USER MOD reduce.3.24.130724 H: found=0, std=0, add=1156, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1151 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 58 TYR OH : rot 154:sc= 1.8 USER MOD Set 1.2: A 141 ASN : amide:sc= 1.77 K(o=3.6,f=1.2) USER MOD Set 2.1: A 50 GLN : amide:sc= 1.65 K(o=4.6,f=-3.1!) USER MOD Set 2.2: A 57 LYS NZ :NH3+ -173:sc= 3 (180deg=2.21) USER MOD Set 3.1: A 38 SER OG : rot -49:sc= 1.13 USER MOD Set 3.2: A 40 SER OG : rot -158:sc= 1.31 USER MOD Set 3.3: A 41 CYS SG : rot 180:sc= 0 USER MOD Set 3.4: A 44 CYS SG : rot 40:sc= 0.37 USER MOD Set 3.5: A 72 SER OG : rot 68:sc= 1.65 USER MOD Set 4.1: A 35 HIS : no HE2:sc= -1.4 K(o=-0.62,f=-7.6!) USER MOD Set 4.2: A 92 GLN : amide:sc= 0.771 K(o=-0.62,f=-3.7) USER MOD Set 5.1: A 22 THR OG1 : rot 180:sc= 0.825 USER MOD Set 5.2: A 25 GLN : amide:sc= 0.68 K(o=1.5,f=-0.031) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc= -3.35! C(o=-3.3!,f=-15!) USER MOD Single : A 7 MET CE :methyl -179:sc= -0.434 (180deg=-0.436) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 LYS NZ :NH3+ 147:sc= 1.11 (180deg=0.44) USER MOD Single : A 18 ASN : amide:sc= 0.699 K(o=0.7,f=-0.11) USER MOD Single : A 30 LYS NZ :NH3+ 167:sc= 1.21 (180deg=1.19) USER MOD Single : A 32 THR OG1 : rot 90:sc= 0 USER MOD Single : A 42 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 45 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0501) USER MOD Single : A 48 MET CE :methyl 150:sc= -1.77 (180deg=-4.85!) USER MOD Single : A 52 ASN : amide:sc= 0.977 K(o=0.98,f=-2.9!) USER MOD Single : A 59 GLN : amide:sc= 0.476 K(o=0.48,f=-0.34) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 63 ASN : amide:sc= 0.356 X(o=0.36,f=0) USER MOD Single : A 68 HIS : no HE2:sc= -0.998 K(o=-1,f=-3.9) USER MOD Single : A 69 MET CE :methyl -163:sc= 0 (180deg=-0.323) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00464) USER MOD Single : A 84 THR OG1 : rot 83:sc= 1.24 USER MOD Single : A 88 HIS : no HE2:sc= -1.6 X(o=-1.6,f=-1.4) USER MOD Single : A 91 THR OG1 : rot 160:sc= 0.866 USER MOD Single : A 98 SER OG : rot 180:sc= 0.0819 USER MOD Single : A 100 HIS : no HE2:sc= -1.16 K(o=-1.2,f=-3.4!) USER MOD Single : A 103 THR OG1 : rot 168:sc= 1.31 USER MOD Single : A 108 ASN : amide:sc= 0.475 K(o=0.48,f=-0.091) USER MOD Single : A 110 TYR OH : rot 151:sc= 0 USER MOD Single : A 114 TYR OH : rot 110:sc= 0.554 USER MOD Single : A 115 TYR OH : rot 56:sc= 1.81 USER MOD Single : A 119 LYS NZ :NH3+ 146:sc= 0.912 (180deg=0.286) USER MOD Single : A 120 THR OG1 : rot 180:sc= 0.129 USER MOD Single : A 122 GLN : amide:sc= 1.64 K(o=1.6,f=-6.6!) USER MOD Single : A 125 HIS : no HE2:sc= -1.98! C(o=-2!,f=-5.3!) USER MOD Single : A 127 GLN : amide:sc= 0.695 K(o=0.7,f=-0.11) USER MOD Single : A 131 SER OG : rot 180:sc= 0.0153 USER MOD Single : A 133 MET CE :methyl -177:sc= -0.48 (180deg=-0.576) USER MOD Single : A 134 LYS NZ :NH3+ -178:sc= 1.26 (180deg=1.2) USER MOD Single : A 135 MET CE :methyl 168:sc= -0.198 (180deg=-0.727) USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 147 THR OG1 : rot 166:sc= 1.28 USER MOD ----------------------------------------------------------------- ATOM 20 N LYS A 2 4.793 -1.826 -4.575 1.00 0.00 N ATOM 21 CA LYS A 2 5.764 -2.740 -3.960 1.00 0.00 C ATOM 22 C LYS A 2 6.988 -1.889 -3.626 1.00 0.00 C ATOM 23 O LYS A 2 6.833 -0.876 -2.950 1.00 0.00 O ATOM 24 CB LYS A 2 6.033 -3.938 -4.903 1.00 0.00 C ATOM 25 CG LYS A 2 4.763 -4.731 -5.248 1.00 0.00 C ATOM 26 CD LYS A 2 5.101 -5.997 -6.047 1.00 0.00 C ATOM 27 CE LYS A 2 3.817 -6.770 -6.384 1.00 0.00 C ATOM 28 NZ LYS A 2 4.093 -8.009 -7.153 1.00 0.00 N ATOM 0 HA LYS A 2 5.407 -3.201 -3.039 1.00 0.00 H new ATOM 0 HB2 LYS A 2 6.487 -3.573 -5.824 1.00 0.00 H new ATOM 0 HB3 LYS A 2 6.755 -4.606 -4.434 1.00 0.00 H new ATOM 0 HG2 LYS A 2 4.241 -5.005 -4.331 1.00 0.00 H new ATOM 0 HG3 LYS A 2 4.084 -4.103 -5.826 1.00 0.00 H new ATOM 0 HD2 LYS A 2 5.624 -5.728 -6.965 1.00 0.00 H new ATOM 0 HD3 LYS A 2 5.775 -6.631 -5.470 1.00 0.00 H new ATOM 0 HE2 LYS A 2 3.296 -7.026 -5.461 1.00 0.00 H new ATOM 0 HE3 LYS A 2 3.149 -6.129 -6.959 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 3.198 -8.497 -7.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 4.566 -7.765 -8.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 4.709 -8.634 -6.595 1.00 0.00 H new ATOM 42 N LEU A 3 8.158 -2.310 -4.097 1.00 0.00 N ATOM 43 CA LEU A 3 9.439 -1.611 -4.127 1.00 0.00 C ATOM 44 C LEU A 3 9.844 -1.331 -5.582 1.00 0.00 C ATOM 45 O LEU A 3 9.407 -2.011 -6.515 1.00 0.00 O ATOM 46 CB LEU A 3 10.524 -2.449 -3.430 1.00 0.00 C ATOM 47 CG LEU A 3 10.177 -2.843 -1.985 1.00 0.00 C ATOM 48 CD1 LEU A 3 11.369 -3.557 -1.350 1.00 0.00 C ATOM 49 CD2 LEU A 3 9.777 -1.622 -1.159 1.00 0.00 C ATOM 0 H LEU A 3 8.241 -3.240 -4.507 1.00 0.00 H new ATOM 0 HA LEU A 3 9.336 -0.665 -3.595 1.00 0.00 H new ATOM 0 HB2 LEU A 3 10.698 -3.355 -4.011 1.00 0.00 H new ATOM 0 HB3 LEU A 3 11.458 -1.887 -3.428 1.00 0.00 H new ATOM 0 HG LEU A 3 9.322 -3.519 -2.004 1.00 0.00 H new ATOM 0 HD11 LEU A 3 11.122 -3.836 -0.326 1.00 0.00 H new ATOM 0 HD12 LEU A 3 11.604 -4.453 -1.924 1.00 0.00 H new ATOM 0 HD13 LEU A 3 12.232 -2.892 -1.347 1.00 0.00 H new ATOM 0 HD21 LEU A 3 9.538 -1.933 -0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 3 10.603 -0.912 -1.136 1.00 0.00 H new ATOM 0 HD23 LEU A 3 8.904 -1.149 -1.609 1.00 0.00 H new ATOM 61 N ARG A 4 10.720 -0.336 -5.749 1.00 0.00 N ATOM 62 CA ARG A 4 11.281 0.193 -6.994 1.00 0.00 C ATOM 63 C ARG A 4 10.246 0.684 -8.011 1.00 0.00 C ATOM 64 O ARG A 4 10.538 0.745 -9.206 1.00 0.00 O ATOM 65 CB ARG A 4 12.365 -0.742 -7.560 1.00 0.00 C ATOM 66 CG ARG A 4 13.485 -0.985 -6.530 1.00 0.00 C ATOM 67 CD ARG A 4 14.721 -1.636 -7.163 1.00 0.00 C ATOM 68 NE ARG A 4 15.405 -0.723 -8.100 1.00 0.00 N ATOM 69 CZ ARG A 4 16.367 -1.055 -8.967 1.00 0.00 C ATOM 70 NH1 ARG A 4 16.832 -2.301 -9.035 1.00 0.00 N ATOM 71 NH2 ARG A 4 16.851 -0.114 -9.766 1.00 0.00 N ATOM 0 H ARG A 4 11.088 0.165 -4.941 1.00 0.00 H new ATOM 0 HA ARG A 4 11.789 1.122 -6.734 1.00 0.00 H new ATOM 0 HB2 ARG A 4 11.916 -1.694 -7.844 1.00 0.00 H new ATOM 0 HB3 ARG A 4 12.788 -0.306 -8.465 1.00 0.00 H new ATOM 0 HG2 ARG A 4 13.769 -0.037 -6.074 1.00 0.00 H new ATOM 0 HG3 ARG A 4 13.109 -1.623 -5.730 1.00 0.00 H new ATOM 0 HD2 ARG A 4 15.415 -1.937 -6.378 1.00 0.00 H new ATOM 0 HD3 ARG A 4 14.424 -2.542 -7.691 1.00 0.00 H new ATOM 0 HE ARG A 4 15.116 0.255 -8.084 1.00 0.00 H new ATOM 0 HH11 ARG A 4 16.454 -3.021 -8.419 1.00 0.00 H new ATOM 0 HH12 ARG A 4 17.566 -2.536 -9.703 1.00 0.00 H new ATOM 0 HH21 ARG A 4 16.489 0.838 -9.710 1.00 0.00 H new ATOM 0 HH22 ARG A 4 17.585 -0.342 -10.436 1.00 0.00 H new ATOM 85 N GLN A 5 9.051 1.057 -7.553 1.00 0.00 N ATOM 86 CA GLN A 5 8.069 1.763 -8.390 1.00 0.00 C ATOM 87 C GLN A 5 8.444 3.244 -8.316 1.00 0.00 C ATOM 88 O GLN A 5 9.048 3.660 -7.322 1.00 0.00 O ATOM 89 CB GLN A 5 6.593 1.602 -7.939 1.00 0.00 C ATOM 90 CG GLN A 5 6.305 0.437 -6.997 1.00 0.00 C ATOM 91 CD GLN A 5 6.707 0.870 -5.604 1.00 0.00 C ATOM 92 OE1 GLN A 5 7.806 0.607 -5.160 1.00 0.00 O ATOM 93 NE2 GLN A 5 5.868 1.599 -4.904 1.00 0.00 N ATOM 0 H GLN A 5 8.734 0.882 -6.599 1.00 0.00 H new ATOM 0 HA GLN A 5 8.111 1.338 -9.393 1.00 0.00 H new ATOM 0 HB2 GLN A 5 6.281 2.525 -7.450 1.00 0.00 H new ATOM 0 HB3 GLN A 5 5.973 1.487 -8.828 1.00 0.00 H new ATOM 0 HG2 GLN A 5 5.248 0.172 -7.026 1.00 0.00 H new ATOM 0 HG3 GLN A 5 6.864 -0.448 -7.300 1.00 0.00 H new ATOM 0 HE21 GLN A 5 4.946 1.818 -5.280 1.00 0.00 H new ATOM 0 HE22 GLN A 5 6.139 1.946 -3.984 1.00 0.00 H new ATOM 102 N PRO A 6 8.065 4.070 -9.298 1.00 0.00 N ATOM 103 CA PRO A 6 8.215 5.500 -9.151 1.00 0.00 C ATOM 104 C PRO A 6 7.197 6.045 -8.138 1.00 0.00 C ATOM 105 O PRO A 6 6.063 5.568 -8.033 1.00 0.00 O ATOM 106 CB PRO A 6 8.025 6.064 -10.551 1.00 0.00 C ATOM 107 CG PRO A 6 7.070 5.069 -11.214 1.00 0.00 C ATOM 108 CD PRO A 6 7.454 3.732 -10.575 1.00 0.00 C ATOM 0 HA PRO A 6 9.189 5.788 -8.755 1.00 0.00 H new ATOM 0 HB2 PRO A 6 7.602 7.068 -10.525 1.00 0.00 H new ATOM 0 HB3 PRO A 6 8.971 6.130 -11.088 1.00 0.00 H new ATOM 0 HG2 PRO A 6 6.028 5.322 -11.021 1.00 0.00 H new ATOM 0 HG3 PRO A 6 7.198 5.049 -12.296 1.00 0.00 H new ATOM 0 HD2 PRO A 6 6.578 3.098 -10.435 1.00 0.00 H new ATOM 0 HD3 PRO A 6 8.149 3.180 -11.208 1.00 0.00 H new ATOM 116 N MET A 7 7.627 7.075 -7.415 1.00 0.00 N ATOM 117 CA MET A 7 6.839 7.907 -6.512 1.00 0.00 C ATOM 118 C MET A 7 5.511 8.321 -7.179 1.00 0.00 C ATOM 119 O MET A 7 5.540 8.765 -8.333 1.00 0.00 O ATOM 120 CB MET A 7 7.701 9.125 -6.142 1.00 0.00 C ATOM 121 CG MET A 7 7.112 9.964 -5.006 1.00 0.00 C ATOM 122 SD MET A 7 8.048 11.471 -4.609 1.00 0.00 S ATOM 123 CE MET A 7 9.641 10.778 -4.095 1.00 0.00 C ATOM 0 H MET A 7 8.603 7.370 -7.447 1.00 0.00 H new ATOM 0 HA MET A 7 6.571 7.360 -5.608 1.00 0.00 H new ATOM 0 HB2 MET A 7 8.695 8.783 -5.854 1.00 0.00 H new ATOM 0 HB3 MET A 7 7.824 9.755 -7.023 1.00 0.00 H new ATOM 0 HG2 MET A 7 6.093 10.245 -5.271 1.00 0.00 H new ATOM 0 HG3 MET A 7 7.049 9.345 -4.111 1.00 0.00 H new ATOM 0 HE1 MET A 7 10.313 11.586 -3.805 1.00 0.00 H new ATOM 0 HE2 MET A 7 9.490 10.109 -3.248 1.00 0.00 H new ATOM 0 HE3 MET A 7 10.080 10.221 -4.923 1.00 0.00 H new ATOM 133 N PRO A 8 4.357 8.185 -6.496 1.00 0.00 N ATOM 134 CA PRO A 8 3.055 8.536 -7.045 1.00 0.00 C ATOM 135 C PRO A 8 2.809 10.047 -6.904 1.00 0.00 C ATOM 136 O PRO A 8 3.730 10.869 -6.890 1.00 0.00 O ATOM 137 CB PRO A 8 2.057 7.675 -6.250 1.00 0.00 C ATOM 138 CG PRO A 8 2.680 7.663 -4.860 1.00 0.00 C ATOM 139 CD PRO A 8 4.186 7.634 -5.157 1.00 0.00 C ATOM 0 HA PRO A 8 2.962 8.338 -8.113 1.00 0.00 H new ATOM 0 HB2 PRO A 8 1.058 8.110 -6.245 1.00 0.00 H new ATOM 0 HB3 PRO A 8 1.965 6.671 -6.664 1.00 0.00 H new ATOM 0 HG2 PRO A 8 2.399 8.545 -4.284 1.00 0.00 H new ATOM 0 HG3 PRO A 8 2.365 6.793 -4.284 1.00 0.00 H new ATOM 0 HD2 PRO A 8 4.737 8.222 -4.423 1.00 0.00 H new ATOM 0 HD3 PRO A 8 4.572 6.616 -5.105 1.00 0.00 H new ATOM 147 N GLU A 9 1.539 10.417 -6.856 1.00 0.00 N ATOM 148 CA GLU A 9 1.025 11.741 -6.567 1.00 0.00 C ATOM 149 C GLU A 9 1.331 12.133 -5.120 1.00 0.00 C ATOM 150 O GLU A 9 1.020 11.379 -4.198 1.00 0.00 O ATOM 151 CB GLU A 9 -0.495 11.655 -6.714 1.00 0.00 C ATOM 152 CG GLU A 9 -0.989 11.222 -8.092 1.00 0.00 C ATOM 153 CD GLU A 9 -0.567 12.184 -9.215 1.00 0.00 C ATOM 154 OE1 GLU A 9 0.539 12.012 -9.776 1.00 0.00 O ATOM 155 OE2 GLU A 9 -1.339 13.111 -9.552 1.00 0.00 O ATOM 0 H GLU A 9 0.788 9.749 -7.031 1.00 0.00 H new ATOM 0 HA GLU A 9 1.476 12.474 -7.235 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -0.877 10.954 -5.972 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.923 12.630 -6.482 1.00 0.00 H new ATOM 0 HG2 GLU A 9 -0.605 10.226 -8.312 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -2.076 11.148 -8.075 1.00 0.00 H new ATOM 162 N LEU A 10 1.853 13.344 -4.921 1.00 0.00 N ATOM 163 CA LEU A 10 2.057 13.969 -3.621 1.00 0.00 C ATOM 164 C LEU A 10 1.143 15.190 -3.594 1.00 0.00 C ATOM 165 O LEU A 10 1.486 16.204 -4.207 1.00 0.00 O ATOM 166 CB LEU A 10 3.529 14.403 -3.503 1.00 0.00 C ATOM 167 CG LEU A 10 4.536 13.345 -3.029 1.00 0.00 C ATOM 168 CD1 LEU A 10 4.561 13.275 -1.497 1.00 0.00 C ATOM 169 CD2 LEU A 10 4.335 11.946 -3.617 1.00 0.00 C ATOM 0 H LEU A 10 2.156 13.937 -5.694 1.00 0.00 H new ATOM 0 HA LEU A 10 1.832 13.293 -2.796 1.00 0.00 H new ATOM 0 HB2 LEU A 10 3.854 14.766 -4.478 1.00 0.00 H new ATOM 0 HB3 LEU A 10 3.578 15.248 -2.816 1.00 0.00 H new ATOM 0 HG LEU A 10 5.499 13.683 -3.411 1.00 0.00 H new ATOM 0 HD11 LEU A 10 5.280 12.520 -1.179 1.00 0.00 H new ATOM 0 HD12 LEU A 10 4.851 14.245 -1.093 1.00 0.00 H new ATOM 0 HD13 LEU A 10 3.570 13.010 -1.129 1.00 0.00 H new ATOM 0 HD21 LEU A 10 5.095 11.272 -3.221 1.00 0.00 H new ATOM 0 HD22 LEU A 10 3.346 11.576 -3.347 1.00 0.00 H new ATOM 0 HD23 LEU A 10 4.421 11.992 -4.703 1.00 0.00 H new ATOM 181 N THR A 11 -0.022 15.106 -2.942 1.00 0.00 N ATOM 182 CA THR A 11 -0.892 16.257 -2.763 1.00 0.00 C ATOM 183 C THR A 11 -1.881 15.948 -1.629 1.00 0.00 C ATOM 184 O THR A 11 -2.203 14.783 -1.360 1.00 0.00 O ATOM 185 CB THR A 11 -1.570 16.641 -4.106 1.00 0.00 C ATOM 186 OG1 THR A 11 -2.178 17.915 -4.016 1.00 0.00 O ATOM 187 CG2 THR A 11 -2.606 15.642 -4.617 1.00 0.00 C ATOM 0 H THR A 11 -0.379 14.244 -2.530 1.00 0.00 H new ATOM 0 HA THR A 11 -0.322 17.138 -2.468 1.00 0.00 H new ATOM 0 HB THR A 11 -0.754 16.642 -4.828 1.00 0.00 H new ATOM 0 HG1 THR A 11 -2.598 18.138 -4.873 1.00 0.00 H new ATOM 0 HG21 THR A 11 -3.022 15.999 -5.559 1.00 0.00 H new ATOM 0 HG22 THR A 11 -2.131 14.674 -4.774 1.00 0.00 H new ATOM 0 HG23 THR A 11 -3.405 15.539 -3.883 1.00 0.00 H new ATOM 195 N GLY A 12 -2.378 17.007 -0.995 1.00 0.00 N ATOM 196 CA GLY A 12 -3.412 17.001 0.021 1.00 0.00 C ATOM 197 C GLY A 12 -3.933 18.431 0.148 1.00 0.00 C ATOM 198 O GLY A 12 -3.219 19.374 -0.207 1.00 0.00 O ATOM 0 H GLY A 12 -2.044 17.950 -1.194 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -4.218 16.322 -0.255 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -3.013 16.652 0.973 1.00 0.00 H new ATOM 202 N GLU A 13 -5.166 18.604 0.629 1.00 0.00 N ATOM 203 CA GLU A 13 -5.854 19.893 0.585 1.00 0.00 C ATOM 204 C GLU A 13 -6.520 20.263 1.919 1.00 0.00 C ATOM 205 O GLU A 13 -6.888 21.424 2.105 1.00 0.00 O ATOM 206 CB GLU A 13 -6.875 19.823 -0.569 1.00 0.00 C ATOM 207 CG GLU A 13 -7.433 21.177 -1.037 1.00 0.00 C ATOM 208 CD GLU A 13 -6.343 22.111 -1.599 1.00 0.00 C ATOM 209 OE1 GLU A 13 -6.038 22.032 -2.811 1.00 0.00 O ATOM 210 OE2 GLU A 13 -5.801 22.948 -0.842 1.00 0.00 O ATOM 0 H GLU A 13 -5.712 17.857 1.058 1.00 0.00 H new ATOM 0 HA GLU A 13 -5.130 20.689 0.411 1.00 0.00 H new ATOM 0 HB2 GLU A 13 -6.404 19.330 -1.419 1.00 0.00 H new ATOM 0 HB3 GLU A 13 -7.708 19.194 -0.257 1.00 0.00 H new ATOM 0 HG2 GLU A 13 -8.190 21.008 -1.803 1.00 0.00 H new ATOM 0 HG3 GLU A 13 -7.930 21.668 -0.201 1.00 0.00 H new ATOM 217 N LYS A 14 -6.661 19.331 2.876 1.00 0.00 N ATOM 218 CA LYS A 14 -7.207 19.690 4.190 1.00 0.00 C ATOM 219 C LYS A 14 -6.217 20.605 4.919 1.00 0.00 C ATOM 220 O LYS A 14 -6.647 21.569 5.554 1.00 0.00 O ATOM 221 CB LYS A 14 -7.628 18.448 5.000 1.00 0.00 C ATOM 222 CG LYS A 14 -8.370 18.867 6.280 1.00 0.00 C ATOM 223 CD LYS A 14 -9.174 17.761 6.980 1.00 0.00 C ATOM 224 CE LYS A 14 -8.312 16.585 7.463 1.00 0.00 C ATOM 225 NZ LYS A 14 -9.072 15.683 8.369 1.00 0.00 N ATOM 0 H LYS A 14 -6.411 18.348 2.768 1.00 0.00 H new ATOM 0 HA LYS A 14 -8.131 20.253 4.059 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -8.270 17.811 4.392 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -6.748 17.860 5.259 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -7.641 19.263 6.987 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -9.049 19.683 6.033 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -9.699 18.190 7.833 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -9.934 17.386 6.294 1.00 0.00 H new ATOM 0 HE2 LYS A 14 -7.953 16.019 6.603 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -7.433 16.967 7.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 -8.744 14.704 8.239 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 -8.918 15.972 9.