USER MOD reduce.3.24.130724 H: found=0, std=0, add=1081, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1077 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 133 ASN : amide:sc= -0.0861 K(o=-0.2,f=-1.2) USER MOD Set 1.2: A 134 ASN : amide:sc= -0.115 K(o=-0.2,f=-2.3) USER MOD Set 2.1: A 55 HIS : no HD1:sc= -0.852 X(o=-2.3,f=-2.1) USER MOD Set 2.2: A 80 LYS NZ :NH3+ -107:sc= -1.43 (180deg=-3.78!) USER MOD Single : A 1 GLY N :NH3+ 155:sc= -2.14! (180deg=-3.59!) USER MOD Single : A 3 THR OG1 : rot 180:sc= -0.862 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 9 THR OG1 : rot 80:sc= 0 USER MOD Single : A 10 GLN : amide:sc= -0.826 X(o=-0.83,f=-1.3) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= -0.251 X(o=-0.25,f=-0.26) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0.721 K(o=0.72,f=-6!) USER MOD Single : A 38 ASN : amide:sc= -2.03 K(o=-2,f=-5.4!) USER MOD Single : A 39 MET CE :methyl -157:sc= -2.46 (180deg=-4.41!) USER MOD Single : A 43 HIS : no HD1:sc= -0.279 X(o=-0.28,f=-0.11) USER MOD Single : A 45 SER OG : rot 132:sc= 0.664 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 TYR OH : rot -146:sc= -4.18! USER MOD Single : A 63 SER OG : rot 180:sc= -0.553 USER MOD Single : A 64 THR OG1 : rot 180:sc= -0.217 USER MOD Single : A 66 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 CYS SG : rot 8:sc= 0.464 USER MOD Single : A 75 ASN : amide:sc= 0.0659 X(o=0.066,f=0.047) USER MOD Single : A 77 LYS NZ :NH3+ -152:sc= 1.21 (180deg=0.463) USER MOD Single : A 82 ASN : amide:sc= 0.791 K(o=0.79,f=-0.11) USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc= -0.693 K(o=-0.69,f=0) USER MOD Single : A 86 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 GLN : amide:sc=-0.00543 X(o=-0.0054,f=0.00015) USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= -0.0632 K(o=-0.063,f=-1.8!) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.187 USER MOD Single : A 116 LYS NZ :NH3+ 166:sc= -0.0218 (180deg=-0.222) USER MOD Single : A 117 LYS NZ :NH3+ 164:sc= -0.0178 (180deg=-0.202) USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 GLN : amide:sc= -0.153 K(o=-0.15,f=-1.8!) USER MOD Single : A 120 LYS NZ :NH3+ 164:sc=-0.00724 (180deg=-0.156) USER MOD Single : A 124 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 THR OG1 : rot 180:sc= -0.475 USER MOD Single : A 132 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 4.055 -0.508 0.824 1.00 0.00 N ATOM 2 CA GLY A 1 4.310 -0.694 -0.592 1.00 0.00 C ATOM 3 C GLY A 1 4.821 -2.085 -0.911 1.00 0.00 C ATOM 4 O GLY A 1 5.759 -2.570 -0.276 1.00 0.00 O ATOM 0 H1 GLY A 1 4.124 0.503 1.059 1.00 0.00 H new ATOM 0 H2 GLY A 1 3.101 -0.853 1.053 1.00 0.00 H new ATOM 0 H3 GLY A 1 4.757 -1.041 1.376 1.00 0.00 H new ATOM 0 HA2 GLY A 1 3.392 -0.510 -1.151 1.00 0.00 H new ATOM 0 HA3 GLY A 1 5.040 0.043 -0.927 1.00 0.00 H new ATOM 8 N ILE A 2 4.203 -2.730 -1.895 1.00 0.00 N ATOM 9 CA ILE A 2 4.601 -4.074 -2.295 1.00 0.00 C ATOM 10 C ILE A 2 5.791 -4.034 -3.247 1.00 0.00 C ATOM 11 O ILE A 2 6.640 -4.927 -3.237 1.00 0.00 O ATOM 12 CB ILE A 2 3.441 -4.825 -2.974 1.00 0.00 C ATOM 13 CG1 ILE A 2 2.284 -5.016 -1.990 1.00 0.00 C ATOM 14 CG2 ILE A 2 3.918 -6.169 -3.505 1.00 0.00 C ATOM 15 CD1 ILE A 2 1.037 -5.587 -2.628 1.00 0.00 C ATOM 0 H ILE A 2 3.425 -2.344 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 2 4.884 -4.604 -1.385 1.00 0.00 H new ATOM 0 HB ILE A 2 3.085 -4.230 -3.815 1.00 0.00 H new ATOM 0 HG12 ILE A 2 2.607 -5.678 -1.186 1.00 0.00 H new ATOM 0 HG13 ILE A 2 2.042 -4.056 -1.535 1.00 0.00 H new ATOM 0 HG21 ILE A 2 3.086 -6.688 -3.982 1.00 0.00 H new ATOM 0 HG22 ILE A 2 4.713 -6.011 -4.234 1.00 0.00 H new ATOM 0 HG23 ILE A 2 4.297 -6.772 -2.680 1.00 0.00 H new ATOM 0 HD11 ILE A 2 0.259 -5.695 -1.873 1.00 0.00 H new ATOM 0 HD12 ILE A 2 0.690 -4.915 -3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 2 1.263 -6.562 -3.059 1.00 0.00 H new ATOM 27 N THR A 3 5.850 -2.991 -4.070 1.00 0.00 N ATOM 28 CA THR A 3 6.937 -2.833 -5.028 1.00 0.00 C ATOM 29 C THR A 3 8.291 -2.834 -4.328 1.00 0.00 C ATOM 30 O THR A 3 8.441 -2.334 -3.213 1.00 0.00 O ATOM 31 CB THR A 3 6.789 -1.529 -5.835 1.00 0.00 C ATOM 32 OG1 THR A 3 7.991 -1.269 -6.569 1.00 0.00 O ATOM 33 CG2 THR A 3 6.486 -0.355 -4.916 1.00 0.00 C ATOM 0 H THR A 3 5.157 -2.243 -4.092 1.00 0.00 H new ATOM 0 HA THR A 3 6.884 -3.682 -5.710 1.00 0.00 H new ATOM 0 HB THR A 3 5.958 -1.650 -6.530 1.00 0.00 H new ATOM 0 HG1 THR A 3 7.889 -0.439 -7.081 1.00 0.00 H new ATOM 0 HG21 THR A 3 6.386 0.554 -5.508 1.00 0.00 H new ATOM 0 HG22 THR A 3 5.556 -0.543 -4.380 1.00 0.00 H new ATOM 0 HG23 THR A 3 7.299 -0.234 -4.200 1.00 0.00 H new ATOM 41 N PRO A 4 9.303 -3.407 -4.997 1.00 0.00 N ATOM 42 CA PRO A 4 10.664 -3.485 -4.458 1.00 0.00 C ATOM 43 C PRO A 4 11.344 -2.122 -4.401 1.00 0.00 C ATOM 44 O PRO A 4 11.912 -1.742 -3.377 1.00 0.00 O ATOM 45 CB PRO A 4 11.386 -4.402 -5.448 1.00 0.00 C ATOM 46 CG PRO A 4 10.629 -4.252 -6.723 1.00 0.00 C ATOM 47 CD PRO A 4 9.196 -4.023 -6.330 1.00 0.00 C ATOM 0 HA PRO A 4 10.675 -3.851 -3.431 1.00 0.00 H new ATOM 0 HB2 PRO A 4 12.429 -4.110 -5.570 1.00 0.00 H new ATOM 0 HB3 PRO A 4 11.383 -5.437 -5.105 1.00 0.00 H new ATOM 0 HG2 PRO A 4 11.012 -3.415 -7.308 1.00 0.00 H new ATOM 0 HG3 PRO A 4 10.726 -5.144 -7.342 1.00 0.00 H new ATOM 0 HD2 PRO A 4 8.685 -3.368 -7.036 1.00 0.00 H new ATOM 0 HD3 PRO A 4 8.634 -4.956 -6.298 1.00 0.00 H new ATOM 55 N ARG A 5 11.284 -1.389 -5.509 1.00 0.00 N ATOM 56 CA ARG A 5 11.895 -0.068 -5.585 1.00 0.00 C ATOM 57 C ARG A 5 11.131 0.830 -6.554 1.00 0.00 C ATOM 58 O ARG A 5 10.594 0.361 -7.558 1.00 0.00 O ATOM 59 CB ARG A 5 13.356 -0.183 -6.022 1.00 0.00 C ATOM 60 CG ARG A 5 14.323 -0.390 -4.868 1.00 0.00 C ATOM 61 CD ARG A 5 14.660 -1.861 -4.681 1.00 0.00 C ATOM 62 NE ARG A 5 16.038 -2.159 -5.062 1.00 0.00 N ATOM 63 CZ ARG A 5 17.091 -1.854 -4.311 1.00 0.00 C ATOM 64 NH1 ARG A 5 16.923 -1.245 -3.145 1.00 0.00 N ATOM 65 NH2 ARG A 5 18.314 -2.158 -4.725 1.00 0.00 N ATOM 0 H ARG A 5 10.818 -1.688 -6.366 1.00 0.00 H new ATOM 0 HA ARG A 5 11.854 0.381 -4.593 1.00 0.00 H new ATOM 0 HB2 ARG A 5 13.453 -1.015 -6.720 1.00 0.00 H new ATOM 0 HB3 ARG A 5 13.637 0.721 -6.562 1.00 0.00 H new ATOM 0 HG2 ARG A 5 15.238 0.173 -5.053 1.00 0.00 H new ATOM 0 HG3 ARG A 5 13.886 0.004 -3.950 1.00 0.00 H new ATOM 0 HD2 ARG A 5 14.504 -2.139 -3.639 1.00 0.00 H new ATOM 0 HD3 ARG A 5 13.979 -2.468 -5.278 1.00 0.00 H new ATOM 0 HE ARG A 5 16.201 -2.627 -5.954 1.00 0.00 H new ATOM 0 HH11 ARG A 5 15.984 -1.010 -2.823 1.00 0.00 H new ATOM 0 HH12 ARG A 5 17.733 -1.012 -2.570 1.00 0.00 H new ATOM 0 HH21 ARG A 5 18.447 -2.627 -5.621 1.00 0.00 H new ATOM 0 HH22 ARG A 5 19.121 -1.923 -4.147 1.00 0.00 H new ATOM 79 N PHE A 6 11.087 2.122 -6.247 1.00 0.00 N ATOM 80 CA PHE A 6 10.388 3.085 -7.090 1.00 0.00 C ATOM 81 C PHE A 6 10.834 4.509 -6.773 1.00 0.00 C ATOM 82 O PHE A 6 10.913 4.902 -5.609 1.00 0.00 O ATOM 83 CB PHE A 6 8.875 2.957 -6.900 1.00 0.00 C ATOM 84 CG PHE A 6 8.389 3.498 -5.586 1.00 0.00 C ATOM 85 CD1 PHE A 6 8.023 4.829 -5.463 1.00 0.00 C ATOM 86 CD2 PHE A 6 8.296 2.676 -4.475 1.00 0.00 C ATOM 87 CE1 PHE A 6 7.575 5.329 -4.254 1.00 0.00 C ATOM 88 CE2 PHE A 6 7.849 3.170 -3.264 1.00 0.00 C ATOM 89 CZ PHE A 6 7.487 4.499 -3.154 1.00 0.00 C ATOM 0 H PHE A 6 11.527 2.526 -5.421 1.00 0.00 H new ATOM 0 HA PHE A 6 10.636 2.869 -8.129 1.00 0.00 H new ATOM 0 HB2 PHE A 6 8.369 3.483 -7.710 1.00 0.00 H new ATOM 0 HB3 PHE A 6 8.594 1.907 -6.978 1.00 0.00 H new ATOM 0 HD1 PHE A 6 8.088 5.483 -6.320 1.00 0.00 H new ATOM 0 HD2 PHE A 6 8.576 1.636 -4.556 1.00 0.00 H new ATOM 0 HE1 PHE A 6 7.294 6.368 -4.170 1.00 0.00 H new ATOM 0 HE2 PHE A 6 7.783 2.518 -2.405 1.00 0.00 H new ATOM 0 HZ PHE A 6 7.136 4.888 -2.210 1.00 0.00 H new ATOM 99 N SER A 7 11.124 5.278 -7.818 1.00 0.00 N ATOM 100 CA SER A 7 11.566 6.658 -7.652 1.00 0.00 C ATOM 101 C SER A 7 10.677 7.612 -8.444 1.00 0.00 C ATOM 102 O SER A 7 10.207 7.280 -9.532 1.00 0.00 O ATOM 103 CB SER A 7 13.021 6.807 -8.101 1.00 0.00 C ATOM 104 OG SER A 7 13.915 6.485 -7.050 1.00 0.00 O ATOM 0 H SER A 7 11.061 4.969 -8.788 1.00 0.00 H new ATOM 0 HA SER A 7 11.492 6.913 -6.595 1.00 0.00 H new ATOM 0 HB2 SER A 7 13.210 6.157 -8.955 1.00 0.00 H new ATOM 0 HB3 SER A 7 13.199 7.830 -8.434 1.00 0.00 H new ATOM 0 HG SER A 7 14.838 6.586 -7.363 1.00 0.00 H new ATOM 110 N ILE A 8 10.452 8.798 -7.889 1.00 0.00 N ATOM 111 CA ILE A 8 9.620 9.801 -8.543 1.00 0.00 C ATOM 112 C ILE A 8 10.451 11.002 -8.982 1.00 0.00 C ATOM 113 O ILE A 8 11.385 11.412 -8.291 1.00 0.00 O ATOM 114 CB ILE A 8 8.488 10.285 -7.617 1.00 0.00 C ATOM 115 CG1 ILE A 8 7.994 9.135 -6.737 1.00 0.00 C ATOM 116 CG2 ILE A 8 7.344 10.862 -8.437 1.00 0.00 C ATOM 117 CD1 ILE A 8 6.787 9.493 -5.898 1.00 0.00 C ATOM 0 H ILE A 8 10.834 9.088 -6.989 1.00 0.00 H new ATOM 0 HA ILE A 8 9.182 9.325 -9.420 1.00 0.00 H new ATOM 0 HB ILE A 8 8.877 11.071 -6.970 1.00 0.00 H new ATOM 0 HG12 ILE A 8 7.746 8.283 -7.371 1.00 0.00 H new ATOM 0 HG13 ILE A 8 8.803 8.818 -6.079 1.00 0.00 H new ATOM 0 HG21 ILE A 8 6.552 11.200 -7.769 1.00 0.00 H new ATOM 0 HG22 ILE A 8 7.707 11.705 -9.025 1.00 0.00 H new ATOM 0 HG23 ILE A 8 6.953 10.095 -9.105 1.00 0.00 H new ATOM 0 HD11 ILE A 8 6.491 8.631 -5.300 1.00 0.00 H new ATOM 0 HD12 ILE A 8 7.036 10.325 -5.239 1.00 0.00 H new ATOM 0 HD13 ILE A 8 5.963 9.781 -6.551 1.00 0.00 H new ATOM 129 N THR A 9 10.104 11.565 -10.135 1.00 0.00 N ATOM 130 CA THR A 9 10.817 12.720 -10.667 1.00 0.00 C ATOM 131 C THR A 9 9.853 13.848 -11.015 1.00 0.00 C ATOM 132 O THR A 9 8.725 13.603 -11.443 1.00 0.00 O ATOM 133 CB THR A 9 11.630 12.350 -11.921 1.00 0.00 C ATOM 134 OG1 THR A 9 12.290 11.094 -11.724 1.00 0.00 O ATOM 135 CG2 THR A 9 12.659 13.425 -12.237 1.00 0.00 C ATOM 0 H THR A 9 9.333 11.240 -10.719 1.00 0.00 H new ATOM 0 HA THR A 9 11.500 13.056 -9.887 1.00 0.00 H new ATOM 0 HB THR A 9 10.942 12.271 -12.762 1.00 0.00 H new ATOM 0 HG1 THR A 9 11.653 10.364 -11.867 1.00 0.00 H new ATOM 0 HG21 THR A 9 13.221 13.141 -13.127 1.00 0.00 H new ATOM 0 HG22 THR A 9 12.152 14.373 -12.416 1.00 0.00 H new ATOM 0 HG23 THR A 9 13.343 13.533 -11.395 1.00 0.00 H new ATOM 143 N GLN A 10 10.304 15.085 -10.830 1.00 0.00 N ATOM 144 CA GLN A 10 9.480 16.251 -11.125 1.00 0.00 C ATOM 145 C GLN A 10 10.063 17.049 -12.286 1.00 0.00 C ATOM 146 O GLN A 10 11.281 17.150 -12.434 1.00 0.00 O ATOM 147 CB GLN A 10 9.358 17.142 -9.888 1.00 0.00 C ATOM 148 CG GLN A 10 10.695 17.641 -9.363 1.00 0.00 C ATOM 149 CD GLN A 10 11.310 16.701 -8.345 1.00 0.00 C ATOM 150 OE1 GLN A 10 12.271 15.990 -8.641 1.00 0.00 O ATOM 151 NE2 GLN A 10 10.758 16.692 -7.138 1.00 0.00 N ATOM 0 H GLN A 10 11.235 15.305 -10.477 1.00 0.00 H new ATOM 0 HA GLN A 10 8.488 15.901 -11.410 1.00 0.00 H new ATOM 0 HB2 GLN A 10 8.729 17.999 -10.128 1.00 0.00 H new ATOM 0 HB3 GLN A 10 8.852 16.586 -9.099 1.00 0.00 H new ATOM 0 HG2 GLN A 10 11.384 17.768 -10.198 1.00 0.00 H new ATOM 0 HG3 GLN A 10 10.559 18.623 -8.910 1.00 0.00 H new ATOM 0 HE21 GLN A 10 9.963 17.298 -6.936 1.00 0.00 H new ATOM 0 HE22 GLN A 10 11.129 16.079 -6.412 1.00 0.00 H new ATOM 160 N ASP A 11 9.186 17.616 -13.107 1.00 0.00 N ATOM 161 CA ASP A 11 9.613 18.407 -14.255 1.00 0.00 C ATOM 162 C ASP A 11 8.829 19.713 -14.338 1.00 0.00 C ATOM 163 O ASP A 11 7.877 19.924 -13.589 1.00 0.00 O ATOM 164 CB ASP A 11 9.434 17.608 -15.547 1.00 0.00 C ATOM 165 CG ASP A 11 9.693 16.126 -15.352 1.00 0.00 C ATOM 166 OD1 ASP A 11 10.705 15.780 -14.708 1.00 0.00 O ATOM 167 OD2 ASP A 11 8.883 15.314 -15.844 1.00 0.00 O ATOM 0 H ASP A 11 8.174 17.542 -12.999 1.00 0.00 H new ATOM 0 HA ASP A 11 10.669 18.646 -14.127 1.00 0.00 H new ATOM 0 HB2 ASP A 11 8.420 17.751 -15.921 1.00 0.00 H new ATOM 0 HB3 ASP A 11 10.112 17.995 -16.307 1.00 0.00 H new ATOM 172 N GLU A 12 9.239 20.586 -15.253 1.00 0.00 N ATOM 173 CA GLU A 12 8.575 21.872 -15.431 1.00 0.00 C ATOM 174 C GLU A 12 7.413 21.754 -16.414 1.00 0.00 C ATOM 175 O GLU A 12 6.824 22.756 -16.816 1.00 0.00 O ATOM 176 CB GLU A 12 9.572 22.921 -15.928 1.00 0.00 C ATOM 177 CG GLU A 12 10.153 22.609 -17.297 1.00 0.00 C ATOM 178 CD GLU A 12 11.450 21.829 -17.216 1.00 0.00 C ATOM 179 OE1 GLU A 12 11.845 21.446 -16.095 1.00 0.00 O ATOM 180 OE2 GLU A 12 12.072 21.601 -18.276 1.00 0.00 O ATOM 0 H GLU A 12 10.026 20.426 -15.881 1.00 0.00 H new ATOM 0 HA GLU A 12 8.180 22.184 -14.464 1.00 0.00 H new ATOM 0 HB2 GLU A 12 9.077 23.891 -15.965 1.00 0.00 H new ATOM 0 