.00 O ATOM 2317 CB GLU A 145 -11.768 -23.744 0.112 1.00 0.00 C ATOM 2318 CG GLU A 145 -13.027 -24.598 0.331 1.00 0.00 C ATOM 2319 CD GLU A 145 -14.222 -24.110 -0.512 1.00 0.00 C ATOM 2320 OE1 GLU A 145 -14.968 -23.223 -0.047 1.00 0.00 O ATOM 2321 OE2 GLU A 145 -14.396 -24.580 -1.654 1.00 0.00 O ATOM 0 H GLU A 145 -9.597 -22.635 -0.145 1.00 0.00 H new ATOM 0 HA GLU A 145 -10.858 -24.026 2.050 1.00 0.00 H new ATOM 0 HB2 GLU A 145 -12.028 -22.698 0.278 1.00 0.00 H new ATOM 0 HB3 GLU A 145 -11.467 -23.836 -0.931 1.00 0.00 H new ATOM 0 HG2 GLU A 145 -12.807 -25.635 0.079 1.00 0.00 H new ATOM 0 HG3 GLU A 145 -13.298 -24.577 1.387 1.00 0.00 H new ATOM 2328 N HIS A 146 -10.361 -26.455 1.682 1.00 0.00 N ATOM 2329 CA HIS A 146 -9.936 -27.869 1.607 1.00 0.00 C ATOM 2330 C HIS A 146 -10.553 -28.551 0.364 1.00 0.00 C ATOM 2331 O HIS A 146 -11.738 -28.897 0.358 1.00 0.00 O ATOM 2332 CB HIS A 146 -10.338 -28.643 2.899 1.00 0.00 C ATOM 2333 CG HIS A 146 -9.725 -28.132 4.183 1.00 0.00 C ATOM 2334 ND1 HIS A 146 -10.480 -27.726 5.264 1.00 0.00 N ATOM 2335 CD2 HIS A 146 -8.431 -28.042 4.586 1.00 0.00 C ATOM 2336 CE1 HIS A 146 -9.684 -27.418 6.268 1.00 0.00 C ATOM 2337 NE2 HIS A 146 -8.440 -27.602 5.884 1.00 0.00 N ATOM 0 H HIS A 146 -10.910 -26.241 2.515 1.00 0.00 H new ATOM 0 HA HIS A 146 -8.850 -27.891 1.520 1.00 0.00 H new ATOM 0 HB2 HIS A 146 -11.423 -28.611 2.997 1.00 0.00 H new ATOM 0 HB3 HIS A 146 -10.060 -29.690 2.776 1.00 0.00 H new ATOM 0 HD2 HIS A 146 -7.558 -28.274 3.994 1.00 0.00 H new ATOM 0 HE1 HIS A 146 -10.000 -27.073 7.241 1.00 0.00 H new ATOM 0 HE2 HIS A 146 -7.614 -27.443 6.460 1.00 0.00 H new ATOM 2346 N HIS A 147 -9.739 -28.679 -0.693 1.00 0.00 N ATOM 2347 CA HIS A 147 -10.116 -29.326 -1.958 1.00 0.00 C ATOM 2348 C HIS A 147 -8.997 -30.313 -2.359 1.00 0.00 C ATOM 2349 O HIS A 147 -9.238 -31.533 -2.377 1.00 0.00 O ATOM 2350 CB HIS A 147 -10.356 -28.260 -3.066 1.00 0.00 C ATOM 2351 CG HIS A 147 -10.702 -28.836 -4.416 1.00 0.00 C ATOM 2352 ND1 HIS A 147 -9.758 -29.089 -5.383 1.00 0.00 N ATOM 2353 CD2 HIS A 147 -11.892 -29.203 -4.956 1.00 0.00 C ATOM 2354 CE1 HIS A 147 -10.345 -29.575 -6.458 1.00 0.00 C ATOM 2355 NE2 HIS A 147 -11.643 -29.657 -6.227 1.00 0.00 N ATOM 0 H HIS A 147 -8.781 -28.329 -0.693 1.00 0.00 H new ATOM 0 HA HIS A 147 -11.049 -29.875 -1.833 1.00 0.00 H new ATOM 0 HB2 HIS A 147 -11.162 -27.598 -2.749 1.00 0.00 H new ATOM 0 HB3 HIS A 147 -9.460 -27.647 -3.164 1.00 0.00 H new ATOM 0 HD2 HIS A 147 -12.857 -29.148 -4.474 1.00 0.00 H new ATOM 0 HE1 HIS A 147 -9.848 -29.859 -7.374 1.00 0.00 H new ATOM 0 HE2 HIS A 147 -12.344 -30.001 -6.884 1.00 0.00 H new TER 2364 HIS A 147