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 -10.086 15.741 8.146 1.00 0.00 H new ATOM 239 N ALA A 15 -4.911 20.346 4.800 1.00 0.00 N ATOM 240 CA ALA A 15 -3.842 21.238 5.237 1.00 0.00 C ATOM 241 C ALA A 15 -2.557 20.878 4.488 1.00 0.00 C ATOM 242 O ALA A 15 -2.418 19.778 3.954 1.00 0.00 O ATOM 243 CB ALA A 15 -3.644 21.167 6.761 1.00 0.00 C ATOM 0 H ALA A 15 -4.562 19.483 4.384 1.00 0.00 H new ATOM 0 HA ALA A 15 -4.114 22.268 5.004 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -2.841 21.843 7.055 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.567 21.460 7.262 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -3.384 20.148 7.047 1.00 0.00 H new ATOM 249 N TRP A 16 -1.607 21.809 4.482 1.00 0.00 N ATOM 250 CA TRP A 16 -0.340 21.762 3.747 1.00 0.00 C ATOM 251 C TRP A 16 0.682 22.546 4.585 1.00 0.00 C ATOM 252 O TRP A 16 1.227 23.576 4.184 1.00 0.00 O ATOM 253 CB TRP A 16 -0.510 22.251 2.292 1.00 0.00 C ATOM 254 CG TRP A 16 -1.773 22.995 1.960 1.00 0.00 C ATOM 255 CD1 TRP A 16 -2.630 22.671 0.965 1.00 0.00 C ATOM 256 CD2 TRP A 16 -2.385 24.128 2.649 1.00 0.00 C ATOM 257 NE1 TRP A 16 -3.716 23.517 0.984 1.00 0.00 N ATOM 258 CE2 TRP A 16 -3.627 24.434 2.011 1.00 0.00 C ATOM 259 CE3 TRP A 16 -2.038 24.893 3.786 1.00 0.00 C ATOM 260 CZ2 TRP A 16 -4.466 25.461 2.465 1.00 0.00 C ATOM 261 CZ3 TRP A 16 -2.875 25.926 4.249 1.00 0.00 C ATOM 262 CH2 TRP A 16 -4.085 26.213 3.590 1.00 0.00 C ATOM 0 H TRP A 16 -1.704 22.669 5.022 1.00 0.00 H new ATOM 0 HA TRP A 16 0.027 20.743 3.623 1.00 0.00 H new ATOM 0 HB2 TRP A 16 0.335 22.896 2.052 1.00 0.00 H new ATOM 0 HB3 TRP A 16 -0.446 21.384 1.635 1.00 0.00 H new ATOM 0 HD1 TRP A 16 -2.484 21.867 0.259 1.00 0.00 H new ATOM 0 HE1 TRP A 16 -4.490 23.472 0.321 1.00 0.00 H new ATOM 0 HE3 TRP A 16 -1.116 24.682 4.308 1.00 0.00 H new ATOM 0 HZ2 TRP A 16 -5.395 25.672 1.956 1.00 0.00 H new ATOM 0 HZ3 TRP A 16 -2.587 26.502 5.116 1.00 0.00 H new ATOM 0 HH2 TRP A 16 -4.720 27.010 3.948 1.00 0.00 H new ATOM 273 N LEU A 17 0.788 22.128 5.848 1.00 0.00 N ATOM 274 CA LEU A 17 1.510 22.803 6.918 1.00 0.00 C ATOM 275 C LEU A 17 2.989 22.910 6.548 1.00 0.00 C ATOM 276 O LEU A 17 3.586 21.943 6.080 1.00 0.00 O ATOM 277 CB LEU A 17 1.337 22.043 8.249 1.00 0.00 C ATOM 278 CG LEU A 17 -0.121 21.771 8.673 1.00 0.00 C ATOM 279 CD1 LEU A 17 -0.131 20.999 9.994 1.00 0.00 C ATOM 280 CD2 LEU A 17 -0.957 23.049 8.808 1.00 0.00 C ATOM 0 H LEU A 17 0.348 21.264 6.164 1.00 0.00 H new ATOM 0 HA LEU A 17 1.103 23.806 7.047 1.00 0.00 H new ATOM 0 HB2 LEU A 17 1.859 21.089 8.173 1.00 0.00 H new ATOM 0 HB3 LEU A 17 1.827 22.613 9.039 1.00 0.00 H new ATOM 0 HG LEU A 17 -0.581 21.180 7.881 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -1.161 20.806 10.295 1.00 0.00 H new ATOM 0 HD12 LEU A 17 0.393 20.052 9.866 1.00 0.00 H new ATOM 0 HD13 LEU A 17 0.368 21.588 10.764 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -1.972 22.790 9.108 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -0.510 23.698 9.561 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -0.984 23.569 7.850 1.00 0.00 H new ATOM 292 N ASN A 18 3.563 24.100 6.750 1.00 0.00 N ATOM 293 CA ASN A 18 4.900 24.550 6.332 1.00 0.00 C ATOM 294 C ASN A 18 5.005 24.719 4.813 1.00 0.00 C ATOM 295 O ASN A 18 5.763 25.569 4.342 1.00 0.00 O ATOM 296 CB ASN A 18 6.040 23.646 6.819 1.00 0.00 C ATOM 297 CG ASN A 18 6.099 23.462 8.329 1.00 0.00 C ATOM 298 OD1 ASN A 18 5.977 24.410 9.099 1.00 0.00 O ATOM 299 ND2 ASN A 18 6.312 22.239 8.781 1.00 0.00 N ATOM 0 H ASN A 18 3.066 24.836 7.251 1.00 0.00 H new ATOM 0 HA ASN A 18 5.020 25.520 6.814 1.00 0.00 H new ATOM 0 HB2 ASN A 18 5.936 22.667 6.350 1.00 0.00 H new ATOM 0 HB3 ASN A 18 6.988 24.063 6.479 1.00 0.00 H new ATOM 0 HD21 ASN A 18 6.378 22.071 9.785 1.00 0.00 H new ATOM 0 HD22 ASN A 18 6.411 21.463 8.126 1.00 0.00 H new ATOM 306 N GLY A 19 4.250 23.931 4.049 1.00 0.00 N ATOM 307 CA GLY A 19 4.210 23.916 2.598 1.00 0.00 C ATOM 308 C GLY A 19 3.956 22.491 2.113 1.00 0.00 C ATOM 309 O GLY A 19 3.930 21.547 2.903 1.00 0.00 O ATOM 0 H GLY A 19 3.613 23.247 4.457 1.00 0.00 H new ATOM 0 HA2 GLY A 19 3.424 24.580 2.238 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.151 24.287 2.193 1.00 0.00 H new ATOM 313 N GLU A 20 3.813 22.323 0.802 1.00 0.00 N ATOM 314 CA GLU A 20 3.710 21.043 0.125 1.00 0.00 C ATOM 315 C GLU A 20 4.485 21.128 -1.195 1.00 0.00 C ATOM 316 O GLU A 20 4.718 22.230 -1.702 1.00 0.00 O ATOM 317 CB GLU A 20 2.224 20.692 -0.046 1.00 0.00 C ATOM 318 CG GLU A 20 1.350 21.656 -0.874 1.00 0.00 C ATOM 319 CD GLU A 20 1.624 21.656 -2.391 1.00 0.00 C ATOM 320 OE1 GLU A 20 1.774 20.570 -2.994 1.00 0.00 O ATOM 321 OE2 GLU A 20 1.626 22.748 -3.004 1.00 0.00 O ATOM 0 H GLU A 20 3.764 23.112 0.158 1.00 0.00 H new ATOM 0 HA GLU A 20 4.156 20.234 0.703 1.00 0.00 H new ATOM 0 HB2 GLU A 20 2.163 19.706 -0.506 1.00 0.00 H new ATOM 0 HB3 GLU A 20 1.783 20.609 0.947 1.00 0.00 H new ATOM 0 HG2 GLU A 20 0.303 21.402 -0.711 1.00 0.00 H new ATOM 0 HG3 GLU A 20 1.495 22.668 -0.495 1.00 0.00 H new ATOM 328 N VAL A 21 4.882 19.982 -1.749 1.00 0.00 N ATOM 329 CA VAL A 21 5.586 19.893 -3.023 1.00 0.00 C ATOM 330 C VAL A 21 5.201 18.592 -3.717 1.00 0.00 C ATOM 331 O VAL A 21 4.985 17.562 -3.075 1.00 0.00 O ATOM 332 CB VAL A 21 7.127 19.954 -2.865 1.00 0.00 C ATOM 333 CG1 VAL A 21 7.661 21.354 -3.177 1.00 0.00 C ATOM 334 CG2 VAL A 21 7.662 19.483 -1.504 1.00 0.00 C ATOM 0 H VAL A 21 4.719 19.074 -1.314 1.00 0.00 H new ATOM 0 HA VAL A 21 5.290 20.756 -3.619 1.00 0.00 H new ATOM 0 HB VAL A 21 7.501 19.237 -3.596 1.00 0.00 H new ATOM 0 HG11 VAL A 21 8.744 21.365 -3.057 1.00 0.00 H new ATOM 0 HG12 VAL A 21 7.406 21.620 -4.203 1.00 0.00 H new ATOM 0 HG13 VAL A 21 7.213 22.075 -2.493 1.00 0.00 H new ATOM 0 HG21 VAL A 21 8.749 19.564 -1.493 1.00 0.00 H new ATOM 0 HG22 VAL A 21 7.244 20.106 -0.713 1.00 0.00 H new ATOM 0 HG23 VAL A 21 7.374 18.445 -1.339 1.00 0.00 H new ATOM 344 N THR A 22 5.146 18.659 -5.042 1.00 0.00 N ATOM 345 CA THR A 22 5.017 17.524 -5.932 1.00 0.00 C ATOM 346 C THR A 22 6.312 16.732 -5.961 1.00 0.00 C ATOM 347 O THR A 22 7.378 17.254 -5.614 1.00 0.00 O ATOM 348 CB THR A 22 4.658 18.055 -7.328 1.00 0.00 C ATOM 349 OG1 THR A 22 5.300 19.293 -7.608 1.00 0.00 O ATOM 350 CG2 THR A 22 3.156 18.269 -7.379 1.00 0.00 C ATOM 0 H THR A 22 5.193 19.547 -5.542 1.00 0.00 H new ATOM 0 HA THR A 22 4.233 16.851 -5.585 1.00 0.00 H new ATOM 0 HB THR A 22 4.990 17.328 -8.069 1.00 0.00 H new ATOM 0 HG1 THR A 22 5.048 19.597 -8.505 1.00 0.00 H new ATOM 0 HG21 THR A 22 2.875 18.647 -8.362 1.00 0.00 H new ATOM 0 HG22 THR A 22 2.647 17.323 -7.195 1.00 0.00 H new ATOM 0 HG23 THR A 22 2.865 18.992 -6.616 1.00 0.00 H new ATOM 358 N ARG A 23 6.235 15.489 -6.463 1.00 0.00 N ATOM 359 CA ARG A 23 7.426 14.707 -6.755 1.00 0.00 C ATOM 360 C ARG A 23 8.386 15.555 -7.578 1.00 0.00 C ATOM 361 O ARG A 23 9.544 15.656 -7.217 1.00 0.00 O ATOM 362 CB ARG A 23 7.087 13.344 -7.394 1.00 0.00 C ATOM 363 CG ARG A 23 6.400 13.386 -8.768 1.00 0.00 C ATOM 364 CD ARG A 23 6.151 11.965 -9.286 1.00 0.00 C ATOM 365 NE ARG A 23 5.361 11.986 -10.532 1.00 0.00 N ATOM 366 CZ ARG A 23 4.023 11.978 -10.614 1.00 0.00 C ATOM 367 NH1 ARG A 23 3.271 11.861 -9.528 1.00 0.00 N ATOM 368 NH2 ARG A 23 3.425 12.098 -11.794 1.00 0.00 N ATOM 0 H ARG A 23 5.357 15.013 -6.672 1.00 0.00 H new ATOM 0 HA ARG A 23 7.930 14.446 -5.824 1.00 0.00 H new ATOM 0 HB2 ARG A 23 8.010 12.773 -7.491 1.00 0.00 H new ATOM 0 HB3 ARG A 23 6.443 12.795 -6.707 1.00 0.00 H new ATOM 0 HG2 ARG A 23 5.454 13.923 -8.692 1.00 0.00 H new ATOM 0 HG3 ARG A 23 7.022 13.934 -9.476 1.00 0.00 H new ATOM 0 HD2 ARG A 23 7.104 11.467 -9.464 1.00 0.00 H new ATOM 0 HD3 ARG A 23 5.625 11.385 -8.528 1.00 0.00 H new ATOM 0 HE ARG A 23 5.880 12.009 -11.410 1.00 0.00 H new ATOM 0 HH11 ARG A 23 3.709 11.775 -8.611 1.00 0.00 H new ATOM 0 HH12 ARG A 23 2.254 11.857 -9.610 1.00 0.00 H new ATOM 0 HH21 ARG A 23 3.984 12.197 -12.641 1.00 0.00 H new ATOM 0 HH22 ARG A 23 2.407 12.091 -11.853 1.00 0.00 H new ATOM 382 N GLU A 24 7.913 16.290 -8.583 1.00 0.00 N ATOM 383 CA GLU A 24 8.827 16.977 -9.499 1.00 0.00 C ATOM 384 C GLU A 24 9.613 18.130 -8.845 1.00 0.00 C ATOM 385 O GLU A 24 10.593 18.592 -9.430 1.00 0.00 O ATOM 386 CB GLU A 24 8.072 17.449 -10.754 1.00 0.00 C ATOM 387 CG GLU A 24 7.009 18.518 -10.458 1.00 0.00 C ATOM 388 CD GLU A 24 6.333 19.010 -11.750 1.00 0.00 C ATOM 389 OE1 GLU A 24 5.305 18.429 -12.166 1.00 0.00 O ATOM 390 OE2 GLU A 24 6.812 19.994 -12.359 1.00 0.00 O ATOM 0 H GLU A 24 6.922 16.425 -8.783 1.00 0.00 H new ATOM 0 HA GLU A 24 9.581 16.246 -9.791 1.00 0.00 H new ATOM 0 HB2 GLU A 24 8.789 17.848 -11.472 1.00 0.00 H new ATOM 0 HB3 GLU A 24 7.593 16.591 -11.225 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.256 18.108 -9.785 1.00 0.00 H new ATOM 0 HG3 GLU A 24 7.471 19.361 -9.944 1.00 0.00 H new ATOM 397 N GLN A 25 9.218 18.593 -7.649 1.00 0.00 N ATOM 398 CA GLN A 25 9.962 19.591 -6.886 1.00 0.00 C ATOM 399 C GLN A 25 10.776 18.921 -5.765 1.00 0.00 C ATOM 400 O GLN A 25 11.783 19.475 -5.324 1.00 0.00 O ATOM 401 CB GLN A 25 8.969 20.617 -6.322 1.00 0.00 C ATOM 402 CG GLN A 25 8.273 21.435 -7.422 1.00 0.00 C ATOM 403 CD GLN A 25 7.246 22.404 -6.836 1.00 0.00 C ATOM 404 OE1 GLN A 25 7.568 23.533 -6.469 1.00 0.00 O ATOM 405 NE2 GLN A 25 5.995 21.987 -6.721 1.00 0.00 N ATOM 0 H GLN A 25 8.365 18.279 -7.186 1.00 0.00 H new ATOM 0 HA GLN A 25 10.673 20.102 -7.536 1.00 0.00 H new ATOM 0 HB2 GLN A 25 8.216 20.099 -5.728 1.00 0.00 H new ATOM 0 HB3 GLN A 25 9.495 21.294 -5.649 1.00 0.00 H new ATOM 0 HG2 GLN A 25 9.019 21.993 -7.989 1.00 0.00 H new ATOM 0 HG3 GLN A 25 7.780 20.760 -8.122 1.00 0.00 H new ATOM 0 HE21 GLN A 25 5.740 21.049 -7.029 1.00 0.00 H new ATOM 0 HE22 GLN A 25 5.286 22.604 -6.325 1.00 0.00 H new ATOM 414 N LEU A 26 10.361 17.731 -5.316 1.00 0.00 N ATOM 415 CA LEU A 26 11.065 16.891 -4.358 1.00 0.00 C ATOM 416 C LEU A 26 12.300 16.255 -5.012 1.00 0.00 C ATOM 417 O LEU A 26 13.424 16.500 -4.576 1.00 0.00 O ATOM 418 CB LEU A 26 10.073 15.810 -3.882 1.00 0.00 C ATOM 419 CG LEU A 26 9.072 16.289 -2.822 1.00 0.00 C ATOM 420 CD1 LEU A 26 7.943 15.261 -2.715 1.00 0.00 C ATOM 421 CD2 LEU A 26 9.733 16.490 -1.456 1.00 0.00 C ATOM 0 H LEU A 26 9.484 17.314 -5.629 1.00 0.00 H new ATOM 0 HA LEU A 26 11.417 17.479 -3.511 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.520 15.437 -4.744 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.637 14.970 -3.478 1.00 0.00 H new ATOM 0 HG LEU A 26 8.678 17.257 -3.131 1.00 0.00 H new ATOM 0 HD11 LEU A 26 7.223 15.588 -1.965 1.00 0.00 H new ATOM 0 HD12 LEU A 26 7.444 15.167 -3.680 1.00 0.00 H new ATOM 0 HD13 LEU A 26 8.357 14.295 -2.424 1.00 0.00 H new ATOM 0 HD21 LEU A 26 8.987 16.829 -0.737 1.00 0.00 H new ATOM 0 HD22 LEU A 26 10.161 15.547 -1.117 1.00 0.00 H new ATOM 0 HD23 LEU A 26 10.522 17.237 -1.540 1.00 0.00 H new ATOM 433 N ILE A 27 12.104 15.459 -6.065 1.00 0.00 N ATOM 434 CA ILE A 27 13.153 14.707 -6.749 1.00 0.00 C ATOM 435 C ILE A 27 13.823 15.526 -7.859 1.00 0.00 C ATOM 436 O ILE A 27 13.429 16.655 -8.161 1.00 0.00 O ATOM 437 CB ILE A 27 12.612 13.366 -7.307 1.00 0.00 C ATOM 438 CG1 ILE A 27 11.191 13.418 -7.895 1.00 0.00 C ATOM 439 CG2 ILE A 27 12.717 12.289 -6.223 1.00 0.00 C ATOM 440 CD1 ILE A 27 10.845 12.249 -8.813 1.00 0.00 C ATOM 0 H ILE A 27 11.182 15.317 -6.476 1.00 0.00 H new ATOM 0 HA ILE A 27 13.916 14.485 -6.003 1.00 0.00 H new ATOM 0 HB ILE A 27 13.243 13.122 -8.162 1.00 0.00 H new ATOM 0 HG12 ILE A 27 10.473 13.445 -7.076 1.00 0.00 H new ATOM 0 HG13 ILE A 27 11.075 14.348 -8.452 1.00 0.00 H new ATOM 0 HG21 ILE A 27 12.337 11.344 -6.611 1.00 0.00 H new ATOM 0 HG22 ILE A 27 13.760 12.168 -5.930 1.00 0.00 H new ATOM 0 HG23 ILE A 27 12.128 12.587 -5.355 1.00 0.00 H new ATOM 0 HD11 ILE A 27 9.826 12.366 -9.182 1.00 0.00 H new ATOM 0 HD12 ILE A 27 11.537 12.231 -9.655 1.00 0.00 H new ATOM 0 HD13 ILE A 27 10.925 11.314 -8.258 1.00 0.00 H new ATOM 452 N GLY A 28 14.852 14.921 -8.463 1.00 0.00 N ATOM 453 CA GLY A 28 15.593 15.426 -9.611 1.00 0.00 C ATOM 454 C GLY A 28 17.075 15.584 -9.284 1.00 0.00 C ATOM 455 O GLY A 28 17.904 15.629 -10.194 1.00 0.00 O ATOM 0 H GLY A 28 15.204 14.019 -8.143 1.00 0.00 H new ATOM 0 HA2 GLY A 28 15.474 14.744 -10.453 1.00 0.00 H new ATOM 0 HA3 GLY A 28 15.181 16.387 -9.919 1.00 0.00 H new ATOM 459 N GLU A 29 17.429 15.597 -7.996 1.00 0.00 N ATOM 460 CA GLU A 29 18.764 15.971 -7.540 1.00 0.00 C ATOM 461 C GLU A 29 19.173 15.234 -6.262 1.00 0.00 C ATOM 462 O GLU A 29 20.317 14.798 -6.142 1.00 0.00 O ATOM 463 CB GLU A 29 18.712 17.481 -7.272 1.00 0.00 C ATOM 464 CG GLU A 29 20.109 18.091 -7.111 1.00 0.00 C ATOM 465 CD GLU A 29 20.029 19.588 -6.784 1.00 0.00 C ATOM 466 OE1 GLU A 29 19.959 19.931 -5.583 1.00 0.00 O ATOM 467 OE2 GLU A 29 20.055 20.429 -7.714 1.00 0.00 O ATOM 0 H GLU A 29 16.792 15.347 -7.239 1.00 0.00 H new ATOM 0 HA GLU A 29 19.503 15.704 -8.296 1.00 0.00 H new ATOM 0 HB2 GLU A 29 18.194 17.976 -8.093 1.00 0.00 H new ATOM 0 HB3 GLU A 29 18.130 17.668 -6.370 1.00 0.00 H new ATOM 0 HG2 GLU A 29 20.646 17.571 -6.317 1.00 0.00 H new ATOM 0 HG3 GLU A 29 20.679 17.947 -8.029 1.00 0.00 H new ATOM 474 N LYS A 30 18.238 15.068 -5.320 1.00 0.00 N ATOM 475 CA LYS A 30 18.488 14.499 -3.999 1.00 0.00 C ATOM 476 C LYS A 30 17.376 13.497 -3.685 1.00 0.00 C ATOM 477 O LYS A 30 16.251 13.704 -4.150 1.00 0.00 O ATOM 478 CB LYS A 30 18.487 15.622 -2.946 1.00 0.00 C ATOM 479 CG LYS A 30 19.618 16.651 -3.102 1.00 0.00 C ATOM 480 CD LYS A 30 19.474 17.735 -2.024 1.00 0.00 C ATOM 481 CE LYS A 30 20.632 18.744 -2.031 1.00 0.00 C ATOM 482 NZ LYS A 30 20.371 19.937 -2.872 1.00 0.00 N ATOM 0 H LYS A 30 17.264 15.333 -5.463 1.00 0.00 H new ATOM 0 HA LYS A 30 19.456 13.999 -3.982 1.00 0.00 H new ATOM 0 HB2 LYS A 30 17.531 16.144 -2.992 1.00 0.00 H new ATOM 0 HB3 LYS A 30 18.557 15.173 -1.955 1.00 0.00 H new ATOM 0 HG2 LYS A 30 20.587 16.159 -3.012 1.00 0.00 H new ATOM 0 HG3 LYS A 30 19.580 17.102 -4.094 1.00 0.00 H new ATOM 0 HD2 LYS A 30 18.535 18.267 -2.174 1.00 0.00 H new ATOM 0 HD3 LYS A 30 19.418 17.261 -1.044 1.00 0.00 H new ATOM 0 HE2 LYS A 30 20.829 19.066 -1.008 1.00 0.00 H new ATOM 0 HE3 LYS A 30 21.534 18.247 -2.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 21.079 20.670 -2.665 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 20.429 19.673 -3.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 19.421 20.306 -2.666 1.00 0.00 H new ATOM 496 N PRO A 31 17.658 12.426 -2.923 1.00 0.00 N ATOM 497 CA PRO A 31 16.651 11.467 -2.491 1.00 0.00 C ATOM 498 C PRO A 31 15.565 12.128 -1.645 1.00 0.00 C ATOM 499 O PRO A 31 15.690 13.271 -1.191 1.00 0.00 O ATOM 500 CB PRO A 31 17.412 10.364 -1.744 1.00 0.00 C ATOM 501 CG PRO A 31 18.721 11.015 -1.325 1.00 0.00 C ATOM 502 CD PRO A 31 18.971 12.040 -2.428 1.00 0.00 C ATOM 0 HA PRO A 31 16.109 11.044 -3.337 1.00 0.00 H new ATOM 0 HB2 PRO A 31 16.850 10.011 -0.879 1.00 0.00 H new ATOM 0 HB3 PRO A 31 17.587 9.500 -2.385 1.00 0.00 H new ATOM 0 HG2 PRO A 31 18.640 11.488 -0.347 1.00 0.00 H new ATOM 0 HG3 PRO A 31 19.530 10.287 -1.261 1.00 0.00 H new ATOM 0 HD2 PRO A 31 19.512 12.904 -2.042 1.00 0.00 H new ATOM 0 HD3 PRO A 31 19.579 11.614 -3.226 1.00 0.00 H new ATOM 510 N THR A 32 14.497 11.378 -1.406 1.00 0.00 N ATOM 511 CA THR A 32 13.328 11.832 -0.664 1.00 0.00 C ATOM 512 C THR A 32 12.969 10.783 0.391 1.00 0.00 C ATOM 513 O THR A 32 13.185 9.588 0.195 1.00 0.00 O ATOM 514 CB THR A 32 12.186 12.106 -1.664 1.00 0.00 C ATOM 515 OG1 THR A 32 12.586 13.094 -2.598 1.00 0.00 O ATOM 516 CG2 THR A 32 10.882 12.592 -1.026 1.00 0.00 C ATOM 0 H THR A 32 14.418 10.414 -1.730 1.00 0.00 H new ATOM 0 HA THR A 32 13.524 12.763 -0.132 1.00 0.00 H new ATOM 0 HB THR A 32 11.989 11.141 -2.132 1.00 0.00 H new ATOM 0 HG1 THR A 32 13.009 12.663 -3.370 1.00 0.00 H new ATOM 0 HG21 THR A 32 10.137 12.759 -1.804 1.00 0.00 H new ATOM 0 HG22 THR A 32 10.516 11.839 -0.328 1.00 0.00 H new ATOM 0 HG23 THR A 32 11.064 13.525 -0.492 1.00 0.00 H new ATOM 524 N LEU A 33 12.393 11.232 1.504 1.00 0.00 N ATOM 525 CA LEU A 33 11.809 10.402 2.545 1.00 0.00 C ATOM 526 C LEU A 33 10.399 10.938 2.757 1.00 0.00 C ATOM 527 O LEU A 33 10.252 12.064 3.234 1.00 0.00 O ATOM 528 CB LEU A 33 12.663 10.471 3.829 1.00 0.00 C ATOM 529 CG LEU A 33 11.944 10.017 5.121 1.00 0.00 C ATOM 530 CD1 LEU A 33 11.366 8.600 5.034 1.00 0.00 C ATOM 531 CD2 LEU A 33 12.913 10.082 6.304 1.00 0.00 C ATOM 0 H LEU A 33 12.319 12.228 1.710 1.00 0.00 H new ATOM 0 HA LEU A 33 11.777 9.348 2.267 1.00 0.00 H new ATOM 0 HB2 LEU A 33 13.551 9.854 3.690 1.00 0.00 H new ATOM 0 HB3 LEU A 33 13.006 11.497 3.964 1.00 0.00 H new ATOM 0 HG LEU A 33 11.106 10.701 5.259 1.00 0.00 H new ATOM 0 HD11 LEU A 33 10.877 8.348 5.975 1.00 0.00 H new ATOM 0 HD12 LEU A 33 10.639 8.553 4.223 1.00 0.00 H new ATOM 0 HD13 LEU A 33 12.171 7.890 4.842 1.00 0.00 H new ATOM 0 HD21 LEU A 33 12.401 9.761 7.211 1.00 0.00 H new ATOM 0 HD22 LEU A 33 13.762 9.426 6.115 1.00 0.00 H new ATOM 0 HD23 LEU A 33 13.266 11.106 6.429 1.00 0.00 H new ATOM 543 N ILE A 34 9.385 10.161 2.376 1.00 0.00 N ATOM 544 CA ILE A 34 8.000 10.459 2.726 1.00 0.00 C ATOM 545 C ILE A 34 7.745 9.651 4.000 1.00 0.00 C ATOM 546 O ILE A 34 8.100 8.469 4.044 1.00 0.00 O ATOM 547 CB ILE A 34 6.990 10.070 1.614 1.00 0.00 C ATOM 548 CG1 ILE A 34 7.405 10.537 0.198 1.00 0.00 C ATOM 549 CG2 ILE A 34 5.605 10.655 1.971 1.00 0.00 C ATOM 550 CD1 ILE A 34 6.481 10.011 -0.910 1.00 0.00 C ATOM 0 H ILE A 34 9.501 9.314 1.820 1.00 0.00 H new ATOM 0 HA ILE A 34 7.857 11.531 2.861 1.00 0.00 H new ATOM 0 HB ILE A 34 6.963 8.981 1.576 1.00 0.00 H new ATOM 0 HG12 ILE A 34 7.411 11.627 0.170 1.00 0.00 H new ATOM 0 HG13 ILE A 34 8.425 10.207 -0.002 1.00 0.00 H new ATOM 0 HG21 ILE A 34 4.886 10.388 1.196 1.00 0.00 H new ATOM 0 HG22 ILE A 34 5.275 10.250 2.927 1.00 0.00 H new ATOM 0 HG23 ILE A 34 5.676 11.740 2.042 1.00 0.00 H new ATOM 0 HD11 ILE A 34 6.828 10.375 -1.877 1.00 0.00 H new ATOM 0 HD12 ILE A 34 6.493 8.921 -0.907 1.00 0.00 H new ATOM 0 HD13 ILE A 34 5.464 10.363 -0.733 1.00 0.00 H new ATOM 562 N HIS A 35 7.098 10.236 5.010 1.00 0.00 N ATOM 563 CA HIS A 35 6.635 9.465 6.155 1.00 0.00 C ATOM 564 C HIS A 35 5.181 9.784 6.486 1.00 0.00 C ATOM 565 O HIS A 35 4.701 10.901 6.292 1.00 0.00 O ATOM 566 CB HIS A 35 7.587 9.602 7.353 1.00 0.00 C ATOM 567 CG HIS A 35 7.424 10.837 8.200 1.00 0.00 C ATOM 568 ND1 HIS A 35 6.807 10.889 9.431 