HB3 GLU A 12 10.386 23.006 -15.208 1.00 0.00 H new ATOM 0 HG2 GLU A 12 9.426 22.038 -17.875 1.00 0.00 H new ATOM 0 HG3 GLU A 12 10.327 23.541 -17.835 1.00 0.00 H new ATOM 187 N GLU A 13 7.092 20.521 -16.795 1.00 0.00 N ATOM 188 CA GLU A 13 6.002 20.272 -17.732 1.00 0.00 C ATOM 189 C GLU A 13 5.051 19.209 -17.189 1.00 0.00 C ATOM 190 O GLU A 13 3.838 19.289 -17.383 1.00 0.00 O ATOM 191 CB GLU A 13 6.557 19.831 -19.088 1.00 0.00 C ATOM 192 CG GLU A 13 7.824 19.000 -18.987 1.00 0.00 C ATOM 193 CD GLU A 13 8.348 18.566 -20.342 1.00 0.00 C ATOM 194 OE1 GLU A 13 7.700 18.888 -21.360 1.00 0.00 O ATOM 195 OE2 GLU A 13 9.406 17.905 -20.385 1.00 0.00 O ATOM 0 H GLU A 13 7.570 19.681 -16.470 1.00 0.00 H new ATOM 0 HA GLU A 13 5.446 21.201 -17.860 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.795 19.254 -19.612 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.760 20.715 -19.693 1.00 0.00 H new ATOM 0 HG2 GLU A 13 8.592 19.577 -18.473 1.00 0.00 H new ATOM 0 HG3 GLU A 13 7.627 18.117 -18.378 1.00 0.00 H new ATOM 202 N PHE A 14 5.611 18.214 -16.509 1.00 0.00 N ATOM 203 CA PHE A 14 4.814 17.134 -15.939 1.00 0.00 C ATOM 204 C PHE A 14 5.639 16.312 -14.952 1.00 0.00 C ATOM 205 O PHE A 14 6.811 16.603 -14.713 1.00 0.00 O ATOM 206 CB PHE A 14 4.275 16.229 -17.049 1.00 0.00 C ATOM 207 CG PHE A 14 5.349 15.654 -17.927 1.00 0.00 C ATOM 208 CD1 PHE A 14 5.822 16.362 -19.020 1.00 0.00 C ATOM 209 CD2 PHE A 14 5.885 14.404 -17.660 1.00 0.00 C ATOM 210 CE1 PHE A 14 6.809 15.834 -19.830 1.00 0.00 C ATOM 211 CE2 PHE A 14 6.873 13.871 -18.467 1.00 0.00 C ATOM 212 CZ PHE A 14 7.336 14.588 -19.553 1.00 0.00 C ATOM 0 H PHE A 14 6.614 18.133 -16.339 1.00 0.00 H new ATOM 0 HA PHE A 14 3.975 17.578 -15.403 1.00 0.00 H new ATOM 0 HB2 PHE A 14 3.709 15.413 -16.599 1.00 0.00 H new ATOM 0 HB3 PHE A 14 3.579 16.798 -17.665 1.00 0.00 H new ATOM 0 HD1 PHE A 14 5.415 17.337 -19.241 1.00 0.00 H new ATOM 0 HD2 PHE A 14 5.527 13.840 -16.812 1.00 0.00 H new ATOM 0 HE1 PHE A 14 7.168 16.396 -20.680 1.00 0.00 H new ATOM 0 HE2 PHE A 14 7.282 12.896 -18.249 1.00 0.00 H new ATOM 0 HZ PHE A 14 8.109 14.175 -20.184 1.00 0.00 H new ATOM 222 N ILE A 15 5.017 15.286 -14.383 1.00 0.00 N ATOM 223 CA ILE A 15 5.692 14.421 -13.423 1.00 0.00 C ATOM 224 C ILE A 15 6.153 13.124 -14.080 1.00 0.00 C ATOM 225 O ILE A 15 5.455 12.561 -14.924 1.00 0.00 O ATOM 226 CB ILE A 15 4.779 14.083 -12.230 1.00 0.00 C ATOM 227 CG1 ILE A 15 4.767 15.237 -11.225 1.00 0.00 C ATOM 228 CG2 ILE A 15 5.237 12.795 -11.561 1.00 0.00 C ATOM 229 CD1 ILE A 15 6.094 15.446 -10.529 1.00 0.00 C ATOM 0 H ILE A 15 4.047 15.033 -14.570 1.00 0.00 H new ATOM 0 HA ILE A 15 6.561 14.970 -13.060 1.00 0.00 H new ATOM 0 HB ILE A 15 3.764 13.937 -12.598 1.00 0.00 H new ATOM 0 HG12 ILE A 15 4.488 16.155 -11.742 1.00 0.00 H new ATOM 0 HG13 ILE A 15 3.999 15.047 -10.475 1.00 0.00 H new ATOM 0 HG21 ILE A 15 4.582 12.569 -10.720 1.00 0.00 H new ATOM 0 HG22 ILE A 15 5.198 11.977 -12.281 1.00 0.00 H new ATOM 0 HG23 ILE A 15 6.259 12.915 -11.203 1.00 0.00 H new ATOM 0 HD11 ILE A 15 6.012 16.280 -9.832 1.00 0.00 H new ATOM 0 HD12 ILE A 15 6.365 14.542 -9.984 1.00 0.00 H new ATOM 0 HD13 ILE A 15 6.862 15.667 -11.270 1.00 0.00 H new ATOM 241 N PHE A 16 7.332 12.654 -13.687 1.00 0.00 N ATOM 242 CA PHE A 16 7.886 11.423 -14.237 1.00 0.00 C ATOM 243 C PHE A 16 8.187 10.419 -13.128 1.00 0.00 C ATOM 244 O PHE A 16 9.237 10.482 -12.486 1.00 0.00 O ATOM 245 CB PHE A 16 9.160 11.721 -15.030 1.00 0.00 C ATOM 246 CG PHE A 16 9.914 10.488 -15.439 1.00 0.00 C ATOM 247 CD1 PHE A 16 9.512 9.748 -16.539 1.00 0.00 C ATOM 248 CD2 PHE A 16 11.025 10.070 -14.724 1.00 0.00 C ATOM 249 CE1 PHE A 16 10.204 8.613 -16.917 1.00 0.00 C ATOM 250 CE2 PHE A 16 11.721 8.936 -15.098 1.00 0.00 C ATOM 251 CZ PHE A 16 11.310 8.207 -16.196 1.00 0.00 C ATOM 0 H PHE A 16 7.922 13.107 -12.989 1.00 0.00 H new ATOM 0 HA PHE A 16 7.144 10.987 -14.906 1.00 0.00 H new ATOM 0 HB2 PHE A 16 8.898 12.290 -15.922 1.00 0.00 H new ATOM 0 HB3 PHE A 16 9.813 12.354 -14.429 1.00 0.00 H new ATOM 0 HD1 PHE A 16 8.649 10.061 -17.107 1.00 0.00 H new ATOM 0 HD2 PHE A 16 11.351 10.637 -13.864 1.00 0.00 H new ATOM 0 HE1 PHE A 16 9.880 8.044 -17.776 1.00 0.00 H new ATOM 0 HE2 PHE A 16 12.585 8.621 -14.532 1.00 0.00 H new ATOM 0 HZ PHE A 16 11.852 7.321 -16.491 1.00 0.00 H new ATOM 261 N LEU A 17 7.259 9.495 -12.906 1.00 0.00 N ATOM 262 CA LEU A 17 7.424 8.477 -11.874 1.00 0.00 C ATOM 263 C LEU A 17 7.940 7.172 -12.474 1.00 0.00 C ATOM 264 O LEU A 17 7.328 6.608 -13.381 1.00 0.00 O ATOM 265 CB LEU A 17 6.096 8.231 -11.156 1.00 0.00 C ATOM 266 CG LEU A 17 6.048 7.014 -10.232 1.00 0.00 C ATOM 267 CD1 LEU A 17 5.780 5.748 -11.031 1.00 0.00 C ATOM 268 CD2 LEU A 17 7.346 6.888 -9.448 1.00 0.00 C ATOM 0 H LEU A 17 6.384 9.430 -13.427 1.00 0.00 H new ATOM 0 HA LEU A 17 8.158 8.840 -11.154 1.00 0.00 H new ATOM 0 HB2 LEU A 17 5.853 9.117 -10.570 1.00 0.00 H new ATOM 0 HB3 LEU A 17 5.314 8.122 -11.908 1.00 0.00 H new ATOM 0 HG LEU A 17 5.231 7.151 -9.523 1.00 0.00 H new ATOM 0 HD11 LEU A 17 5.749 4.892 -10.357 1.00 0.00 H new ATOM 0 HD12 LEU A 17 4.824 5.839 -11.546 1.00 0.00 H new ATOM 0 HD13 LEU A 17 6.575 5.605 -11.763 1.00 0.00 H new ATOM 0 HD21 LEU A 17 7.294 6.016 -8.796 1.00 0.00 H new ATOM 0 HD22 LEU A 17 8.180 6.773 -10.141 1.00 0.00 H new ATOM 0 HD23 LEU A 17 7.495 7.784 -8.845 1.00 0.00 H new ATOM 280 N LYS A 18 9.069 6.697 -11.959 1.00 0.00 N ATOM 281 CA LYS A 18 9.666 5.456 -12.439 1.00 0.00 C ATOM 282 C LYS A 18 9.544 4.353 -11.394 1.00 0.00 C ATOM 283 O LYS A 18 9.740 4.590 -10.201 1.00 0.00 O ATOM 284 CB LYS A 18 11.138 5.679 -12.792 1.00 0.00 C ATOM 285 CG LYS A 18 12.069 5.606 -11.594 1.00 0.00 C ATOM 286 CD LYS A 18 13.512 5.868 -11.992 1.00 0.00 C ATOM 287 CE LYS A 18 13.747 7.338 -12.300 1.00 0.00 C ATOM 288 NZ LYS A 18 14.992 7.847 -11.661 1.00 0.00 N ATOM 0 H LYS A 18 9.589 7.153 -11.209 1.00 0.00 H new ATOM 0 HA LYS A 18 9.127 5.144 -13.334 1.00 0.00 H new ATOM 0 HB2 LYS A 18 11.444 4.933 -13.525 1.00 0.00 H new ATOM 0 HB3 LYS A 18 11.245 6.655 -13.266 1.00 0.00 H new ATOM 0 HG2 LYS A 18 11.759 6.336 -10.846 1.00 0.00 H new ATOM 0 HG3 LYS A 18 11.991 4.622 -11.131 1.00 0.00 H new ATOM 0 HD2 LYS A 18 14.176 5.553 -11.186 1.00 0.00 H new ATOM 0 HD3 LYS A 18 13.764 5.267 -12.866 1.00 0.00 H new ATOM 0 HE2 LYS A 18 13.810 7.477 -13.379 1.00 0.00 H new ATOM 0 HE3 LYS A 18 12.895 7.923 -11.952 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 15.116 8.853 -11.895 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 14.922 7.738 -10.629 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 15.808 7.306 -12.012 1.00 0.00 H new ATOM 302 N ILE A 19 9.221 3.147 -11.848 1.00 0.00 N ATOM 303 CA ILE A 19 9.076 2.007 -10.951 1.00 0.00 C ATOM 304 C ILE A 19 10.062 0.899 -11.306 1.00 0.00 C ATOM 305 O ILE A 19 10.035 0.360 -12.412 1.00 0.00 O ATOM 306 CB ILE A 19 7.645 1.437 -10.991 1.00 0.00 C ATOM 307 CG1 ILE A 19 6.620 2.569 -10.905 1.00 0.00 C ATOM 308 CG2 ILE A 19 7.440 0.441 -9.860 1.00 0.00 C ATOM 309 CD1 ILE A 19 5.927 2.859 -12.218 1.00 0.00 C ATOM 0 H ILE A 19 9.055 2.934 -12.832 1.00 0.00 H new ATOM 0 HA ILE A 19 9.286 2.369 -9.945 1.00 0.00 H new ATOM 0 HB ILE A 19 7.503 0.915 -11.937 1.00 0.00 H new ATOM 0 HG12 ILE A 19 5.870 2.313 -10.157 1.00 0.00 H new ATOM 0 HG13 ILE A 19 7.119 3.474 -10.559 1.00 0.00 H new ATOM 0 HG21 ILE A 19 6.424 0.047 -9.902 1.00 0.00 H new ATOM 0 HG22 ILE A 19 8.151 -0.378 -9.963 1.00 0.00 H new ATOM 0 HG23 ILE A 19 7.597 0.939 -8.903 1.00 0.00 H new ATOM 0 HD11 ILE A 19 5.214 3.672 -12.081 1.00 0.00 H new ATOM 0 HD12 ILE A 19 6.667 3.147 -12.964 1.00 0.00 H new ATOM 0 HD13 ILE A 19 5.399 1.967 -12.556 1.00 0.00 H new ATOM 321 N PHE A 20 10.932 0.563 -10.358 1.00 0.00 N ATOM 322 CA PHE A 20 11.927 -0.481 -10.570 1.00 0.00 C ATOM 323 C PHE A 20 11.306 -1.865 -10.408 1.00 0.00 C ATOM 324 O PHE A 20 11.121 -2.347 -9.290 1.00 0.00 O ATOM 325 CB PHE A 20 13.090 -0.313 -9.589 1.00 0.00 C ATOM 326 CG PHE A 20 13.799 1.004 -9.720 1.00 0.00 C ATOM 327 CD1 PHE A 20 14.689 1.227 -10.758 1.00 0.00 C ATOM 328 CD2 PHE A 20 13.576 2.020 -8.804 1.00 0.00 C ATOM 329 CE1 PHE A 20 15.343 2.438 -10.882 1.00 0.00 C ATOM 330 CE2 PHE A 20 14.227 3.233 -8.923 1.00 0.00 C ATOM 331 CZ PHE A 20 15.112 3.442 -9.962 1.00 0.00 C ATOM 0 H PHE A 20 10.967 0.999 -9.436 1.00 0.00 H new ATOM 0 HA PHE A 20 12.304 -0.388 -11.589 1.00 0.00 H new ATOM 0 HB2 PHE A 20 12.714 -0.414 -8.571 1.00 0.00 H new ATOM 0 HB3 PHE A 20 13.806 -1.119 -9.746 1.00 0.00 H new ATOM 0 HD1 PHE A 20 14.874 0.445 -11.479 1.00 0.00 H new ATOM 0 HD2 PHE A 20 12.886 1.862 -7.988 1.00 0.00 H new ATOM 0 HE1 PHE A 20 16.033 2.599 -11.697 1.00 0.00 H new ATOM 0 HE2 PHE A 20 14.044 4.017 -8.204 1.00 0.00 H new ATOM 0 HZ PHE A 20 15.623 4.389 -10.055 1.00 0.00 H new ATOM 341 N ILE A 21 10.985 -2.498 -11.531 1.00 0.00 N ATOM 342 CA ILE A 21 10.385 -3.827 -11.514 1.00 0.00 C ATOM 343 C ILE A 21 11.290 -4.847 -12.196 1.00 0.00 C ATOM 344 O ILE A 21 12.203 -4.485 -12.938 1.00 0.00 O ATOM 345 CB ILE A 21 9.010 -3.832 -12.207 1.00 0.00 C ATOM 346 CG1 ILE A 21 9.163 -3.512 -13.695 1.00 0.00 C ATOM 347 CG2 ILE A 21 8.076 -2.834 -11.538 1.00 0.00 C ATOM 348 CD1 ILE A 21 7.902 -3.748 -14.497 1.00 0.00 C ATOM 0 H ILE A 21 11.130 -2.112 -12.464 1.00 0.00 H new ATOM 0 HA ILE A 21 10.256 -4.102 -10.467 1.00 0.00 H new ATOM 0 HB ILE A 21 8.575 -4.827 -12.112 1.00 0.00 H new ATOM 0 HG12 ILE A 21 9.464 -2.470 -13.805 1.00 0.00 H new ATOM 0 HG13 ILE A 21 9.966 -4.122 -14.109 1.00 0.00 H new ATOM 0 HG21 ILE A 21 7.108 -2.849 -12.039 1.00 0.00 H new ATOM 0 HG22 ILE A 21 7.946 -3.103 -10.490 1.00 0.00 H new ATOM 0 HG23 ILE A 21 8.504 -1.834 -11.605 1.00 0.00 H new ATOM 0 HD11 ILE A 21 8.084 -3.500 -15.543 1.00 0.00 H new ATOM 0 HD12 ILE A 21 7.611 -4.795 -14.417 1.00 0.00 H new ATOM 0 HD13 ILE A 21 7.101 -3.118 -14.109 1.00 0.00 H new ATOM 360 N SER A 22 11.028 -6.125 -11.941 1.00 0.00 N ATOM 361 CA SER A 22 11.820 -7.200 -12.529 1.00 0.00 C ATOM 362 C SER A 22 11.211 -7.663 -13.849 1.00 0.00 C ATOM 363 O SER A 22 10.222 -7.103 -14.319 1.00 0.00 O ATOM 364 CB SER A 22 11.920 -8.378 -11.559 1.00 0.00 C ATOM 365 OG SER A 22 12.867 -8.119 -10.538 1.00 0.00 O ATOM 0 H SER A 22 10.274 -6.442 -11.331 1.00 0.00 H new ATOM 0 HA SER A 22 12.821 -6.815 -12.725 1.00 0.00 H new ATOM 0 HB2 SER A 22 10.944 -8.570 -11.114 1.00 0.00 H new ATOM 0 HB3 SER A 22 12.205 -9.278 -12.104 1.00 0.00 H new ATOM 0 HG SER A 22 12.911 -8.886 -9.930 1.00 0.00 H new ATOM 371 N ASN A 23 11.811 -8.691 -14.442 1.00 0.00 N ATOM 372 CA ASN A 23 11.329 -9.230 -15.708 1.00 0.00 C ATOM 373 C ASN A 23 10.327 -10.356 -15.473 1.00 0.00 C ATOM 374 O ASN A 23 10.052 -11.153 -16.371 1.00 0.00 O ATOM 375 CB ASN A 23 12.501 -9.743 -16.547 1.00 0.00 C ATOM 376 CG ASN A 23 13.436 -10.633 -15.751 1.00 0.00 C ATOM 377 OD1 ASN A 23 13.138 -11.802 -15.506 1.00 0.00 O ATOM 378 ND2 ASN A 23 14.573 -10.082 -15.344 1.00 0.00 N ATOM 0 H ASN A 23 12.631 -9.167 -14.066 1.00 0.00 H new ATOM 0 HA ASN A 23 10.827 -8.427 -16.249 1.00 0.00 H new ATOM 0 HB2 ASN A 23 12.116 -10.298 -17.403 1.00 0.00 H new ATOM 0 HB3 ASN A 23 13.060 -8.895 -16.942 1.00 0.00 H new ATOM 0 HD21 ASN A 23 15.242 -10.632 -14.805 1.00 0.00 H new ATOM 0 HD22 ASN A 23 14.778 -9.109 -15.571 1.00 0.00 H new ATOM 385 N ILE A 24 9.784 -10.414 -14.262 1.00 0.00 N ATOM 386 CA ILE A 24 8.811 -11.441 -13.910 1.00 0.00 C ATOM 387 C ILE A 24 7.628 -11.430 -14.872 1.00 0.00 C ATOM 388 O ILE A 24 7.582 -10.631 -15.807 1.00 0.00 O ATOM 389 CB ILE A 24 8.291 -11.254 -12.472 1.00 0.00 C ATOM 390 CG1 ILE A 24 7.281 -10.106 -12.417 1.00 0.00 C ATOM 391 CG2 ILE A 24 9.448 -10.995 -11.520 1.00 0.00 C ATOM 392 CD1 ILE A 24 7.842 -8.784 -12.892 1.00 0.00 C ATOM 0 H ILE A 24 10.001 -9.762 -13.508 1.00 0.00 H new ATOM 0 HA ILE A 24 9.324 -12.400 -13.980 1.00 0.00 H new ATOM 0 HB ILE A 24 7.789 -12.170 -12.161 1.00 0.00 H new ATOM 0 HG12 ILE A 24 6.416 -10.365 -13.027 1.00 0.00 H new ATOM 0 HG13 ILE A 24 6.926 -9.994 -11.392 1.00 0.00 H new ATOM 0 HG21 ILE A 24 9.064 -10.865 -10.508 1.00 0.00 H new ATOM 0 HG22 ILE A 24 10.134 -11.842 -11.542 1.00 0.00 H new ATOM 0 HG23 ILE A 24 9.976 -10.092 -11.827 1.00 0.00 H new ATOM 0 HD11 ILE A 24 7.071 -8.017 -12.825 1.00 0.00 H new ATOM 0 HD12 ILE A 24 8.689 -8.503 -12.267 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.171 -8.879 -13.927 1.00 0.00 H new ATOM 404 N ARG A 25 