1.00 0.00 N ATOM 569 CD2 HIS A 35 7.918 12.087 7.942 1.00 0.00 C ATOM 570 CE1 HIS A 35 6.924 12.141 9.898 1.00 0.00 C ATOM 571 NE2 HIS A 35 7.606 12.911 9.032 1.00 0.00 N ATOM 0 H HIS A 35 6.886 11.233 5.055 1.00 0.00 H new ATOM 0 HA HIS A 35 6.655 8.409 5.887 1.00 0.00 H new ATOM 0 HB2 HIS A 35 7.458 8.729 7.993 1.00 0.00 H new ATOM 0 HB3 HIS A 35 8.611 9.576 6.980 1.00 0.00 H new ATOM 0 HD1 HIS A 35 6.343 10.113 9.903 1.00 0.00 H new ATOM 0 HD2 HIS A 35 8.454 12.386 7.054 1.00 0.00 H new ATOM 0 HE1 HIS A 35 6.525 12.484 10.841 1.00 0.00 H new ATOM 579 N PHE A 36 4.487 8.772 6.990 1.00 0.00 N ATOM 580 CA PHE A 36 3.115 8.800 7.446 1.00 0.00 C ATOM 581 C PHE A 36 3.189 8.710 8.961 1.00 0.00 C ATOM 582 O PHE A 36 4.000 7.954 9.494 1.00 0.00 O ATOM 583 CB PHE A 36 2.313 7.641 6.844 1.00 0.00 C ATOM 584 CG PHE A 36 1.764 7.962 5.468 1.00 0.00 C ATOM 585 CD1 PHE A 36 2.640 8.224 4.396 1.00 0.00 C ATOM 586 CD2 PHE A 36 0.371 8.033 5.263 1.00 0.00 C ATOM 587 CE1 PHE A 36 2.129 8.583 3.140 1.00 0.00 C ATOM 588 CE2 PHE A 36 -0.140 8.373 3.998 1.00 0.00 C ATOM 589 CZ PHE A 36 0.740 8.653 2.939 1.00 0.00 C ATOM 0 H PHE A 36 4.903 7.847 7.096 1.00 0.00 H new ATOM 0 HA PHE A 36 2.599 9.708 7.132 1.00 0.00 H new ATOM 0 HB2 PHE A 36 2.950 6.759 6.780 1.00 0.00 H new ATOM 0 HB3 PHE A 36 1.488 7.391 7.511 1.00 0.00 H new ATOM 0 HD1 PHE A 36 3.707 8.148 4.542 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -0.305 7.826 6.079 1.00 0.00 H new ATOM 0 HE1 PHE A 36 2.804 8.806 2.327 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -1.207 8.419 3.841 1.00 0.00 H new ATOM 0 HZ PHE A 36 0.348 8.922 1.969 1.00 0.00 H new ATOM 599 N TRP A 37 2.376 9.485 9.663 1.00 0.00 N ATOM 600 CA TRP A 37 2.414 9.593 11.120 1.00 0.00 C ATOM 601 C TRP A 37 1.053 10.102 11.600 1.00 0.00 C ATOM 602 O TRP A 37 0.188 10.430 10.785 1.00 0.00 O ATOM 603 CB TRP A 37 3.549 10.543 11.534 1.00 0.00 C ATOM 604 CG TRP A 37 3.444 11.901 10.921 1.00 0.00 C ATOM 605 CD1 TRP A 37 3.624 12.171 9.610 1.00 0.00 C ATOM 606 CD2 TRP A 37 3.061 13.162 11.543 1.00 0.00 C ATOM 607 NE1 TRP A 37 3.308 13.491 9.369 1.00 0.00 N ATOM 608 CE2 TRP A 37 2.968 14.155 10.527 1.00 0.00 C ATOM 609 CE3 TRP A 37 2.790 13.574 12.864 1.00 0.00 C ATOM 610 CZ2 TRP A 37 2.604 15.479 10.804 1.00 0.00 C ATOM 611 CZ3 TRP A 37 2.466 14.911 13.156 1.00 0.00 C ATOM 612 CH2 TRP A 37 2.360 15.863 12.131 1.00 0.00 C ATOM 0 H TRP A 37 1.658 10.068 9.232 1.00 0.00 H new ATOM 0 HA TRP A 37 2.610 8.623 11.578 1.00 0.00 H new ATOM 0 HB2 TRP A 37 3.551 10.642 12.619 1.00 0.00 H new ATOM 0 HB3 TRP A 37 4.504 10.099 11.253 1.00 0.00 H new ATOM 0 HD1 TRP A 37 3.962 11.464 8.867 1.00 0.00 H new ATOM 0 HE1 TRP A 37 3.324 13.923 8.445 1.00 0.00 H new ATOM 0 HE3 TRP A 37 2.832 12.851 13.665 1.00 0.00 H new ATOM 0 HZ2 TRP A 37 2.512 16.198 10.003 1.00 0.00 H new ATOM 0 HZ3 TRP A 37 2.297 15.208 14.180 1.00 0.00 H new ATOM 0 HH2 TRP A 37 2.093 16.884 12.362 1.00 0.00 H new ATOM 623 N SER A 38 0.866 10.177 12.913 1.00 0.00 N ATOM 624 CA SER A 38 -0.329 10.705 13.542 1.00 0.00 C ATOM 625 C SER A 38 0.092 11.512 14.773 1.00 0.00 C ATOM 626 O SER A 38 1.273 11.521 15.134 1.00 0.00 O ATOM 627 CB SER A 38 -1.264 9.543 13.908 1.00 0.00 C ATOM 628 OG SER A 38 -0.749 8.782 14.988 1.00 0.00 O ATOM 0 H SER A 38 1.565 9.861 13.585 1.00 0.00 H new ATOM 0 HA SER A 38 -0.874 11.364 12.866 1.00 0.00 H new ATOM 0 HB2 SER A 38 -2.246 9.935 14.173 1.00 0.00 H new ATOM 0 HB3 SER A 38 -1.402 8.898 13.040 1.00 0.00 H new ATOM 0 HG SER A 38 0.187 8.552 14.809 1.00 0.00 H new ATOM 634 N ILE A 39 -0.859 12.142 15.462 1.00 0.00 N ATOM 635 CA ILE A 39 -0.616 12.746 16.770 1.00 0.00 C ATOM 636 C ILE A 39 -1.318 11.922 17.858 1.00 0.00 C ATOM 637 O ILE A 39 -1.602 12.442 18.938 1.00 0.00 O ATOM 638 CB ILE A 39 -0.945 14.256 16.792 1.00 0.00 C ATOM 639 CG1 ILE A 39 -2.444 14.573 16.634 1.00 0.00 C ATOM 640 CG2 ILE A 39 -0.109 15.008 15.741 1.00 0.00 C ATOM 641 CD1 ILE A 39 -2.813 15.914 17.262 1.00 0.00 C ATOM 0 H ILE A 39 -1.817 12.247 15.129 1.00 0.00 H new ATOM 0 HA ILE A 39 0.451 12.712 16.990 1.00 0.00 H new ATOM 0 HB ILE A 39 -0.675 14.608 17.788 1.00 0.00 H new ATOM 0 HG12 ILE A 39 -2.703 14.585 15.575 1.00 0.00 H new ATOM 0 HG13 ILE A 39 -3.033 13.781 17.097 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.355 16.069 15.772 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.951 14.875 15.956 1.00 0.00 H new ATOM 0 HG23 ILE A 39 -0.330 14.613 14.749 1.00 0.00 H new ATOM 0 HD11 ILE A 39 -3.879 16.098 17.128 1.00 0.00 H new ATOM 0 HD12 ILE A 39 -2.580 15.894 18.327 1.00 0.00 H new ATOM 0 HD13 ILE A 39 -2.244 16.710 16.781 1.00 0.00 H new ATOM 653 N SER A 40 -1.582 10.638 17.595 1.00 0.00 N ATOM 654 CA SER A 40 -2.428 9.796 18.434 1.00 0.00 C ATOM 655 C SER A 40 -1.762 8.480 18.868 1.00 0.00 C ATOM 656 O SER A 40 -2.315 7.797 19.735 1.00 0.00 O ATOM 657 CB SER A 40 -3.738 9.537 17.683 1.00 0.00 C ATOM 658 OG SER A 40 -3.497 9.200 16.330 1.00 0.00 O ATOM 0 H SER A 40 -1.207 10.151 16.781 1.00 0.00 H new ATOM 0 HA SER A 40 -2.616 10.329 19.366 1.00 0.00 H new ATOM 0 HB2 SER A 40 -4.285 8.729 18.169 1.00 0.00 H new ATOM 0 HB3 SER A 40 -4.369 10.424 17.732 1.00 0.00 H new ATOM 0 HG SER A 40 -4.301 9.382 15.799 1.00 0.00 H new ATOM 664 N CYS A 41 -0.581 8.127 18.335 1.00 0.00 N ATOM 665 CA CYS A 41 0.095 6.863 18.641 1.00 0.00 C ATOM 666 C CYS A 41 1.487 7.142 19.206 1.00 0.00 C ATOM 667 O CYS A 41 2.168 8.064 18.754 1.00 0.00 O ATOM 668 CB CYS A 41 0.182 6.000 17.374 1.00 0.00 C ATOM 669 SG CYS A 41 -1.475 5.615 16.739 1.00 0.00 S ATOM 0 H CYS A 41 -0.069 8.715 17.677 1.00 0.00 H new ATOM 0 HA CYS A 41 -0.477 6.317 19.391 1.00 0.00 H new ATOM 0 HB2 CYS A 41 0.756 6.525 16.610 1.00 0.00 H new ATOM 0 HB3 CYS A 41 0.715 5.075 17.595 1.00 0.00 H new ATOM 0 HG CYS A 41 -1.371 4.887 15.667 1.00 0.00 H new ATOM 675 N HIS A 42 1.928 6.338 20.179 1.00 0.00 N ATOM 676 CA HIS A 42 3.154 6.605 20.930 1.00 0.00 C ATOM 677 C HIS A 42 4.395 6.585 20.036 1.00 0.00 C ATOM 678 O HIS A 42 5.262 7.447 20.165 1.00 0.00 O ATOM 679 CB HIS A 42 3.293 5.604 22.086 1.00 0.00 C ATOM 680 CG HIS A 42 4.503 5.863 22.954 1.00 0.00 C ATOM 681 ND1 HIS A 42 4.614 6.815 23.944 1.00 0.00 N ATOM 682 CD2 HIS A 42 5.707 5.211 22.885 1.00 0.00 C ATOM 683 CE1 HIS A 42 5.854 6.739 24.459 1.00 0.00 C ATOM 684 NE2 HIS A 42 6.561 5.769 23.848 1.00 0.00 N ATOM 0 H HIS A 42 1.445 5.487 20.466 1.00 0.00 H new ATOM 0 HA HIS A 42 3.079 7.612 21.340 1.00 0.00 H new ATOM 0 HB2 HIS A 42 2.395 5.644 22.703 1.00 0.00 H new ATOM 0 HB3 HIS A 42 3.355 4.595 21.679 1.00 0.00 H new ATOM 0 HD2 HIS A 42 5.955 4.408 22.207 1.00 0.00 H new ATOM 0 HE1 HIS A 42 6.230 7.368 25.252 1.00 0.00 H new ATOM 0 HE2 HIS A 42 7.523 5.495 24.046 1.00 0.00 H new ATOM 692 N LEU A 43 4.471 5.644 19.090 1.00 0.00 N ATOM 693 CA LEU A 43 5.598 5.584 18.157 1.00 0.00 C ATOM 694 C LEU A 43 5.668 6.860 17.319 1.00 0.00 C ATOM 695 O LEU A 43 6.767 7.346 17.059 1.00 0.00 O ATOM 696 CB LEU A 43 5.507 4.346 17.245 1.00 0.00 C ATOM 697 CG LEU A 43 5.985 3.045 17.918 1.00 0.00 C ATOM 698 CD1 LEU A 43 5.592 1.843 17.054 1.00 0.00 C ATOM 699 CD2 LEU A 43 7.506 3.027 18.121 1.00 0.00 C ATOM 0 H LEU A 43 3.769 4.917 18.951 1.00 0.00 H new ATOM 0 HA LEU A 43 6.512 5.500 18.745 1.00 0.00 H new ATOM 0 HB2 LEU A 43 4.474 4.219 16.922 1.00 0.00 H new ATOM 0 HB3 LEU A 43 6.102 4.521 16.349 1.00 0.00 H new ATOM 0 HG LEU A 43 5.507 2.991 18.896 1.00 0.00 H new ATOM 0 HD11 LEU A 43 5.931 0.924 17.533 1.00 0.00 H new ATOM 0 HD12 LEU A 43 4.508 1.815 16.942 1.00 0.00 H new ATOM 0 HD13 LEU A 43 6.056 1.933 16.072 1.00 0.00 H new ATOM 0 HD21 LEU A 43 7.798 2.092 18.598 1.00 0.00 H new ATOM 0 HD22 LEU A 43 8.003 3.112 17.155 1.00 0.00 H new ATOM 0 HD23 LEU A 43 7.798 3.864 18.754 1.00 0.00 H new ATOM 711 N CYS A 44 4.523 7.451 16.955 1.00 0.00 N ATOM 712 CA CYS A 44 4.507 8.753 16.303 1.00 0.00 C ATOM 713 C CYS A 44 5.092 9.819 17.226 1.00 0.00 C ATOM 714 O CYS A 44 5.878 10.637 16.764 1.00 0.00 O ATOM 715 CB CYS A 44 3.097 9.147 15.856 1.00 0.00 C ATOM 716 SG CYS A 44 2.336 7.854 14.836 1.00 0.00 S ATOM 0 H CYS A 44 3.600 7.043 17.104 1.00 0.00 H new ATOM 0 HA CYS A 44 5.127 8.681 15.409 1.00 0.00 H new ATOM 0 HB2 CYS A 44 2.476 9.334 16.732 1.00 0.00 H new ATOM 0 HB3 CYS A 44 3.140 10.078 15.292 1.00 0.00 H new ATOM 0 HG CYS A 44 2.631 6.686 15.324 1.00 0.00 H new ATOM 722 N LYS A 45 4.777 9.807 18.526 1.00 0.00 N ATOM 723 CA LYS A 45 5.316 10.796 19.464 1.00 0.00 C ATOM 724 C LYS A 45 6.829 10.692 19.642 1.00 0.00 C ATOM 725 O LYS A 45 7.435 11.664 20.081 1.00 0.00 O ATOM 726 CB LYS A 45 4.671 10.689 20.852 1.00 0.00 C ATOM 727 CG LYS A 45 3.135 10.730 20.896 1.00 0.00 C ATOM 728 CD LYS A 45 2.529 11.868 20.058 1.00 0.00 C ATOM 729 CE LYS A 45 1.020 12.037 20.299 1.00 0.00 C ATOM 730 NZ LYS A 45 0.688 12.532 21.661 1.00 0.00 N ATOM 0 H LYS A 45 4.151 9.123 18.952 1.00 0.00 H new ATOM 0 HA LYS A 45 5.076 11.759 19.012 1.00 0.00 H new ATOM 0 HB2 LYS A 45 5.001 9.757 21.312 1.00 0.00 H new ATOM 0 HB3 LYS A 45 5.052 11.502 21.470 1.00 0.00 H new ATOM 0 HG2 LYS A 45 2.743 9.778 20.539 1.00 0.00 H new ATOM 0 HG3 LYS A 45 2.812 10.839 21.931 1.00 0.00 H new ATOM 0 HD2 LYS A 45 3.039 12.802 20.296 1.00 0.00 H new ATOM 0 HD3 LYS A 45 2.705 11.670 19.001 1.00 0.00 H new ATOM 0 HE2 LYS A 45 0.618 12.731 19.561 1.00 0.00 H new ATOM 0 HE3 LYS A 45 0.525 11.079 20.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -0.327 12.752 21.713 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 0.920 11.800 22.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 1.239 13.391 21.862 1.00 0.00 H new ATOM 744 N GLU A 46 7.440 9.548 19.336 1.00 0.00 N ATOM 745 CA GLU A 46 8.888 9.352 19.432 1.00 0.00 C ATOM 746 C GLU A 46 9.547 9.708 18.089 1.00 0.00 C ATOM 747 O GLU A 46 10.589 10.378 18.023 1.00 0.00 O ATOM 748 CB GLU A 46 9.152 7.883 19.803 1.00 0.00 C ATOM 749 CG GLU A 46 8.574 7.487 21.175 1.00 0.00 C ATOM 750 CD GLU A 46 9.408 8.048 22.341 1.00 0.00 C ATOM 751 OE1 GLU A 46 10.405 7.406 22.746 1.00 0.00 O ATOM 752 OE2 GLU A 46 9.080 9.134 22.870 1.00 0.00 O ATOM 0 H GLU A 46 6.939 8.721 19.011 1.00 0.00 H new ATOM 0 HA GLU A 46 9.315 10.000 20.198 1.00 0.00 H new ATOM 0 HB2 GLU A 46 8.722 7.239 19.036 1.00 0.00 H new ATOM 0 HB3 GLU A 46 10.227 7.703 19.804 1.00 0.00 H new ATOM 0 HG2 GLU A 46 7.550 7.851 21.255 1.00 0.00 H new ATOM 0 HG3 GLU A 46 8.532 6.400 21.250 1.00 0.00 H new ATOM 759 N ALA A 47 8.895 9.313 16.991 1.00 0.00 N ATOM 760 CA ALA A 47 9.327 9.697 15.666 1.00 0.00 C ATOM 761 C ALA A 47 9.265 11.209 15.533 1.00 0.00 C ATOM 762 O ALA A 47 10.169 11.765 14.944 1.00 0.00 O ATOM 763 CB ALA A 47 8.478 9.002 14.596 1.00 0.00 C ATOM 0 H ALA A 47 8.062 8.724 17.006 1.00 0.00 H new ATOM 0 HA ALA A 47 10.358 9.378 15.515 1.00 0.00 H new ATOM 0 HB1 ALA A 47 8.820 9.305 13.606 1.00 0.00 H new ATOM 0 HB2 ALA A 47 8.576 7.921 14.699 1.00 0.00 H new ATOM 0 HB3 ALA A 47 7.433 9.285 14.721 1.00 0.00 H new ATOM 769 N MET A 48 8.277 11.890 16.112 1.00 0.00 N ATOM 770 CA MET A 48 8.117 13.334 16.009 1.00 0.00 C ATOM 771 C MET A 48 9.393 14.133 16.346 1.00 0.00 C ATOM 772 O MET A 48 9.886 14.857 15.476 1.00 0.00 O ATOM 773 CB MET A 48 6.900 13.774 16.838 1.00 0.00 C ATOM 774 CG MET A 48 5.581 13.679 16.063 1.00 0.00 C ATOM 775 SD MET A 48 5.266 15.013 14.878 1.00 0.00 S ATOM 776 CE MET A 48 6.122 14.444 13.383 1.00 0.00 C ATOM 0 H MET A 48 7.554 11.443 16.675 1.00 0.00 H new ATOM 0 HA MET A 48 7.934 13.571 14.961 1.00 0.00 H new ATOM 0 HB2 MET A 48 6.834 13.155 17.733 1.00 0.00 H new ATOM 0 HB3 MET A 48 7.046 14.802 17.171 1.00 0.00 H new ATOM 0 HG2 MET A 48 5.564 12.730 15.527 1.00 0.00 H new ATOM 0 HG3 MET A 48 4.761 13.654 16.780 1.00 0.00 H new ATOM 0 HE1 MET A 48 5.609 14.829 12.501 1.00 0.00 H new ATOM 0 HE2 MET A 48 7.150 14.806 13.392 1.00 0.00 H new ATOM 0 HE3 MET A 48 6.122 13.354 13.356 1.00 0.00 H new ATOM 786 N PRO A 49 9.996 13.998 17.542 1.00 0.00 N ATOM 787 CA PRO A 49 11.265 14.638 17.830 1.00 0.00 C ATOM 788 C PRO A 49 12.378 14.117 16.925 1.00 0.00 C ATOM 789 O PRO A 49 13.212 14.923 16.501 1.00 0.00 O ATOM 790 CB PRO A 49 11.566 14.381 19.309 1.00 0.00 C ATOM 791 CG PRO A 49 10.635 13.243 19.714 1.00 0.00 C ATOM 792 CD PRO A 49 9.476 13.348 18.728 1.00 0.00 C ATOM 0 HA PRO A 49 11.208 15.709 17.634 1.00 0.00 H new ATOM 0 HB2 PRO A 49 12.611 14.107 19.456 1.00 0.00 H new ATOM 0 HB3 PRO A 49 11.383 15.272 19.909 1.00 0.00 H new ATOM 0 HG2 PRO A 49 11.133 12.276 19.644 1.00 0.00 H new ATOM 0 HG3 PRO A 49 10.295 13.353 20.744 1.00 0.00 H new ATOM 0 HD2 PRO A 49 9.082 12.361 18.487 1.00 0.00 H new ATOM 0 HD3 PRO A 49 8.655 13.923 19.156 1.00 0.00 H new ATOM 800 N GLN A 50 12.419 12.816 16.591 1.00 0.00 N ATOM 801 CA GLN A 50 13.536 12.364 15.763 1.00 0.00 C ATOM 802 C GLN A 50 13.432 12.918 14.342 1.00 0.00 C ATOM 803 O GLN A 50 14.457 13.266 13.778 1.00 0.00 O ATOM 804 CB GLN A 50 13.767 10.844 15.806 1.00 0.00 C ATOM 805 CG GLN A 50 15.280 10.506 15.851 1.00 0.00 C ATOM 806 CD GLN A 50 15.934 10.136 14.513 1.00 0.00 C ATOM 807 OE1 GLN A 50 16.790 10.847 13.984 1.00 0.00 O ATOM 808 NE2 GLN A 50 15.603 8.975 13.971 1.00 0.00 N ATOM 0 H GLN A 50 11.739 12.105 16.862 1.00 0.00 H new ATOM 0 HA GLN A 50 14.439 12.783 16.207 1.00 0.00 H new ATOM 0 HB2 GLN A 50 13.272 10.423 16.681 1.00 0.00 H new ATOM 0 HB3 GLN A 50 13.314 10.380 14.930 1.00 0.00 H new ATOM 0 HG2 GLN A 50 15.810 11.364 16.265 1.00 0.00 H new ATOM 0 HG3 GLN A 50 15.425 9.677 16.544 1.00 0.00 H new ATOM 0 HE21 GLN A 50 14.894 8.390 14.413 1.00 0.00 H new ATOM 0 HE22 GLN A 50 16.057 8.665 13.112 1.00 0.00 H new ATOM 817 N VAL A 51 12.229 13.101 13.796 1.00 0.00 N ATOM 818 CA VAL A 51 11.955 13.781 12.536 1.00 0.00 C ATOM 819 C VAL A 51 12.528 15.193 12.609 1.00 0.00 C ATOM 820 O VAL A 51 13.124 15.623 11.624 1.00 0.00 O ATOM 821 CB VAL A 51 10.434 13.773 12.225 1.00 0.00 C ATOM 822 CG1 VAL A 51 10.027 14.685 11.061 1.00 0.00 C ATOM 823 CG2 VAL A 51 9.911 12.371 11.872 1.00 0.00 C ATOM 0 H VAL A 51 11.379 12.761 14.246 1.00 0.00 H new ATOM 0 HA VAL A 51 12.437 13.255 11.712 1.00 0.00 H new ATOM 0 HB VAL A 51 9.994 14.140 13.152 1.00 0.00 H new ATOM 0 HG11 VAL A 51 8.950 14.622 10.909 1.00 0.00 H new ATOM 0 HG12 VAL A 51 10.301 15.714 11.292 1.00 0.00 H new ATOM 0 HG13 VAL A 51 10.541 14.368 10.154 1.00 0.00 H new ATOM 0 HG21 VAL A 51 8.842 12.423 11.664 1.00 0.00 H new ATOM 0 HG22 VAL A 51 10.435 11.998 10.992 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.085 11.696 12.710 1.00 0.00 H new ATOM 833 N ASN A 52 12.425 15.903 13.745 1.00 0.00 N ATOM 834 CA ASN A 52 13.039 17.226 13.850 1.00 0.00 C ATOM 835 C ASN A 52 14.547 17.156 13.609 1.00 0.00 C ATOM 836 O ASN A 52 15.070 17.948 12.812 1.00 0.00 O ATOM 837 CB ASN A 52 12.687 17.909 15.182 1.00 0.00 C ATOM 838 CG ASN A 52 13.892 18.290 16.049 1.00 0.00 C ATOM 839 OD1 ASN A 52 14.478 19.352 15.885 1.00 0.00 O ATOM 840 ND2 ASN A 52 14.310 17.429 16.962 1.00 0.00 N ATOM 0 H ASN A 52 11.934 15.588 14.582 1.00 0.00 H new ATOM 0 HA ASN A 52 12.621 17.853 13.062 1.00 0.00 H new ATOM 0 HB2 ASN A 52 12.110 18.810 14.971 1.00 0.00 H new ATOM 0 HB3 ASN A 52 12.041 17.244 15.755 1.00 0.00 H new ATOM 0 HD21 ASN A 52 15.125 17.648 17.534 1.00 0.00 H new ATOM 0 HD22 ASN A 52 13.817 16.546 17.094 1.00 0.00 H new ATOM 847 N GLU A 53 15.251 16.217 14.251 1.00 0.00 N ATOM 848 CA GLU A 53 16.691 16.153 14.035 1.00 0.00 C ATOM 849 C GLU A 53 16.984 15.597 12.642 1.00 0.00 C ATOM 850 O GLU A 53 17.897 16.094 12.003 1.00 0.00 O ATOM 851 CB GLU A 53 17.464 15.445 15.161 1.00 0.00 C ATOM 852 CG GLU A 53 17.219 13.942 15.304 1.00 0.00 C ATOM 853 CD GLU A 53 18.250 13.290 16.239 1.00 0.00 C ATOM 854 OE1 GLU A 53 18.032 13.257 17.472 1.00 0.00 O ATOM 855 OE2 GLU A 53 19.289 12.802 15.736 1.00 0.00 O ATOM 0 H GLU A 53 14.867 15.524 14.893 1.00 0.00 H new ATOM 0 HA GLU A 53 17.075 17.172 14.076 1.00 0.00 H new ATOM 0 HB2 GLU A 53 18.530 15.605 14.998 1.00 0.00 H new ATOM 0 HB3 GLU A 53 17.210 15.925 16.106 1.00 0.00 H new ATOM 0 HG2 GLU A 53 16.215 13.771 15.692 1.00 0.00 H new ATOM 0 HG3 GLU A 53 17.266 13.470 14.323 1.00 0.00 H new ATOM 862 N PHE A 54 16.189 14.659 12.117 1.00 0.00 N ATOM 863 CA PHE A 54 16.355 14.045 10.802 1.00 0.00 C ATOM 864 C PHE A 54 16.316 15.140 9.746 1.00 0.00 C ATOM 865 O PHE A 54 17.158 15.195 8.849 1.00 0.00 O ATOM 866 CB PHE A 54 15.221 13.027 10.565 1.00 0.00 C ATOM 867 CG PHE A 54 15.613 11.771 9.825 1.00 0.00 C ATOM 868 CD1 PHE A 54 15.704 11.771 8.424 1.00 0.00 C ATOM 869 CD2 PHE A 54 15.812 10.576 10.542 1.00 0.00 C ATOM 870 CE1 PHE A 54 15.997 10.576 7.749 1.00 0.00 C ATOM 871 CE2 PHE A 54 16.086 9.377 9.863 1.00 0.00 C ATOM 872 CZ PHE A 54 16.182 9.378 8.462 1.00 0.00 C ATOM 0 H PHE A 54 15.380 14.294 12.620 1.00 0.00 H new ATOM 0 HA PHE A 54 17.309 13.521 10.745 1.00 0.00 H new ATOM 0 HB2 PHE A 54 14.805 12.742 11.532 1.00 0.00 H new ATOM 0 HB3 PHE A 54 14.425 13.521 10.008 1.00 0.00 H new ATOM 0 HD1 PHE A 54 15.550 12.685 7.869 1.00 0.00 H new ATOM 0 HD2 PHE A 54 15.754 10.581 11.620 1.00 0.00 H new ATOM 0 HE1 PHE A 54 16.081 10.576 6.672 1.00 0.00 H new ATOM 0 HE2 PHE A 54 16.222 8.459 10.416 1.00 0.00 H new ATOM 0 HZ PHE A 54 16.397 8.461 7.933 1.00 0.00 H new ATOM 882 N ARG A 55 15.345 16.043 9.902 1.00 0.00 N ATOM 883 CA ARG A 55 15.143 17.175 9.030 1.00 0.00 C ATOM 884 C ARG A 55 16.381 18.047 9.008 1.00 0.00 C ATOM 885 O ARG A 55 16.858 18.341 7.923 1.00 0.00 O ATOM 886 CB ARG A 55 13.818 17.866 9.415 1.00 0.00 C ATOM 887 CG ARG A 55 13.549 19.294 8.891 1.00 0.00 C ATOM 888 CD ARG A 55 14.326 20.430 9.587 1.00 0.00 C ATOM 889 NE ARG A 55 14.442 20.218 11.043 1.00 0.00 N ATOM 890 CZ ARG A 55 14.025 21.009 12.041 1.00 0.00 C ATOM 891 NH1 ARG A 55 13.345 22.123 11.836 1.00 0.00 N ATOM 892 NH2 ARG A 55 14.285 20.664 13.290 1.00 0.00 N ATOM 0 H ARG A 55 14.666 15.995 10.662 1.00 0.00 H new ATOM 0 HA ARG A 55 15.020 16.878 7.988 1.00 0.00 H new ATOM 0 HB2 ARG A 55 13.002 17.229 9.074 1.00 0.00 H new ATOM 0 HB3 ARG A 55 13.765 17.897 10.503 1.00 0.00 H new ATOM 0 HG2 ARG A 55 13.785 19.319 7.827 1.00 0.00 H new ATOM 0 HG3 ARG A 55 12.483 19.499 8.986 1.00 0.00 H new ATOM 0 HD2 ARG A 55 15.323 20.505 9.152 1.00 0.00 H new ATOM 0 HD3 ARG A 55 13.824 21.379 9.399 1.00 0.00 H new ATOM 0 HE ARG A 55 14.901 19.353 11.328 1.00 0.00 H new ATOM 0 HH11 ARG A 55 13.116 22.413 10.885 1.00 0.00 H new ATOM 0 HH12 ARG A 55 13.049 22.693 12.628 1.00 0.00 H new ATOM 0 HH21 ARG A 55 14.798 19.804 13.485 1.00 0.00 H new ATOM 0 HH22 ARG A 55 13.973 21.258 14.059 1.00 0.00 H new ATOM 906 N ASP A 56 16.942 18.437 10.153 1.00 0.00 N ATOM 907 CA ASP A 56 18.080 19.365 10.139 1.00 0.00 C ATOM 908 C ASP A 56 19.349 18.660 9.668 1.00 0.00 C ATOM 909 O ASP A 56 20.127 19.190 8.872 1.00 0.00 O ATOM 910 CB ASP A 56 18.302 19.927 11.538 1.00 0.00 C ATOM 911 CG ASP A 56 19.541 20.839 11.575 1.00 0.00 C ATOM 912 OD1 ASP A 56 19.476 21.970 11.045 1.00 0.00 O ATOM 913 OD2 ASP A 56 20.574 20.440 12.154 1.00 0.00 O ATOM 0 H ASP A 56 16.640 18.137 11.080 1.00 0.00 H new ATOM 0 HA ASP A 56 17.854 20.176 9.447 1.00 0.00 H new ATOM 0 HB2 ASP A 56 17.423 20.489 11.852 1.00 0.00 H new ATOM 0 HB3 ASP A 56 18.427 19.109 12.247 1.00 0.00 H new ATOM 918 N LYS A 57 19.522 17.429 10.142 1.00 0.00 N ATOM 919 CA LYS A 57 20.682 16.581 9.936 1.00 0.00 C ATOM 920 C LYS A 57 20.857 16.205 8.468 1.00 0.00 C ATOM 921 O LYS A 57 21.998 16.035 8.035 1.00 0.00 O ATOM 922 CB LYS A 57 20.460 15.364 10.842 1.00 0.00 C ATOM 923 CG LYS A 57 21.517 14.265 10.917 1.00 0.00 C ATOM 924 CD LYS A 57 21.188 13.285 12.070 1.00 0.00 C ATOM 925 CE LYS A 57 19.692 12.904 12.175 1.00 0.00 C ATOM 926 NZ LYS A 57 19.440 11.834 13.166 1.00 0.00 N ATOM 0 H LYS A 57 18.811 16.974 10.714 1.00 0.00 H new ATOM 0 HA LYS A 57 21.610 17.091 10.193 1.00 0.00 H new ATOM 0 HB2 LYS A 57 20.308 15.737 11.855 1.00 0.00 H new ATOM 0 HB3 LYS A 57 19.526 14.895 10.532 1.00 0.00 H new ATOM 0 HG2 LYS A 57 21.558 13.725 9.971 1.00 0.00 H new ATOM 0 HG3 LYS A 57 22.501 14.707 11.075 1.00 0.00 H new ATOM 0 HD2 LYS A 57 21.774 12.376 11.936 1.00 0.00 H new ATOM 0 HD3 LYS A 57 21.504 13.732 13.012 1.00 0.00 H new ATOM 0 HE2 LYS A 57 19.115 13.788 12.447 1.00 0.00 H new ATOM 0 HE3 LYS A 57 19.335 12.579 11.198 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 18.445 11.537 13.111 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 20.056 11.021 12.963 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 19.642 12.191 14.122 1.00 0.00 H new ATOM 940 N TYR A 58 19.764 16.115 7.698 1.00 0.00 N ATOM 941 CA TYR A 58 19.805 15.633 6.322 1.00 0.00 C ATOM 942 C TYR A 58 19.158 16.582 5.310 1.00 0.00 C ATOM 943 O TYR A 58 19.225 16.259 4.128 1.00 0.00 O ATOM 944 CB TYR A 58 19.223 14.208 6.234 1.00 0.00 C ATOM 945 CG TYR A 58 19.945 13.166 7.075 1.00 0.00 C ATOM 946 CD1 TYR A 58 21.278 12.823 6.778 1.00 0.00 C ATOM 947 CD2 TYR A 58 19.283 12.530 8.145 1.00 0.00 C ATOM 948 CE1 TYR A 58 21.967 11.892 7.576 1.00 0.00 C ATOM 949 CE2 TYR A 58 19.960 11.585 8.937 1.00 0.00 C ATOM 950 CZ TYR A 58 21.318 11.289 8.677 1.00 0.00 C ATOM 951 OH TYR A 58 22.018 10.456 9.494 1.00 0.00 O ATOM 0 H TYR A 58 18.831 16.375 8.016 1.00 0.00 H new ATOM 0 HA TYR A 58 20.856 15.600 6.036 1.00 0.00 H new ATOM 0 HB2 TYR A 58 18.177 14.239 6.540 1.00 0.00 H new ATOM 0 HB3 TYR A 58 19.241 13.888 5.192 1.00 0.00 H new ATOM 0 HD1 TYR A 58 21.774 13.277 5.933 1.00 0.00 H new ATOM 0 HD2 TYR A 58 18.252 12.769 8.358 1.00 0.00 H new ATOM 0 HE1 TYR A 58 22.992 11.638 7.347 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.443 11.086 9.743 1.00 0.00 H new ATOM 0 HH TYR A 58 21.611 10.454 10.385 1.00 0.00 H new ATOM 961 N GLN A 59 18.604 17.752 5.674 1.00 0.00 N ATOM 962 CA GLN A 59 18.019 18.673 4.673 1.00 0.00 C ATOM 963 C GLN A 59 18.957 19.049 3.510 1.00 0.00 C ATOM 964 O GLN A 59 18.492 19.399 2.426 1.00 0.00 O ATOM 965 CB GLN A 59 17.394 19.938 5.304 1.00 0.00 C ATOM 966 CG GLN A 59 18.226 20.717 6.341 1.00 0.00 C ATOM 967 CD GLN A 59 19.586 21.209 5.850 1.00 0.00 C ATOM 968 OE1 GLN A 59 19.686 21.966 4.888 1.00 0.00 O ATOM 969 NE2 GLN A 59 20.659 20.788 6.503 1.00 0.00 N ATOM 0 H GLN A 59 18.547 18.082 6.637 1.00 0.00 H new ATOM 0 HA GLN A 59 17.216 18.083 4.232 1.00 0.00 H new ATOM 0 HB2 GLN A 59 17.141 20.624 4.496 1.00 0.00 H new ATOM 0 HB3 GLN A 59 16.457 19.646 5.779 1.00 0.00 H new ATOM 0 HG2 GLN A 59 17.646 21.577 6.676 1.00 0.00 H new ATOM 0 HG3 GLN A 59 18.381 20.079 7.211 1.00 0.00 H new ATOM 0 HE21 GLN A 59 20.557 20.159 7.300 1.00 0.00 H new ATOM 0 HE22 GLN A 59 21.587 21.092 6.209 1.00 0.00 H new ATOM 978 N ASP A 60 20.271 18.961 3.720 1.00 0.00 N ATOM 979 CA ASP A 60 21.294 19.278 2.718 1.00 0.00 C ATOM 980 C ASP A 60 21.491 18.141 1.701 1.00 0.00 C ATOM 981 O ASP A 60 22.182 18.316 0.699 1.00 0.00 O ATOM 982 CB ASP A 60 22.615 19.580 3.442 1.00 0.00 C ATOM 983 CG ASP A 60 23.733 20.020 2.482 1.00 0.00 C ATOM 984 OD1 ASP A 60 23.600 21.086 1.838 1.00 0.00 O ATOM 985 OD2 ASP A 60 24.784 19.343 2.419 1.00 0.00 O ATOM 0 H ASP A 60 20.665 18.660 4.612 1.00 0.00 H new ATOM 0 HA ASP A 60 20.961 20.148 2.152 1.00 0.00 H new ATOM 0 HB2 ASP A 60 22.448 20.363 4.181 1.00 0.00 H new ATOM 0 HB3 ASP A 60 22.938 18.692 3.986 1.00 0.00 H new ATOM 990 N GLN A 61 20.880 16.973 1.938 1.00 0.00 N ATOM 991 CA GLN A 61 21.134 15.731 1.206 1.00 0.00 C ATOM 992 C GLN A 61 19.860 14.923 0.915 1.00 0.00 C ATOM 993 O GLN A 61 19.905 13.994 0.114 1.00 0.00 O ATOM 994 CB GLN A 61 22.064 14.854 2.064 1.00 0.00 C ATOM 995 CG GLN A 61 23.418 15.493 2.410 1.00 0.00 C ATOM 996 CD GLN A 61 24.307 14.519 3.183 1.00 0.00 C ATOM 997 OE1 GLN A 61 25.030 13.714 2.601 1.00 0.00 O ATOM 998 NE2 GLN A 61 24.277 14.560 4.508 1.00 0.00 N ATOM 0 H GLN A 61 20.175 16.866 2.667 1.00 0.00 H new ATOM 0 HA GLN A 61 21.574 16.004 0.247 1.00 0.00 H new ATOM 0 HB2 GLN A 61 21.549 14.603 2.992 1.00 0.00 H new ATOM 0 HB3 GLN A 61 22.245 13.917 1.537 1.00 0.00 H new ATOM 0 HG2 GLN A 61 23.922 15.801 1.494 1.00 0.00 H new ATOM 0 HG3 GLN A 61 23.257 16.393 3.004 1.00 0.00 H new ATOM 0 HE21 GLN A 61 23.674 15.231 4.984 1.00 0.00 H new ATOM 0 HE22 GLN A 61 24.857 13.920 5.051 1.00 0.00 H new ATOM 1007 N LEU A 62 18.733 15.248 1.549 1.00 0.00 N ATOM 1008 CA LEU A 62 17.503 14.466 1.559 1.00 0.00 C ATOM 1009 C LEU A 62 16.332 15.439 1.650 1.00 0.00 C ATOM 1010 O LEU A 62 16.401 16.433 2.374 1.00 0.00 O ATOM 1011 CB LEU A 62 17.515 13.577 2.816 1.00 0.00 C ATOM 1012 CG LEU A 62 16.260 12.713 3.048 1.00 0.00 C ATOM 1013 CD1 LEU A 62 16.218 11.502 2.110 1.00 0.00 C ATOM 1014 CD2 LEU A 62 16.251 12.242 4.502 1.00 0.00 C ATOM 0 H LEU A 62 18.652 16.106 2.095 1.00 0.00 H new ATOM 0 HA LEU A 62 17.417 13.851 0.663 1.00 0.00 H new ATOM 0 HB2 LEU A 62 18.381 12.917 2.761 1.00 0.00 H new ATOM 0 HB3 LEU A 62 17.657 14.217 3.687 1.00 0.00 H new ATOM 0 HG LEU A 62 15.380 13.319 2.835 1.00 0.00 H new ATOM 0 HD11 LEU A 62 15.318 10.920 2.307 1.00 0.00 H new ATOM 0 HD12 LEU A 62 16.210 11.844 1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.097 10.880 2.280 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.368 11.629 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 62 17.147 11.653 4.699 1.00 0.00 H new ATOM 0 HD23 LEU A 62 16.232 13.107 5.165 1.00 0.00 H new ATOM 1026 N ASN A 63 15.239 15.120 0.963 1.00 0.00 N ATOM 1027 CA ASN A 63 13.987 15.861 1.053 1.00 0.00 C ATOM 1028 C ASN A 63 13.084 15.119 2.030 1.00 0.00 C ATOM 1029 O ASN A 63 12.508 14.098 1.653 1.00 0.00 O ATOM 1030 CB ASN A 63 13.298 15.961 -0.318 1.00 0.00 C ATOM 1031 CG ASN A 63 14.131 16.700 -1.351 1.00 0.00 C ATOM 1032 OD1 ASN A 63 13.978 17.902 -1.545 1.00 0.00 O ATOM 1033 ND2 ASN A 63 15.036 16.001 -2.014 1.00 0.00 N ATOM 0 H ASN A 63 15.198 14.329 0.320 1.00 0.00 H new ATOM 0 HA ASN A 63 14.186 16.877 1.394 1.00 0.00 H new ATOM 0 HB2 ASN A 63 13.083 14.957 -0.684 1.00 0.00 H new ATOM 0 HB3 ASN A 63 12.341 16.469 -0.201 1.00 0.00 H new ATOM 0 HD21 ASN A 63 15.628 16.460 -2.706 1.00 0.00 H new ATOM 0 HD22 ASN A 63 15.142 15.003 -1.833 1.00 0.00 H new ATOM 1040 N VAL A 64 12.986 15.562 3.283 1.00 0.00 N ATOM 1041 CA VAL A 64 11.963 15.017 4.173 1.00 0.00 C ATOM 1042 C VAL A 64 10.635 15.661 3.747 1.00 0.00 C ATOM 1043 O VAL A 64 10.593 16.861 3.460 1.00 0.00 O ATOM 1044 CB VAL A 64 12.267 15.266 5.671 1.00 0.00 C ATOM 1045 CG1 VAL A 64 11.690 14.109 6.504 1.00 0.00 C ATOM 1046 CG2 VAL A 64 13.766 15.347 6.012 1.00 0.00 C ATOM 0 H VAL A 64 13.585 16.277 3.696 1.00 0.00 H new ATOM 0 HA VAL A 64 11.927 13.932 4.081 1.00 0.00 H new ATOM 0 HB VAL A 64 11.816 16.231 5.900 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.902 14.280 7.560 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.612 14.055 6.354 1.00 0.00 H new ATOM 0 HG13 VAL A 64 12.147 13.171 6.190 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.887 15.523 7.081 1.00 0.00 H new ATOM 0 HG22 VAL A 64 14.252 14.410 5.741 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.222 16.166 5.456 1.00 0.00 H new ATOM 1056 N VAL A 65 9.560 14.883 3.698 1.00 0.00 N ATOM 1057 CA VAL A 65 8.194 15.354 3.506 1.00 0.00 C ATOM 1058 C VAL A 65 7.296 14.391 4.288 1.00 0.00 C ATOM 1059 O VAL A 65 7.685 13.243 4.537 1.00 0.00 O ATOM 1060 CB VAL A 65 7.878 15.454 1.993 1.00 0.00 C ATOM 1061 CG1 VAL A 65 8.104 14.143 1.228 1.00 0.00 C ATOM 1062 CG2 VAL A 65 6.453 15.952 1.697 1.00 0.00 C ATOM 0 H VAL A 65 9.618 13.869 3.795 1.00 0.00 H new ATOM 0 HA VAL A 65 8.027 16.362 3.886 1.00 0.00 H new ATOM 0 HB VAL A 65 8.594 16.195 1.637 1.00 0.00 H new ATOM 0 HG11 VAL A 65 7.862 14.290 0.175 1.00 0.00 H new ATOM 0 HG12 VAL A 65 9.147 13.842 1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 65 7.463 13.365 1.642 1.00 0.00 H new ATOM 0 HG21 VAL A 65 6.300 15.998 0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 65 5.729 15.266 2.137 1.00 0.00 H new ATOM 0 HG23 VAL A 65 6.318 16.945 2.125 1.00 0.00 H new ATOM 1072 N ALA A 66 6.099 14.823 4.690 1.00 0.00 N ATOM 1073 CA ALA A 66 5.255 13.994 5.536 1.00 0.00 C ATOM 1074 C ALA A 66 3.772 14.123 5.240 1.00 0.00 C ATOM 1075 O ALA A 66 3.316 15.079 4.610 1.00 0.00 O ATOM 1076 CB ALA A 66 5.531 14.327 6.998 1.00 0.00 C ATOM 0 H ALA A 66 5.701 15.730 4.445 1.00 0.00 H new ATOM 0 HA ALA A 66 5.511 12.957 5.320 1.00 0.00 H new ATOM 0 HB1 ALA A 66 4.901 13.708 7.637 1.00 0.00 H new ATOM 0 HB2 ALA A 66 6.579 14.132 7.224 1.00 0.00 H new ATOM 0 HB3 ALA A 66 5.310 15.379 7.180 1.00 0.00 H new ATOM 1082 N VAL A 67 3.020 13.160 5.765 1.00 0.00 N ATOM 1083 CA VAL A 67 1.598 13.015 5.549 1.00 0.00 C ATOM 1084 C VAL A 67 1.016 12.634 6.905 1.00 0.00 C ATOM 1085 O VAL A 67 1.291 11.549 7.423 1.00 0.00 O ATOM 1086 CB VAL A 67 1.328 11.956 4.458 1.00 0.00 C ATOM 1087 CG1 VAL A 67 -0.172 11.907 4.162 1.00 0.00 C ATOM 1088 CG2 VAL A 67 2.088 12.246 3.150 1.00 0.00 C ATOM 0 H VAL A 67 3.405 12.437 6.373 1.00 0.00 H new ATOM 0 HA VAL A 67 1.131 13.930 5.185 1.00 0.00 H new ATOM 0 HB VAL A 67 1.683 10.999 4.840 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -0.367 11.160 3.392 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -0.714 11.642 5.070 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -0.506 12.884 3.813 1.00 0.00 H new ATOM 0 HG21 VAL A 67 1.862 11.471 2.418 1.00 0.00 H new ATOM 0 HG22 VAL A 67 1.781 13.216 2.758 1.00 0.00 H new ATOM 0 HG23 VAL A 67 3.160 12.257 3.347 1.00 0.00 H new ATOM 1098 N HIS A 68 0.272 13.543 7.530 1.00 0.00 N ATOM 1099 CA HIS A 68 -0.452 13.181 8.737 1.00 0.00 C ATOM 1100 C HIS A 68 -1.631 12.319 8.302 1.00 0.00 C ATOM 1101 O HIS A 68 -2.479 12.799 7.552 1.00 0.00 O ATOM 1102 CB HIS A 68 -0.946 14.430 9.467 1.00 0.00 C ATOM 1103 CG HIS A 68 -1.669 14.048 10.731 1.00 0.00 C ATOM 1104 ND1 HIS A 68 -2.972 13.613 10.816 1.00 0.00 N ATOM 1105 CD2 HIS A 68 -1.133 13.970 11.988 1.00 0.00 C ATOM 1106 CE1 HIS A 68 -3.220 13.295 12.096 1.00 0.00 C ATOM 1107 NE2 HIS A 68 -2.126 13.494 12.853 1.00 0.00 N ATOM 0 H HIS A 68 0.158 14.511 7.228 1.00 0.00 H new ATOM 0 HA HIS A 68 0.195 12.640 9.427 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -0.102 15.078 9.705 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -1.611 14.999 8.818 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -3.633 13.544 10.042 1.00 0.00 H new ATOM 0 HD2 HIS A 68 -0.122 14.230 12.264 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -4.166 12.930 12.467 1.00 0.00 H new ATOM 1115 N MET A 69 -1.718 11.075 8.768 1.00 0.00 N ATOM 1116 CA MET A 69 -2.873 10.231 8.528 1.00 0.00 C ATOM 1117 C MET A 69 -3.920 10.580 9.588 1.00 0.00 C ATOM 1118 O MET A 69 -3.688 10.267 10.759 1.00 0.00 O ATOM 1119 CB MET A 69 -2.455 8.756 8.588 1.00 0.00 C ATOM 1120 CG MET A 69 -3.616 7.848 8.169 1.00 0.00 C ATOM 1121 SD MET A 69 -3.238 6.078 8.207 1.00 0.00 S ATOM 1122 CE MET A 69 -4.807 5.418 7.595 1.00 0.00 C ATOM 0 H MET A 69 -0.987 10.629 9.322 1.00 0.00 H new ATOM 0 HA MET A 69 -3.297 10.398 7.538 1.00 0.00 H new ATOM 0 HB2 MET A 69 -1.600 8.588 7.933 1.00 0.00 H new ATOM 0 HB3 MET A 69 -2.136 8.504 9.599 1.00 0.00 H new ATOM 0 HG2 MET A 69 -4.465 8.039 8.825 1.00 0.00 H new ATOM 0 HG3 MET A 69 -3.926 8.119 7.160 1.00 0.00 H new ATOM 0 HE1 MET A 69 -4.872 4.356 7.831 1.00 0.00 H new ATOM 0 HE2 MET A 69 -5.634 5.947 8.069 1.00 0.00 H new ATOM 0 HE3 MET A 69 -4.862 5.553 6.515 1.00 0.00 H new ATOM 1132 N PRO A 70 -5.050 11.232 9.242 1.00 0.00 N ATOM 1133 CA PRO A 70 -6.139 11.366 10.189 1.00 0.00 C ATOM 1134 C PRO A 70 -6.640 9.947 10.464 1.00 0.00 C ATOM 1135 O PRO A 70 -6.863 9.149 9.548 1.00 0.00 O ATOM 1136 CB PRO A 70 -7.166 12.285 9.541 1.00 0.00 C ATOM 1137 CG PRO A 70 -6.960 12.037 8.046 1.00 0.00 C ATOM 1138 CD PRO A 70 -5.469 11.716 7.933 1.00 0.00 C ATOM 0 HA PRO A 70 -5.872 11.810 11.148 1.00 0.00 H new ATOM 0 HB2 PRO A 70 -8.181 12.040 9.854 1.00 0.00 H new ATOM 0 HB3 PRO A 70 -6.995 13.329 9.804 1.00 0.00 H new ATOM 0 HG2 PRO A 70 -7.575 11.211 7.689 1.00 0.00 H new ATOM 0 HG3 PRO A 70 -7.227 12.913 7.454 1.00 0.00 H new ATOM 0 HD2 PRO A 70 -5.291 10.963 7.166 1.00 0.00 H new ATOM 0 HD3 PRO A 70 -4.902 12.602 7.647 1.00 0.00 H new ATOM 1146 N ARG A 71 -6.795 9.636 11.740 1.00 0.00 N ATOM 1147 CA ARG A 71 -7.024 8.299 12.246 1.00 0.00 C ATOM 1148 C ARG A 71 -8.042 8.315 13.387 1.00 0.00 C ATOM 1149 O ARG A 71 -8.805 7.354 13.510 1.00 0.00 O ATOM 1150 CB ARG A 71 -5.636 7.812 12.697 1.00 0.00 C ATOM 1151 CG ARG A 71 -5.652 6.425 13.354 1.00 0.00 C ATOM 1152 CD ARG A 71 -4.334 6.207 14.091 1.00 0.00 C ATOM 1153 NE ARG A 71 -4.337 4.945 14.849 1.00 0.00 N ATOM 1154 CZ ARG A 71 -4.855 4.756 16.073 1.00 0.00 C ATOM 1155 NH1 ARG A 71 -5.518 5.722 16.708 1.00 0.00 N ATOM 1156 NH2 ARG A 71 -4.715 3.572 16.662 1.00 0.00 N ATOM 0 H ARG A 71 -6.763 10.338 12.479 1.00 0.00 H new ATOM 0 HA ARG A 71 -7.451 7.630 11.499 1.00 0.00 H new ATOM 0 HB2 ARG A 71 -4.971 7.788 11.834 1.00 0.00 H new ATOM 0 HB3 ARG A 71 -5.219 8.533 13.400 1.00 0.00 H new ATOM 0 HG2 ARG A 71 -6.489 6.347 14.048 1.00 0.00 H new ATOM 0 HG3 ARG A 71 -5.793 5.652 12.598 1.00 0.00 H new ATOM 0 HD2 ARG A 71 -3.513 6.199 13.374 1.00 0.00 H new ATOM 0 HD3 ARG A 71 -4.155 7.040 14.771 1.00 0.00 H new ATOM 0 HE ARG A 71 -3.904 4.137 14.401 1.00 0.00 H new ATOM 0 HH11 ARG A 71 -5.642 6.632 16.264 1.00 0.00 H new ATOM 0 HH12 ARG A 71 -5.901 5.551 17.638 1.00 0.00 H new ATOM 0 HH21 ARG A 71 -4.219 2.820 16.184 1.00 0.00 H new ATOM 0 HH22 ARG A 71 -5.104 3.416 17.592 1.00 0.00 H new ATOM 1170 N SER A 72 -8.106 9.387 14.178 1.00 0.00 N ATOM 1171 CA SER A 72 -8.874 9.421 15.418 1.00 0.00 C ATOM 1172 C SER A 72 -9.378 10.843 15.680 1.00 0.00 C ATOM 1173 O SER A 72 -8.809 11.812 15.180 1.00 0.00 O ATOM 1174 CB