6.671 -12.322 -14.635 1.00 0.00 N ATOM 405 CA ARG A 25 5.487 -12.414 -15.480 1.00 0.00 C ATOM 406 C ARG A 25 4.842 -11.044 -15.664 1.00 0.00 C ATOM 407 O ARG A 25 4.168 -10.537 -14.767 1.00 0.00 O ATOM 408 CB ARG A 25 4.476 -13.388 -14.873 1.00 0.00 C ATOM 409 CG ARG A 25 5.098 -14.686 -14.384 1.00 0.00 C ATOM 410 CD ARG A 25 4.479 -15.894 -15.070 1.00 0.00 C ATOM 411 NE ARG A 25 3.021 -15.882 -14.988 1.00 0.00 N ATOM 412 CZ ARG A 25 2.346 -16.107 -13.867 1.00 0.00 C ATOM 413 NH1 ARG A 25 2.994 -16.361 -12.738 1.00 0.00 N ATOM 414 NH2 ARG A 25 1.019 -16.080 -13.872 1.00 0.00 N ATOM 0 H ARG A 25 6.693 -12.991 -13.865 1.00 0.00 H new ATOM 0 HA ARG A 25 5.797 -12.784 -16.457 1.00 0.00 H new ATOM 0 HB2 ARG A 25 3.970 -12.901 -14.039 1.00 0.00 H new ATOM 0 HB3 ARG A 25 3.714 -13.618 -15.618 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.171 -14.670 -14.572 1.00 0.00 H new ATOM 0 HG3 ARG A 25 4.965 -14.771 -13.306 1.00 0.00 H new ATOM 0 HD2 ARG A 25 4.783 -15.912 -16.117 1.00 0.00 H new ATOM 0 HD3 ARG A 25 4.860 -16.806 -14.611 1.00 0.00 H new ATOM 0 HE ARG A 25 2.492 -15.690 -15.839 1.00 0.00 H new ATOM 0 HH11 ARG A 25 4.014 -16.384 -12.729 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.473 -16.533 -11.878 1.00 0.00 H new ATOM 0 HH21 ARG A 25 0.516 -15.886 -14.738 1.00 0.00 H new ATOM 0 HH22 ARG A 25 0.502 -16.253 -13.010 1.00 0.00 H new ATOM 428 N PHE A 26 5.053 -10.448 -16.833 1.00 0.00 N ATOM 429 CA PHE A 26 4.493 -9.136 -17.135 1.00 0.00 C ATOM 430 C PHE A 26 3.435 -9.234 -18.230 1.00 0.00 C ATOM 431 O PHE A 26 3.756 -9.269 -19.417 1.00 0.00 O ATOM 432 CB PHE A 26 5.601 -8.173 -17.566 1.00 0.00 C ATOM 433 CG PHE A 26 5.102 -6.797 -17.904 1.00 0.00 C ATOM 434 CD1 PHE A 26 4.676 -6.496 -19.187 1.00 0.00 C ATOM 435 CD2 PHE A 26 5.059 -5.805 -16.937 1.00 0.00 C ATOM 436 CE1 PHE A 26 4.215 -5.231 -19.501 1.00 0.00 C ATOM 437 CE2 PHE A 26 4.599 -4.538 -17.245 1.00 0.00 C ATOM 438 CZ PHE A 26 4.178 -4.251 -18.529 1.00 0.00 C ATOM 0 H PHE A 26 5.608 -10.853 -17.587 1.00 0.00 H new ATOM 0 HA PHE A 26 4.019 -8.754 -16.231 1.00 0.00 H new ATOM 0 HB2 PHE A 26 6.337 -8.097 -16.766 1.00 0.00 H new ATOM 0 HB3 PHE A 26 6.115 -8.588 -18.433 1.00 0.00 H new ATOM 0 HD1 PHE A 26 4.704 -7.259 -19.951 1.00 0.00 H new ATOM 0 HD2 PHE A 26 5.388 -6.024 -15.932 1.00 0.00 H new ATOM 0 HE1 PHE A 26 3.884 -5.010 -20.505 1.00 0.00 H new ATOM 0 HE2 PHE A 26 4.569 -3.774 -16.483 1.00 0.00 H new ATOM 0 HZ PHE A 26 3.820 -3.261 -18.772 1.00 0.00 H new ATOM 448 N SER A 27 2.171 -9.280 -17.820 1.00 0.00 N ATOM 449 CA SER A 27 1.065 -9.379 -18.765 1.00 0.00 C ATOM 450 C SER A 27 0.450 -8.007 -19.027 1.00 0.00 C ATOM 451 O SER A 27 0.583 -7.090 -18.217 1.00 0.00 O ATOM 452 CB SER A 27 -0.004 -10.336 -18.233 1.00 0.00 C ATOM 453 OG SER A 27 0.507 -11.652 -18.109 1.00 0.00 O ATOM 0 H SER A 27 1.888 -9.250 -16.841 1.00 0.00 H new ATOM 0 HA SER A 27 1.456 -9.768 -19.705 1.00 0.00 H new ATOM 0 HB2 SER A 27 -0.359 -9.987 -17.263 1.00 0.00 H new ATOM 0 HB3 SER A 27 -0.862 -10.337 -18.905 1.00 0.00 H new ATOM 0 HG SER A 27 -0.194 -12.244 -17.766 1.00 0.00 H new ATOM 459 N ALA A 28 -0.223 -7.875 -20.165 1.00 0.00 N ATOM 460 CA ALA A 28 -0.860 -6.617 -20.534 1.00 0.00 C ATOM 461 C ALA A 28 -2.314 -6.583 -20.075 1.00 0.00 C ATOM 462 O ALA A 28 -3.116 -5.797 -20.579 1.00 0.00 O ATOM 463 CB ALA A 28 -0.775 -6.404 -22.039 1.00 0.00 C ATOM 0 H ALA A 28 -0.341 -8.624 -20.847 1.00 0.00 H new ATOM 0 HA ALA A 28 -0.329 -5.808 -20.033 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -1.255 -5.461 -22.301 1.00 0.00 H new ATOM 0 HB2 ALA A 28 0.271 -6.376 -22.344 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -1.281 -7.222 -22.551 1.00 0.00 H new ATOM 469 N VAL A 29 -2.647 -7.441 -19.116 1.00 0.00 N ATOM 470 CA VAL A 29 -4.005 -7.508 -18.588 1.00 0.00 C ATOM 471 C VAL A 29 -4.101 -6.824 -17.229 1.00 0.00 C ATOM 472 O VAL A 29 -4.153 -7.484 -16.193 1.00 0.00 O ATOM 473 CB VAL A 29 -4.482 -8.966 -18.452 1.00 0.00 C ATOM 474 CG1 VAL A 29 -4.812 -9.550 -19.817 1.00 0.00 C ATOM 475 CG2 VAL A 29 -3.431 -9.806 -17.743 1.00 0.00 C ATOM 0 H VAL A 29 -1.995 -8.099 -18.689 1.00 0.00 H new ATOM 0 HA VAL A 29 -4.647 -6.988 -19.299 1.00 0.00 H new ATOM 0 HB VAL A 29 -5.390 -8.978 -17.850 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -5.147 -10.581 -19.700 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -5.603 -8.962 -20.283 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -3.923 -9.527 -20.447 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -3.785 -10.833 -17.655 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -2.504 -9.789 -18.316 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -3.250 -9.399 -16.748 1.00 0.00 H new ATOM 485 N GLY A 30 -4.124 -5.494 -17.242 1.00 0.00 N ATOM 486 CA GLY A 30 -4.215 -4.742 -16.004 1.00 0.00 C ATOM 487 C GLY A 30 -3.557 -3.380 -16.105 1.00 0.00 C ATOM 488 O GLY A 30 -3.882 -2.468 -15.343 1.00 0.00 O ATOM 0 H GLY A 30 -4.081 -4.925 -18.087 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.264 -4.617 -15.735 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -3.745 -5.311 -15.201 1.00 0.00 H new ATOM 492 N LEU A 31 -2.628 -3.241 -17.044 1.00 0.00 N ATOM 493 CA LEU A 31 -1.921 -1.980 -17.240 1.00 0.00 C ATOM 494 C LEU A 31 -2.903 -0.836 -17.471 1.00 0.00 C ATOM 495 O LEU A 31 -3.423 -0.665 -18.574 1.00 0.00 O ATOM 496 CB LEU A 31 -0.961 -2.090 -18.426 1.00 0.00 C ATOM 497 CG LEU A 31 0.437 -2.623 -18.110 1.00 0.00 C ATOM 498 CD1 LEU A 31 0.350 -3.856 -17.223 1.00 0.00 C ATOM 499 CD2 LEU A 31 1.190 -2.940 -19.394 1.00 0.00 C ATOM 0 H LEU A 31 -2.347 -3.986 -17.682 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.350 -1.768 -16.336 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -1.414 -2.738 -19.176 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -0.858 -1.103 -18.878 1.00 0.00 H new ATOM 0 HG LEU A 31 0.986 -1.851 -17.571 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.354 -4.221 -17.008 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -0.149 -3.598 -16.289 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -0.217 -4.633 -17.735 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.183 -3.318 -19.150 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.643 -3.695 -19.960 1.00 0.00 H new ATOM 0 HD23 LEU A 31 1.284 -2.035 -19.994 1.00 0.00 H new ATOM 511 N GLU A 32 -3.150 -0.054 -16.425 1.00 0.00 N ATOM 512 CA GLU A 32 -4.068 1.075 -16.515 1.00 0.00 C ATOM 513 C GLU A 32 -3.915 1.999 -15.310 1.00 0.00 C ATOM 514 O GLU A 32 -4.807 2.089 -14.467 1.00 0.00 O ATOM 515 CB GLU A 32 -5.512 0.580 -16.612 1.00 0.00 C ATOM 516 CG GLU A 32 -6.019 0.456 -18.039 1.00 0.00 C ATOM 517 CD GLU A 32 -7.526 0.591 -18.137 1.00 0.00 C ATOM 518 OE1 GLU A 32 -8.236 -0.227 -17.515 1.00 0.00 O ATOM 519 OE2 GLU A 32 -7.995 1.513 -18.835 1.00 0.00 O ATOM 0 H GLU A 32 -2.727 -0.182 -15.506 1.00 0.00 H new ATOM 0 HA GLU A 32 -3.823 1.638 -17.416 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -5.588 -0.391 -16.123 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -6.159 1.264 -16.064 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -5.549 1.222 -18.655 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -5.717 -0.510 -18.445 1.00 0.00 H new ATOM 526 N ILE A 33 -2.778 2.682 -15.237 1.00 0.00 N ATOM 527 CA ILE A 33 -2.508 3.599 -14.136 1.00 0.00 C ATOM 528 C ILE A 33 -3.420 4.819 -14.200 1.00 0.00 C ATOM 529 O ILE A 33 -3.568 5.441 -15.253 1.00 0.00 O ATOM 530 CB ILE A 33 -1.041 4.067 -14.141 1.00 0.00 C ATOM 531 CG1 ILE A 33 -0.099 2.868 -14.013 1.00 0.00 C ATOM 532 CG2 ILE A 33 -0.798 5.060 -13.014 1.00 0.00 C ATOM 533 CD1 ILE A 33 1.356 3.216 -14.236 1.00 0.00 C ATOM 0 H ILE A 33 -2.029 2.618 -15.927 1.00 0.00 H new ATOM 0 HA ILE A 33 -2.703 3.051 -13.214 1.00 0.00 H new ATOM 0 HB ILE A 33 -0.838 4.565 -15.089 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -0.212 2.432 -13.020 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -0.396 2.105 -14.732 1.00 0.00 H new ATOM 0 HG21 ILE A 33 0.243 5.382 -13.031 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -1.447 5.926 -13.145 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -1.016 4.585 -12.057 1.00 0.00 H new ATOM 0 HD11 ILE A 33 1.965 2.318 -14.130 1.00 0.00 H new ATOM 0 HD12 ILE A 33 1.483 3.624 -15.239 1.00 0.00 H new ATOM 0 HD13 ILE A 33 1.670 3.957 -13.500 1.00 0.00 H new ATOM 545 N ILE A 34 -4.027 5.157 -13.068 1.00 0.00 N ATOM 546 CA ILE A 34 -4.923 6.305 -12.996 1.00 0.00 C ATOM 547 C ILE A 34 -4.503 7.260 -11.883 1.00 0.00 C ATOM 548 O ILE A 34 -3.876 6.852 -10.905 1.00 0.00 O ATOM 549 CB ILE A 34 -6.380 5.868 -12.759 1.00 0.00 C ATOM 550 CG1 ILE A 34 -6.540 5.288 -11.353 1.00 0.00 C ATOM 551 CG2 ILE A 34 -6.806 4.853 -13.809 1.00 0.00 C ATOM 552 CD1 ILE A 34 -7.256 6.214 -10.395 1.00 0.00 C ATOM 0 H ILE A 34 -3.915 4.653 -12.188 1.00 0.00 H new ATOM 0 HA ILE A 34 -4.858 6.817 -13.956 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.024 6.743 -12.845 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -7.089 4.349 -11.417 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -5.554 5.054 -10.951 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -7.838 4.554 -13.628 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -6.726 5.299 -14.800 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -6.159 3.977 -13.752 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.333 5.737 -9.418 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.696 7.145 -10.302 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.255 6.428 -10.774 1.00 0.00 H new ATOM 564 N ILE A 35 -4.855 8.532 -12.038 1.00 0.00 N ATOM 565 CA ILE A 35 -4.518 9.544 -11.045 1.00 0.00 C ATOM 566 C ILE A 35 -5.766 10.056 -10.336 1.00 0.00 C ATOM 567 O ILE A 35 -6.745 10.434 -10.978 1.00 0.00 O ATOM 568 CB ILE A 35 -3.779 10.735 -11.684 1.00 0.00 C ATOM 569 CG1 ILE A 35 -2.526 10.253 -12.418 1.00 0.00 C ATOM 570 CG2 ILE A 35 -3.416 11.764 -10.623 1.00 0.00 C ATOM 571 CD1 ILE A 35 -2.616 10.390 -13.921 1.00 0.00 C ATOM 0 H ILE A 35 -5.373 8.886 -12.842 1.00 0.00 H new ATOM 0 HA ILE A 35 -3.861 9.066 -10.318 1.00 0.00 H new ATOM 0 HB ILE A 35 -4.442 11.208 -12.409 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -1.665 10.818 -12.061 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -2.347 9.208 -12.167 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -2.894 12.600 -11.090 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.324 12.127 -10.142 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.769 11.304 -9.876 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -1.693 10.029 -14.375 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -3.456 9.802 -14.290 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -2.764 11.438 -14.183 1.00 0.00 H new ATOM 583 N GLN A 36 -5.724 10.065 -9.007 1.00 0.00 N ATOM 584 CA GLN A 36 -6.852 10.532 -8.210 1.00 0.00 C ATOM 585 C GLN A 36 -6.977 12.050 -8.280 1.00 0.00 C ATOM 586 O GLN A 36 -6.272 12.705 -9.047 1.00 0.00 O ATOM 587 CB GLN A 36 -6.694 10.087 -6.755 1.00 0.00 C ATOM 588 CG GLN A 36 -7.703 9.034 -6.328 1.00 0.00 C ATOM 589 CD GLN A 36 -9.137 9.503 -6.479 1.00 0.00 C ATOM 590 OE1 GLN A 36 -9.437 10.684 -6.301 1.00 0.00 O ATOM 591 NE2 GLN A 36 -10.031 8.579 -6.811 1.00 0.00 N ATOM 0 H GLN A 36 -4.921 9.754 -8.460 1.00 0.00 H new ATOM 0 HA GLN A 36 -7.761 10.092 -8.620 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -5.688 9.693 -6.611 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -6.792 10.957 -6.105 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.555 8.133 -6.923 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -7.521 8.763 -5.288 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -9.738 7.612 -6.949 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -11.011 8.836 -6.928 1.00 0.00 H new ATOM 600 N GLU A 37 -7.878 12.602 -7.474 1.00 0.00 N ATOM 601 CA GLU A 37 -8.095 14.044 -7.446 1.00 0.00 C ATOM 602 C GLU A 37 -6.773 14.791 -7.290 1.00 0.00 C ATOM 603 O GLU A 37 -6.575 15.853 -7.878 1.00 0.00 O ATOM 604 CB GLU A 37 -9.042 14.418 -6.304 1.00 0.00 C ATOM 605 CG GLU A 37 -8.755 13.678 -5.008 1.00 0.00 C ATOM 606 CD GLU A 37 -9.044 14.519 -3.780 1.00 0.00 C ATOM 607 OE1 GLU A 37 -9.641 15.605 -3.931 1.00 0.00 O ATOM 608 OE2 GLU A 37 -8.672 14.090 -2.667 1.00 0.00 O ATOM 0 H GLU A 37 -8.469 12.073 -6.832 1.00 0.00 H new ATOM 0 HA GLU A 37 -8.547 14.335 -8.394 1.00 0.00 H new ATOM 0 HB2 GLU A 37 -8.973 15.491 -6.123 1.00 0.00 H new ATOM 0 HB3 GLU A 37 -10.067 14.212 -6.611 1.00 0.00 H new ATOM 0 HG2 GLU A 37 -9.357 12.770 -4.972 1.00 0.00 H new ATOM 0 HG3 GLU A 37 -7.710 13.369 -4.994 1.00 0.00 H new ATOM 615 N ASN A 38 -5.872 14.226 -6.493 1.00 0.00 N ATOM 616 CA ASN A 38 -4.569 14.838 -6.258 1.00 0.00 C ATOM 617 C ASN A 38 -3.468 13.782 -6.240 1.00 0.00 C ATOM 618 O ASN A 38 -2.449 13.923 -6.915 1.00 0.00 O ATOM 619 CB ASN A 38 -4.575 15.608 -4.935 1.00 0.00 C ATOM 620 CG ASN A 38 -4.981 14.737 -3.762 1.00 0.00 C ATOM 621 OD1 ASN A 38 -6.166 14.494 -3.535 1.00 0.00 O ATOM 622 ND2 ASN A 38 -3.995 14.264 -3.008 1.00 0.00 N ATOM 0 H ASN A 38 -6.020 13.346 -5.999 1.00 0.00 H new ATOM 0 HA ASN A 38 -4.369 15.533 -7.074 1.00 0.00 H new ATOM 0 HB2 ASN A 38 -3.582 16.019 -4.752 1.00 0.00 H new ATOM 0 HB3 ASN A 38 -5.260 16.452 -5.012 1.00 0.00 H new ATOM 0 HD21 ASN A 38 -4.206 13.674 -2.204 1.00 0.00 H new ATOM 0 HD22 ASN A 38 -3.027 14.491 -3.233 1.00 0.00 H new ATOM 629 N MET A 39 -3.682 12.725 -5.463 1.00 0.00 N ATOM 630 CA MET A 39 -2.708 11.645 -5.359 1.00 0.00 C ATOM 631 C MET A 39 -2.730 10.771 -6.609 1.00 0.00 C ATOM 632 O MET A 39 -3.638 10.875 -7.434 1.00 0.00 O ATOM 633 CB MET A 39 -2.991 10.792 -4.121 1.00 0.00 C ATOM 634 CG MET A 39 -3.708 9.489 -4.432 1.00 0.00 C ATOM 635 SD MET A 39 -4.407 8.713 -2.962 1.00 0.00 S ATOM 636 CE MET A 39 -2.942 8.532 -1.946 1.00 0.00 C ATOM 0 H MET A 39 -4.520 12.594 -4.897 1.00 0.00 H new ATOM 0 HA MET A 39 -1.717 12.090 -5.266 1.00 0.00 H new ATOM 0 HB2 MET A 39 -2.049 10.568 -3.621 1.00 0.00 H new ATOM 0 HB3 MET A 39 -3.594 11.371 -3.421 1.00 0.00 H new ATOM 0 HG2 MET A 39 -4.505 9.680 -5.151 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.010 8.799 -4.905 1.00 0.00 H new ATOM 0 HE1 MET A 39 -3.100 7.737 -1.218 1.00 0.00 H new ATOM 0 HE2 MET A 39 -2.090 8.281 -2.578 1.00 0.00 H new ATOM 0 HE3 MET A 39 -2.743 9.468 -1.424 1.00 0.00 H new ATOM 646 N ILE A 40 -1.726 9.910 -6.742 1.00 0.00 N ATOM 647 CA ILE A 40 -1.632 9.018 -7.890 1.00 0.00 C ATOM 648 C ILE A 40 -1.879 7.569 -7.483 1.00 0.00 C ATOM 649 O ILE A 40 -1.374 7.107 -6.460 1.00 0.00 O ATOM 650 CB ILE A 40 -0.255 9.120 -8.572 1.00 0.00 C ATOM 651 CG1 ILE A 40 -0.045 10.526 -9.139 1.00 0.00 C ATOM 652 CG2 ILE A 40 -0.128 8.076 -9.671 1.00 0.00 C ATOM 653 CD1 ILE A 40 1.279 10.700 -9.849 1.00 0.00 C ATOM 0 H ILE A 40 -0.966 9.812 -6.068 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.402 9.331 -8.595 1.00 0.00 H new ATOM 0 HB ILE A 40 0.517 8.930 -7.827 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -0.853 10.753 -9.834 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -0.110 11.250 -8.327 1.00 0.00 H new ATOM 0 HG21 ILE A 40 0.851 8.162 -10.143 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.238 7.080 -9.241 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -0.906 8.237 -10.417 1.00 0.00 H new ATOM 0 HD11 ILE A 40 1.359 11.720 -10.225 1.00 0.00 H new ATOM 0 HD12 ILE A 40 2.094 10.505 -9.152 1.00 0.00 H new ATOM 0 HD13 ILE A 40 1.339 10.000 -10.683 1.00 0.00 H new ATOM 665 N ILE A 41 -2.657 6.857 -8.292 1.00 0.00 N ATOM 666 CA ILE A 41 -2.968 5.460 -8.017 1.00 0.00 C ATOM 667 C ILE A 41 -2.249 4.535 -8.993 1.00 0.00 C ATOM 668 O ILE A 41 -2.453 4.613 -10.204 1.00 0.00 O ATOM 669 CB ILE A 41 -4.483 5.194 -8.096 1.00 0.00 C ATOM 670 CG1 ILE A 41 -5.233 6.092 -7.110 1.00 0.00 C ATOM 671 CG2 ILE A 41 -4.779 3.729 -7.817 1.00 0.00 C ATOM 672 CD1 ILE A 41 -4.726 5.984 -5.689 1.00 0.00 C ATOM 0 H ILE A 41 -3.083 7.225 -9.143 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.624 5.254 -7.004 1.00 0.00 H new ATOM 0 HB ILE A 41 -4.826 5.428 -9.104 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.150 7.128 -7.439 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -6.292 5.835 -7.130 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.854 3.557 -7.877 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.271 3.108 -8.555 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -4.425 3.470 -6.819 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.303 6.648 -5.045 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.834 4.957 -5.341 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.675 6.270 -5.655 1.00 0.00 H new ATOM 684 N PHE A 42 -1.407 3.657 -8.456 1.00 0.00 N ATOM 685 CA PHE A 42 -0.658 2.715 -9.279 1.00 0.00 C ATOM 686 C PHE A 42 -1.316 1.338 -9.267 1.00 0.00 C ATOM 687 O PHE A 42 -1.232 0.607 -8.280 1.00 0.00 O ATOM 688 CB PHE A 42 0.785 2.607 -8.783 1.00 0.00 C ATOM 689 CG PHE A 42 1.606 1.604 -9.541 1.00 0.00 C ATOM 690 CD1 PHE A 42 2.179 1.935 -10.758 1.00 0.00 C ATOM 691 CD2 PHE A 42 1.806 0.329 -9.036 1.00 0.00 C ATOM 692 CE1 PHE A 42 2.935 1.014 -11.458 1.00 0.00 C ATOM 693 CE2 PHE A 42 2.562 -0.596 -9.731 1.00 0.00 C ATOM 694 CZ PHE A 42 3.126 -0.254 -10.944 1.00 0.00 C ATOM 0 H PHE A 42 -1.227 3.579 -7.455 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.656 3.088 -10.303 1.00 0.00 H new ATOM 0 HB2 PHE A 42 1.261 3.585 -8.858 1.00 0.00 H new ATOM 0 HB3 PHE A 42 0.779 2.336 -7.727 1.00 0.00 H new ATOM 0 HD1 PHE A 42 2.033 2.925 -11.165 1.00 0.00 H new ATOM 0 HD2 PHE A 42 1.366 0.055 -8.088 1.00 0.00 H new ATOM 0 HE1 PHE A 42 3.376 1.285 -12.406 1.00 0.00 H new ATOM 0 HE2 PHE A 42 2.712 -1.586 -9.326 1.00 0.00 H new ATOM 0 HZ PHE A 42 3.715 -0.976 -11.490 1.00 0.00 H new ATOM 704 N HIS A 43 -1.972 0.993 -10.370 1.00 0.00 N ATOM 705 CA HIS A 43 -2.646 -0.296 -10.487 1.00 0.00 C ATOM 706 C HIS A 43 -1.835 -1.256 -11.351 1.00 0.00 C ATOM 707 O HIS A 43 -2.012 -2.473 -11.280 1.00 0.00 O ATOM 708 CB HIS A 43 -4.043 -0.113 -11.080 1.00 0.00 C ATOM 709 CG HIS A 43 -5.108 -0.873 -10.350 1.00 0.00 C ATOM 710 ND1 HIS A 43 -6.455 -0.665 -10.554 1.00 0.00 N ATOM 711 CD2 HIS A 43 -5.017 -1.846 -9.414 1.00 0.00 C ATOM 712 CE1 HIS A 43 -7.147 -1.476 -9.774 1.00 0.00 C ATOM 713 NE2 HIS A 43 -6.298 -2.204 -9.072 1.00 0.00 N ATOM 0 H HIS A 43 -2.052 1.587 -11.195 1.00 0.00 H new ATOM 0 HA HIS A 43 -2.737 -0.723 -9.488 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -4.296 0.947 -11.073 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -4.031 -0.431 -12.122 1.00 0.00 H new ATOM 0 HD2 HIS A 43 -4.106 -2.263 -9.011 1.00 0.00 H new ATOM 0 HE1 HIS A 43 -8.224 -1.534 -9.720 1.00 0.00 H new ATOM 0 HE2 HIS A 43 -6.552 -2.916 -8.387 1.00 0.00 H new ATOM 721 N LEU A 44 -0.946 -0.702 -12.168 1.00 0.00 N ATOM 722 CA LEU A 44 -0.107 -1.509 -13.048 1.00 0.00 C ATOM 723 C LEU A 44 0.599 -2.613 -12.266 1.00 0.00 C ATOM 724 O LEU A 44 0.827 -2.486 -11.063 1.00 0.00 O ATOM 725 CB LEU A 44 0.925 -0.627 -13.752 1.00 0.00 C ATOM 726 CG LEU A 44 1.328 -1.061 -15.162 1.00 0.00 C ATOM 727 CD1 LEU A 44 1.704 0.148 -16.005 1.00 0.00 C ATOM 728 CD2 LEU A 44 2.480 -2.053 -15.105 1.00 0.00 C ATOM 0 H LEU A 44 -0.787 0.303 -12.240 1.00 0.00 H new ATOM 0 HA LEU A 44 -0.750 -1.973 -13.796 1.00 0.00 H new ATOM 0 HB2 LEU A 44 0.531 0.388 -13.804 1.00 0.00 H new ATOM 0 HB3 LEU A 44 1.823 -0.589 -13.135 1.00 0.00 H new ATOM 0 HG LEU A 44 0.474 -1.552 -15.629 1.00 0.00 H new ATOM 0 HD11 LEU A 44 1.988 -0.180 -17.005 1.00 0.00 H new ATOM 0 HD12 LEU A 44 0.851 0.823 -16.073 1.00 0.00 H new ATOM 0 HD13 LEU A 44 2.543 0.668 -15.542 1.00 0.00 H new ATOM 0 HD21 LEU A 44 2.754 -2.351 -16.117 1.00 0.00 H new ATOM 0 HD22 LEU A 44 3.338 -1.587 -14.619 1.00 0.00 H new ATOM 0 HD23 LEU A 44 2.175 -2.932 -14.538 1.00 0.00 H new ATOM 740 N SER A 45 0.944 -3.693 -12.958 1.00 0.00 N ATOM 741 CA SER A 45 1.623 -4.820 -12.328 1.00 0.00 C ATOM 742 C SER A 45 0.758 -5.429 -11.229 1.00 0.00 C ATOM 743 O SER A 45 -0.240 -4.852 -10.797 1.00 0.00 O ATOM 744 CB SER A 45 2.966 -4.373 -11.748 1.00 0.00 C ATOM 745 OG SER A 45 3.006 -4.570 -10.345 1.00 0.00 O ATOM 0 H SER A 45 0.765 -3.812 -13.955 1.00 0.00 H new ATOM 0 HA SER A 45 1.799 -5.579 -13.090 1.00 0.00 H new ATOM 0 HB2 SER A 45 3.774 -4.932 -12.220 1.00 0.00 H new ATOM 0 HB3 SER A 45 3.132 -3.320 -11.976 1.00 0.00 H new ATOM 0 HG SER A 45 3.840 -5.024 -10.102 1.00 0.00 H new ATOM 751 N PRO A 46 1.150 -6.625 -10.764 1.00 0.00 N ATOM 752 CA PRO A 46 0.426 -7.340 -9.708 1.00 0.00 C ATOM 753 C PRO A 46 0.558 -6.659 -8.351 1.00 0.00 C ATOM 754 O PRO A 46 -0.072 -7.068 -7.376 1.00 0.00 O ATOM 755 CB PRO A 46 1.099 -8.714 -9.685 1.00 0.00 C ATOM 756 CG PRO A 46 2.468 -8.475 -10.221 1.00 0.00 C ATOM 757 CD PRO A 46 2.330 -7.371 -11.232 1.00 0.00 C ATOM 0 HA PRO A 46 -0.646 -7.378 -9.903 1.00 0.00 H new ATOM 0 HB2 PRO A 46 1.135 -9.120 -8.674 1.00 0.00 H new ATOM 0 HB3 PRO A 46 0.554 -9.432 -10.298 1.00 0.00 H new ATOM 0 HG2 PRO A 46 3.155 -8.191 -9.424 1.00 0.00 H new ATOM 0 HG3 PRO A 46 2.870 -9.378 -10.681 1.00 0.00 H new ATOM 0 HD2 PRO A 46 3.218 -6.740 -11.262 1.00 0.00 H new ATOM 0 HD3 PRO A 46 2.184 -7.764 -12.238 1.00 0.00 H new ATOM 765 N TYR A 47 1.381 -5.618 -8.294 1.00 0.00 N ATOM 766 CA TYR A 47 1.598 -4.881 -7.055 1.00 0.00 C ATOM 767 C TYR A 47 0.951 -3.501 -7.121 1.00 0.00 C ATOM 768 O TYR A 47 1.171 -2.744 -8.068 1.00 0.00 O ATOM 769 CB TYR A 47 3.096 -4.741 -6.775 1.00 0.00 C ATOM 770 CG TYR A 47 3.884 -5.999 -7.060 1.00 0.00 C ATOM 771 CD1 TYR A 47 3.474 -7.229 -6.559 1.00 0.00 C ATOM 772 CD2 TYR A 47 5.040 -5.959 -7.830 1.00 0.00 C ATOM 773 CE1 TYR A 47 4.192 -8.381 -6.816 1.00 0.00 C ATOM 774 CE2 TYR A 47 5.764 -7.106 -8.093 1.00 0.00 C ATOM 775 CZ TYR A 47 5.336 -8.314 -7.584 1.00 0.00 C ATOM 776 OH TYR A 47 6.054 -9.459 -7.843 1.00 0.00 O ATOM 0 H TYR A 47 1.909 -5.265 -9.092 1.00 0.00 H new ATOM 0 HA TYR A 47 1.134 -5.442 -6.243 1.00 0.00 H new ATOM 0 HB2 TYR A 47 3.496 -3.927 -7.380 1.00 0.00 H new ATOM 0 HB3 TYR A 47 3.238 -4.462 -5.731 1.00 0.00 H new ATOM 0 HD1 TYR A 47 2.578 -7.285 -5.958 1.00 0.00 H new ATOM 0 HD2 TYR A 47 5.379 -5.015 -8.230 1.00 0.00 H new ATOM 0 HE1 TYR A 47 3.860 -9.328 -6.418 1.00 0.00 H new ATOM 0 HE2 TYR A 47 6.660 -7.057 -8.694 1.00 0.00 H new ATOM 0 HH TYR A 47 6.831 -9.239 -8.399 1.00 0.00 H new ATOM 786 N TYR A 48 0.153 -3.180 -6.109 1.00 0.00 N ATOM 787 CA TYR A 48 -0.528 -1.892 -6.052 1.00 0.00 C ATOM 788 C TYR A 48 0.283 -0.882 -5.245 1.00 0.00 C ATOM 789 O TYR A 48 0.772 -1.189 -4.156 1.00 0.00 O ATOM 790 CB TYR A 48 -1.919 -2.054 -5.437 1.00 0.00 C ATOM 791 CG TYR A 48 -2.683 -0.755 -5.317 1.00 0.00 C ATOM 792 CD1 TYR A 48 -2.561 0.044 -4.186 1.00 0.00 C ATOM 793 CD2 TYR A 48 -3.528 -0.326 -6.333 1.00 0.00 C ATOM 794 CE1 TYR A 48 -3.257 1.232 -4.072 1.00 0.00 C ATOM 795 CE2 TYR A 48 -4.227 0.861 -6.228 1.00 0.00 C ATOM 796 CZ TYR A 48 -4.089 1.636 -5.095 1.00 0.00 C ATOM 797 OH TYR A 48 -4.785 2.818 -4.986 1.00 0.00 O ATOM 0 H TYR A 48 -0.038 -3.794 -5.317 1.00 0.00 H new ATOM 0 HA TYR A 48 -0.630 -1.518 -7.071 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -2.497 -2.751 -6.044 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -1.820 -2.500 -4.447 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -1.911 -0.269 -3.383 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -3.640 -0.931 -7.220 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -3.150 1.841 -3.187 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -4.878 1.180 -7.028 1.00 0.00 H new ATOM 0 HH TYR A 48 -5.654 2.728 -5.431 1.00 0.00 H new ATOM 807 N LEU A 49 0.420 0.324 -5.785 1.00 0.00 N ATOM 808 CA LEU A 49 1.171 1.381 -5.116 1.00 0.00 C ATOM 809 C LEU A 49 0.326 2.643 -4.975 1.00 0.00 C ATOM 810 O LEU A 49 -0.451 2.984 -5.867 1.00 0.00 O ATOM 811 CB LEU A 49 2.451 1.694 -5.893 1.00 0.00 C ATOM 812 CG LEU A 49 3.703 1.943 -5.051 1.00 0.00 C ATOM 813 CD1 LEU A 49 4.904 2.203 -5.946 1.00 0.00 C ATOM 814 CD2 LEU A 49 3.482 3.108 -4.098 1.00 0.00 C ATOM 0 H LEU A 49 0.021 0.594 -6.684 1.00 0.00 H new ATOM 0 HA LEU A 49 1.436 1.030 -4.119 1.00 0.00 H new ATOM 0 HB2 LEU A 49 2.653 0.865 -6.571 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.272 2.574 -6.510 1.00 0.00 H new ATOM 0 HG LEU A 49 3.904 1.050 -4.459 1.00 0.00 H new ATOM 0 HD11 LEU A 49 5.786 2.378 -5.330 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.075 1.338 -6.586 1.00 0.00 H new ATOM 0 HD13 LEU A 49 4.714 3.080 -6.565 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.383 3.271 -3.507 1.00 0.00 H new ATOM 0 HD22 LEU A 49 3.256 4.008 -4.670 1.00 0.00 H new ATOM 0 HD23 LEU A 49 2.648 2.881 -3.433 1.00 0.00 H new ATOM 826 N ARG A 50 0.485 3.332 -3.850 1.00 0.00 N ATOM 827 CA ARG A 50 -0.263 4.557 -3.593 1.00 0.00 