SER A 72 -7.985 8.952 16.593 1.00 0.00 C ATOM 1175 OG SER A 72 -6.794 8.288 16.189 1.00 0.00 O ATOM 0 H SER A 72 -7.622 10.261 13.972 1.00 0.00 H new ATOM 0 HA SER A 72 -9.731 8.753 15.328 1.00 0.00 H new ATOM 0 HB2 SER A 72 -7.718 9.817 17.201 1.00 0.00 H new ATOM 0 HB3 SER A 72 -8.564 8.282 17.228 1.00 0.00 H new ATOM 0 HG SER A 72 -6.194 8.929 15.754 1.00 0.00 H new ATOM 1181 N GLU A 73 -10.404 11.002 16.519 1.00 0.00 N ATOM 1182 CA GLU A 73 -10.905 12.321 16.914 1.00 0.00 C ATOM 1183 C GLU A 73 -9.810 13.150 17.611 1.00 0.00 C ATOM 1184 O GLU A 73 -9.792 14.376 17.504 1.00 0.00 O ATOM 1185 CB GLU A 73 -12.170 12.141 17.763 1.00 0.00 C ATOM 1186 CG GLU A 73 -12.839 13.469 18.147 1.00 0.00 C ATOM 1187 CD GLU A 73 -14.177 13.238 18.869 1.00 0.00 C ATOM 1188 OE1 GLU A 73 -14.188 13.086 20.113 1.00 0.00 O ATOM 1189 OE2 GLU A 73 -15.240 13.224 18.207 1.00 0.00 O ATOM 0 H GLU A 73 -10.909 10.224 16.942 1.00 0.00 H new ATOM 0 HA GLU A 73 -11.179 12.896 16.030 1.00 0.00 H new ATOM 0 HB2 GLU A 73 -12.884 11.528 17.213 1.00 0.00 H new ATOM 0 HB3 GLU A 73 -11.915 11.595 18.671 1.00 0.00 H new ATOM 0 HG2 GLU A 73 -12.171 14.041 18.791 1.00 0.00 H new ATOM 0 HG3 GLU A 73 -13.006 14.066 17.250 1.00 0.00 H new ATOM 1196 N ASP A 74 -8.853 12.479 18.259 1.00 0.00 N ATOM 1197 CA ASP A 74 -7.702 13.105 18.911 1.00 0.00 C ATOM 1198 C ASP A 74 -6.702 13.720 17.918 1.00 0.00 C ATOM 1199 O ASP A 74 -5.785 14.421 18.343 1.00 0.00 O ATOM 1200 CB ASP A 74 -6.986 12.065 19.788 1.00 0.00 C ATOM 1201 CG ASP A 74 -5.962 12.704 20.743 1.00 0.00 C ATOM 1202 OD1 ASP A 74 -6.329 13.620 21.514 1.00 0.00 O ATOM 1203 OD2 ASP A 74 -4.808 12.224 20.799 1.00 0.00 O ATOM 0 H ASP A 74 -8.858 11.463 18.346 1.00 0.00 H new ATOM 0 HA ASP A 74 -8.086 13.925 19.518 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -7.725 11.514 20.369 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -6.480 11.342 19.148 1.00 0.00 H new ATOM 1208 N ASP A 75 -6.848 13.477 16.607 1.00 0.00 N ATOM 1209 CA ASP A 75 -5.844 13.827 15.600 1.00 0.00 C ATOM 1210 C ASP A 75 -6.401 14.333 14.266 1.00 0.00 C ATOM 1211 O ASP A 75 -5.648 14.921 13.495 1.00 0.00 O ATOM 1212 CB ASP A 75 -4.920 12.622 15.347 1.00 0.00 C ATOM 1213 CG ASP A 75 -5.581 11.433 14.652 1.00 0.00 C ATOM 1214 OD1 ASP A 75 -6.120 11.580 13.540 1.00 0.00 O ATOM 1215 OD2 ASP A 75 -5.527 10.318 15.216 1.00 0.00 O ATOM 0 H ASP A 75 -7.676 13.027 16.216 1.00 0.00 H new ATOM 0 HA ASP A 75 -5.297 14.669 16.024 1.00 0.00 H new ATOM 0 HB2 ASP A 75 -4.075 12.952 14.743 1.00 0.00 H new ATOM 0 HB3 ASP A 75 -4.517 12.286 16.302 1.00 0.00 H new ATOM 1220 N LEU A 76 -7.697 14.175 13.988 1.00 0.00 N ATOM 1221 CA LEU A 76 -8.274 14.415 12.664 1.00 0.00 C ATOM 1222 C LEU A 76 -8.380 15.890 12.259 1.00 0.00 C ATOM 1223 O LEU A 76 -8.857 16.180 11.158 1.00 0.00 O ATOM 1224 CB LEU A 76 -9.611 13.653 12.530 1.00 0.00 C ATOM 1225 CG LEU A 76 -10.763 14.080 13.470 1.00 0.00 C ATOM 1226 CD1 LEU A 76 -11.422 15.417 13.107 1.00 0.00 C ATOM 1227 CD2 LEU A 76 -11.851 12.997 13.456 1.00 0.00 C ATOM 0 H LEU A 76 -8.381 13.874 14.682 1.00 0.00 H new ATOM 0 HA LEU A 76 -7.565 14.015 11.939 1.00 0.00 H new ATOM 0 HB2 LEU A 76 -9.958 13.756 11.502 1.00 0.00 H new ATOM 0 HB3 LEU A 76 -9.415 12.594 12.695 1.00 0.00 H new ATOM 0 HG LEU A 76 -10.310 14.207 14.453 1.00 0.00 H new ATOM 0 HD11 LEU A 76 -12.218 15.636 13.819 1.00 0.00 H new ATOM 0 HD12 LEU A 76 -10.676 16.211 13.141 1.00 0.00 H new ATOM 0 HD13 LEU A 76 -11.841 15.355 12.103 1.00 0.00 H new ATOM 0 HD21 LEU A 76 -12.666 13.292 14.117 1.00 0.00 H new ATOM 0 HD22 LEU A 76 -12.231 12.877 12.442 1.00 0.00 H new ATOM 0 HD23 LEU A 76 -11.429 12.053 13.800 1.00 0.00 H new ATOM 1239 N ASP A 77 -7.965 16.820 13.120 1.00 0.00 N ATOM 1240 CA ASP A 77 -8.159 18.259 12.939 1.00 0.00 C ATOM 1241 C ASP A 77 -6.811 18.963 12.727 1.00 0.00 C ATOM 1242 O ASP A 77 -5.949 18.888 13.609 1.00 0.00 O ATOM 1243 CB ASP A 77 -8.858 18.852 14.161 1.00 0.00 C ATOM 1244 CG ASP A 77 -9.083 20.356 13.963 1.00 0.00 C ATOM 1245 OD1 ASP A 77 -8.178 21.145 14.309 1.00 0.00 O ATOM 1246 OD2 ASP A 77 -10.154 20.745 13.448 1.00 0.00 O ATOM 0 H ASP A 77 -7.473 16.588 13.983 1.00 0.00 H new ATOM 0 HA ASP A 77 -8.780 18.413 12.057 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -9.813 18.352 14.321 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -8.255 18.681 15.053 1.00 0.00 H new ATOM 1251 N PRO A 78 -6.596 19.661 11.596 1.00 0.00 N ATOM 1252 CA PRO A 78 -5.336 20.331 11.297 1.00 0.00 C ATOM 1253 C PRO A 78 -4.842 21.351 12.321 1.00 0.00 C ATOM 1254 O PRO A 78 -3.648 21.648 12.317 1.00 0.00 O ATOM 1255 CB PRO A 78 -5.502 21.002 9.941 1.00 0.00 C ATOM 1256 CG PRO A 78 -6.610 20.199 9.277 1.00 0.00 C ATOM 1257 CD PRO A 78 -7.480 19.736 10.443 1.00 0.00 C ATOM 0 HA PRO A 78 -4.565 19.561 11.315 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -5.775 22.052 10.044 1.00 0.00 H new ATOM 0 HB3 PRO A 78 -4.580 20.968 9.361 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -7.177 20.808 8.573 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -6.210 19.354 8.717 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -8.297 20.435 10.622 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -7.931 18.766 10.233 1.00 0.00 H new ATOM 1265 N GLY A 79 -5.703 21.891 13.186 1.00 0.00 N ATOM 1266 CA GLY A 79 -5.287 22.853 14.193 1.00 0.00 C ATOM 1267 C GLY A 79 -4.517 22.124 15.283 1.00 0.00 C ATOM 1268 O GLY A 79 -3.448 22.577 15.694 1.00 0.00 O ATOM 0 H GLY A 79 -6.699 21.672 13.204 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -4.663 23.624 13.742 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -6.157 23.355 14.617 1.00 0.00 H new ATOM 1272 N LYS A 80 -5.000 20.942 15.684 1.00 0.00 N ATOM 1273 CA LYS A 80 -4.270 20.078 16.606 1.00 0.00 C ATOM 1274 C LYS A 80 -2.933 19.698 15.985 1.00 0.00 C ATOM 1275 O LYS A 80 -1.907 19.772 16.659 1.00 0.00 O ATOM 1276 CB LYS A 80 -5.049 18.790 16.908 1.00 0.00 C ATOM 1277 CG LYS A 80 -6.468 18.974 17.460 1.00 0.00 C ATOM 1278 CD LYS A 80 -7.149 17.596 17.483 1.00 0.00 C ATOM 1279 CE LYS A 80 -8.599 17.629 17.992 1.00 0.00 C ATOM 1280 NZ LYS A 80 -8.706 18.001 19.426 1.00 0.00 N ATOM 0 H LYS A 80 -5.898 20.565 15.380 1.00 0.00 H new ATOM 0 HA LYS A 80 -4.127 20.626 17.537 1.00 0.00 H new ATOM 0 HB2 LYS A 80 -5.111 18.203 15.991 1.00 0.00 H new ATOM 0 HB3 LYS A 80 -4.476 18.202 17.625 1.00 0.00 H new ATOM 0 HG2 LYS A 80 -6.435 19.400 18.463 1.00 0.00 H new ATOM 0 HG3 LYS A 80 -7.032 19.668 16.837 1.00 0.00 H new ATOM 0 HD2 LYS A 80 -7.137 17.178 16.476 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -6.567 16.924 18.114 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -9.171 18.339 17.395 1.00 0.00 H new ATOM 0 HE3 LYS A 80 -9.052 16.649 17.842 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 -9.707 18.006 19.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 -8.186 17.310 20.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 -8.301 18.948 19.570 1.00 0.00 H new ATOM 1294 N ILE A 81 -2.951 19.300 14.709 1.00 0.00 N ATOM 1295 CA ILE A 81 -1.765 18.843 13.999 1.00 0.00 C ATOM 1296 C ILE A 81 -0.746 19.985 13.990 1.00 0.00 C ATOM 1297 O ILE A 81 0.362 19.785 14.480 1.00 0.00 O ATOM 1298 CB ILE A 81 -2.135 18.324 12.588 1.00 0.00 C ATOM 1299 CG1 ILE A 81 -3.107 17.125 12.673 1.00 0.00 C ATOM 1300 CG2 ILE A 81 -0.872 17.898 11.813 1.00 0.00 C ATOM 1301 CD1 ILE A 81 -3.732 16.739 11.324 1.00 0.00 C ATOM 0 H ILE A 81 -3.798 19.288 14.141 1.00 0.00 H new ATOM 0 HA ILE A 81 -1.309 17.991 14.504 1.00 0.00 H new ATOM 0 HB ILE A 81 -2.625 19.142 12.059 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.573 16.264 13.076 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.904 17.364 13.377 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -1.156 17.537 10.825 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -0.204 18.753 11.709 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -0.362 17.103 12.357 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -4.402 15.891 11.463 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.295 17.585 10.928 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.944 16.468 10.622 1.00 0.00 H new ATOM 1313 N LYS A 82 -1.107 21.183 13.508 1.00 0.00 N ATOM 1314 CA LYS A 82 -0.229 22.343 13.519 1.00 0.00 C ATOM 1315 C LYS A 82 0.326 22.650 14.906 1.00 0.00 C ATOM 1316 O LYS A 82 1.539 22.804 15.028 1.00 0.00 O ATOM 1317 CB LYS A 82 -0.985 23.545 12.924 1.00 0.00 C ATOM 1318 CG LYS A 82 -0.159 24.839 12.841 1.00 0.00 C ATOM 1319 CD LYS A 82 1.162 24.643 12.082 1.00 0.00 C ATOM 1320 CE LYS A 82 1.977 25.940 11.945 1.00 0.00 C ATOM 1321 NZ LYS A 82 1.310 26.973 11.109 1.00 0.00 N ATOM 0 H LYS A 82 -2.023 21.367 13.099 1.00 0.00 H new ATOM 0 HA LYS A 82 0.643 22.123 12.904 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -1.328 23.283 11.923 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -1.873 23.734 13.527 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -0.748 25.612 12.346 1.00 0.00 H new ATOM 0 HG3 LYS A 82 0.054 25.196 13.849 1.00 0.00 H new ATOM 0 HD2 LYS A 82 1.764 23.896 12.599 1.00 0.00 H new ATOM 0 HD3 LYS A 82 0.948 24.249 11.089 1.00 0.00 H new ATOM 0 HE2 LYS A 82 2.161 26.351 12.938 1.00 0.00 H new ATOM 0 HE3 LYS A 82 2.949 25.705 11.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 1.927 27.807 11.030 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 1.126 26.587 10.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 0.410 27.249 11.551 1.00 0.00 H new ATOM 1335 N GLU A 83 -0.510 22.733 15.943 1.00 0.00 N ATOM 1336 CA GLU A 83 -0.036 23.106 17.276 1.00 0.00 C ATOM 1337 C GLU A 83 0.962 22.071 17.810 1.00 0.00 C ATOM 1338 O GLU A 83 1.934 22.429 18.474 1.00 0.00 O ATOM 1339 CB GLU A 83 -1.227 23.260 18.238 1.00 0.00 C ATOM 1340 CG GLU A 83 -2.039 24.544 17.997 1.00 0.00 C ATOM 1341 CD GLU A 83 -1.271 25.813 18.411 1.00 0.00 C ATOM 1342 OE1 GLU A 83 -1.287 26.175 19.610 1.00 0.00 O ATOM 1343 OE2 GLU A 83 -0.662 26.475 17.542 1.00 0.00 O ATOM 0 H GLU A 83 -1.512 22.548 15.886 1.00 0.00 H new ATOM 0 HA GLU A 83 0.480 24.063 17.204 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -1.884 22.397 18.133 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.859 23.258 19.264 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -2.303 24.611 16.941 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -2.973 24.490 18.556 1.00 0.00 H new ATOM 1350 N THR A 84 0.748 20.797 17.494 1.00 0.00 N ATOM 1351 CA THR A 84 1.611 19.696 17.892 1.00 0.00 C ATOM 1352 C THR A 84 2.935 19.753 17.108 1.00 0.00 C ATOM 1353 O THR A 84 4.017 19.802 17.693 1.00 0.00 O ATOM 1354 CB THR A 84 0.798 18.410 17.653 1.00 0.00 C ATOM 1355 OG1 THR A 84 -0.377 18.417 18.441 1.00 0.00 O ATOM 1356 CG2 THR A 84 1.576 17.144 17.956 1.00 0.00 C ATOM 0 H THR A 84 -0.053 20.497 16.939 1.00 0.00 H new ATOM 0 HA THR A 84 1.903 19.742 18.941 1.00 0.00 H new ATOM 0 HB THR A 84 0.553 18.404 16.591 1.00 0.00 H new ATOM 0 HG1 THR A 84 -1.072 18.938 17.987 1.00 0.00 H new ATOM 0 HG21 THR A 84 0.945 16.275 17.767 1.00 0.00 H new ATOM 0 HG22 THR A 84 2.458 17.098 17.318 1.00 0.00 H new ATOM 0 HG23 THR A 84 1.884 17.148 19.002 1.00 0.00 H new ATOM 1364 N ALA A 85 2.857 19.810 15.779 1.00 0.00 N ATOM 1365 CA ALA A 85 3.993 19.916 14.870 1.00 0.00 C ATOM 1366 C ALA A 85 4.908 21.093 15.224 1.00 0.00 C ATOM 1367 O ALA A 85 6.128 20.936 15.279 1.00 0.00 O ATOM 1368 CB ALA A 85 3.443 20.070 13.450 1.00 0.00 C ATOM 0 H ALA A 85 1.963 19.782 15.288 1.00 0.00 H new ATOM 0 HA ALA A 85 4.604 19.017 14.953 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.271 20.152 12.746 1.00 0.00 H new ATOM 0 HB2 ALA A 85 2.837 19.200 13.198 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.828 20.968 13.393 1.00 0.00 H new ATOM 1374 N ALA A 86 4.320 22.255 15.514 1.00 0.00 N ATOM 1375 CA ALA A 86 5.042 23.467 15.881 1.00 0.00 C ATOM 1376 C ALA A 86 5.943 23.261 17.102 1.00 0.00 C ATOM 1377 O ALA A 86 6.975 23.921 17.228 1.00 0.00 O ATOM 1378 CB ALA A 86 4.030 24.572 16.195 1.00 0.00 C ATOM 0 H ALA A 86 3.308 22.379 15.499 1.00 0.00 H new ATOM 0 HA ALA A 86 5.679 23.741 15.040 1.00 0.00 H new ATOM 0 HB1 ALA A 86 4.560 25.483 16.471 1.00 0.00 H new ATOM 0 HB2 ALA A 86 3.415 24.762 15.316 1.00 0.00 H new ATOM 0 HB3 ALA A 86 3.394 24.258 17.022 1.00 0.00 H new ATOM 1384 N GLU A 87 5.555 22.355 17.999 1.00 0.00 N ATOM 1385 CA GLU A 87 6.265 22.089 19.242 1.00 0.00 C ATOM 1386 C GLU A 87 7.329 21.014 19.001 1.00 0.00 C ATOM 1387 O GLU A 87 8.428 21.104 19.551 1.00 0.00 O ATOM 1388 CB GLU A 87 5.251 21.673 20.322 1.00 0.00 C ATOM 1389 CG GLU A 87 4.487 22.867 20.915 1.00 0.00 C ATOM 1390 CD GLU A 87 5.382 23.772 21.782 1.00 0.00 C ATOM 1391 OE1 GLU A 87 5.637 23.436 22.962 1.00 0.00 O ATOM 1392 OE2 GLU A 87 5.821 24.843 21.306 1.00 0.00 O ATOM 0 H GLU A 87 4.723 21.777 17.877 1.00 0.00 H new ATOM 0 HA GLU A 87 6.778 22.985 19.593 1.00 0.00 H new ATOM 0 HB2 GLU A 87 4.538 20.969 19.892 1.00 0.00 H new ATOM 0 HB3 GLU A 87 5.774 21.149 21.122 1.00 0.00 H new ATOM 0 HG2 GLU A 87 4.057 23.456 20.105 1.00 0.00 H new ATOM 0 HG3 GLU A 87 3.657 22.499 21.518 1.00 0.00 H new ATOM 1399 N HIS A 88 7.041 20.037 18.134 1.00 0.00 N ATOM 1400 CA HIS A 88 8.012 19.057 17.659 1.00 0.00 C ATOM 1401 C HIS A 88 9.084 19.641 16.733 1.00 0.00 C ATOM 1402 O HIS A 88 10.034 18.926 16.429 1.00 0.00 O ATOM 1403 CB HIS A 88 7.278 17.903 16.975 1.00 0.00 C ATOM 1404 CG HIS A 88 6.349 17.192 17.918 1.00 0.00 C ATOM 1405 ND1 HIS A 88 6.648 16.771 19.196 1.00 0.00 N ATOM 1406 CD2 HIS A 88 5.051 16.845 17.669 1.00 0.00 C ATOM 1407 CE1 HIS A 88 5.549 16.195 19.705 1.00 0.00 C ATOM 1408 NE2 HIS A 88 4.552 16.195 18.804 1.00 0.00 N ATOM 0 H HIS A 88 6.110 19.907 17.739 1.00 0.00 H new ATOM 0 HA HIS A 88 8.550 18.697 18.536 1.00 0.00 H new ATOM 0 HB2 HIS A 88 6.711 18.286 16.126 1.00 0.00 H new ATOM 0 HB3 HIS A 88 8.005 17.194 16.579 1.00 0.00 H new ATOM 0 HD1 HIS A 88 7.545 16.878 19.670 1.00 0.00 H new ATOM 0 HD2 HIS A 88 4.506 17.038 16.757 1.00 0.00 H new ATOM 0 HE1 HIS A 88 5.475 15.787 20.702 1.00 0.00 H new ATOM 1416 N ASP A 89 8.965 20.902 16.295 1.00 0.00 N ATOM 1417 CA ASP A 89 9.984 21.661 15.562 1.00 0.00 C ATOM 1418 C ASP A 89 10.088 21.236 14.096 1.00 0.00 C ATOM 1419 O ASP A 89 11.035 21.608 13.407 1.00 0.00 O ATOM 1420 CB ASP A 89 11.359 21.621 16.263 1.00 0.00 C ATOM 1421 CG ASP A 89 12.286 22.741 15.758 1.00 0.00 C ATOM 1422 OD1 ASP A 89 11.962 23.934 15.965 1.00 0.00 O ATOM 1423 OD2 ASP A 89 13.362 22.442 15.193 1.00 0.00 O ATOM 0 H ASP A 89 8.115 21.445 16.450 1.00 0.00 H new ATOM 0 HA ASP A 89 9.650 22.699 15.568 1.00 0.00 H new ATOM 0 HB2 ASP A 89 11.222 21.719 17.340 1.00 0.00 H new ATOM 0 HB3 ASP A 89 11.829 20.653 16.089 1.00 0.00 H new ATOM 1428 N ILE A 90 9.144 20.432 13.600 1.00 0.00 N ATOM 1429 CA ILE A 90 9.154 19.954 12.227 1.00 0.00 C ATOM 1430 C ILE A 90 8.799 21.105 11.270 1.00 0.00 C ATOM 1431 O ILE A 90 7.715 21.688 11.342 1.00 0.00 O ATOM 1432 CB ILE A 90 8.255 18.702 12.103 1.00 0.00 C ATOM 1433 CG1 ILE A 90 6.766 18.971 12.421 1.00 0.00 C ATOM 1434 CG2 ILE A 90 8.839 17.591 13.001 1.00 0.00 C ATOM 1435 CD1 ILE A 90 5.909 17.708 12.458 1.00 0.00 C ATOM 0 H ILE A 90 8.351 20.097 14.147 1.00 0.00 H new ATOM 0 HA ILE A 90 10.152 19.628 11.932 1.00 0.00 H new ATOM 0 HB ILE A 90 8.259 18.385 11.060 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.695 19.476 13.384 1.00 0.00 H new ATOM 0 HG13 ILE A 90 6.361 19.653 11.673 1.00 0.00 H new ATOM 0 HG21 ILE A 90 8.217 16.699 12.927 1.00 0.00 H new ATOM 0 HG22 ILE A 90 9.852 17.355 12.676 1.00 0.00 H new ATOM 0 HG23 ILE A 90 8.860 17.933 14.036 1.00 0.00 H new ATOM 0 HD11 ILE A 90 4.877 17.975 12.687 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.949 17.213 11.488 1.00 0.00 H new ATOM 0 HD13 ILE A 90 6.288 17.034 13.226 1.00 0.00 H new ATOM 1447 N THR A 91 9.717 21.421 10.354 1.00 0.00 N ATOM 1448 CA THR A 91 9.580 22.526 9.398 1.00 0.00 C ATOM 1449 C THR A 91 9.609 22.028 7.940 1.00 0.00 C ATOM 1450 O THR A 91 9.482 22.824 7.008 1.00 0.00 O ATOM 1451 CB THR A 91 10.635 23.603 9.695 1.00 0.00 C ATOM 1452 OG1 THR A 91 11.929 23.035 9.623 1.00 0.00 O ATOM 1453 CG2 THR A 91 10.436 24.222 11.087 1.00 0.00 C ATOM 0 H THR A 91 10.593 20.908 10.253 1.00 0.00 H new ATOM 0 HA THR A 91 8.600 22.986 9.522 1.00 0.00 H new ATOM 0 HB THR A 91 10.524 24.391 8.950 1.00 0.00 H new ATOM 0 HG1 THR A 91 12.591 23.745 9.491 1.00 0.00 H new ATOM 0 HG21 THR A 91 11.201 24.979 11.261 1.00 0.00 H new ATOM 0 HG22 THR A 91 9.450 24.683 11.143 1.00 0.00 H new ATOM 0 HG23 THR A 91 10.516 23.444 11.846 1.00 0.00 H new ATOM 1461 N GLN A 92 9.757 20.710 7.739 1.00 0.00 N ATOM 1462 CA GLN A 92 9.589 20.037 6.452 1.00 0.00 C ATOM 1463 C GLN A 92 8.198 20.337 5.865 1.00 0.00 C ATOM 1464 O GLN A 92 7.290 20.657 6.636 1.00 0.00 O ATOM 1465 CB GLN A 92 9.744 18.514 6.658 1.00 0.00 C ATOM 1466 CG GLN A 92 8.784 17.943 7.728 1.00 0.00 C ATOM 1467 CD GLN A 92 8.621 16.425 7.700 1.00 0.00 C ATOM 1468 OE1 GLN A 92 8.986 15.752 6.746 1.00 0.00 O ATOM 1469 NE2 GLN A 92 8.038 15.857 8.744 1.00 0.00 N ATOM 0 H GLN A 92 10.004 20.068 8.492 1.00 0.00 H new ATOM 0 HA GLN A 92 10.346 20.401 5.757 1.00 0.00 H new ATOM 0 HB2 GLN A 92 9.565 18.006 5.710 1.00 0.00 H new ATOM 0 HB3 GLN A 92 10.772 18.296 6.948 1.00 0.00 H new ATOM 0 HG2 GLN A 92 9.145 18.237 8.713 1.00 0.00 H new ATOM 0 HG3 GLN A 92 7.804 18.402 7.598 1.00 0.00 H new ATOM 0 HE21 GLN A 92 7.738 16.428 9.534 1.00 0.00 H new ATOM 0 HE22 GLN A 92 7.889 14.848 8.759 1.00 0.00 H new ATOM 1478 N PRO A 93 7.981 20.189 4.548 1.00 0.00 N ATOM 1479 CA PRO A 93 6.641 20.231 3.974 1.00 0.00 C ATOM 1480 C PRO A 93 5.811 19.060 4.525 1.00 0.00 C ATOM 1481 O PRO A 93 6.322 17.944 4.664 1.00 0.00 O ATOM 1482 CB PRO A 93 6.842 20.137 2.455 1.00 0.00 C ATOM 1483 CG PRO A 93 8.222 19.499 2.292 1.00 0.00 C ATOM 1484 CD PRO A 93 8.987 19.983 3.518 1.00 0.00 C ATOM 0 HA PRO A 93 6.096 21.141 4.228 1.00 0.00 H new ATOM 0 HB2 PRO A 93 6.066 19.530 1.988 1.00 0.00 H new ATOM 0 HB3 PRO A 93 6.801 21.121 1.987 1.00 0.00 H new ATOM 0 HG2 PRO A 93 8.160 18.411 2.262 1.00 0.00 H new ATOM 0 HG3 PRO A 93 8.704 19.817 1.367 1.00 0.00 H new ATOM 0 HD2 PRO A 93 9.727 19.248 3.834 1.00 0.00 H new ATOM 0 HD3 PRO A 93 9.525 20.906 3.305 1.00 0.00 H new ATOM 1492 N ILE A 94 4.532 19.288 4.828 1.00 0.00 N ATOM 1493 CA ILE A 94 3.631 18.299 5.409 1.00 0.00 C ATOM 1494 C ILE A 94 2.274 18.537 4.761 1.00 0.00 C ATOM 1495 O ILE A 94 1.910 19.688 4.531 1.00 0.00 O ATOM 1496 CB ILE A 94 3.542 18.487 6.950 1.00 0.00 C ATOM 1497 CG1 ILE A 94 4.932 18.338 7.604 1.00 0.00 C ATOM 1498 CG2 ILE A 94 2.517 17.544 7.606 1.00 0.00 C ATOM 1499 CD1 ILE A 94 4.995 18.342 9.136 1.00 0.00 C ATOM 0 H ILE A 94 4.085 20.191 4.671 1.00 0.00 H new ATOM 0 HA ILE A 94 3.983 17.283 5.231 1.00 0.00 H new ATOM 0 HB ILE A 94 3.185 19.502 7.123 1.00 0.00 H new ATOM 0 HG12 ILE A 94 5.372 17.405 7.251 1.00 0.00 H new ATOM 0 HG13 ILE A 94 5.565 19.147 7.239 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.498 17.719 8.682 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.528 17.735 7.189 1.00 0.00 H new ATOM 0 HG23 ILE A 94 2.799 16.509 7.412 1.00 0.00 H new ATOM 0 HD11 ILE A 94 6.030 18.230 9.458 1.00 0.00 H new ATOM 0 HD12 ILE A 94 4.597 19.284 9.514 1.00 0.00 H new ATOM 0 HD13 ILE A 94 4.402 17.515 9.527 1.00 0.00 H new ATOM 1511 N PHE A 95 1.493 17.485 4.510 1.00 0.00 N ATOM 1512 CA PHE A 95 0.101 17.652 4.116 1.00 0.00 C ATOM 1513 C PHE A 95 -0.814 16.737 4.927 1.00 0.00 C ATOM 1514 O PHE A 95 -0.378 15.771 5.558 1.00 0.00 O ATOM 1515 CB PHE A 95 -0.090 17.591 2.586 1.00 0.00 C ATOM 1516 CG PHE A 95 0.256 16.309 1.842 1.00 0.00 C ATOM 1517 CD1 PHE A 95 -0.517 15.146 2.019 1.00 0.00 C ATOM 1518 CD2 PHE A 95 1.269 16.316 0.860 1.00 0.00 C ATOM 1519 CE1 PHE A 95 -0.297 14.017 1.207 1.00 0.00 C ATOM 1520 CE2 PHE A 95 1.482 15.187 0.046 1.00 0.00 C ATOM 1521 CZ PHE A 95 0.679 14.044 0.201 1.00 0.00 C ATOM 0 H PHE A 95 1.802 16.515 4.573 1.00 0.00 H new ATOM 0 HA PHE A 95 -0.212 18.664 4.371 1.00 0.00 H new ATOM 0 HB2 PHE A 95 -1.135 17.819 2.377 1.00 0.00 H new ATOM 0 HB3 PHE A 95 0.505 18.394 2.150 1.00 0.00 H new ATOM 0 HD1 PHE A 95 -1.282 15.120 2.781 1.00 0.00 H new ATOM 0 HD2 PHE A 95 1.885 17.193 0.732 1.00 0.00 H new ATOM 0 HE1 PHE A 95 -0.884 13.124 1.360 1.00 0.00 H new ATOM 0 HE2 PHE A 95 2.264 15.199 -0.699 1.00 0.00 H new ATOM 0 HZ PHE A 95 0.813 13.193 -0.450 1.00 0.00 H new ATOM 1531 N VAL A 96 -2.092 17.094 4.916 1.00 0.00 N ATOM 1532 CA VAL A 96 -3.205 16.418 5.547 1.00 0.00 C ATOM 1533 C VAL A 96 -4.333 16.508 4.524 1.00 0.00 C ATOM 1534 O VAL A 96 -4.501 17.542 3.867 1.00 0.00 O ATOM 1535 CB VAL A 96 -3.633 17.129 6.853 1.00 0.00 C ATOM 1536 CG1 VAL A 96 -4.499 16.174 7.688 1.00 0.00 C ATOM 1537 CG2 VAL A 96 -2.477 17.684 7.706 1.00 0.00 C ATOM 0 H VAL A 96 -2.395 17.934 4.423 1.00 0.00 H new ATOM 0 HA VAL A 96 -2.949 15.394 5.820 1.00 0.00 H new ATOM 0 HB VAL A 96 -4.198 18.008 6.544 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -4.803 16.670 8.610 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -5.384 15.893 7.118 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -3.925 15.280 7.930 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -2.880 18.163 8.598 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.817 16.868 7.999 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -1.914 18.415 7.125 1.00 0.00 H new ATOM 1547 N ASP A 97 -5.134 15.462 4.391 1.00 0.00 N ATOM 1548 CA ASP A 97 -6.219 15.419 3.430 1.00 0.00 C ATOM 1549 C ASP A 97 -7.281 14.437 3.894 1.00 0.00 C ATOM 1550 O ASP A 97 -7.004 13.530 4.682 1.00 0.00 O ATOM 1551 CB ASP A 97 -5.669 14.985 2.074 1.00 0.00 C ATOM 1552 CG ASP A 97 -6.680 15.255 0.969 1.00 0.00 C ATOM 1553 OD1 ASP A 97 -7.012 16.441 0.764 1.00 0.00 O ATOM 1554 OD2 ASP A 97 -7.123 14.274 0.339 1.00 0.00 O ATOM 0 H ASP A 97 -5.047 14.615 4.952 1.00 0.00 H new ATOM 0 HA ASP A 97 -6.668 16.408 3.342 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -4.743 15.520 1.864 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -5.425 13.923 2.098 1.00 0.00 H new ATOM 1559 N SER A 98 -8.499 14.617 3.397 1.00 0.00 N ATOM 1560 CA SER A 98 -9.609 13.699 3.588 1.00 0.00 C ATOM 1561 C SER A 98 -9.393 12.354 2.869 1.00 0.00 C ATOM 1562 O SER A 98 -10.063 11.378 3.216 1.00 0.00 O ATOM 1563 CB SER A 98 -10.895 14.403 3.125 1.00 0.00 C ATOM 1564 OG SER A 98 -10.677 15.175 1.948 1.00 0.00 O ATOM 0 H SER A 98 -8.746 15.431 2.834 1.00 0.00 H new ATOM 0 HA SER A 98 -9.689 13.445 4.645 1.00 0.00 H new ATOM 0 HB2 SER A 98 -11.669 13.659 2.935 1.00 0.00 H new ATOM 0 HB3 SER A 98 -11.263 15.050 3.922 1.00 0.00 H new ATOM 0 HG SER A 98 -11.515 15.607 1.680 1.00 0.00 H new ATOM 1570 N ASP A 99 -8.471 12.270 1.899 1.00 0.00 N ATOM 1571 CA ASP A 99 -8.265 11.084 1.066 1.00 0.00 C ATOM 1572 C ASP A 99 -6.784 10.717 0.925 1.00 0.00 C ATOM 1573 O ASP A 99 -6.449 9.559 1.153 1.00 0.00 O ATOM 1574 CB ASP A 99 -8.891 11.322 -0.314 1.00 0.00 C ATOM 1575 CG ASP A 99 -8.713 10.107 -1.241 1.00 0.00 C ATOM 1576 OD1 ASP A 99 -9.159 8.994 -0.884 1.00 0.00 O ATOM 1577 OD2 ASP A 99 -8.190 10.280 -2.364 1.00 0.00 O ATOM 0 H ASP A 99 -7.840 13.038 1.670 1.00 0.00 H new ATOM 0 HA ASP A 99 -8.750 10.241 1.557 1.00 0.00 H new ATOM 0 HB2 ASP A 99 -9.953 11.538 -0.199 1.00 0.00 H new ATOM 0 HB3 ASP A 99 -8.435 12.199 -0.773 1.00 0.00 H new ATOM 1582 N HIS A 100 -5.910 11.693 0.636 1.00 0.00 N ATOM 1583 CA HIS A 100 -4.505 11.582 0.258 1.00 0.00 C ATOM 1584 C HIS A 100 -4.377 10.929 -1.106 1.00 0.00 C ATOM 1585 O HIS A 100 -4.919 9.853 -1.362 1.00 0.00 O ATOM 1586 CB HIS A 100 -3.615 10.890 1.301 1.00 0.00 C ATOM 1587 CG HIS A 100 -3.553 11.618 2.610 1.00 0.00 C ATOM 1588 ND1 HIS A 100 -3.874 11.107 3.844 1.00 0.00 N ATOM 1589 CD2 HIS A 100 -3.165 12.917 2.790 1.00 0.00 C ATOM 1590 CE1 HIS A 100 -3.685 12.082 4.745 1.00 0.00 C ATOM 1591 NE2 HIS A 100 -3.251 13.208 4.153 1.00 0.00 N ATOM 0 H HIS A 100 -6.203 12.669 0.666 1.00 0.00 H new ATOM 0 HA HIS A 100 -4.126 12.603 0.208 1.00 0.00 H new ATOM 0 HB2 HIS A 100 -3.988 9.880 1.473 1.00 0.00 H new ATOM 0 HB3 HIS A 100 -2.606 10.793 0.900 1.00 0.00 H new ATOM 0 HD1 HIS A 100 -4.197 10.159 4.039 1.00 0.00 H new ATOM 0 HD2 HIS A 100 -2.848 13.598 2.014 1.00 0.00 H new ATOM 0 HE1 HIS A 100 -3.858 11.977 5.806 1.00 0.00 H new ATOM 1599 N ALA A 101 -3.597 11.557 -1.987 1.00 0.00 N ATOM 1600 CA ALA A 101 -3.433 11.029 -3.333 1.00 0.00 C ATOM 1601 C ALA A 101 -2.606 9.741 -3.331 1.00 0.00 C ATOM 1602 O ALA A 101 -2.667 8.969 -4.287 1.00 0.00 O ATOM 1603 CB ALA A 101 -2.792 12.094 -4.201 1.00 0.00 C ATOM 0 H ALA A 101 -3.080 12.415 -1.794 1.00 0.00 H new ATOM 0 HA ALA A 101 -4.411 10.772 -3.740 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -2.664 11.710 -5.213 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.431 12.976 -4.226 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -1.819 12.362 -3.789 1.00 0.00 H new ATOM 1609 N LEU A 102 -1.878 9.471 -2.240 1.00 0.00 N ATOM 1610 CA LEU A 102 -1.167 8.198 -2.105 1.00 0.00 C ATOM 1611 C LEU A 102 -2.159 7.073 -1.969 1.00 0.00 C ATOM 1612 O LEU A 102 -1.907 5.999 -2.484 1.00 0.00 O ATOM 1613 CB LEU A 102 -0.210 8.091 -0.902 1.00 0.00 C ATOM 1614 CG LEU A 102 1.256 8.275 -1.328 1.00 0.00 C ATOM 1615 CD1 LEU A 102 1.668 9.747 -1.245 1.00 0.00 C ATOM 1616 CD2 LEU A 102 2.208 7.417 -0.491 1.00 0.00 C ATOM 0 H LEU A 102 -1.768 10.107 -1.450 1.00 0.00 H new ATOM 0 HA LEU A 102 -0.560 8.137 -3.008 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -0.471 8.845 -0.160 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -0.332 7.119 -0.425 1.00 0.00 H new ATOM 0 HG LEU A 102 1.329 7.943 -2.364 1.00 0.00 H new ATOM 0 HD11 LEU A 102 2.709 9.851 -1.551 1.00 0.00 H new ATOM 0 HD12 LEU A 102 1.035 10.340 -1.905 1.00 0.00 H new ATOM 0 HD13 LEU A 102 1.554 10.099 -0.220 1.00 0.00 H new ATOM 0 HD21 LEU A 102 3.233 7.578 -0.826 1.00 0.00 H new ATOM 0 HD22 LEU A 102 2.121 7.696 0.559 1.00 0.00 H new ATOM 0 HD23 LEU A 102 1.949 6.365 -0.609 1.00 0.00 H new ATOM 1628 N THR A 103 -3.284 7.278 -1.303 1.00 0.00 N ATOM 1629 CA THR A 103 -4.296 6.252 -1.135 1.00 0.00 C ATOM 1630 C THR A 103 -4.877 5.845 -2.493 1.00 0.00 C ATOM 1631 O THR A 103 -5.343 4.719 -2.634 1.00 0.00 O ATOM 1632 CB THR A 103 -5.386 6.808 -0.223 1.00 0.00 C ATOM 1633 OG1 THR A 103 -4.799 7.557 0.819 1.00 0.00 O ATOM 1634 CG2 THR A 103 -6.294 5.764 0.430 1.00 0.00 C ATOM 0 H THR A 103 -3.520 8.167 -0.862 1.00 0.00 H new ATOM 0 HA THR A 103 -3.858 5.360 -0.687 1.00 0.00 H new ATOM 0 HB THR A 103 -6.011 7.409 -0.884 1.00 0.00 H new ATOM 0 HG1 THR A 103 -5.492 8.074 1.280 1.00 0.00 H new ATOM 0 HG21 THR A 103 -7.032 6.265 1.056 1.00 0.00 H new ATOM 0 HG22 THR A 103 -6.804 5.190 -0.344 1.00 0.00 H new ATOM 0 HG23 THR A 103 -5.694 5.092 1.043 1.00 0.00 H new ATOM 1642 N ASP A 104 -4.791 6.693 -3.523 1.00 0.00 N ATOM 1643 CA ASP A 104 -5.246 6.302 -4.854 1.00 0.00 C ATOM 1644 C ASP A 104 -4.266 5.344 -5.523 1.00 0.00 C ATOM 1645 O ASP A 104 -4.630 4.635 -6.463 1.00 0.00 O ATOM 1646 CB ASP A 104 -5.410 7.542 -5.737 1.00 0.00 C ATOM 1647 CG ASP A 104 -6.035 7.195 -7.100 1.00 0.00 C ATOM 1648 OD1 ASP A 104 -7.212 6.770 -7.140 1.00 0.00 O ATOM 1649 OD2 ASP A 104 -5.371 7.389 -8.143 1.00 0.00 O ATOM 0 H ASP A 104 -4.416 7.639 -3.460 1.00 0.00 H new ATOM 0 HA ASP A 104 -6.203 5.794 -4.737 1.00 0.00 H new ATOM 0 HB2 ASP A 104 -6.037 8.272 -5.225 1.00 0.00 H new ATOM 0 HB3 ASP A 104 -4.437 8.009 -5.892 1.00 0.00 H new ATOM 1654 N ALA A 105 -3.032 5.303 -5.018 1.00 0.00 N ATOM 1655 CA ALA A 105 -1.954 4.507 -5.592 1.00 0.00 C ATOM 1656 C ALA A 105 -1.552 3.354 -4.668 1.00 0.00 C ATOM 1657 O ALA A 105 -1.052 2.337 -5.148 1.00 0.00 O ATOM 1658 CB ALA A 105 -0.767 5.430 -5.885 1.00 0.00 C ATOM 0 H ALA A 105 -2.753 5.829 -4.190 1.00 0.00 H new ATOM 0 HA ALA A 105 -2.297 4.051 -6.521 1.00 0.00 H new ATOM 0 HB1 ALA A 105 0.048 4.849 -6.315 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -1.073 6.203 -6.590 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -0.431 5.896 -4.959 1.00 0.00 H new ATOM 1664 N PHE A 106 -1.815 3.480 -3.364 1.00 0.00 N ATOM 1665 CA PHE A 106 -1.301 2.580 -2.336 1.00 0.00 C ATOM 1666 C PHE A 106 -2.396 2.212 -1.330 1.00 0.00 C ATOM 1667 O PHE A 106 -2.141 1.383 -0.459 1.00 0.00 O ATOM 1668 CB PHE A 106 -0.102 3.257 -1.632 1.00 0.00 C ATOM 1669 CG PHE A 106 1.121 2.396 -1.325 1.00 0.00 C ATOM 1670 CD1 PHE A 106 1.027 1.017 -1.033 1.00 0.00 C ATOM 1671 CD2 PHE A 106 2.394 3.003 -1.336 1.00 0.00 C ATOM 1672 CE1 PHE A 106 2.187 0.260 -0.788 1.00 0.00 C ATOM 1673 CE2 PHE A 106 3.553 2.245 -1.098 1.00 0.00 C ATOM 1674 CZ PHE A 106 3.452 0.869 -0.828 1.00 0.00 C ATOM 0 H PHE A 106 -2.402 4.225 -2.990 1.00 0.00 H new ATOM 0 HA PHE A 106 -0.969 1.652 -2.801 1.00 0.00 H new ATOM 0 HB2 PHE A 106 0.223 4.092 -2.253 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -0.459 3.679 -0.693 1.00 0.00 H new ATOM 0 HD1 PHE A 106 0.058 0.541 -0.998 1.00 0.00 H new ATOM 0 HD2 PHE A 106 2.479 4.062 -1.529 1.00 0.00 H new ATOM 0 HE1 PHE A 106 2.105 -0.794 -0.568 1.00 0.00 H new ATOM 0 HE2 PHE A 106 4.523 2.720 -1.123 1.00 0.00 H new ATOM 0 HZ PHE A 106 4.342 0.283 -0.652 1.00 0.00 H new ATOM 1684 N GLU A 107 -3.605 2.793 -1.437 1.00 0.00 N ATOM 1685 CA GLU A 107 -4.753 2.446 -0.592 1.00 0.00 C ATOM 1686 C GLU A 107 -4.373 2.452 0.904 1.00 0.00 C ATOM 1687 O GLU A 107 -4.702 1.538 1.662 1.00 0.00 O ATOM 1688 CB GLU A 107 -5.382 1.154 -1.134 1.00 0.00 C ATOM 1689 CG GLU A 107 -6.118 1.382 -2.462 1.00 0.00 C ATOM 1690 CD GLU A 107 -6.766 0.084 -2.976 1.00 0.00 C ATOM 1691 OE1 GLU A 107 -6.114 -0.676 -3.727 1.00 0.00 O ATOM 1692 OE2 GLU A 107 -7.945 -0.186 -2.651 1.00 0.00 O ATOM 0 H GLU A 107 -3.810 3.523 -2.120 1.00 0.00 H new ATOM 0 HA GLU A 107 -5.534 3.204 -0.643 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -4.604 0.404 -1.276 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -6.079 0.754 -0.398 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -6.885 2.145 -2.328 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -5.418 1.761 -3.207 1.00 0.00 H new ATOM 1699 N ASN A 108 -3.628 3.502 1.281 1.00 0.00 N ATOM 1700 CA ASN A 108 -3.061 3.787 2.595 1.00 0.00 C ATOM 1701 C ASN A 108 -3.941 3.322 3.759 1.00 0.00 C ATOM 1702 O ASN A 108 -5.064 3.796 3.941 1.00 0.00 O ATOM 1703 CB ASN A 108 -2.734 5.290 2.694 1.00 0.00 C ATOM 1704 CG ASN A 108 -2.621 5.774 4.144 1.00 0.00 C ATOM 1705 OD1 ASN A 108 -3.390 6.620 4.584 1.00 0.00 O ATOM 1706 ND2 ASN A 108 -1.696 5.240 4.926 1.00 0.00 N ATOM 0 H ASN A 108 -3.390 4.233 0.611 1.00 0.00 H new ATOM 0 HA ASN A 108 -2.144 3.205 2.688 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -1.797 5.489 2.174 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -3.509 5.861 2.183 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -1.621 5.533 5.900 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -1.058 4.536 4.554 1.00 0.00 H new ATOM 1713 N GLU A 109 -3.378 2.420 4.566 1.00 0.00 N ATOM 1714 CA GLU A 109 -3.959 1.878 5.789 1.00 0.00 C ATOM 1715 C GLU A 109 -2.795 1.521 6.739 1.00 0.00 C ATOM 1716 O GLU A 109 -2.738 0.435 7.319 1.00 0.00 O ATOM 1717 CB GLU A 109 -4.877 0.690 5.429 1.00 0.00 C ATOM 1718 CG GLU A 109 -5.859 0.341 6.558 1.00 0.00 C ATOM 1719 CD GLU A 109 -6.790 -0.818 6.157 1.00 0.00 C ATOM 1720 OE1 GLU A 109 -6.425 -2.000 6.355 1.00 0.00 O ATOM 1721 OE2 GLU A 109 -7.911 -0.562 5.659 1.00 0.00 O ATOM 0 H GLU A 109 -2.456 2.030 4.371 1.00 0.00 H new ATOM 0 HA GLU A 109 -4.594 2.595 6.309 1.00 0.00 H new ATOM 0 HB2 GLU A 109 -5.438 0.929 4.525 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -4.264 -0.183 5.202 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -5.302 0.069 7.455 1.00 0.00 H new ATOM 0 HG3 GLU A 109 -6.455 1.219 6.807 1.00 0.00 H new ATOM 1728 N TYR A 110 -1.799 2.410 6.827 1.00 0.00 N ATOM 1729 CA TYR A 110 -0.538 2.240 7.502 1.00 0.00 C ATOM 1730 C TYR A 110 -0.197 3.574 8.151 1.00 0.00 C ATOM 1731 O TYR A 110 -0.375 4.629 7.539 1.00 0.00 O ATOM 1732 CB TYR A 110 0.527 1.821 6.479 1.00 0.00 C ATOM 1733 CG TYR A 110 0.651 2.647 5.195 1.00 0.00 C ATOM 1734 CD1 TYR A 110 1.231 3.931 5.208 1.00 0.00 C ATOM 1735 CD2 TYR A 110 0.213 2.111 3.967 1.00 0.00 C ATOM 1736 CE1 TYR A 110 1.316 4.699 4.035 1.00 0.00 C ATOM 1737 CE2 TYR A 110 0.338 2.853 2.776 1.00 0.00 C ATOM 1738 CZ TYR A 110 0.876 4.161 2.805 1.00 0.00 C ATOM 1739 OH TYR A 110 0.964 4.907 1.672 1.00 0.00 O ATOM 0 H TYR A 110 -1.874 3.329 6.391 1.00 0.00 H new ATOM 0 HA TYR A 110 -0.584 1.463 8.265 1.00 0.00 H new ATOM 0 HB2 TYR A 110 1.495 1.834 6.980 1.00 0.00 H new ATOM 0 HB3 TYR A 110 0.329 0.788 6.194 1.00 0.00 H new ATOM 0 HD1 TYR A 110 1.616 4.331 6.134 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -0.222 1.123 3.939 1.00 0.00 H new ATOM 0 HE1 TYR A 110 1.718 5.701 4.073 1.00 0.00 H new ATOM 0 HE2 TYR A 110 0.022 2.422 1.838 1.00 0.00 H new ATOM 0 HH TYR A 110 1.084 4.316 0.900 1.00 0.00 H new ATOM 1749 N VAL A 111 0.294 3.503 9.384 1.00 0.00 N ATOM 1750 CA VAL A 111 0.842 4.612 10.165 1.00 0.00 C ATOM 1751 C VAL A 111 1.400 4.072 11.505 1.00 0.00 C ATOM 1752 O VAL A 111 0.780 3.168 12.077 1.00 0.00 O ATOM 1753 CB VAL A 111 -0.259 5.683 10.414 1.00 0.00 C ATOM 1754 CG1 VAL A 111 -1.478 5.202 11.217 1.00 0.00 C ATOM 1755 CG2 VAL A 111 0.321 6.933 11.060 1.00 0.00 C ATOM 0 H VAL A 111 0.323 2.621 9.896 1.00 0.00 H new ATOM 0 HA VAL A 111 1.655 5.083 9.612 1.00 0.00 H new ATOM 0 HB VAL A 111 -0.634 5.911 9.416 1.00 0.00 H new ATOM 0 HG11 VAL A 111 -2.184 6.024 11.334 1.00 0.00 H