C ATOM 828 C ARG A 50 0.682 5.722 -3.314 1.00 0.00 C ATOM 829 O ARG A 50 1.384 5.738 -2.301 1.00 0.00 O ATOM 830 CB ARG A 50 -1.212 4.362 -2.409 1.00 0.00 C ATOM 831 CG ARG A 50 -2.300 5.419 -2.319 1.00 0.00 C ATOM 832 CD ARG A 50 -3.607 4.926 -2.920 1.00 0.00 C ATOM 833 NE ARG A 50 -4.329 4.042 -2.008 1.00 0.00 N ATOM 834 CZ ARG A 50 -5.087 4.478 -1.009 1.00 0.00 C ATOM 835 NH1 ARG A 50 -5.222 5.779 -0.793 1.00 0.00 N ATOM 836 NH2 ARG A 50 -5.712 3.611 -0.222 1.00 0.00 N ATOM 0 H ARG A 50 1.125 3.063 -3.102 1.00 0.00 H new ATOM 0 HA ARG A 50 -0.847 4.790 -4.483 1.00 0.00 H new ATOM 0 HB2 ARG A 50 -1.678 3.379 -2.486 1.00 0.00 H new ATOM 0 HB3 ARG A 50 -0.633 4.369 -1.485 1.00 0.00 H new ATOM 0 HG2 ARG A 50 -2.458 5.692 -1.276 1.00 0.00 H new ATOM 0 HG3 ARG A 50 -1.977 6.321 -2.839 1.00 0.00 H new ATOM 0 HD2 ARG A 50 -4.236 5.780 -3.171 1.00 0.00 H new ATOM 0 HD3 ARG A 50 -3.402 4.397 -3.851 1.00 0.00 H new ATOM 0 HE ARG A 50 -4.246 3.035 -2.146 1.00 0.00 H new ATOM 0 HH11 ARG A 50 -4.743 6.448 -1.395 1.00 0.00 H new ATOM 0 HH12 ARG A 50 -5.805 6.111 -0.025 1.00 0.00 H new ATOM 0 HH21 ARG A 50 -5.610 2.609 -0.385 1.00 0.00 H new ATOM 0 HH22 ARG A 50 -6.294 3.947 0.545 1.00 0.00 H new ATOM 850 N LEU A 51 0.696 6.696 -4.218 1.00 0.00 N ATOM 851 CA LEU A 51 1.555 7.865 -4.070 1.00 0.00 C ATOM 852 C LEU A 51 0.743 9.089 -3.657 1.00 0.00 C ATOM 853 O LEU A 51 -0.194 9.487 -4.350 1.00 0.00 O ATOM 854 CB LEU A 51 2.295 8.148 -5.379 1.00 0.00 C ATOM 855 CG LEU A 51 3.383 7.146 -5.765 1.00 0.00 C ATOM 856 CD1 LEU A 51 3.997 7.515 -7.106 1.00 0.00 C ATOM 857 CD2 LEU A 51 4.454 7.079 -4.686 1.00 0.00 C ATOM 0 H LEU A 51 0.122 6.699 -5.061 1.00 0.00 H new ATOM 0 HA LEU A 51 2.283 7.653 -3.287 1.00 0.00 H new ATOM 0 HB2 LEU A 51 1.563 8.188 -6.186 1.00 0.00 H new ATOM 0 HB3 LEU A 51 2.748 9.137 -5.311 1.00 0.00 H new ATOM 0 HG LEU A 51 2.926 6.161 -5.857 1.00 0.00 H new ATOM 0 HD11 LEU A 51 4.769 6.791 -7.364 1.00 0.00 H new ATOM 0 HD12 LEU A 51 3.224 7.510 -7.874 1.00 0.00 H new ATOM 0 HD13 LEU A 51 4.439 8.509 -7.043 1.00 0.00 H new ATOM 0 HD21 LEU A 51 5.220 6.361 -4.978 1.00 0.00 H new ATOM 0 HD22 LEU A 51 4.907 8.062 -4.562 1.00 0.00 H new ATOM 0 HD23 LEU A 51 4.003 6.766 -3.745 1.00 0.00 H new ATOM 869 N ARG A 52 1.109 9.681 -2.525 1.00 0.00 N ATOM 870 CA ARG A 52 0.415 10.860 -2.021 1.00 0.00 C ATOM 871 C ARG A 52 1.336 12.077 -2.026 1.00 0.00 C ATOM 872 O ARG A 52 2.231 12.195 -1.189 1.00 0.00 O ATOM 873 CB ARG A 52 -0.103 10.606 -0.604 1.00 0.00 C ATOM 874 CG ARG A 52 -1.323 11.437 -0.244 1.00 0.00 C ATOM 875 CD ARG A 52 -0.928 12.804 0.292 1.00 0.00 C ATOM 876 NE ARG A 52 -0.240 12.710 1.577 1.00 0.00 N ATOM 877 CZ ARG A 52 0.493 13.692 2.091 1.00 0.00 C ATOM 878 NH1 ARG A 52 0.632 14.834 1.433 1.00 0.00 N ATOM 879 NH2 ARG A 52 1.089 13.531 3.266 1.00 0.00 N ATOM 0 H ARG A 52 1.882 9.364 -1.940 1.00 0.00 H new ATOM 0 HA ARG A 52 -0.430 11.062 -2.679 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.350 9.549 -0.500 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.694 10.818 0.109 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -1.954 11.559 -1.124 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.916 10.910 0.503 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.282 13.303 -0.430 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -1.819 13.422 0.402 1.00 0.00 H new ATOM 0 HE ARG A 52 -0.327 11.844 2.109 1.00 0.00 H new ATOM 0 HH11 ARG A 52 0.176 14.961 0.530 1.00 0.00 H new ATOM 0 HH12 ARG A 52 1.195 15.586 1.830 1.00 0.00 H new ATOM 0 HH21 ARG A 52 0.984 12.653 3.775 1.00 0.00 H new ATOM 0 HH22 ARG A 52 1.652 14.285 3.660 1.00 0.00 H new ATOM 893 N PHE A 53 1.110 12.979 -2.975 1.00 0.00 N ATOM 894 CA PHE A 53 1.920 14.186 -3.091 1.00 0.00 C ATOM 895 C PHE A 53 1.245 15.363 -2.393 1.00 0.00 C ATOM 896 O PHE A 53 0.027 15.398 -2.217 1.00 0.00 O ATOM 897 CB PHE A 53 2.163 14.524 -4.564 1.00 0.00 C ATOM 898 CG PHE A 53 2.759 13.390 -5.348 1.00 0.00 C ATOM 899 CD1 PHE A 53 3.519 12.418 -4.717 1.00 0.00 C ATOM 900 CD2 PHE A 53 2.559 13.296 -6.716 1.00 0.00 C ATOM 901 CE1 PHE A 53 4.069 11.374 -5.437 1.00 0.00 C ATOM 902 CE2 PHE A 53 3.106 12.254 -7.441 1.00 0.00 C ATOM 903 CZ PHE A 53 3.861 11.291 -6.800 1.00 0.00 C ATOM 0 H PHE A 53 0.373 12.897 -3.675 1.00 0.00 H new ATOM 0 HA PHE A 53 2.878 13.998 -2.606 1.00 0.00 H new ATOM 0 HB2 PHE A 53 1.218 14.815 -5.023 1.00 0.00 H new ATOM 0 HB3 PHE A 53 2.827 15.387 -4.626 1.00 0.00 H new ATOM 0 HD1 PHE A 53 3.683 12.477 -3.651 1.00 0.00 H new ATOM 0 HD2 PHE A 53 1.969 14.046 -7.222 1.00 0.00 H new ATOM 0 HE1 PHE A 53 4.661 10.624 -4.934 1.00 0.00 H new ATOM 0 HE2 PHE A 53 2.943 12.193 -8.507 1.00 0.00 H new ATOM 0 HZ PHE A 53 4.288 10.475 -7.364 1.00 0.00 H new ATOM 913 N PRO A 54 2.055 16.351 -1.983 1.00 0.00 N ATOM 914 CA PRO A 54 1.559 17.548 -1.298 1.00 0.00 C ATOM 915 C PRO A 54 0.757 18.456 -2.223 1.00 0.00 C ATOM 916 O PRO A 54 0.146 19.428 -1.779 1.00 0.00 O ATOM 917 CB PRO A 54 2.840 18.249 -0.838 1.00 0.00 C ATOM 918 CG PRO A 54 3.888 17.785 -1.789 1.00 0.00 C ATOM 919 CD PRO A 54 3.517 16.376 -2.159 1.00 0.00 C ATOM 0 HA PRO A 54 0.877 17.299 -0.485 1.00 0.00 H new ATOM 0 HB2 PRO A 54 2.731 19.333 -0.868 1.00 0.00 H new ATOM 0 HB3 PRO A 54 3.091 17.982 0.189 1.00 0.00 H new ATOM 0 HG2 PRO A 54 3.924 18.424 -2.672 1.00 0.00 H new ATOM 0 HG3 PRO A 54 4.876 17.821 -1.329 1.00 0.00 H new ATOM 0 HD2 PRO A 54 3.802 16.141 -3.184 1.00 0.00 H new ATOM 0 HD3 PRO A 54 4.012 15.648 -1.516 1.00 0.00 H new ATOM 927 N HIS A 55 0.764 18.133 -3.513 1.00 0.00 N ATOM 928 CA HIS A 55 0.035 18.920 -4.502 1.00 0.00 C ATOM 929 C HIS A 55 -1.107 18.109 -5.107 1.00 0.00 C ATOM 930 O HIS A 55 -1.398 17.001 -4.659 1.00 0.00 O ATOM 931 CB HIS A 55 0.981 19.394 -5.605 1.00 0.00 C ATOM 932 CG HIS A 55 2.074 20.291 -5.113 1.00 0.00 C ATOM 933 ND1 HIS A 55 1.937 21.660 -5.015 1.00 0.00 N ATOM 934 CD2 HIS A 55 3.328 20.009 -4.688 1.00 0.00 C ATOM 935 CE1 HIS A 55 3.060 22.181 -4.553 1.00 0.00 C ATOM 936 NE2 HIS A 55 3.920 21.200 -4.345 1.00 0.00 N ATOM 0 H HIS A 55 1.266 17.333 -3.897 1.00 0.00 H new ATOM 0 HA HIS A 55 -0.388 19.789 -3.999 1.00 0.00 H new ATOM 0 HB2 HIS A 55 1.426 18.525 -6.089 1.00 0.00 H new ATOM 0 HB3 HIS A 55 0.404 19.921 -6.365 1.00 0.00 H new ATOM 0 HD2 HIS A 55 3.779 19.029 -4.630 1.00 0.00 H new ATOM 0 HE1 HIS A 55 3.244 23.230 -4.376 1.00 0.00 H new ATOM 0 HE2 HIS A 55 4.869 21.309 -3.988 1.00 0.00 H new ATOM 944 N GLU A 56 -1.749 18.670 -6.127 1.00 0.00 N ATOM 945 CA GLU A 56 -2.859 17.999 -6.792 1.00 0.00 C ATOM 946 C GLU A 56 -2.589 17.852 -8.287 1.00 0.00 C ATOM 947 O GLU A 56 -2.379 18.840 -8.992 1.00 0.00 O ATOM 948 CB GLU A 56 -4.159 18.775 -6.571 1.00 0.00 C ATOM 949 CG GLU A 56 -3.996 20.281 -6.688 1.00 0.00 C ATOM 950 CD GLU A 56 -5.322 21.016 -6.648 1.00 0.00 C ATOM 951 OE1 GLU A 56 -6.345 20.379 -6.323 1.00 0.00 O ATOM 952 OE2 GLU A 56 -5.335 22.230 -6.941 1.00 0.00 O ATOM 0 H GLU A 56 -1.519 19.587 -6.510 1.00 0.00 H new ATOM 0 HA GLU A 56 -2.960 17.004 -6.359 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.900 18.441 -7.297 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -4.551 18.536 -5.583 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -3.362 20.638 -5.876 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -3.483 20.516 -7.620 1.00 0.00 H new ATOM 959 N LEU A 57 -2.596 16.612 -8.764 1.00 0.00 N ATOM 960 CA LEU A 57 -2.352 16.333 -10.175 1.00 0.00 C ATOM 961 C LEU A 57 -3.663 16.092 -10.917 1.00 0.00 C ATOM 962 O LEU A 57 -4.736 16.085 -10.314 1.00 0.00 O ATOM 963 CB LEU A 57 -1.437 15.117 -10.324 1.00 0.00 C ATOM 964 CG LEU A 57 -0.172 15.119 -9.465 1.00 0.00 C ATOM 965 CD1 LEU A 57 0.224 13.698 -9.094 1.00 0.00 C ATOM 966 CD2 LEU A 57 0.966 15.819 -10.193 1.00 0.00 C ATOM 0 H LEU A 57 -2.768 15.784 -8.194 1.00 0.00 H new ATOM 0 HA LEU A 57 -1.863 17.203 -10.613 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -2.013 14.223 -10.085 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.142 15.036 -11.370 1.00 0.00 H new ATOM 0 HG LEU A 57 -0.381 15.667 -8.546 1.00 0.00 H new ATOM 0 HD11 LEU A 57 1.126 13.720 -8.483 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -0.584 13.230 -8.532 1.00 0.00 H new ATOM 0 HD13 LEU A 57 0.414 13.125 -10.001 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.858 15.811 -9.567 1.00 0.00 H new ATOM 0 HD22 LEU A 57 1.174 15.299 -11.128 1.00 0.00 H new ATOM 0 HD23 LEU A 57 0.682 16.849 -10.407 1.00 0.00 H new ATOM 978 N ILE A 58 -3.567 15.894 -12.227 1.00 0.00 N ATOM 979 CA ILE A 58 -4.744 15.649 -13.051 1.00 0.00 C ATOM 980 C ILE A 58 -4.461 14.595 -14.116 1.00 0.00 C ATOM 981 O ILE A 58 -3.356 14.524 -14.655 1.00 0.00 O ATOM 982 CB ILE A 58 -5.229 16.939 -13.738 1.00 0.00 C ATOM 983 CG1 ILE A 58 -6.465 16.654 -14.593 1.00 0.00 C ATOM 984 CG2 ILE A 58 -4.117 17.537 -14.587 1.00 0.00 C ATOM 985 CD1 ILE A 58 -7.078 17.896 -15.201 1.00 0.00 C ATOM 0 H ILE A 58 -2.686 15.898 -12.741 1.00 0.00 H new ATOM 0 HA ILE A 58 -5.526 15.286 -12.383 1.00 0.00 H new ATOM 0 HB ILE A 58 -5.502 17.662 -12.969 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -6.193 15.964 -15.392 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -7.213 16.152 -13.980 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -4.475 18.448 -15.066 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -3.262 17.772 -13.953 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -3.816 16.820 -15.351 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -7.950 17.619 -15.794 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -7.381 18.578 -14.407 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -6.345 18.387 -15.841 1.00 0.00 H new ATOM 997 N ASP A 59 -5.466 13.780 -14.415 1.00 0.00 N ATOM 998 CA ASP A 59 -5.327 12.730 -15.418 1.00 0.00 C ATOM 999 C ASP A 59 -6.023 13.125 -16.717 1.00 0.00 C ATOM 1000 O ASP A 59 -7.251 13.118 -16.801 1.00 0.00 O ATOM 1001 CB ASP A 59 -5.904 11.414 -14.895 1.00 0.00 C ATOM 1002 CG ASP A 59 -6.187 10.423 -16.007 1.00 0.00 C ATOM 1003 OD1 ASP A 59 -5.225 9.807 -16.511 1.00 0.00 O ATOM 1004 OD2 ASP A 59 -7.370 10.265 -16.373 1.00 0.00 O ATOM 0 H ASP A 59 -6.386 13.826 -13.977 1.00 0.00 H new ATOM 0 HA ASP A 59 -4.265 12.595 -15.622 1.00 0.00 H new ATOM 0 HB2 ASP A 59 -5.205 10.970 -14.186 1.00 0.00 H new ATOM 0 HB3 ASP A 59 -6.826 11.616 -14.349 1.00 0.00 H new ATOM 1009 N ASP A 60 -5.231 13.468 -17.727 1.00 0.00 N ATOM 1010 CA ASP A 60 -5.771 13.865 -19.022 1.00 0.00 C ATOM 1011 C ASP A 60 -5.354 12.880 -20.110 1.00 0.00 C ATOM 1012 O ASP A 60 -4.861 11.791 -19.818 1.00 0.00 O ATOM 1013 CB ASP A 60 -5.299 15.274 -19.384 1.00 0.00 C ATOM 1014 CG ASP A 60 -6.372 16.081 -20.088 1.00 0.00 C ATOM 1015 OD1 ASP A 60 -7.347 15.473 -20.576 1.00 0.00 O ATOM 1016 OD2 ASP A 60 -6.237 17.321 -20.151 1.00 0.00 O ATOM 0 H ASP A 60 -4.212 13.479 -17.674 1.00 0.00 H new ATOM 0 HA ASP A 60 -6.859 13.861 -18.952 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -4.993 15.795 -18.477 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -4.420 15.206 -20.025 1.00 0.00 H new ATOM 1021 N GLU A 61 -5.557 13.271 -21.364 1.00 0.00 N ATOM 1022 CA GLU A 61 -5.204 12.421 -22.495 1.00 0.00 C ATOM 1023 C GLU A 61 -3.689 12.317 -22.645 1.00 0.00 C ATOM 1024 O GLU A 61 -3.174 11.337 -23.183 1.00 0.00 O ATOM 1025 CB GLU A 61 -5.819 12.968 -23.784 1.00 0.00 C ATOM 1026 CG GLU A 61 -5.141 14.229 -24.295 1.00 0.00 C ATOM 1027 CD GLU A 61 -6.001 14.995 -25.281 1.00 0.00 C ATOM 1028 OE1 GLU A 61 -6.778 14.350 -26.016 1.00 0.00 O ATOM 1029 OE2 GLU A 61 -5.896 16.239 -25.319 1.00 0.00 O ATOM 0 H GLU A 61 -5.964 14.170 -21.622 1.00 0.00 H new ATOM 0 HA GLU A 61 -5.602 11.424 -22.306 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -5.768 12.200 -24.556 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -6.875 13.177 -23.612 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -4.900 14.875 -23.451 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -4.198 13.962 -24.772 1.00 0.00 H new ATOM 1036 N ARG A 62 -2.981 13.334 -22.165 1.00 0.00 N ATOM 1037 CA ARG A 62 -1.526 13.359 -22.248 1.00 0.00 C ATOM 1038 C ARG A 62 -0.910 12.347 -21.286 1.00 0.00 C ATOM 1039 O ARG A 62 0.120 11.740 -21.583 1.00 0.00 O ATOM 1040 CB ARG A 62 -0.999 14.761 -21.935 1.00 0.00 C ATOM 1041 CG ARG A 62 -1.595 15.368 -20.675 1.00 0.00 C ATOM 1042 CD ARG A 62 -2.430 16.599 -20.991 1.00 0.00 C ATOM 1043 NE ARG A 62 -1.614 17.808 -21.069 1.00 0.00 N ATOM 1044 CZ ARG A 62 -1.215 18.353 -22.212 1.00 0.00 C ATOM 1045 NH1 ARG A 62 -1.555 17.801 -23.368 1.00 0.00 N ATOM 1046 NH2 ARG A 62 -0.475 19.455 -22.201 1.00 0.00 N ATOM 0 H ARG A 62 -3.392 14.152 -21.714 1.00 0.00 H new ATOM 0 HA ARG A 62 -1.241 13.090 -23.265 1.00 0.00 H new ATOM 0 HB2 ARG A 62 0.085 14.717 -21.830 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -1.211 15.417 -22.780 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -2.214 14.627 -20.170 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -0.795 15.637 -19.986 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -2.950 16.451 -21.937 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -3.194 16.726 -20.224 1.00 0.00 H new ATOM 0 HE ARG A 62 -1.335 18.258 -20.197 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -2.125 16.955 -23.381 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -1.247 18.222 -24.244 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -0.212 19.884 -21.314 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -0.169 19.873 -23.080 1.00 0.00 H new ATOM 1060 N SER A 63 -1.547 12.170 -20.133 1.00 0.00 N ATOM 1061 CA SER A 63 -1.059 11.234 -19.126 1.00 0.00 C ATOM 1062 C SER A 63 -0.991 9.818 -19.688 1.00 0.00 C ATOM 1063 O SER A 63 -1.934 9.342 -20.322 1.00 0.00 O ATOM 1064 CB SER A 63 -1.963 11.263 -17.893 1.00 0.00 C ATOM 1065 OG SER A 63 -1.486 12.189 -16.932 1.00 0.00 O ATOM 0 H SER A 63 -2.402 12.662 -19.873 1.00 0.00 H new ATOM 0 HA SER A 63 -0.053 11.540 -18.838 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.977 11.531 -18.188 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.012 10.268 -17.451 1.00 0.00 H new ATOM 0 HG SER A 63 -2.082 12.190 -16.154 1.00 0.00 H new ATOM 1071 N THR A 64 0.132 9.147 -19.452 1.00 0.00 N ATOM 1072 CA THR A 64 0.325 7.785 -19.934 1.00 0.00 C ATOM 1073 C THR A 64 1.605 7.179 -19.372 1.00 0.00 C ATOM 1074 O THR A 64 2.485 7.895 -18.895 1.00 0.00 O ATOM 1075 CB THR A 64 0.380 7.737 -21.473 1.00 0.00 C ATOM 1076 OG1 THR A 64 0.584 6.390 -21.914 1.00 0.00 O ATOM 1077 CG2 THR A 64 1.497 8.624 -22.002 1.00 0.00 C ATOM 0 H THR A 64 0.922 9.525 -18.930 1.00 0.00 H new ATOM 0 HA THR A 64 -0.530 7.203 -19.590 1.00 0.00 H new ATOM 0 HB THR A 64 -0.570 8.106 -21.861 1.00 0.00 H new ATOM 0 HG1 THR A 64 0.616 6.368 -22.893 1.00 0.00 H new ATOM 0 HG21 THR A 64 1.517 8.574 -23.091 1.00 0.00 H new ATOM 0 HG22 THR A 64 1.323 9.654 -21.689 1.00 0.00 H new ATOM 0 HG23 THR A 64 2.453 8.281 -21.606 1.00 0.00 H new ATOM 1085 N ALA A 65 1.703 5.855 -19.432 1.00 0.00 N ATOM 1086 CA ALA A 65 2.878 5.153 -18.930 1.00 0.00 C ATOM 1087 C ALA A 65 3.462 4.229 -19.995 1.00 0.00 C ATOM 1088 O ALA A 65 2.726 3.616 -20.767 1.00 0.00 O ATOM 1089 CB ALA A 65 2.527 4.363 -17.678 1.00 0.00 C ATOM 0 H ALA A 65 0.983 5.247 -19.823 1.00 0.00 H new ATOM 0 HA ALA A 65 3.634 5.896 -18.677 1.00 0.00 H new ATOM 0 HB1 ALA A 65 3.414 3.844 -17.315 1.00 0.00 H new ATOM 0 HB2 ALA A 65 2.164 5.044 -16.908 1.00 0.00 H new ATOM 0 HB3 ALA A 65 1.751 3.634 -17.913 1.00 0.00 H new ATOM 1095 N GLN A 66 4.787 4.136 -20.029 1.00 0.00 N ATOM 1096 CA GLN A 66 5.468 3.288 -21.000 1.00 0.00 C ATOM 1097 C GLN A 66 6.357 2.265 -20.300 1.00 0.00 C ATOM 1098 O GLN A 66 7.140 2.611 -19.415 1.00 0.00 O ATOM 1099 CB GLN A 66 6.305 4.141 -21.955 1.00 0.00 C ATOM 1100 CG GLN A 66 5.571 5.365 -22.479 1.00 0.00 C ATOM 1101 CD GLN A 66 5.928 5.688 -23.917 1.00 0.00 C ATOM 1102 OE1 GLN A 66 7.081 5.554 -24.327 1.00 0.00 O ATOM 1103 NE2 GLN A 66 4.938 6.116 -24.691 1.00 0.00 N ATOM 0 H GLN A 66 5.410 4.637 -19.396 1.00 0.00 H new ATOM 0 HA GLN A 66 4.710 2.752 -21.572 1.00 0.00 H new ATOM 0 HB2 GLN A 66 7.211 4.463 -21.442 1.00 0.00 H new ATOM 0 HB3 GLN A 66 6.618 3.526 -22.799 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.496 5.199 -22.404 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.806 6.223 -21.849 1.00 0.00 H new ATOM 0 HE21 GLN A 66 3.997 6.212 -24.309 1.00 0.00 H new ATOM 0 HE22 GLN A 66 5.118 6.349 -25.668 1.00 0.00 H new ATOM 1112 N TYR A 67 6.232 1.006 -20.704 1.00 0.00 N ATOM 1113 CA TYR A 67 7.022 -0.068 -20.113 1.00 0.00 C ATOM 1114 C TYR A 67 8.351 -0.231 -20.845 1.00 0.00 C ATOM 1115 O TYR A 67 8.386 -0.378 -22.067 1.00 0.00 O ATOM 1116 CB TYR A 67 6.242 -1.383 -20.150 1.00 0.00 C ATOM 1117 CG TYR A 67 7.098 -2.602 -19.890 1.00 0.00 C ATOM 1118 CD1 TYR A 67 8.063 -2.597 -18.890 1.00 0.00 C ATOM 1119 CD2 TYR A 67 6.943 -3.759 -20.644 1.00 0.00 C ATOM 1120 CE1 TYR A 67 8.848 -3.708 -18.649 1.00 0.00 C ATOM 1121 CE2 TYR A 67 7.722 -4.875 -20.409 1.00 0.00 C ATOM 1122 CZ TYR A 67 8.673 -4.845 -19.411 1.00 0.00 C ATOM 1123 OH TYR A 67 9.453 -5.954 -19.175 1.00 0.00 O ATOM 0 H TYR A 67 5.591 0.704 -21.438 1.00 0.00 H new ATOM 0 HA TYR A 67 7.228 0.195 -19.075 1.00 0.00 H new ATOM 0 HB2 TYR A 67 5.445 -1.344 -19.408 1.00 0.00 H new ATOM 0 HB3 TYR A 67 5.765 -1.486 -21.125 1.00 0.00 H new ATOM 0 HD1 TYR A 67 8.202 -1.709 -18.291 1.00 0.00 H new ATOM 0 HD2 TYR A 67 6.200 -3.786 -21.428 1.00 0.00 H new ATOM 0 HE1 TYR A 67 9.594 -3.687 -17.869 1.00 0.00 H new ATOM 0 HE2 TYR A 67 7.587 -5.766 -21.004 1.00 0.00 H new ATOM 0 HH TYR A 67 9.202 -6.669 -19.797 1.00 0.00 H new ATOM 1133 N ASP A 68 9.442 -0.205 -20.088 1.00 0.00 N ATOM 1134 CA ASP A 68 10.775 -0.351 -20.662 1.00 0.00 C ATOM 1135 C ASP A 68 11.305 -1.766 -20.450 1.00 0.00 C ATOM 1136 O ASP A 68 11.420 -2.233 -19.316 1.00 0.00 O ATOM 1137 CB ASP A 68 11.735 0.665 -20.042 1.00 0.00 C ATOM 1138 CG ASP A 68 11.647 2.025 -20.707 1.00 0.00 C ATOM 1139 OD1 ASP A 68 10.928 2.144 -21.721 1.00 0.00 O ATOM 1140 OD2 ASP A 68 12.296 2.970 -20.212 1.00 0.00 O ATOM 0 H ASP A 68 9.430 -0.084 -19.075 1.00 0.00 H new ATOM 0 HA ASP A 68 10.705 -0.165 -21.734 1.00 0.00 H new ATOM 0 HB2 ASP A 68 11.514 0.768 -18.980 1.00 0.00 H new ATOM 0 HB3 ASP A 68 12.756 0.291 -20.120 1.00 0.00 H new ATOM 1145 N SER A 69 11.626 -2.443 -21.547 1.00 0.00 N ATOM 1146 CA SER A 69 12.140 -3.806 -21.482 1.00 0.00 C ATOM 1147 C SER A 69 13.656 -3.808 -21.317 1.00 0.00 C ATOM 1148 O SER A 69 14.204 -4.557 -20.508 1.00 0.00 O ATOM 1149 CB SER A 69 11.751 -4.581 -22.743 1.00 0.00 C ATOM 1150 OG SER A 69 12.304 -5.886 -22.730 1.00 0.00 O ATOM 0 H SER A 69 11.539 -2.070 -22.492 1.00 0.00 H new ATOM 0 HA SER A 69 11.697 -4.294 -20.613 1.00 0.00 H new ATOM 0 HB2 SER A 69 10.665 -4.643 -22.815 1.00 0.00 H new ATOM 0 HB3 SER A 69 12.099 -4.044 -23.626 1.00 0.00 H new ATOM 0 HG SER A 69 12.040 -6.361 -23.545 1.00 0.00 H new ATOM 1156 N LYS A 70 14.330 -2.963 -22.091 1.00 0.00 N ATOM 1157 CA LYS A 70 15.784 -2.864 -22.032 1.00 0.00 C ATOM 1158 C LYS A 70 16.247 -2.486 -20.629 1.00 0.00 C ATOM 1159 O LYS A 70 17.405 -2.697 -20.269 1.00 0.00 O ATOM 1160 CB LYS A 70 16.286 -1.831 -23.042 1.00 0.00 C ATOM 1161 CG LYS A 70 15.965 -0.397 -22.657 1.00 0.00 C ATOM 1162 CD LYS A 70 14.733 0.113 -23.385 1.00 0.00 C ATOM 1163 CE LYS A 70 13.966 1.121 -22.543 1.00 0.00 C ATOM 1164 NZ LYS A 70 14.457 2.511 -22.757 1.00 0.00 N ATOM 0 H LYS A 70 13.892 -2.337 -22.767 1.00 0.00 H new ATOM 0 HA LYS A 70 16.200 -3.840 -22.282 1.00 0.00 H new ATOM 0 HB2 LYS A 70 17.365 -1.936 -23.150 1.00 0.00 H new ATOM 0 HB3 LYS A 70 15.846 -2.044 -24.016 1.00 0.00 H new ATOM 0 HG2 LYS A 70 15.804 -0.336 -21.581 1.00 0.00 H new ATOM 0 HG3 LYS A 70 16.817 0.242 -22.889 1.00 0.00 H new ATOM 0 HD2 LYS A 70 15.030 0.575 -24.326 1.00 0.00 H new ATOM 0 HD3 LYS A 70 14.082 -0.726 -23.633 1.00 0.00 H new ATOM 0 HE2 LYS A 70 12.906 1.068 -22.790 1.00 0.00 H new ATOM 0 HE3 LYS A 70 14.061 0.861 -21.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 13.909 3.168 -22.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 15.462 2.568 -22.497 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 14.343 2.769 -23.758 1.00 0.00 H new ATOM 1178 N ASP A 71 15.335 -1.928 -19.840 1.00 0.00 N ATOM 1179 CA ASP A 71 15.650 -1.523 -18.475 1.00 0.00 C ATOM 1180 C ASP A 71 14.707 -2.191 -17.479 1.00 0.00 C ATOM 1181 O ASP A 71 14.877 -2.062 -16.267 1.00 0.00 O ATOM 1182 CB ASP A 71 15.562 -0.002 -18.338 1.00 0.00 C ATOM 1183 CG ASP A 71 16.347 0.519 -17.151 1.00 0.00 C ATOM 1184 OD1 ASP A 71 15.860 0.378 -16.009 1.00 0.00 O ATOM 1185 OD2 ASP A 71 17.449 1.066 -17.363 1.00 0.00 O ATOM 0 H ASP A 71 14.372 -1.746 -20.122 1.00 0.00 H new ATOM 0 HA ASP A 71 16.669 -1.841 -18.254 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.936 0.464 -19.250 1.00 0.00 H new ATOM 0 HB3 ASP A 71 14.517 0.291 -18.235 1.00 0.00 H new ATOM 1190 N GLU A 72 13.712 -2.904 -17.999 1.00 0.00 N ATOM 1191 CA GLU A 72 12.742 -3.590 -17.155 1.00 0.00 C ATOM 1192 C GLU A 72 12.131 -2.630 -16.137 1.00 0.00 C ATOM 1193 O GLU A 72 11.725 -3.039 -15.049 1.00 0.00 O ATOM 1194 CB GLU A 72 13.402 -4.765 -16.432 1.00 0.00 C ATOM 1195 CG GLU A 72 14.047 -5.772 -17.369 1.00 0.00 C ATOM 1196 CD GLU A 72 14.992 -6.716 -16.651 1.00 0.00 C ATOM 1197 OE1 GLU A 72 15.154 -6.572 -15.422 1.00 0.00 O ATOM 1198 OE2 GLU A 72 15.569 -7.599 -17.320 1.00 0.00 O ATOM 0 H GLU A 72 13.557 -3.021 -19.000 1.00 0.00 H new ATOM 0 HA GLU A 72 11.945 -3.969 -17.795 1.00 0.00 H new ATOM 0 HB2 GLU A 72 14.159 -4.381 -15.748 1.00 0.00 H new ATOM 0 HB3 GLU A 72 12.653 -5.274 -15.825 1.00 0.00 H new ATOM 0 HG2 GLU A 72 13.268 -6.351 -17.865 1.00 0.00 H new ATOM 0 HG3 GLU A 72 14.593 -5.240 -18.148 1.00 0.00 H new ATOM 1205 N CYS A 73 12.072 -1.354 -16.499 1.00 0.00 N ATOM 1206 CA CYS A 73 11.512 -0.335 -15.618 1.00 0.00 C ATOM 1207 C CYS A 73 10.217 0.229 -16.192 1.00 0.00 C ATOM 1208 O CYS A 73 9.992 0.186 -17.402 1.00 0.00 O ATOM 1209 CB CYS A 73 12.523 0.793 -15.402 1.00 0.00 C ATOM 1210 SG CYS A 73 12.101 1.913 -14.047 1.00 0.00 S ATOM 0 H CYS A 73 12.405 -1.000 -17.396 1.00 0.00 H new ATOM 0 HA CYS A 73 11.289 -0.802 -14.659 1.00 0.00 H new ATOM 0 HB2 CYS A 73 13.502 0.356 -15.206 1.00 0.00 H new ATOM 0 HB3 CYS A 73 12.610 1.370 -16.323 1.00 0.00 H new ATOM 0 HG CYS A 73 11.086 1.436 -13.390 1.00 0.00 H new ATOM 1216 N ILE A 74 9.368 0.756 -15.316 1.00 0.00 N ATOM 1217 CA ILE A 74 8.095 1.328 -15.736 1.00 0.00 C ATOM 1218 C ILE A 74 8.098 2.846 -15.587 1.00 0.00 C ATOM 1219 O ILE A 74 8.479 3.377 -14.545 1.00 0.00 O ATOM 1220 CB ILE A 74 6.922 0.746 -14.925 1.00 0.00 C ATOM 1221 CG1 ILE A 74 6.870 -0.775 -15.081 1.00 0.00 C ATOM 1222 CG2 ILE A 74 5.609 1.374 -15.369 1.00 0.00 C ATOM 1223 CD1 ILE A 74 6.462 -1.227 -16.465 1.00 0.00 C ATOM 0 H ILE A 74 9.539 0.799 -14.311 1.00 0.00 H new ATOM 0 HA ILE A 74 7.964 1.069 -16.787 1.00 0.00 H new ATOM 0 HB ILE A 74 7.077 0.979 -13.872 1.00 0.00 H new ATOM 0 HG12 ILE A 74 7.850 -1.190 -14.846 1.00 0.00 H new ATOM 0 HG13 ILE A 74 6.169 -1.183 -14.353 1.00 0.00 H new ATOM 0 HG21 ILE A 74 4.789 0.953 -14.787 1.00 0.00 H new ATOM 0 HG22 ILE A 74 5.650 2.452 -15.212 1.00 0.00 H new ATOM 0 HG23 ILE A 74 5.446 1.168 -16.427 1.00 0.00 H new ATOM 0 HD11 ILE A 74 6.447 -2.316 -16.502 1.00 0.00 H new ATOM 0 HD12 ILE A 74 5.469 -0.842 -16.695 1.00 0.00 H new ATOM 0 HD13 ILE A 74 7.176 -0.849 -17.197 1.00 0.00 H new ATOM 1235 N ASN A 75 7.668 3.539 -16.637 1.00 0.00 N ATOM 1236 CA ASN A 75 7.620 4.996 -16.623 1.00 0.00 C ATOM 1237 C ASN A 75 6.177 5.493 -16.624 1.00 0.00 C ATOM 1238 O ASN A 75 5.390 5.145 -17.504 1.00 0.00 O ATOM 1239 CB ASN A 75 8.368 5.564 -17.831 1.00 0.00 C ATOM 1240 CG ASN A 75 9.738 4.939 -18.008 1.00 0.00 C ATOM 1241 OD1 ASN A 75 10.631 5.129 -17.182 1.00 0.00 O ATOM 1242 ND2 ASN A 75 9.910 4.188 -19.090 1.00 0.00 N ATOM 0 H ASN A 75 7.348 3.115 -17.508 1.00 0.00 H new ATOM 0 HA ASN A 75 8.104 5.342 -15.710 1.00 0.00 H new ATOM 0 HB2 ASN A 75 7.777 5.398 -18.732 1.00 0.00 H new ATOM 0 HB3 ASN A 75 8.476 6.642 -17.714 1.00 0.00 H new ATOM 0 HD21 ASN A 75 10.811 3.741 -19.263 1.00 0.00 H new ATOM 0 HD22 ASN A 75 9.142 4.058 -19.748 1.00 0.00 H new ATOM 1249 N VAL A 76 5.837 6.310 -15.632 1.00 0.00 N ATOM 1250 CA VAL A 76 4.490 6.857 -15.519 1.00 0.00 C ATOM 1251 C VAL A 76 4.501 8.375 -15.655 1.00 0.00 C ATOM 1252 O VAL A 76 5.221 9.069 -14.937 1.00 0.00 O ATOM 1253 CB VAL A 76 3.841 6.476 -14.176 1.00 0.00 C ATOM 1254 CG1 VAL A 76 2.379 6.896 -14.151 1.00 0.00 C ATOM 1255 CG2 VAL A 76 3.980 4.983 -13.921 1.00 0.00 C ATOM 0 H VAL A 76 6.476 6.608 -14.895 1.00 0.00 H new ATOM 0 HA VAL A 76 3.904 6.427 -16.331 1.00 0.00 H new ATOM 0 HB VAL A 76 4.360 7.007 -13.378 1.00 0.00 H new ATOM 0 HG11 VAL A 76 1.937 6.618 -13.194 1.00 0.00 H new ATOM 0 HG12 VAL A 76 2.308 7.976 -14.284 1.00 0.00 H new ATOM 0 HG13 VAL A 76 1.843 6.395 -14.957 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.516 4.732 -12.967 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.488 4.430 -14.721 1.00 0.00 H new ATOM 0 HG23 VAL A 76 5.036 4.716 -13.892 1.00 0.00 H new ATOM 1265 N LYS A 77 3.695 8.886 -16.580 1.00 0.00 N ATOM 1266 CA LYS A 77 3.609 10.324 -16.810 1.00 0.00 C ATOM 1267 C LYS A 77 2.319 10.892 -16.226 1.00 0.00 C ATOM 1268 O LYS A 77 1.261 10.269 -16.311 1.00 0.00 O ATOM 1269 CB LYS A 77 3.680 10.626 -18.308 1.00 0.00 C ATOM 1270 CG LYS A 77 3.837 12.104 -18.624 1.00 0.00 C ATOM 1271 CD LYS A 77 2.733 12.598 -19.543 1.00 0.00 C ATOM 1272 CE LYS A 77 3.254 13.621 -20.540 1.00 0.00 C ATOM 1273 NZ LYS A 77 2.984 15.017 -20.096 1.00 0.00 N ATOM 0 H LYS A 77 3.092 8.326 -17.183 1.00 0.00 H new ATOM 0 HA LYS A 77 4.453 10.798 -16.310 1.00 0.00 H new ATOM 0 HB2 LYS A 77 4.518 10.080 -18.741 1.00 0.00 H new ATOM 0 HB3 LYS A 77 2.775 10.255 -18.788 1.00 0.00 H new ATOM 0 HG2 LYS A 77 3.825 12.678 -17.698 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.806 12.276 -19.093 1.00 0.00 H new ATOM 0 HD2 LYS A 77 2.300 11.754 -20.079 1.00 0.00 H new ATOM 0 HD3 LYS A 77 1.935 13.042 -18.948 1.00 0.00 H new ATOM 0 HE2 LYS A 77 4.327 13.484 -20.674 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.788 13.452 -21.511 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 2.899 15.636 -20.