new ATOM 0 HG12 VAL A 111 -1.961 4.381 10.688 1.00 0.00 H new ATOM 0 HG13 VAL A 111 -1.154 4.859 12.200 1.00 0.00 H new ATOM 0 HG21 VAL A 111 -0.474 7.662 11.221 1.00 0.00 H new ATOM 0 HG22 VAL A 111 0.773 6.672 12.017 1.00 0.00 H new ATOM 0 HG23 VAL A 111 1.080 7.362 10.406 1.00 0.00 H new ATOM 1765 N PRO A 112 2.538 4.572 12.028 1.00 0.00 N ATOM 1766 CA PRO A 112 3.488 5.451 11.355 1.00 0.00 C ATOM 1767 C PRO A 112 4.288 4.620 10.352 1.00 0.00 C ATOM 1768 O PRO A 112 4.591 3.454 10.620 1.00 0.00 O ATOM 1769 CB PRO A 112 4.400 6.020 12.444 1.00 0.00 C ATOM 1770 CG PRO A 112 4.329 4.980 13.560 1.00 0.00 C ATOM 1771 CD PRO A 112 2.923 4.392 13.419 1.00 0.00 C ATOM 0 HA PRO A 112 2.998 6.261 10.814 1.00 0.00 H new ATOM 0 HB2 PRO A 112 5.420 6.150 12.083 1.00 0.00 H new ATOM 0 HB3 PRO A 112 4.055 6.996 12.785 1.00 0.00 H new ATOM 0 HG2 PRO A 112 5.097 4.215 13.444 1.00 0.00 H new ATOM 0 HG3 PRO A 112 4.477 5.434 14.540 1.00 0.00 H new ATOM 0 HD2 PRO A 112 2.915 3.336 13.690 1.00 0.00 H new ATOM 0 HD3 PRO A 112 2.223 4.897 14.084 1.00 0.00 H new ATOM 1779 N ALA A 113 4.634 5.198 9.203 1.00 0.00 N ATOM 1780 CA ALA A 113 5.322 4.460 8.147 1.00 0.00 C ATOM 1781 C ALA A 113 6.301 5.357 7.412 1.00 0.00 C ATOM 1782 O ALA A 113 6.127 6.572 7.404 1.00 0.00 O ATOM 1783 CB ALA A 113 4.294 3.860 7.186 1.00 0.00 C ATOM 0 H ALA A 113 4.449 6.176 8.980 1.00 0.00 H new ATOM 0 HA ALA A 113 5.896 3.649 8.596 1.00 0.00 H new ATOM 0 HB1 ALA A 113 4.810 3.310 6.399 1.00 0.00 H new ATOM 0 HB2 ALA A 113 3.637 3.183 7.732 1.00 0.00 H new ATOM 0 HB3 ALA A 113 3.701 4.660 6.741 1.00 0.00 H new ATOM 1789 N TYR A 114 7.316 4.772 6.784 1.00 0.00 N ATOM 1790 CA TYR A 114 8.442 5.511 6.222 1.00 0.00 C ATOM 1791 C TYR A 114 8.824 4.883 4.883 1.00 0.00 C ATOM 1792 O TYR A 114 8.914 3.658 4.778 1.00 0.00 O ATOM 1793 CB TYR A 114 9.631 5.501 7.207 1.00 0.00 C ATOM 1794 CG TYR A 114 9.273 5.253 8.666 1.00 0.00 C ATOM 1795 CD1 TYR A 114 8.771 6.296 9.467 1.00 0.00 C ATOM 1796 CD2 TYR A 114 9.359 3.951 9.193 1.00 0.00 C ATOM 1797 CE1 TYR A 114 8.308 6.032 10.767 1.00 0.00 C ATOM 1798 CE2 TYR A 114 8.910 3.680 10.495 1.00 0.00 C ATOM 1799 CZ TYR A 114 8.364 4.716 11.283 1.00 0.00 C ATOM 1800 OH TYR A 114 7.886 4.434 12.527 1.00 0.00 O ATOM 0 H TYR A 114 7.381 3.763 6.650 1.00 0.00 H new ATOM 0 HA TYR A 114 8.162 6.551 6.057 1.00 0.00 H new ATOM 0 HB2 TYR A 114 10.337 4.734 6.889 1.00 0.00 H new ATOM 0 HB3 TYR A 114 10.147 6.458 7.136 1.00 0.00 H new ATOM 0 HD1 TYR A 114 8.742 7.304 9.080 1.00 0.00 H new ATOM 0 HD2 TYR A 114 9.773 3.155 8.592 1.00 0.00 H new ATOM 0 HE1 TYR A 114 7.910 6.833 11.372 1.00 0.00 H new ATOM 0 HE2 TYR A 114 8.982 2.679 10.894 1.00 0.00 H new ATOM 0 HH TYR A 114 7.069 3.898 12.450 1.00 0.00 H new ATOM 1810 N TYR A 115 9.061 5.718 3.872 1.00 0.00 N ATOM 1811 CA TYR A 115 9.255 5.318 2.484 1.00 0.00 C ATOM 1812 C TYR A 115 10.428 6.128 1.944 1.00 0.00 C ATOM 1813 O TYR A 115 10.374 7.360 1.949 1.00 0.00 O ATOM 1814 CB TYR A 115 7.978 5.626 1.684 1.00 0.00 C ATOM 1815 CG TYR A 115 6.752 4.825 2.074 1.00 0.00 C ATOM 1816 CD1 TYR A 115 5.919 5.251 3.129 1.00 0.00 C ATOM 1817 CD2 TYR A 115 6.445 3.648 1.371 1.00 0.00 C ATOM 1818 CE1 TYR A 115 4.802 4.481 3.503 1.00 0.00 C ATOM 1819 CE2 TYR A 115 5.347 2.863 1.752 1.00 0.00 C ATOM 1820 CZ TYR A 115 4.522 3.271 2.823 1.00 0.00 C ATOM 1821 OH TYR A 115 3.487 2.472 3.197 1.00 0.00 O ATOM 0 H TYR A 115 9.125 6.727 4.005 1.00 0.00 H new ATOM 0 HA TYR A 115 9.461 4.251 2.401 1.00 0.00 H new ATOM 0 HB2 TYR A 115 7.748 6.686 1.795 1.00 0.00 H new ATOM 0 HB3 TYR A 115 8.182 5.453 0.627 1.00 0.00 H new ATOM 0 HD1 TYR A 115 6.139 6.170 3.651 1.00 0.00 H new ATOM 0 HD2 TYR A 115 7.057 3.346 0.534 1.00 0.00 H new ATOM 0 HE1 TYR A 115 4.160 4.812 4.306 1.00 0.00 H new ATOM 0 HE2 TYR A 115 5.132 1.945 1.225 1.00 0.00 H new ATOM 0 HH TYR A 115 2.655 2.991 3.193 1.00 0.00 H new ATOM 1831 N VAL A 116 11.490 5.456 1.497 1.00 0.00 N ATOM 1832 CA VAL A 116 12.748 6.098 1.131 1.00 0.00 C ATOM 1833 C VAL A 116 12.887 5.961 -0.378 1.00 0.00 C ATOM 1834 O VAL A 116 12.820 4.849 -0.905 1.00 0.00 O ATOM 1835 CB VAL A 116 13.941 5.457 1.877 1.00 0.00 C ATOM 1836 CG1 VAL A 116 15.190 6.335 1.720 1.00 0.00 C ATOM 1837 CG2 VAL A 116 13.685 5.275 3.381 1.00 0.00 C ATOM 0 H VAL A 116 11.499 4.443 1.379 1.00 0.00 H new ATOM 0 HA VAL A 116 12.747 7.149 1.419 1.00 0.00 H new ATOM 0 HB VAL A 116 14.082 4.473 1.430 1.00 0.00 H new ATOM 0 HG11 VAL A 116 16.026 5.876 2.248 1.00 0.00 H new ATOM 0 HG12 VAL A 116 15.437 6.430 0.663 1.00 0.00 H new ATOM 0 HG13 VAL A 116 14.995 7.323 2.137 1.00 0.00 H new ATOM 0 HG21 VAL A 116 14.560 4.821 3.847 1.00 0.00 H new ATOM 0 HG22 VAL A 116 13.494 6.246 3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 116 12.819 4.629 3.527 1.00 0.00 H new ATOM 1847 N PHE A 117 13.093 7.073 -1.075 1.00 0.00 N ATOM 1848 CA PHE A 117 13.114 7.145 -2.522 1.00 0.00 C ATOM 1849 C PHE A 117 14.459 7.711 -2.929 1.00 0.00 C ATOM 1850 O PHE A 117 14.969 8.644 -2.308 1.00 0.00 O ATOM 1851 CB PHE A 117 12.000 8.061 -3.045 1.00 0.00 C ATOM 1852 CG PHE A 117 10.587 7.644 -2.686 1.00 0.00 C ATOM 1853 CD1 PHE A 117 10.072 7.933 -1.409 1.00 0.00 C ATOM 1854 CD2 PHE A 117 9.771 7.001 -3.635 1.00 0.00 C ATOM 1855 CE1 PHE A 117 8.760 7.562 -1.083 1.00 0.00 C ATOM 1856 CE2 PHE A 117 8.450 6.648 -3.311 1.00 0.00 C ATOM 1857 CZ PHE A 117 7.944 6.922 -2.031 1.00 0.00 C ATOM 0 H PHE A 117 13.255 7.976 -0.629 1.00 0.00 H new ATOM 0 HA PHE A 117 12.955 6.152 -2.942 1.00 0.00 H new ATOM 0 HB2 PHE A 117 12.171 9.067 -2.662 1.00 0.00 H new ATOM 0 HB3 PHE A 117 12.079 8.116 -4.131 1.00 0.00 H new ATOM 0 HD1 PHE A 117 10.687 8.440 -0.680 1.00 0.00 H new ATOM 0 HD2 PHE A 117 10.162 6.778 -4.617 1.00 0.00 H new ATOM 0 HE1 PHE A 117 8.374 7.770 -0.096 1.00 0.00 H new ATOM 0 HE2 PHE A 117 7.824 6.166 -4.047 1.00 0.00 H new ATOM 0 HZ PHE A 117 6.933 6.642 -1.776 1.00 0.00 H new ATOM 1867 N ASP A 118 15.011 7.159 -3.999 1.00 0.00 N ATOM 1868 CA ASP A 118 16.191 7.698 -4.666 1.00 0.00 C ATOM 1869 C ASP A 118 15.886 9.084 -5.247 1.00 0.00 C ATOM 1870 O ASP A 118 14.718 9.451 -5.395 1.00 0.00 O ATOM 1871 CB ASP A 118 16.552 6.726 -5.783 1.00 0.00 C ATOM 1872 CG ASP A 118 17.997 6.773 -6.264 1.00 0.00 C ATOM 1873 OD1 ASP A 118 18.725 7.743 -5.963 1.00 0.00 O ATOM 1874 OD2 ASP A 118 18.378 5.768 -6.909 1.00 0.00 O ATOM 0 H ASP A 118 14.648 6.312 -4.436 1.00 0.00 H new ATOM 0 HA ASP A 118 17.018 7.809 -3.964 1.00 0.00 H new ATOM 0 HB2 ASP A 118 16.336 5.714 -5.442 1.00 0.00 H new ATOM 0 HB3 ASP A 118 15.899 6.922 -6.634 1.00 0.00 H new ATOM 1879 N LYS A 119 16.904 9.844 -5.659 1.00 0.00 N ATOM 1880 CA LYS A 119 16.725 11.122 -6.364 1.00 0.00 C ATOM 1881 C LYS A 119 15.925 11.020 -7.663 1.00 0.00 C ATOM 1882 O LYS A 119 15.538 12.057 -8.198 1.00 0.00 O ATOM 1883 CB LYS A 119 18.067 11.832 -6.604 1.00 0.00 C ATOM 1884 CG LYS A 119 19.021 11.106 -7.563 1.00 0.00 C ATOM 1885 CD LYS A 119 19.502 11.970 -8.742 1.00 0.00 C ATOM 1886 CE LYS A 119 18.422 12.136 -9.826 1.00 0.00 C ATOM 1887 NZ LYS A 119 18.870 12.998 -10.951 1.00 0.00 N ATOM 0 H LYS A 119 17.881 9.591 -5.514 1.00 0.00 H new ATOM 0 HA LYS A 119 16.121 11.729 -5.690 1.00 0.00 H new ATOM 0 HB2 LYS A 119 17.869 12.829 -6.998 1.00 0.00 H new ATOM 0 HB3 LYS A 119 18.569 11.962 -5.645 1.00 0.00 H new ATOM 0 HG2 LYS A 119 19.889 10.760 -7.002 1.00 0.00 H new ATOM 0 HG3 LYS A 119 18.521 10.221 -7.955 1.00 0.00 H new ATOM 0 HD2 LYS A 119 19.796 12.952 -8.373 1.00 0.00 H new ATOM 0 HD3 LYS A 119 20.389 11.516 -9.183 1.00 0.00 H new ATOM 0 HE2 LYS A 119 18.146 11.155 -10.212 1.00 0.00 H new ATOM 0 HE3 LYS A 119 17.526 12.566 -9.378 1.00 0.00 H new ATOM 0 HZ1 LYS A 119 18.449 12.657 -11.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 119 18.568 13.978 -10.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 119 19.907 12.963 -11.024 1.00 0.00 H new ATOM 1901 N THR A 120 15.708 9.820 -8.196 1.00 0.00 N ATOM 1902 CA THR A 120 14.854 9.586 -9.353 1.00 0.00 C ATOM 1903 C THR A 120 13.380 9.492 -8.968 1.00 0.00 C ATOM 1904 O THR A 120 12.500 9.673 -9.811 1.00 0.00 O ATOM 1905 CB THR A 120 15.217 8.230 -9.954 1.00 0.00 C ATOM 1906 OG1 THR A 120 15.231 7.238 -8.945 1.00 0.00 O ATOM 1907 CG2 THR A 120 16.592 8.209 -10.608 1.00 0.00 C ATOM 0 H THR A 120 16.130 8.968 -7.827 1.00 0.00 H new ATOM 0 HA THR A 120 15.004 10.418 -10.041 1.00 0.00 H new ATOM 0 HB THR A 120 14.460 8.036 -10.714 1.00 0.00 H new ATOM 0 HG1 THR A 120 15.463 6.372 -9.341 1.00 0.00 H new ATOM 0 HG21 THR A 120 16.787 7.216 -11.014 1.00 0.00 H new ATOM 0 HG22 THR A 120 16.623 8.943 -11.413 1.00 0.00 H new ATOM 0 HG23 THR A 120 17.352 8.452 -9.865 1.00 0.00 H new ATOM 1915 N GLY A 121 13.118 9.138 -7.711 1.00 0.00 N ATOM 1916 CA GLY A 121 11.807 8.788 -7.208 1.00 0.00 C ATOM 1917 C GLY A 121 11.562 7.291 -7.264 1.00 0.00 C ATOM 1918 O GLY A 121 10.419 6.902 -7.048 1.00 0.00 O ATOM 0 H GLY A 121 13.844 9.088 -6.996 1.00 0.00 H new ATOM 0 HA2 GLY A 121 11.708 9.134 -6.179 1.00 0.00 H new ATOM 0 HA3 GLY A 121 11.044 9.303 -7.792 1.00 0.00 H new ATOM 1922 N GLN A 122 12.559 6.442 -7.558 1.00 0.00 N ATOM 1923 CA GLN A 122 12.354 5.008 -7.433 1.00 0.00 C ATOM 1924 C GLN A 122 12.281 4.726 -5.927 1.00 0.00 C ATOM 1925 O GLN A 122 13.191 5.102 -5.180 1.00 0.00 O ATOM 1926 CB GLN A 122 13.417 4.203 -8.218 1.00 0.00 C ATOM 1927 CG GLN A 122 14.800 4.103 -7.562 1.00 0.00 C ATOM 1928 CD GLN A 122 15.819 3.305 -8.378 1.00 0.00 C ATOM 1929 OE1 GLN A 122 15.535 2.207 -8.854 1.00 0.00 O ATOM 1930 NE2 GLN A 122 17.037 3.803 -8.533 1.00 0.00 N ATOM 0 H GLN A 122 13.487 6.722 -7.875 1.00 0.00 H new ATOM 0 HA GLN A 122 11.426 4.672 -7.895 1.00 0.00 H new ATOM 0 HB2 GLN A 122 13.037 3.194 -8.376 1.00 0.00 H new ATOM 0 HB3 GLN A 122 13.535 4.657 -9.202 1.00 0.00 H new ATOM 0 HG2 GLN A 122 15.187 5.109 -7.400 1.00 0.00 H new ATOM 0 HG3 GLN A 122 14.693 3.640 -6.581 1.00 0.00 H new ATOM 0 HE21 GLN A 122 17.270 4.714 -8.137 1.00 0.00 H new ATOM 0 HE22 GLN A 122 17.742 3.276 -9.048 1.00 0.00 H new ATOM 1939 N LEU A 123 11.176 4.137 -5.471 1.00 0.00 N ATOM 1940 CA LEU A 123 10.981 3.741 -4.077 1.00 0.00 C ATOM 1941 C LEU A 123 12.024 2.681 -3.721 1.00 0.00 C ATOM 1942 O LEU A 123 11.883 1.527 -4.112 1.00 0.00 O ATOM 1943 CB LEU A 123 9.538 3.236 -3.882 1.00 0.00 C ATOM 1944 CG LEU A 123 9.256 2.617 -2.497 1.00 0.00 C ATOM 1945 CD1 LEU A 123 9.732 3.501 -1.340 1.00 0.00 C ATOM 1946 CD2 LEU A 123 7.764 2.346 -2.274 1.00 0.00 C ATOM 0 H LEU A 123 10.379 3.918 -6.069 1.00 0.00 H new ATOM 0 HA LEU A 123 11.118 4.589 -3.406 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.851 4.068 -4.040 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.320 2.493 -4.649 1.00 0.00 H new ATOM 0 HG LEU A 123 9.816 1.682 -2.501 1.00 0.00 H new ATOM 0 HD11 LEU A 123 9.506 3.013 -0.392 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.808 3.657 -1.420 1.00 0.00 H new ATOM 0 HD13 LEU A 123 9.221 4.463 -1.383 1.00 0.00 H new ATOM 0 HD21 LEU A 123 7.617 1.911 -1.286 1.00 0.00 H new ATOM 0 HD22 LEU A 123 7.210 3.282 -2.344 1.00 0.00 H new ATOM 0 HD23 LEU A 123 7.403 1.652 -3.033 1.00 0.00 H new ATOM 1958 N ARG A 124 13.093 3.048 -3.015 1.00 0.00 N ATOM 1959 CA ARG A 124 14.162 2.114 -2.685 1.00 0.00 C ATOM 1960 C ARG A 124 13.692 1.128 -1.620 1.00 0.00 C ATOM 1961 O ARG A 124 13.943 -0.068 -1.775 1.00 0.00 O ATOM 1962 CB ARG A 124 15.423 2.869 -2.216 1.00 0.00 C ATOM 1963 CG ARG A 124 16.171 3.634 -3.322 1.00 0.00 C ATOM 1964 CD ARG A 124 16.635 2.733 -4.477 1.00 0.00 C ATOM 1965 NE ARG A 124 17.746 3.334 -5.247 1.00 0.00 N ATOM 1966 CZ ARG A 124 19.002 2.883 -5.362 1.00 0.00 C ATOM 1967 NH1 ARG A 124 19.413 1.784 -4.733 1.00 0.00 N ATOM 1968 NH2 ARG A 124 19.843 3.573 -6.123 1.00 0.00 N ATOM 0 H ARG A 124 13.239 3.993 -2.660 1.00 0.00 H new ATOM 0 HA ARG A 124 14.422 1.554 -3.583 1.00 0.00 H new ATOM 0 HB2 ARG A 124 15.137 3.575 -1.436 1.00 0.00 H new ATOM 0 HB3 ARG A 124 16.109 2.154 -1.762 1.00 0.00 H new ATOM 0 HG2 ARG A 124 15.521 4.414 -3.718 1.00 0.00 H new ATOM 0 HG3 ARG A 124 17.038 4.131 -2.887 1.00 0.00 H new ATOM 0 HD2 ARG A 124 16.952 1.769 -4.078 1.00 0.00 H new ATOM 0 HD3 ARG A 124 15.795 2.541 -5.145 1.00 0.00 H new ATOM 0 HE ARG A 124 17.530 4.194 -5.750 1.00 0.00 H new ATOM 0 HH11 ARG A 124 18.765 1.261 -4.144 1.00 0.00 H new ATOM 0 HH12 ARG A 124 20.376 1.465 -4.840 1.00 0.00 H new ATOM 0 HH21 ARG A 124 19.525 4.418 -6.598 1.00 0.00 H new ATOM 0 HH22 ARG A 124 20.807 3.258 -6.233 1.00 0.00 H new ATOM 1982 N HIS A 125 13.034 1.592 -0.551 1.00 0.00 N ATOM 1983 CA HIS A 125 12.687 0.742 0.583 1.00 0.00 C ATOM 1984 C HIS A 125 11.545 1.363 1.391 1.00 0.00 C ATOM 1985 O HIS A 125 11.334 2.576 1.331 1.00 0.00 O ATOM 1986 CB HIS A 125 13.941 0.587 1.457 1.00 0.00 C ATOM 1987 CG HIS A 125 13.820 -0.488 2.501 1.00 0.00 C ATOM 1988 ND1 HIS A 125 14.122 -1.822 2.342 1.00 0.00 N ATOM 1989 CD2 HIS A 125 13.429 -0.309 3.797 1.00 0.00 C ATOM 1990 CE1 HIS A 125 13.923 -2.436 3.519 1.00 0.00 C ATOM 1991 NE2 HIS A 125 13.540 -1.543 4.453 1.00 0.00 N ATOM 0 H HIS A 125 12.731 2.561 -0.452 1.00 0.00 H new ATOM 0 HA HIS A 125 12.349 -0.233 0.232 1.00 0.00 H new ATOM 0 HB2 HIS A 125 14.794 0.365 0.816 1.00 0.00 H new ATOM 0 HB3 HIS A 125 14.150 1.537 1.949 1.00 0.00 H new ATOM 0 HD1 HIS A 125 14.441 -2.266 1.481 1.00 0.00 H new ATOM 0 HD2 HIS A 125 13.094 0.618 4.238 1.00 0.00 H new ATOM 0 HE1 HIS A 125 14.051 -3.494 3.693 1.00 0.00 H new ATOM 1999 N PHE A 126 10.856 0.549 2.196 1.00 0.00 N ATOM 2000 CA PHE A 126 9.797 0.969 3.108 1.00 0.00 C ATOM 2001 C PHE A 126 9.901 0.160 4.404 1.00 0.00 C ATOM 2002 O PHE A 126 10.294 -1.009 4.368 1.00 0.00 O ATOM 2003 CB PHE A 126 8.421 0.781 2.436 1.00 0.00 C ATOM 2004 CG PHE A 126 7.310 0.249 3.326 1.00 0.00 C ATOM 2005 CD1 PHE A 126 6.606 1.124 4.173 1.00 0.00 C ATOM 2006 CD2 PHE A 126 7.001 -1.127 3.338 1.00 0.00 C ATOM 2007 CE1 PHE A 126 5.597 0.630 5.015 1.00 0.00 C ATOM 2008 CE2 PHE A 126 5.996 -1.620 4.191 1.00 0.00 C ATOM 2009 CZ PHE A 126 5.291 -0.737 5.030 1.00 0.00 C ATOM 0 H PHE A 126 11.029 -0.456 2.229 1.00 0.00 H new ATOM 0 HA PHE A 126 9.908 2.026 3.349 1.00 0.00 H new ATOM 0 HB2 PHE A 126 8.104 1.741 2.028 1.00 0.00 H new ATOM 0 HB3 PHE A 126 8.541 0.101 1.593 1.00 0.00 H new ATOM 0 HD1 PHE A 126 6.842 2.178 4.176 1.00 0.00 H new ATOM 0 HD2 PHE A 126 7.537 -1.805 2.690 1.00 0.00 H new ATOM 0 HE1 PHE A 126 5.053 1.308 5.655 1.00 0.00 H new ATOM 0 HE2 PHE A 126 5.766 -2.675 4.202 1.00 0.00 H new ATOM 0 HZ PHE A 126 4.517 -1.112 5.683 1.00 0.00 H new ATOM 2019 N GLN A 127 9.515 0.771 5.526 1.00 0.00 N ATOM 2020 CA GLN A 127 9.319 0.150 6.835 1.00 0.00 C ATOM 2021 C GLN A 127 8.149 0.872 7.516 1.00 0.00 C ATOM 2022 O GLN A 127 7.753 1.960 7.092 1.00 0.00 O ATOM 2023 CB GLN A 127 10.583 0.281 7.714 1.00 0.00 C ATOM 2024 CG GLN A 127 11.750 -0.630 7.321 1.00 0.00 C ATOM 2025 CD GLN A 127 11.429 -2.120 7.469 1.00 0.00 C ATOM 2026 OE1 GLN A 127 11.452 -2.672 8.566 1.00 0.00 O ATOM 2027 NE2 GLN A 127 11.113 -2.800 6.381 1.00 0.00 N ATOM 0 H GLN A 127 9.320 1.772 5.545 1.00 0.00 H new ATOM 0 HA GLN A 127 9.113 -0.913 6.708 1.00 0.00 H new ATOM 0 HB2 GLN A 127 10.924 1.316 7.680 1.00 0.00 H new ATOM 0 HB3 GLN A 127 10.310 0.069 8.748 1.00 0.00 H new ATOM 0 HG2 GLN A 127 12.029 -0.426 6.287 1.00 0.00 H new ATOM 0 HG3 GLN A 127 12.615 -0.388 7.939 1.00 0.00 H new ATOM 0 HE21 GLN A 127 11.097 -2.333 5.474 1.00 0.00 H new ATOM 0 HE22 GLN A 127 10.885 -3.792 6.448 1.00 0.00 H new ATOM 2036 N ALA A 128 7.631 0.315 8.611 1.00 0.00 N ATOM 2037 CA ALA A 128 6.631 0.969 9.443 1.00 0.00 C ATOM 2038 C ALA A 128 6.856 0.608 10.909 1.00 0.00 C ATOM 2039 O ALA A 128 7.440 -0.436 11.212 1.00 0.00 O ATOM 2040 CB ALA A 128 5.228 0.547 8.989 1.00 0.00 C ATOM 0 H ALA A 128 7.899 -0.611 8.945 1.00 0.00 H new ATOM 0 HA ALA A 128 6.722 2.050 9.338 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.481 1.037 9.613 1.00 0.00 H new ATOM 0 HB2 ALA A 128 5.079 0.837 7.949 1.00 0.00 H new ATOM 0 HB3 ALA A 128 5.125 -0.534 9.082 1.00 0.00 H new ATOM 2046 N GLY A 129 6.359 1.463 11.806 1.00 0.00 N ATOM 2047 CA GLY A 129 6.348 1.234 13.247 1.00 0.00 C ATOM 2048 C GLY A 129 7.739 0.944 13.820 1.00 0.00 C ATOM 2049 O GLY A 129 7.918 -0.068 14.501 1.00 0.00 O ATOM 0 H GLY A 129 5.943 2.356 11.540 1.00 0.00 H new ATOM 0 HA2 GLY A 129 5.932 2.110 13.745 1.00 0.00 H new ATOM 0 HA3 GLY A 129 5.688 0.396 13.471 1.00 0.00 H new ATOM 2053 N GLY A 130 8.723 1.797 13.523 1.00 0.00 N ATOM 2054 CA GLY A 130 10.107 1.637 13.951 1.00 0.00 C ATOM 2055 C GLY A 130 10.443 2.672 15.019 1.00 0.00 C ATOM 2056 O GLY A 130 10.163 3.860 14.843 1.00 0.00 O ATOM 0 H GLY A 130 8.571 2.637 12.965 1.00 0.00 H new ATOM 0 HA2 GLY A 130 10.261 0.632 14.345 1.00 0.00 H new ATOM 0 HA3 GLY A 130 10.776 1.751 13.098 1.00 0.00 H new ATOM 2060 N SER A 131 11.037 2.217 16.123 1.00 0.00 N ATOM 2061 CA SER A 131 11.322 2.997 17.321 1.00 0.00 C ATOM 2062 C SER A 131 12.078 4.287 16.984 1.00 0.00 C ATOM 2063 O SER A 131 13.248 4.242 16.592 1.00 0.00 O ATOM 2064 CB SER A 131 12.101 2.117 18.308 1.00 0.00 C ATOM 2065 OG SER A 131 11.464 0.854 18.460 1.00 0.00 O ATOM 0 H SER A 131 11.346 1.248 16.207 1.00 0.00 H new ATOM 0 HA SER A 131 10.386 3.307 17.785 1.00 0.00 H new ATOM 0 HB2 SER A 131 13.121 1.976 17.951 1.00 0.00 H new ATOM 0 HB3 SER A 131 12.168 2.616 19.275 1.00 0.00 H new ATOM 0 HG SER A 131 11.974 0.304 19.091 1.00 0.00 H new ATOM 2071 N GLY A 132 11.398 5.432 17.110 1.00 0.00 N ATOM 2072 CA GLY A 132 11.954 6.759 16.862 1.00 0.00 C ATOM 2073 C GLY A 132 12.634 6.898 15.499 1.00 0.00 C ATOM 2074 O GLY A 132 13.576 7.677 15.384 1.00 0.00 O ATOM 0 H GLY A 132 10.419 5.458 17.395 1.00 0.00 H new ATOM 0 HA2 GLY A 132 11.155 7.497 16.936 1.00 0.00 H new ATOM 0 HA3 GLY A 132 12.677 6.992 17.644 1.00 0.00 H new ATOM 2078 N MET A 133 12.214 6.137 14.479 1.00 0.00 N ATOM 2079 CA MET A 133 12.874 6.043 13.170 1.00 0.00 C ATOM 2080 C MET A 133 14.383 5.730 13.240 1.00 0.00 C ATOM 2081 O MET A 133 15.117 6.034 12.298 1.00 0.00 O ATOM 2082 CB MET A 133 12.629 7.307 12.326 1.00 0.00 C ATOM 2083 CG MET A 133 11.187 7.815 12.278 1.00 0.00 C ATOM 2084 SD MET A 133 10.843 8.974 10.917 1.00 0.00 S ATOM 2085 CE MET A 133 12.305 10.053 10.979 1.00 0.00 C ATOM 0 H MET A 133 11.381 5.552 14.544 1.00 0.00 H new ATOM 0 HA MET A 133 12.410 5.186 12.682 1.00 0.00 H new ATOM 0 HB2 MET A 133 13.261 8.106 12.713 1.00 0.00 H new ATOM 0 HB3 MET A 133 12.956 7.107 11.306 1.00 0.00 H new ATOM 0 HG2 MET A 133 10.516 6.960 12.189 1.00 0.00 H new ATOM 0 HG3 MET A 133 10.956 8.305 13.224 1.00 0.00 H new ATOM 0 HE1 MET A 133 12.205 10.844 10.236 1.00 0.00 H new ATOM 0 HE2 MET A 133 12.388 10.496 11.971 1.00 0.00 H new ATOM 0 HE3 MET A 133 13.199 9.467 10.767 1.00 0.00 H new ATOM 2095 N LYS A 134 14.908 5.167 14.336 1.00 0.00 N ATOM 2096 CA LYS A 134 16.361 5.026 14.489 1.00 0.00 C ATOM 2097 C LYS A 134 16.970 4.051 13.480 1.00 0.00 C ATOM 2098 O LYS A 134 18.120 4.243 13.088 1.00 0.00 O ATOM 2099 CB LYS A 134 16.721 4.643 15.937 1.00 0.00 C ATOM 2100 CG LYS A 134 16.712 5.854 16.891 1.00 0.00 C ATOM 2101 CD LYS A 134 18.073 6.567 17.019 1.00 0.00 C ATOM 2102 CE LYS A 134 18.631 7.085 15.684 1.00 0.00 C ATOM 2103 NZ LYS A 134 19.959 7.729 15.822 1.00 0.00 N ATOM 0 H LYS A 134 14.359 4.808 15.117 1.00 0.00 H new ATOM 0 HA LYS A 134 16.802 5.999 14.272 1.00 0.00 H new ATOM 0 HB2 LYS A 134 16.014 3.896 16.298 1.00 0.00 H new ATOM 0 HB3 LYS A 134 17.708 4.181 15.952 1.00 0.00 H new ATOM 0 HG2 LYS A 134 15.970 6.572 16.542 1.00 0.00 H new ATOM 0 HG3 LYS A 134 16.394 5.522 17.879 1.00 0.00 H new ATOM 0 HD2 LYS A 134 17.970 7.405 17.708 1.00 0.00 H new ATOM 0 HD3 LYS A 134 18.793 5.878 17.460 1.00 0.00 H new ATOM 0 HE2 LYS A 134 18.707 6.255 14.982 1.00 0.00 H new ATOM 0 HE3 LYS A 134 17.929 7.801 15.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 134 20.269 8.088 14.896 1.00 0.00 H new ATOM 0 HZ2 LYS A 134 19.894 8.519 16.496 1.00 0.00 H new ATOM 0 HZ3 LYS A 134 20.648 7.033 16.171 1.00 0.00 H new ATOM 2117 N MET A 135 16.219 3.045 13.022 1.00 0.00 N ATOM 2118 CA MET A 135 16.682 2.150 11.960 1.00 0.00 C ATOM 2119 C MET A 135 16.664 2.878 10.611 1.00 0.00 C ATOM 2120 O MET A 135 17.547 2.675 9.780 1.00 0.00 O ATOM 2121 CB MET A 135 15.804 0.886 11.922 1.00 0.00 C ATOM 2122 CG MET A 135 16.367 -0.205 10.995 1.00 0.00 C ATOM 2123 SD MET A 135 15.257 -0.785 9.676 1.00 0.00 S ATOM 2124 CE MET A 135 15.186 0.689 8.622 1.00 0.00 C ATOM 0 H MET A 135 15.285 2.831 13.372 1.00 0.00 H new ATOM 0 HA MET A 135 17.709 1.847 12.165 1.00 0.00 H new ATOM 0 HB2 MET A 135 15.709 0.485 12.931 1.00 0.00 H new ATOM 0 HB3 MET A 135 14.801 1.156 11.590 1.00 0.00 H new ATOM 0 HG2 MET A 135 17.279 0.174 10.534 1.00 0.00 H new ATOM 0 HG3 MET A 135 16.651 -1.062 11.606 1.00 0.00 H new ATOM 0 HE1 MET A 135 14.723 0.433 7.669 1.00 0.00 H new ATOM 0 HE2 MET A 135 14.596 1.461 9.116 1.00 0.00 H new ATOM 0 HE3 MET A 135 16.196 1.060 8.447 1.00 0.00 H new ATOM 2134 N LEU A 136 15.666 3.739 10.383 1.00 0.00 N ATOM 2135 CA LEU A 136 15.453 4.430 9.113 1.00 0.00 C ATOM 2136 C LEU A 136 16.646 5.297 8.740 1.00 0.00 C ATOM 2137 O LEU A 136 16.969 5.421 7.562 1.00 0.00 O ATOM 2138 CB LEU A 136 14.207 5.310 9.229 1.00 0.00 C ATOM 2139 CG LEU A 136 13.772 5.969 7.913 1.00 0.00 C ATOM 2140 CD1 LEU A 136 13.347 4.918 6.881 1.00 0.00 C ATOM 2141 CD2 LEU A 136 12.646 6.941 8.246 1.00 0.00 C ATOM 0 H LEU A 136 14.972 3.977 11.092 1.00 0.00 H new ATOM 0 HA LEU A 136 15.324 3.680 8.333 1.00 0.00 H new ATOM 0 HB2 LEU A 136 13.383 4.705 9.608 1.00 0.00 H new ATOM 0 HB3 LEU A 136 14.395 6.090 9.967 1.00 0.00 H new ATOM 0 HG LEU A 136 14.601 6.509 7.457 1.00 0.00 H new ATOM 0 HD11 LEU A 136 13.044 5.415 5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 136 14.184 4.251 6.675 1.00 0.00 H new ATOM 0 HD13 LEU A 136 12.510 4.340 7.274 1.00 0.00 H new ATOM 0 HD21 LEU A 136 12.307 7.432 7.334 1.00 0.00 H new ATOM 0 HD22 LEU A 136 11.815 6.396 8.694 1.00 0.00 H new ATOM 0 HD23 LEU A 136 13.009 7.691 8.949 1.00 0.00 H new ATOM 2153 N GLU A 137 17.323 5.863 9.738 1.00 0.00 N ATOM 2154 CA GLU A 137 18.558 6.610 9.549 1.00 0.00 C ATOM 2155 C GLU A 137 19.601 5.786 8.786 1.00 0.00 C ATOM 2156 O GLU A 137 20.272 6.312 7.896 1.00 0.00 O ATOM 2157 CB GLU A 137 19.063 7.060 10.926 1.00 0.00 C ATOM 2158 CG GLU A 137 20.419 7.765 10.838 1.00 0.00 C ATOM 2159 CD GLU A 137 20.664 8.682 12.038 1.00 0.00 C ATOM 2160 OE1 GLU A 137 20.684 8.215 13.199 1.00 0.00 O ATOM 2161 OE2 GLU A 137 20.813 9.902 11.804 1.00 0.00 O ATOM 0 H GLU A 137 17.022 5.813 10.711 1.00 0.00 H new ATOM 0 HA GLU A 137 18.371 7.490 8.934 1.00 0.00 H new ATOM 0 HB2 GLU A 137 18.334 7.732 11.378 1.00 0.00 H new ATOM 0 HB3 GLU A 137 19.147 6.194 11.582 1.00 0.00 H new ATOM 0 HG2 GLU A 137 21.213 7.020 10.782 1.00 0.00 H new ATOM 0 HG3 GLU A 137 20.465 8.349 9.919 1.00 0.00 H new ATOM 2168 N LYS A 138 19.716 4.486 9.075 1.00 0.00 N ATOM 2169 CA LYS A 138 20.656 3.613 8.378 1.00 0.00 C ATOM 2170 C LYS A 138 20.210 3.472 6.931 1.00 0.00 C ATOM 2171 O LYS A 138 21.034 3.556 6.022 1.00 0.00 O ATOM 2172 CB LYS A 138 20.730 2.225 9.045 1.00 0.00 C ATOM 2173 CG LYS A 138 20.912 2.238 10.573 1.00 0.00 C ATOM 2174 CD LYS A 138 22.141 3.009 11.085 1.00 0.00 C ATOM 2175 CE LYS A 138 23.456 2.408 10.563 1.00 0.00 C ATOM 2176 NZ LYS A 138 24.648 3.097 11.119 1.00 0.00 N ATOM 0 H LYS A 138 19.164 4.016 9.792 1.00 0.00 H new ATOM 0 HA LYS A 138 21.651 4.055 8.424 1.00 0.00 H new ATOM 0 HB2 LYS A 138 19.817 1.678 8.809 1.00 0.00 H new ATOM 0 HB3 LYS A 138 21.557 1.671 8.602 1.00 0.00 H new ATOM 0 HG2 LYS A 138 20.019 2.670 11.024 1.00 0.00 H new ATOM 0 HG3 LYS A 138 20.979 1.208 10.923 1.00 0.00 H new ATOM 0 HD2 LYS A 138 22.070 4.051 10.774 1.00 0.00 H new ATOM 0 HD3 LYS A 138 22.146 3.001 12.175 1.00 0.00 H new ATOM 0 HE2 LYS A 138 23.497 1.350 10.821 1.00 0.00 H new ATOM 0 HE3 LYS A 138 23.476 2.472 9.475 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 25.511 2.658 10.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 24.624 4.102 10.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 24.645 3.014 12.156 1.00 0.00 H new ATOM 2190 N ARG A 139 18.903 3.292 6.703 1.00 0.00 N ATOM 2191 CA ARG A 139 18.380 3.078 5.366 1.00 0.00 C ATOM 2192 C ARG A 139 18.578 4.320 4.504 1.00 0.00 C ATOM 2193 O ARG A 139 19.043 4.200 3.376 1.00 0.00 O ATOM 2194 CB ARG A 139 16.911 2.640 5.449 1.00 0.00 C ATOM 2195 CG ARG A 139 16.417 2.032 4.127 1.00 0.00 C ATOM 2196 CD ARG A 139 17.010 0.645 3.814 1.00 0.00 C ATOM 2197 NE ARG A 139 16.368 -0.415 4.613 1.00 0.00 N ATOM 2198 CZ ARG A 139 16.794 -1.014 5.729 1.00 0.00 C ATOM 2199 NH1 ARG A 139 17.997 -0.763 6.238 1.00 0.00 N ATOM 2200 NH2 ARG A 139 15.973 -1.868 6.330 1.00 0.00 N ATOM 0 H ARG A 139 18.194 3.292 7.436 1.00 0.00 H new ATOM 0 HA ARG A 139 18.934 2.275 4.880 1.00 0.00 H new ATOM 0 HB2 ARG A 139 16.795 1.910 6.250 1.00 0.00 H new ATOM 0 HB3 ARG A 139 16.291 3.498 5.708 1.00 0.00 H new ATOM 0 HG2 ARG A 139 15.330 1.952 4.160 1.00 0.00 H new ATOM 0 HG3 ARG A 139 16.662 2.713 3.312 1.00 0.00 H new ATOM 0 HD2 ARG A 139 16.886 0.427 2.753 1.00 0.00 H new ATOM 0 HD3 ARG A 139 18.081 0.654 4.014 1.00 0.00 H new ATOM 0 HE ARG A 139 15.466 -0.739 4.262 1.00 0.00 H new ATOM 0 HH11 ARG A 139 18.618 -0.100 5.775 1.00 0.00 H new ATOM 0 HH12 ARG A 139 18.298 -1.234 7.091 1.00 0.00 H new ATOM 0 HH21 ARG A 139 15.049 -2.049 5.938 1.00 0.00 H new ATOM 0 HH22 ARG A 139 16.267 -2.343 7.184 1.00 0.00 H new ATOM 2214 N VAL A 140 18.291 5.509 5.028 1.00 0.00 N ATOM 2215 CA VAL A 140 18.550 6.765 4.350 1.00 0.00 C ATOM 2216 C VAL A 140 20.038 6.897 4.030 1.00 0.00 C ATOM 2217 O VAL A 140 20.374 7.239 2.899 1.00 0.00 O ATOM 2218 CB VAL A 140 17.981 7.895 5.232 1.00 0.00 C ATOM 2219 CG1 VAL A 140 18.596 9.274 4.975 1.00 0.00 C ATOM 2220 CG2 VAL A 140 16.459 7.940 5.006 1.00 0.00 C ATOM 0 H VAL A 140 17.866 5.623 5.948 1.00 0.00 H new ATOM 0 HA VAL A 140 18.052 6.820 3.382 1.00 0.00 H new ATOM 0 HB VAL A 140 18.236 7.665 6.267 1.00 0.00 H new ATOM 0 HG11 VAL A 140 18.137 10.007 5.639 1.00 0.00 H new ATOM 0 HG12 VAL A 140 19.669 9.235 5.164 1.00 0.00 H new ATOM 0 HG13 VAL A 140 18.421 9.563 3.939 1.00 0.00 H new ATOM 0 HG21 VAL A 140 16.024 8.731 5.617 1.00 0.00 H new ATOM 0 HG22 VAL A 140 16.253 8.139 3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 140 16.021 6.982 5.287 1.00 0.00 H new ATOM 2230 N ASN A 141 20.941 6.587 4.967 1.00 0.00 N ATOM 2231 CA ASN A 141 22.375 6.731 4.709 1.00 0.00 C ATOM 2232 C ASN A 141 22.830 5.751 3.628 1.00 0.00 C ATOM 2233 O ASN A 141 23.648 6.115 2.784 1.00 0.00 O ATOM 2234 CB ASN A 141 23.209 6.562 5.990 1.00 0.00 C ATOM 2235 CG ASN A 141 23.325 7.875 6.760 1.00 0.00 C ATOM 2236 OD1 ASN A 141 24.244 8.657 6.541 1.00 0.00 O ATOM 2237 ND2 ASN A 141 22.397 8.153 7.660 1.00 0.00 N ATOM 0 H ASN A 141 20.708 6.240 5.897 1.00 0.00 H new ATOM 0 HA ASN A 141 22.542 7.746 4.348 1.00 0.00 H new ATOM 0 HB2 ASN A 141 22.751 5.805 6.627 1.00 0.00 H new ATOM 0 HB3 ASN A 141 24.205 6.201 5.732 1.00 0.00 H new ATOM 0 HD21 ASN A 141 22.440 9.028 8.183 1.00 0.00 H new ATOM 0 HD22 ASN A 141 21.639 7.493 7.831 1.00 0.00 H new ATOM 2244 N ARG A 142 22.274 4.536 3.596 1.00 0.00 N ATOM 2245 CA ARG A 142 22.477 3.611 2.484 1.00 0.00 C ATOM 2246 C ARG A 142 21.973 4.247 1.192 1.00 0.00 C ATOM 2247 O ARG A 142 22.731 4.283 0.233 1.00 0.00 O ATOM 2248 CB ARG A 142 21.825 2.251 2.814 1.00 0.00 C ATOM 2249 CG ARG A 142 21.536 1.322 1.620 1.00 0.00 C ATOM 2250 CD ARG A 142 22.737 0.952 0.735 1.00 0.00 C ATOM 2251 NE ARG A 142 23.739 0.127 1.424 1.00 0.00 N ATOM 2252 CZ ARG A 142 24.798 -0.443 0.832 1.00 0.00 C ATOM 2253 NH1 ARG A 142 24.990 -0.353 -0.485 1.00 0.00 N ATOM 2254 NH2 ARG A 142 25.677 -1.112 1.573 1.00 0.00 N ATOM 0 H ARG A 142 21.675 4.171 4.336 1.00 0.00 H new ATOM 0 HA ARG A 142 23.537 3.410 2.331 1.00 0.00 H new ATOM 0 HB2 ARG A 142 22.475 1.721 3.510 1.00 0.00 H new ATOM 0 HB3 ARG A 142 20.886 2.440 3.335 1.00 0.00 H new ATOM 0 HG2 ARG A 142 21.097 0.401 2.003 1.00 0.00 H new ATOM 0 HG3 ARG A 142 20.783 1.797 0.992 1.00 0.00 H new ATOM 0 HD2 ARG A 142 22.379 0.417 -0.144 1.00 0.00 H new ATOM 0 HD3 ARG A 142 23.212 1.866 0.380 1.00 0.00 H new ATOM 0 HE ARG A 142 23.620 -0.023 2.426 1.00 0.00 H new ATOM 0 HH11 ARG A 142 24.323 0.158 -1.064 1.00 0.00 H new ATOM 0 HH12 ARG A 142 25.803 -0.795 -0.913 1.00 0.00 H new ATOM 0 HH21 ARG A 142 25.542 -1.187 2.581 1.00 0.00 H new ATOM 0 HH22 ARG A 142 26.486 -1.550 1.133 1.00 0.00 H new ATOM 2268 N VAL A 143 20.755 4.784 1.133 1.00 0.00 N ATOM 2269 CA VAL A 143 20.243 5.391 -0.097 1.00 0.00 C ATOM 2270 C VAL A 143 21.116 6.579 -0.543 1.00 0.00 C ATOM 2271 O VAL A 143 21.289 6.776 -1.746 1.00 0.00 O ATOM 2272 CB VAL A 143 18.740 5.711 0.053 1.00 0.00 C ATOM 2273 CG1 VAL A 143 18.183 6.535 -1.118 1.00 0.00 C ATOM 2274 CG2 VAL A 143 17.949 4.392 0.133 1.00 0.00 C ATOM 0 H VAL A 143 20.106 4.812 1.919 1.00 0.00 H new ATOM 0 HA VAL A 143 20.315 4.677 -0.917 1.00 0.00 H new ATOM 0 HB VAL A 143 18.631 6.304 0.961 1.00 0.00 H new ATOM 0 HG11 VAL A 143 17.123 6.728 -0.955 1.00 0.00 H new ATOM 0 HG12 VAL A 143 18.718 7.482 -1.183 1.00 0.00 H new ATOM 0 HG13 VAL A 143 18.312 5.980 -2.047 1.00 0.00 H new ATOM 0 HG21 VAL A 143 16.886 4.611 0.239 1.00 0.00 H new ATOM 0 HG22 VAL A 143 18.111 3.815 -0.777 1.00 0.00 H new ATOM 0 HG23 VAL A 143 18.288 3.816 0.994 1.00 0.00 H new ATOM 2284 N LEU A 144 21.731 7.329 0.378 1.00 0.00 N ATOM 2285 CA LEU A 144 22.718 8.345 0.005 1.00 0.00 C ATOM 2286 C LEU A 144 23.921 7.682 -0.655 1.00 0.00 C ATOM 2287 O LEU A 144 24.325 8.111 -1.731 1.00 0.00 O ATOM 2288 CB LEU A 144 23.205 9.174 1.209 1.00 0.00 C ATOM 2289 CG LEU A 144 22.132 10.060 1.855 1.00 0.00 C ATOM 2290 CD1 LEU A 144 22.662 10.678 3.152 1.00 0.00 C ATOM 2291 CD2 LEU A 144 21.675 11.181 0.919 1.00 0.00 C ATOM 0 H LEU A 144 21.563 7.252 1.381 1.00 0.00 H new ATOM 0 HA LEU A 144 22.222 9.024 -0.688 1.00 0.00 H new ATOM 0 HB2 LEU A 144 23.599 8.495 1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 144 24.032 9.806 0.886 1.00 0.00 H new ATOM 0 HG LEU A 144 21.276 9.420 2.068 1.00 0.00 H new ATOM 0 HD11 LEU A 144 21.890 11.304 3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 144 22.934 9.885 3.848 1.00 0.00 H new ATOM 0 HD13 LEU A 144 23.540 11.286 2.933 1.00 0.00 H new ATOM 0 HD21 LEU A 144 20.915 11.784 1.417 1.00 0.00 H new ATOM 0 HD22 LEU A 144 22.527 11.811 0.662 1.00 0.00 H new ATOM 0 HD23 LEU A 144 21.257 10.748 0.010 1.00 0.00 H new ATOM 2303 N ALA A 145 24.478 6.630 -0.047 1.00 0.00 N ATOM 2304 CA ALA A 145 25.611 5.900 -0.611 1.00 0.00 C ATOM 2305 C ALA A 145 25.274 5.286 -1.980 1.00 0.00 C ATOM 2306 O ALA A 145 26.148 5.175 -2.839 1.00 0.00 O ATOM 2307 CB ALA A 145 26.077 4.818 0.370 1.00 0.00 C ATOM 0 H ALA A 145 24.155 6.263 0.848 1.00 0.00 H new ATOM 0 HA ALA A 145 26.422 6.611 -0.770 1.00 0.00 H new ATOM 0 HB1 ALA A 145 26.922 4.278 -0.058 1.00 0.00 H new ATOM 0 HB2 ALA A 145 26.381 5.283 1.308 1.00 0.00 H new ATOM 0 HB3 ALA A 145 25.260 4.122 0.559 1.00 0.00 H new ATOM 2313 N GLU A 146 24.013 4.908 -2.206 1.00 0.00 N ATOM 2314 CA GLU A 146 23.518 4.401 -3.483 1.00 0.00 C ATOM 2315 C GLU A 146 23.431 5.504 -4.553 1.00 0.00 C ATOM 2316 O GLU A 146 23.251 5.176 -5.728 1.00 0.00 O ATOM 2317 CB GLU A 146 22.118 3.784 -3.304 1.00 0.00 C ATOM 2318 CG GLU A 146 22.053 2.501 -2.466 1.00 0.00 C ATOM 2319 CD GLU A 146 22.581 1.262 -3.199 1.00 0.00 C ATOM 2320 OE1 GLU A 146 22.044 0.930 -4.280 1.00 0.00 O ATOM 2321 OE2 GLU A 146 23.495 0.597 -2.656 1.00 0.00 O ATOM 0 H GLU A 146 23.292 4.948 -1.486 1.00 0.00 H new ATOM 0 HA GLU A 146 24.230 3.647 -3.819 1.00 0.00 H new ATOM 0 HB2 GLU A 146 21.470 4.529 -2.843 1.00 0.00 H new ATOM 0 HB3 GLU A 146 21.707 3.571 -4.291 1.00 0.00 H new ATOM 0 HG2 GLU A 146 22.629 2.645 -1.552 1.00 0.00 H new ATOM 0 HG3 GLU A 146 21.020 2.324 -2.168 1.00 0.00 H new ATOM 2328 N THR A 147 23.547 6.788 -4.186 1.00 0.00 N ATOM 2329 CA THR A 147 23.260 7.908 -5.080 1.00 0.00 C ATOM 2330 C THR A 147 24.326 9.021 -5.002 1.00 0.00 C ATOM 2331 O THR A 147 24.126 10.139 -5.482 1.00 0.00 O ATOM 2332 CB THR A 147 21.786 8.327 -4.833 1.00 0.00 C ATOM 2333 OG1 THR A 147 21.160 8.624 -6.060 1.00 0.00 O ATOM 2334 CG2 THR A 147 21.558 9.474 -3.844 1.00 0.00 C ATOM 0 H THR A 147 23.845 7.076 -3.254 1.00 0.00 H new ATOM 0 HA THR A 147 23.340 7.621 -6.128 1.00 0.00 H new ATOM 0 HB THR A 147 21.337 7.459 -4.350 1.00 0.00 H new ATOM 0 HG1 THR A 147 20.189 8.661 -5.931 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.490 9.673 -3.757 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.956 9.197 -2.868 1.00 0.00 H new ATOM 0 HG23 THR A 147 22.066 10.370 -4.202 1.00 0.00 H new ATOM 2342 N GLU A 148 25.500 8.704 -4.454 1.00 0.00 N ATOM 2343 CA GLU A 148 26.636 9.602 -4.297 1.00 0.00 C ATOM 2344 C GLU A 148 27.899 8.820 -4.659 1.00 0.00 C ATOM 2345 O GLU A 148 28.131 7.740 -4.077 1.00 0.00 O ATOM 2346 CB GLU A 148 26.667 10.155 -2.860 1.00 0.00 C ATOM 2347 CG GLU A 148 27.833 11.133 -2.664 1.00 0.00 C ATOM 2348 CD GLU A 148 27.823 11.780 -1.263 1.00 0.00 C ATOM 2349 OE1 GLU A 148 28.388 11.197 -0.309 1.00 0.00 O ATOM 2350 OE2 GLU A 148 27.277 12.897 -1.107 1.00 0.00 O ATOM 2351 OXT GLU A 148 28.624 9.257 -5.575 1.00 0.00 O ATOM 0 H GLU A 148 25.689 7.769 -4.092 1.00 0.00 H new ATOM 0 HA GLU A 148 26.562 10.466 -4.958 1.00 0.00 H new ATOM 0 HB2 GLU A 148 25.726 10.660 -2.642 1.00 0.00 H new ATOM 0 HB3 GLU A 148 26.758 9.331 -2.153 1.00 0.00 H new ATOM 0 HG2 GLU A 148 28.776 10.606 -2.812 1.00 0.00 H new ATOM 0 HG3 GLU A 148 27.782 11.914 -3.423 1.00 0.00 H new