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.097 15.043 -19.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 3.767 15.348 -19.496 1.00 0.00 H new ATOM 1287 N VAL A 78 2.415 12.078 -15.634 1.00 0.00 N ATOM 1288 CA VAL A 78 1.256 12.731 -15.038 1.00 0.00 C ATOM 1289 C VAL A 78 1.326 14.244 -15.215 1.00 0.00 C ATOM 1290 O VAL A 78 2.332 14.871 -14.885 1.00 0.00 O ATOM 1291 CB VAL A 78 1.137 12.405 -13.538 1.00 0.00 C ATOM 1292 CG1 VAL A 78 -0.119 13.032 -12.953 1.00 0.00 C ATOM 1293 CG2 VAL A 78 1.143 10.900 -13.318 1.00 0.00 C ATOM 0 H VAL A 78 3.284 12.606 -15.554 1.00 0.00 H new ATOM 0 HA VAL A 78 0.376 12.348 -15.556 1.00 0.00 H new ATOM 0 HB VAL A 78 1.999 12.828 -13.023 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.186 12.791 -11.892 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -0.077 14.114 -13.077 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.995 12.641 -13.470 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.058 10.688 -12.252 1.00 0.00 H new ATOM 0 HG22 VAL A 78 0.301 10.452 -13.845 1.00 0.00 H new ATOM 0 HG23 VAL A 78 2.074 10.480 -13.698 1.00 0.00 H new ATOM 1303 N ALA A 79 0.250 14.824 -15.736 1.00 0.00 N ATOM 1304 CA ALA A 79 0.189 16.264 -15.953 1.00 0.00 C ATOM 1305 C ALA A 79 -0.172 16.999 -14.667 1.00 0.00 C ATOM 1306 O ALA A 79 -1.069 16.583 -13.933 1.00 0.00 O ATOM 1307 CB ALA A 79 -0.816 16.590 -17.049 1.00 0.00 C ATOM 0 H ALA A 79 -0.591 14.319 -16.016 1.00 0.00 H new ATOM 0 HA ALA A 79 1.177 16.601 -16.268 1.00 0.00 H new ATOM 0 HB1 ALA A 79 -0.852 17.669 -17.201 1.00 0.00 H new ATOM 0 HB2 ALA A 79 -0.514 16.103 -17.976 1.00 0.00 H new ATOM 0 HB3 ALA A 79 -1.803 16.232 -16.756 1.00 0.00 H new ATOM 1313 N LYS A 80 0.532 18.093 -14.398 1.00 0.00 N ATOM 1314 CA LYS A 80 0.287 18.887 -13.200 1.00 0.00 C ATOM 1315 C LYS A 80 -0.685 20.026 -13.493 1.00 0.00 C ATOM 1316 O LYS A 80 -0.638 20.637 -14.561 1.00 0.00 O ATOM 1317 CB LYS A 80 1.602 19.451 -12.659 1.00 0.00 C ATOM 1318 CG LYS A 80 1.810 19.192 -11.177 1.00 0.00 C ATOM 1319 CD LYS A 80 0.592 19.596 -10.363 1.00 0.00 C ATOM 1320 CE LYS A 80 0.872 19.530 -8.870 1.00 0.00 C ATOM 1321 NZ LYS A 80 1.991 20.430 -8.475 1.00 0.00 N ATOM 0 H LYS A 80 1.278 18.451 -14.995 1.00 0.00 H new ATOM 0 HA LYS A 80 -0.158 18.236 -12.447 1.00 0.00 H new ATOM 0 HB2 LYS A 80 2.431 19.014 -13.216 1.00 0.00 H new ATOM 0 HB3 LYS A 80 1.628 20.526 -12.839 1.00 0.00 H new ATOM 0 HG2 LYS A 80 2.020 18.134 -11.018 1.00 0.00 H new ATOM 0 HG3 LYS A 80 2.681 19.746 -10.829 1.00 0.00 H new ATOM 0 HD2 LYS A 80 0.292 20.608 -10.633 1.00 0.00 H new ATOM 0 HD3 LYS A 80 -0.244 18.940 -10.607 1.00 0.00 H new ATOM 0 HE2 LYS A 80 -0.027 19.806 -8.319 1.00 0.00 H new ATOM 0 HE3 LYS A 80 1.115 18.505 -8.591 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 2.833 19.861 -8.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 2.207 21.080 -9.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 1.716 20.978 -7.635 1.00 0.00 H new ATOM 1335 N LEU A 81 -1.564 20.307 -12.537 1.00 0.00 N ATOM 1336 CA LEU A 81 -2.547 21.374 -12.692 1.00 0.00 C ATOM 1337 C LEU A 81 -1.874 22.678 -13.107 1.00 0.00 C ATOM 1338 O LEU A 81 -2.465 23.497 -13.809 1.00 0.00 O ATOM 1339 CB LEU A 81 -3.317 21.578 -11.386 1.00 0.00 C ATOM 1340 CG LEU A 81 -4.247 20.438 -10.970 1.00 0.00 C ATOM 1341 CD1 LEU A 81 -5.026 20.813 -9.719 1.00 0.00 C ATOM 1342 CD2 LEU A 81 -5.197 20.084 -12.105 1.00 0.00 C ATOM 0 H LEU A 81 -1.616 19.811 -11.647 1.00 0.00 H new ATOM 0 HA LEU A 81 -3.245 21.081 -13.476 1.00 0.00 H new ATOM 0 HB2 LEU A 81 -2.597 21.743 -10.585 1.00 0.00 H new ATOM 0 HB3 LEU A 81 -3.909 22.489 -11.475 1.00 0.00 H new ATOM 0 HG LEU A 81 -3.638 19.562 -10.745 1.00 0.00 H new ATOM 0 HD11 LEU A 81 -5.682 19.989 -9.438 1.00 0.00 H new ATOM 0 HD12 LEU A 81 -4.331 21.016 -8.905 1.00 0.00 H new ATOM 0 HD13 LEU A 81 -5.624 21.703 -9.916 1.00 0.00 H new ATOM 0 HD21 LEU A 81 -5.852 19.271 -11.791 1.00 0.00 H new ATOM 0 HD22 LEU A 81 -5.799 20.956 -12.361 1.00 0.00 H new ATOM 0 HD23 LEU A 81 -4.622 19.771 -12.977 1.00 0.00 H new ATOM 1354 N ASN A 82 -0.632 22.863 -12.670 1.00 0.00 N ATOM 1355 CA ASN A 82 0.123 24.067 -12.998 1.00 0.00 C ATOM 1356 C ASN A 82 1.515 23.713 -13.513 1.00 0.00 C ATOM 1357 O ASN A 82 2.271 23.000 -12.852 1.00 0.00 O ATOM 1358 CB ASN A 82 0.236 24.973 -11.771 1.00 0.00 C ATOM 1359 CG ASN A 82 -1.018 24.950 -10.918 1.00 0.00 C ATOM 1360 OD1 ASN A 82 -1.880 25.821 -11.039 1.00 0.00 O ATOM 1361 ND2 ASN A 82 -1.125 23.952 -10.050 1.00 0.00 N ATOM 0 H ASN A 82 -0.127 22.194 -12.088 1.00 0.00 H new ATOM 0 HA ASN A 82 -0.412 24.598 -13.785 1.00 0.00 H new ATOM 0 HB2 ASN A 82 1.088 24.659 -11.168 1.00 0.00 H new ATOM 0 HB3 ASN A 82 0.434 25.995 -12.094 1.00 0.00 H new ATOM 0 HD21 ASN A 82 -1.946 23.885 -9.449 1.00 0.00 H new ATOM 0 HD22 ASN A 82 -0.386 23.252 -9.984 1.00 0.00 H new ATOM 1368 N LYS A 83 1.848 24.216 -14.697 1.00 0.00 N ATOM 1369 CA LYS A 83 3.149 23.956 -15.301 1.00 0.00 C ATOM 1370 C LYS A 83 4.262 24.633 -14.508 1.00 0.00 C ATOM 1371 O LYS A 83 4.008 25.531 -13.706 1.00 0.00 O ATOM 1372 CB LYS A 83 3.169 24.447 -16.750 1.00 0.00 C ATOM 1373 CG LYS A 83 4.237 23.784 -17.602 1.00 0.00 C ATOM 1374 CD LYS A 83 3.865 23.799 -19.075 1.00 0.00 C ATOM 1375 CE LYS A 83 4.720 22.830 -19.877 1.00 0.00 C ATOM 1376 NZ LYS A 83 4.922 23.296 -21.277 1.00 0.00 N ATOM 0 H LYS A 83 1.234 24.807 -15.258 1.00 0.00 H new ATOM 0 HA LYS A 83 3.320 22.880 -15.286 1.00 0.00 H new ATOM 0 HB2 LYS A 83 2.193 24.266 -17.200 1.00 0.00 H new ATOM 0 HB3 LYS A 83 3.328 25.525 -16.757 1.00 0.00 H new ATOM 0 HG2 LYS A 83 5.187 24.298 -17.461 1.00 0.00 H new ATOM 0 HG3 LYS A 83 4.380 22.755 -17.272 1.00 0.00 H new ATOM 0 HD2 LYS A 83 2.813 23.537 -19.188 1.00 0.00 H new ATOM 0 HD3 LYS A 83 3.987 24.807 -19.472 1.00 0.00 H new ATOM 0 HE2 LYS A 83 5.688 22.712 -19.390 1.00 0.00 H new ATOM 0 HE3 LYS A 83 4.246 21.849 -19.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 5.510 22.608 -21.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 4.000 23.385 -21.750 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 5.398 24.221 -21.270 1.00 0.00 H new ATOM 1390 N ASN A 84 5.496 24.197 -14.738 1.00 0.00 N ATOM 1391 CA ASN A 84 6.649 24.762 -14.046 1.00 0.00 C ATOM 1392 C ASN A 84 6.532 24.556 -12.539 1.00 0.00 C ATOM 1393 O ASN A 84 7.185 25.246 -11.756 1.00 0.00 O ATOM 1394 CB ASN A 84 6.777 26.254 -14.359 1.00 0.00 C ATOM 1395 CG ASN A 84 7.701 26.521 -15.531 1.00 0.00 C ATOM 1396 OD1 ASN A 84 8.640 27.312 -15.429 1.00 0.00 O ATOM 1397 ND2 ASN A 84 7.439 25.862 -16.654 1.00 0.00 N ATOM 0 H ASN A 84 5.724 23.454 -15.399 1.00 0.00 H new ATOM 0 HA ASN A 84 7.542 24.246 -14.398 1.00 0.00 H new ATOM 0 HB2 ASN A 84 5.790 26.663 -14.577 1.00 0.00 H new ATOM 0 HB3 ASN A 84 7.151 26.777 -13.479 1.00 0.00 H new ATOM 0 HD21 ASN A 84 8.026 26.002 -17.476 1.00 0.00 H new ATOM 0 HD22 ASN A 84 6.651 25.216 -16.694 1.00 0.00 H new ATOM 1404 N GLU A 85 5.697 23.602 -12.140 1.00 0.00 N ATOM 1405 CA GLU A 85 5.495 23.306 -10.726 1.00 0.00 C ATOM 1406 C GLU A 85 6.339 22.110 -10.295 1.00 0.00 C ATOM 1407 O GLU A 85 6.350 21.073 -10.959 1.00 0.00 O ATOM 1408 CB GLU A 85 4.017 23.028 -10.446 1.00 0.00 C ATOM 1409 CG GLU A 85 3.660 23.065 -8.970 1.00 0.00 C ATOM 1410 CD GLU A 85 2.201 23.405 -8.731 1.00 0.00 C ATOM 1411 OE1 GLU A 85 1.348 22.937 -9.514 1.00 0.00 O ATOM 1412 OE2 GLU A 85 1.913 24.137 -7.762 1.00 0.00 O ATOM 0 H GLU A 85 5.150 23.021 -12.775 1.00 0.00 H new ATOM 0 HA GLU A 85 5.809 24.177 -10.151 1.00 0.00 H new ATOM 0 HB2 GLU A 85 3.411 23.763 -10.976 1.00 0.00 H new ATOM 0 HB3 GLU A 85 3.757 22.049 -10.850 1.00 0.00 H new ATOM 0 HG2 GLU A 85 3.882 22.096 -8.522 1.00 0.00 H new ATOM 0 HG3 GLU A 85 4.288 23.800 -8.466 1.00 0.00 H new ATOM 1419 N TYR A 86 7.044 22.262 -9.180 1.00 0.00 N ATOM 1420 CA TYR A 86 7.894 21.196 -8.661 1.00 0.00 C ATOM 1421 C TYR A 86 7.308 20.608 -7.381 1.00 0.00 C ATOM 1422 O TYR A 86 6.228 21.001 -6.940 1.00 0.00 O ATOM 1423 CB TYR A 86 9.304 21.724 -8.395 1.00 0.00 C ATOM 1424 CG TYR A 86 9.434 22.470 -7.086 1.00 0.00 C ATOM 1425 CD1 TYR A 86 8.880 23.734 -6.926 1.00 0.00 C ATOM 1426 CD2 TYR A 86 10.112 21.911 -6.009 1.00 0.00 C ATOM 1427 CE1 TYR A 86 8.997 24.419 -5.733 1.00 0.00 C ATOM 1428 CE2 TYR A 86 10.232 22.589 -4.812 1.00 0.00 C ATOM 1429 CZ TYR A 86 9.674 23.843 -4.678 1.00 0.00 C ATOM 1430 OH TYR A 86 9.792 24.522 -3.487 1.00 0.00 O ATOM 0 H TYR A 86 7.044 23.113 -8.618 1.00 0.00 H new ATOM 0 HA TYR A 86 7.945 20.407 -9.412 1.00 0.00 H new ATOM 0 HB2 TYR A 86 10.003 20.887 -8.398 1.00 0.00 H new ATOM 0 HB3 TYR A 86 9.595 22.385 -9.211 1.00 0.00 H new ATOM 0 HD1 TYR A 86 8.349 24.189 -7.749 1.00 0.00 H new ATOM 0 HD2 TYR A 86 10.552 20.930 -6.110 1.00 0.00 H new ATOM 0 HE1 TYR A 86 8.561 25.401 -5.626 1.00 0.00 H new ATOM 0 HE2 TYR A 86 10.760 22.139 -3.984 1.00 0.00 H new ATOM 0 HH TYR A 86 10.296 23.976 -2.848 1.00 0.00 H new ATOM 1440 N PHE A 87 8.030 19.662 -6.789 1.00 0.00 N ATOM 1441 CA PHE A 87 7.584 19.017 -5.559 1.00 0.00 C ATOM 1442 C PHE A 87 8.713 18.961 -4.534 1.00 0.00 C ATOM 1443 O PHE A 87 9.887 19.085 -4.882 1.00 0.00 O ATOM 1444 CB PHE A 87 7.076 17.604 -5.854 1.00 0.00 C ATOM 1445 CG PHE A 87 5.870 17.575 -6.749 1.00 0.00 C ATOM 1446 CD1 PHE A 87 5.974 17.921 -8.086 1.00 0.00 C ATOM 1447 CD2 PHE A 87 4.632 17.202 -6.252 1.00 0.00 C ATOM 1448 CE1 PHE A 87 4.866 17.895 -8.912 1.00 0.00 C ATOM 1449 CE2 PHE A 87 3.520 17.173 -7.073 1.00 0.00 C ATOM 1450 CZ PHE A 87 3.638 17.522 -8.405 1.00 0.00 C ATOM 0 H PHE A 87 8.926 19.325 -7.141 1.00 0.00 H new ATOM 0 HA PHE A 87 6.769 19.609 -5.143 1.00 0.00 H new ATOM 0 HB2 PHE A 87 7.877 17.028 -6.318 1.00 0.00 H new ATOM 0 HB3 PHE A 87 6.832 17.110 -4.913 1.00 0.00 H new ATOM 0 HD1 PHE A 87 6.932 18.215 -8.488 1.00 0.00 H new ATOM 0 HD2 PHE A 87 4.534 16.931 -5.211 1.00 0.00 H new ATOM 0 HE1 PHE A 87 4.961 18.166 -9.953 1.00 0.00 H new ATOM 0 HE2 PHE A 87 2.561 16.878 -6.674 1.00 0.00 H new ATOM 0 HZ PHE A 87 2.771 17.503 -9.048 1.00 0.00 H new ATOM 1460 N GLU A 88 8.347 18.773 -3.270 1.00 0.00 N ATOM 1461 CA GLU A 88 9.329 18.702 -2.194 1.00 0.00 C ATOM 1462 C GLU A 88 9.090 17.475 -1.320 1.00 0.00 C ATOM 1463 O GLU A 88 9.628 17.370 -0.217 1.00 0.00 O ATOM 1464 CB GLU A 88 9.275 19.970 -1.339 1.00 0.00 C ATOM 1465 CG GLU A 88 10.314 21.009 -1.724 1.00 0.00 C ATOM 1466 CD GLU A 88 11.020 21.602 -0.520 1.00 0.00 C ATOM 1467 OE1 GLU A 88 10.355 21.809 0.516 1.00 0.00 O ATOM 1468 OE2 GLU A 88 12.239 21.858 -0.615 1.00 0.00 O ATOM 0 H GLU A 88 7.379 18.667 -2.966 1.00 0.00 H new ATOM 0 HA GLU A 88 10.318 18.619 -2.644 1.00 0.00 H new ATOM 0 HB2 GLU A 88 8.282 20.413 -1.423 1.00 0.00 H new ATOM 0 HB3 GLU A 88 9.415 19.699 -0.293 1.00 0.00 H new ATOM 0 HG2 GLU A 88 11.051 20.553 -2.384 1.00 0.00 H new ATOM 0 HG3 GLU A 88 9.832 21.808 -2.288 1.00 0.00 H new ATOM 1475 N ASP A 89 8.279 16.549 -1.820 1.00 0.00 N ATOM 1476 CA ASP A 89 7.968 15.328 -1.085 1.00 0.00 C ATOM 1477 C ASP A 89 8.460 14.098 -1.843 1.00 0.00 C ATOM 1478 O ASP A 89 8.596 13.016 -1.270 1.00 0.00 O ATOM 1479 CB ASP A 89 6.462 15.223 -0.841 1.00 0.00 C ATOM 1480 CG ASP A 89 5.981 16.184 0.228 1.00 0.00 C ATOM 1481 OD1 ASP A 89 6.471 17.333 0.258 1.00 0.00 O ATOM 1482 OD2 ASP A 89 5.113 15.788 1.034 1.00 0.00 O ATOM 0 H ASP A 89 7.825 16.620 -2.731 1.00 0.00 H new ATOM 0 HA ASP A 89 8.481 15.371 -0.124 1.00 0.00 H new ATOM 0 HB2 ASP A 89 5.931 15.424 -1.772 1.00 0.00 H new ATOM 0 HB3 ASP A 89 6.215 14.203 -0.547 1.00 0.00 H new ATOM 1487 N LEU A 90 8.723 14.271 -3.133 1.00 0.00 N ATOM 1488 CA LEU A 90 9.199 13.175 -3.970 1.00 0.00 C ATOM 1489 C LEU A 90 10.581 12.709 -3.524 1.00 0.00 C ATOM 1490 O LEU A 90 11.049 11.645 -3.930 1.00 0.00 O ATOM 1491 CB LEU A 90 9.243 13.609 -5.437 1.00 0.00 C ATOM 1492 CG LEU A 90 7.948 14.189 -6.005 1.00 0.00 C ATOM 1493 CD1 LEU A 90 8.092 14.462 -7.494 1.00 0.00 C ATOM 1494 CD2 LEU A 90 6.782 13.246 -5.744 1.00 0.00 C ATOM 0 H LEU A 90 8.615 15.159 -3.623 1.00 0.00 H new ATOM 0 HA LEU A 90 8.504 12.342 -3.865 1.00 0.00 H new ATOM 0 HB2 LEU A 90 10.031 14.353 -5.551 1.00 0.00 H new ATOM 0 HB3 LEU A 90 9.527 12.748 -6.041 1.00 0.00 H new ATOM 0 HG LEU A 90 7.745 15.134 -5.502 1.00 0.00 H new ATOM 0 HD11 LEU A 90 7.160 14.875 -7.880 1.00 0.00 H new ATOM 0 HD12 LEU A 90 8.900 15.176 -7.657 1.00 0.00 H new ATOM 0 HD13 LEU A 90 8.320 13.532 -8.014 1.00 0.00 H new ATOM 0 HD21 LEU A 90 5.868 13.675 -6.155 1.00 0.00 H new ATOM 0 HD22 LEU A 90 6.978 12.285 -6.220 1.00 0.00 H new ATOM 0 HD23 LEU A 90 6.664 13.102 -4.670 1.00 0.00 H new ATOM 1506 N ASP A 91 11.227 13.510 -2.685 1.00 0.00 N ATOM 1507 CA ASP A 91 12.555 13.179 -2.181 1.00 0.00 C ATOM 1508 C ASP A 91 12.462 12.213 -1.003 1.00 0.00 C ATOM 1509 O ASP A 91 13.472 11.670 -0.551 1.00 0.00 O ATOM 1510 CB ASP A 91 13.295 14.448 -1.758 1.00 0.00 C ATOM 1511 CG ASP A 91 13.711 15.298 -2.942 1.00 0.00 C ATOM 1512 OD1 ASP A 91 13.261 15.004 -4.070 1.00 0.00 O ATOM 1513 OD2 ASP A 91 14.487 16.256 -2.743 1.00 0.00 O ATOM 0 H ASP A 91 10.853 14.394 -2.339 1.00 0.00 H new ATOM 0 HA ASP A 91 13.111 12.695 -2.984 1.00 0.00 H new ATOM 0 HB2 ASP A 91 12.655 15.036 -1.100 1.00 0.00 H new ATOM 0 HB3 ASP A 91 14.179 14.175 -1.182 1.00 0.00 H new ATOM 1518 N LEU A 92 11.247 12.004 -0.510 1.00 0.00 N ATOM 1519 CA LEU A 92 11.022 11.104 0.616 1.00 0.00 C ATOM 1520 C LEU A 92 10.146 9.925 0.204 1.00 0.00 C ATOM 1521 O LEU A 92 8.941 10.060 -0.010 1.00 0.00 O ATOM 1522 CB LEU A 92 10.370 11.859 1.775 1.00 0.00 C ATOM 1523 CG LEU A 92 11.117 13.095 2.276 1.00 0.00 C ATOM 1524 CD1 LEU A 92 12.615 12.835 2.312 1.00 0.00 C ATOM 1525 CD2 LEU A 92 10.804 14.299 1.401 1.00 0.00 C ATOM 0 H LEU A 92 10.402 12.445 -0.872 1.00 0.00 H new ATOM 0 HA LEU A 92 11.989 10.718 0.940 1.00 0.00 H new ATOM 0 HB2 LEU A 92 9.370 12.164 1.467 1.00 0.00 H new ATOM 0 HB3 LEU A 92 10.250 11.169 2.610 1.00 0.00 H new ATOM 0 HG LEU A 92 10.782 13.312 3.290 1.00 0.00 H new ATOM 0 HD11 LEU A 92 13.130 13.726 2.671 1.00 0.00 H new ATOM 0 HD12 LEU A 92 12.823 12.000 2.982 1.00 0.00 H new ATOM 0 HD13 LEU A 92 12.966 12.592 1.309 1.00 0.00 H new ATOM 0 HD21 LEU A 92 11.345 15.169 1.773 1.00 0.00 H new ATOM 0 HD22 LEU A 92 11.110 14.093 0.375 1.00 0.00 H new ATOM 0 HD23 LEU A 92 9.733 14.499 1.427 1.00 0.00 H new ATOM 1537 N PRO A 93 10.763 8.739 0.093 1.00 0.00 N ATOM 1538 CA PRO A 93 10.058 7.513 -0.291 1.00 0.00 C ATOM 1539 C PRO A 93 9.107 7.026 0.798 1.00 0.00 C ATOM 1540 O PRO A 93 8.337 6.088 0.591 1.00 0.00 O ATOM 1541 CB PRO A 93 11.189 6.504 -0.503 1.00 0.00 C ATOM 1542 CG PRO A 93 12.307 7.005 0.346 1.00 0.00 C ATOM 1543 CD PRO A 93 12.197 8.504 0.333 1.00 0.00 C ATOM 0 HA PRO A 93 9.431 7.662 -1.170 1.00 0.00 H new ATOM 0 HB2 PRO A 93 10.885 5.500 -0.206 1.00 0.00 H new ATOM 0 HB3 PRO A 93 11.481 6.451 -1.552 1.00 0.00 H new ATOM 0 HG2 PRO A 93 12.230 6.617 1.362 1.00 0.00 H new ATOM 0 HG3 PRO A 93 13.271 6.681 -0.047 1.00 0.00 H new ATOM 0 HD2 PRO A 93 12.523 8.939 1.278 1.00 0.00 H new ATOM 0 HD3 PRO A 93 12.813 8.945 -0.450 1.00 0.00 H new ATOM 1551 N THR A 94 9.166 7.670 1.959 1.00 0.00 N ATOM 1552 CA THR A 94 8.311 7.302 3.081 1.00 0.00 C ATOM 1553 C THR A 94 7.121 8.247 3.198 1.00 0.00 C ATOM 1554 O THR A 94 6.047 7.857 3.658 1.00 0.00 O ATOM 1555 CB THR A 94 9.092 7.311 4.409 1.00 0.00 C ATOM 1556 OG1 THR A 94 9.639 8.613 4.647 1.00 0.00 O ATOM 1557 CG2 THR A 94 10.211 6.281 4.386 1.00 0.00 C ATOM 0 H THR A 94 9.797 8.449 2.147 1.00 0.00 H new ATOM 0 HA THR A 94 7.951 6.292 2.886 1.00 0.00 H new ATOM 0 HB THR A 94 8.402 7.055 5.213 1.00 0.00 H new ATOM 0 HG1 THR A 94 10.132 8.611 5.494 1.00 0.00 H new ATOM 0 HG21 THR A 94 10.748 6.306 5.334 1.00 0.00 H new ATOM 0 HG22 THR A 94 9.788 5.288 4.235 1.00 0.00 H new ATOM 0 HG23 THR A 94 10.900 6.510 3.573 1.00 0.00 H new ATOM 1565 N LYS A 95 7.317 9.493 2.779 1.00 0.00 N ATOM 1566 CA LYS A 95 6.259 10.495 2.834 1.00 0.00 C ATOM 1567 C LYS A 95 5.119 10.136 1.885 1.00 0.00 C ATOM 1568 O LYS A 95 3.978 10.553 2.085 1.00 0.00 O ATOM 1569 CB LYS A 95 6.816 11.875 2.480 1.00 0.00 C ATOM 1570 CG LYS A 95 7.626 12.509 3.598 1.00 0.00 C ATOM 1571 CD LYS A 95 7.831 13.997 3.364 1.00 0.00 C ATOM 1572 CE LYS A 95 8.491 14.663 4.561 1.00 0.00 C ATOM 1573 NZ LYS A 95 8.798 16.097 4.298 1.00 0.00 N ATOM 0 H LYS A 95 8.200 9.833 2.397 1.00 0.00 H new ATOM 0 HA LYS A 95 5.868 10.518 3.851 1.00 0.00 H new ATOM 0 HB2 LYS A 95 7.443 11.788 1.593 1.00 0.00 H new ATOM 0 HB3 LYS A 95 5.989 12.536 2.222 1.00 0.00 H new ATOM 0 HG2 LYS A 95 7.116 12.356 4.549 1.00 0.00 H new ATOM 0 HG3 LYS A 95 8.595 12.015 3.672 1.00 0.00 H new ATOM 0 HD2 LYS A 95 8.448 14.146 2.478 1.00 0.00 H new ATOM 0 HD3 LYS A 95 6.870 14.471 3.167 1.00 0.00 H new ATOM 0 HE2 LYS A 95 7.835 14.585 5.428 1.00 0.00 H new ATOM 0 HE3 LYS A 95 9.411 14.134 4.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 9.247 16.516 5.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 9.445 16.170 3.487 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 7.917 16.607 4.086 1.00 0.00 H new ATOM 1587 N LEU A 96 5.436 9.361 0.855 1.00 0.00 N ATOM 1588 CA LEU A 96 4.438 8.944 -0.125 1.00 0.00 C ATOM 1589 C LEU A 96 3.692 7.702 0.352 1.00 0.00 C ATOM 1590 O LEU A 96 2.468 7.619 0.242 1.00 0.00 O ATOM 1591 CB LEU A 96 5.104 8.667 -1.474 1.00 0.00 C ATOM 1592 CG LEU A 96 6.229 9.621 -1.876 1.00 0.00 C ATOM 1593 CD1 LEU A 96 7.226 8.919 -2.784 1.00 0.00 C ATOM 1594 CD2 LEU A 96 5.661 10.857 -2.559 1.00 0.00 C ATOM 0 H LEU A 96 6.376 9.008 0.676 1.00 0.00 H new ATOM 0 HA LEU A 96 3.718 9.754 -0.242 1.00 0.00 H new ATOM 0 HB2 LEU A 96 5.503 7.653 -1.458 1.00 0.00 H new ATOM 0 HB3 LEU A 96 4.337 8.695 -2.248 1.00 0.00 H new ATOM 0 HG LEU A 96 6.752 9.937 -0.973 1.00 0.00 H new ATOM 0 HD11 LEU A 96 8.019 9.614 -3.060 1.00 0.00 H new ATOM 0 HD12 LEU A 96 7.657 8.066 -2.260 1.00 0.00 H new ATOM 0 HD13 LEU A 96 6.718 8.573 -3.684 1.00 0.00 H new ATOM 0 HD21 LEU A 96 6.476 11.525 -2.838 1.00 0.00 H new ATOM 0 HD22 LEU A 96 5.113 10.559 -3.453 1.00 0.00 H new ATOM 0 HD23 LEU A 96 4.987 11.373 -1.875 1.00 0.00 H new ATOM 1606 N LEU A 97 4.437 6.739 0.884 1.00 0.00 N ATOM 1607 CA LEU A 97 3.846 5.501 1.381 1.00 0.00 C ATOM 1608 C LEU A 97 3.105 5.740 2.692 1.00 0.00 C ATOM 1609 O LEU A 97 2.169 5.015 3.028 1.00 0.00 O ATOM 1610 CB LEU A 97 4.930 4.440 1.580 1.00 0.00 C ATOM 1611 CG LEU A 97 5.772 4.101 0.349 1.00 0.00 C ATOM 1612 CD1 LEU A 97 6.916 3.172 0.724 1.00 0.00 C ATOM 1613 CD2 LEU A 97 4.906 3.474 -0.733 1.00 0.00 C ATOM 0 H LEU A 97 5.451 6.791 0.982 1.00 0.00 H new ATOM 0 HA LEU A 97 3.130 5.145 0.640 1.00 0.00 H new ATOM 0 HB2 LEU A 97 5.599 4.777 2.371 1.00 0.00 H new ATOM 0 HB3 LEU A 97 4.454 3.525 1.933 1.00 0.00 H new ATOM 0 HG LEU A 97 6.196 5.025 -0.043 1.00 0.00 H new ATOM 0 HD11 LEU A 97 7.504 2.942 -0.164 1.00 0.00 H new ATOM 0 HD12 LEU A 97 7.552 3.658 1.464 1.00 0.00 H new ATOM 0 HD13 LEU A 97 6.513 2.249 1.142 1.00 0.00 H new ATOM 0 HD21 LEU A 97 5.522 3.239 -1.601 1.00 0.00 H new ATOM 0 HD22 LEU A 97 4.453 2.559 -0.352 1.00 0.00 H new ATOM 0 HD23 LEU A 97 4.122 4.174 -1.023 1.00 0.00 H new ATOM 1625 N ALA A 98 3.529 6.762 3.428 1.00 0.00 N ATOM 1626 CA ALA A 98 2.902 7.098 4.701 1.00 0.00 C ATOM 1627 C ALA A 98 1.636 7.921 4.488 1.00 0.00 C ATOM 1628 O ALA A 98 1.615 9.124 4.747 1.00 0.00 O ATOM 1629 CB ALA A 98 3.881 7.853 5.588 1.00 0.00 C ATOM 0 H ALA A 98 4.304 7.371 3.165 1.00 0.00 H new ATOM 0 HA ALA A 98 2.621 6.169 5.197 1.00 0.00 H new ATOM 0 HB1 ALA A 98 3.400 8.098 6.535 1.00 0.00 H new ATOM 0 HB2 ALA A 98 4.756 7.231 5.776 1.00 0.00 H new ATOM 0 HB3 ALA A 98 4.189 8.772 5.090 1.00 0.00 H new ATOM 1635 N ARG A 99 0.581 7.264 4.016 1.00 0.00 N ATOM 1636 CA ARG A 99 -0.688 7.936 3.767 1.00 0.00 C ATOM 1637 C ARG A 99 -1.849 7.138 4.354 1.00 0.00 C ATOM 1638 O ARG A 99 -3.005 7.343 3.983 1.00 0.00 O ATOM 1639 CB ARG A 99 -0.900 8.133 2.265 1.00 0.00 C ATOM 1640 CG ARG A 99 -0.350 6.997 1.418 1.00 0.00 C ATOM 1641 CD ARG A 99 -1.006 5.672 1.770 1.00 0.00 C ATOM 1642 NE ARG A 99 -2.463 5.773 1.801 1.00 0.00 N ATOM 1643 CZ ARG A 99 -3.259 4.798 2.226 1.00 0.00 C ATOM 1644 NH1 ARG A 99 -2.742 3.655 2.655 1.00 0.00 N ATOM 1645 NH2 ARG A 99 -4.575 4.966 2.224 1.00 0.00 N ATOM 0 H ARG A 99 0.581 6.267 3.799 1.00 0.00 H new ATOM 0 HA ARG A 99 -0.655 8.911 4.253 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -1.967 8.238 2.068 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -0.426 9.066 1.959 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -0.514 7.216 0.363 1.00 0.00 H new ATOM 0 HG3 ARG A 99 0.727 6.921 1.565 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -0.711 4.917 1.042 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -0.645 5.336 2.742 1.00 0.00 H new ATOM 0 HE ARG A 99 -2.893 6.640 1.479 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -1.731 3.523 2.659 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -3.356 2.908 2.981 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -4.976 5.844 1.896 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -5.185 4.217 2.550 1.00 0.00 H new ATOM 1659 N GLN A 100 -1.532 6.229 5.270 1.00 0.00 N ATOM 1660 CA GLN A 100 -2.549 5.400 5.907 1.00 0.00 C ATOM 1661 C GLN A 100 -3.239 6.157 7.037 1.00 0.00 C ATOM 1662 O GLN A 100 -3.024 7.355 7.217 1.00 0.00 O ATOM 1663 CB GLN A 100 -1.924 4.113 6.447 1.00 0.00 C ATOM 1664 CG GLN A 100 -1.168 3.316 5.395 1.00 0.00 C ATOM 1665 CD GLN A 100 0.106 2.697 5.936 1.00 0.00 C ATOM 1666 OE1 GLN A 100 1.177 2.838 5.347 1.00 0.00 O ATOM 1667 NE2 GLN A 100 -0.005 2.005 7.065 1.00 0.00 N ATOM 0 H GLN A 100 -0.580 6.048 5.588 1.00 0.00 H new ATOM 0 HA GLN A 100 -3.296 5.145 5.156 1.00 0.00 H new ATOM 0 HB2 GLN A 100 -1.243 4.363 7.260 1.00 0.00 H new ATOM 0 HB3 GLN A 100 -2.710 3.487 6.870 1.00 0.00 H new ATOM 0 HG2 GLN A 100 -1.814 2.528 5.008 1.00 0.00 H new ATOM 0 HG3 GLN A 100 -0.923 3.968 4.557 1.00 0.00 H new ATOM 0 HE21 GLN A 100 -0.913 1.914 7.520 1.00 0.00 H new ATOM 0 HE22 GLN A 100 0.818 1.565 7.477 1.00 0.00 H new ATOM 1676 N GLY A 101 -4.071 5.449 7.795 1.00 0.00 N ATOM 1677 CA GLY A 101 -4.781 6.071 8.898 1.00 0.00 C ATOM 1678 C GLY A 101 -5.145 5.080 9.985 1.00 0.00 C ATOM 1679 O GLY A 101 -4.921 5.336 11.168 1.00 0.00 O ATOM 0 H GLY A 101 -4.266 4.456 7.665 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -4.164 6.862 9.324 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -5.689 6.543 8.522 1.00 0.00 H new ATOM 1683 N ASP A 102 -5.710 3.946 9.585 1.00 0.00 N ATOM 1684 CA ASP A 102 -6.108 2.913 10.534 1.00 0.00 C ATOM 1685 C ASP A 102 -5.617 1.541 10.081 1.00 0.00 C ATOM 1686 O ASP A 102 -6.192 0.514 10.444 1.00 0.00 O ATOM 1687 CB ASP A 102 -7.629 2.897 10.696 1.00 0.00 C ATOM 1688 CG ASP A 102 -8.117 3.944 11.678 1.00 0.00 C ATOM 1689 OD1 ASP A 102 -7.578 5.070 11.662 1.00 0.00 O ATOM 1690 OD2 ASP A 102 -9.040 3.637 12.461 1.00 0.00 O ATOM 0 H ASP A 102 -5.903 3.719 8.609 1.00 0.00 H new ATOM 0 HA ASP A 102 -5.651 3.143 11.497 1.00 0.00 H new ATOM 0 HB2 ASP A 102 -8.097 3.067 9.726 1.00 0.00 H new ATOM 0 HB3 ASP A 102 -7.945 1.910 11.034 1.00 0.00 H new ATOM 1695 N LEU A 103 -4.554 1.532 9.286 1.00 0.00 N ATOM 1696 CA LEU A 103 -3.986 0.287 8.781 1.00 0.00 C ATOM 1697 C LEU A 103 -2.833 -0.183 9.664 1.00 0.00 C ATOM 1698 O LEU A 103 -1.667 -0.079 9.286 1.00 0.00 O ATOM 1699 CB LEU A 103 -3.499 0.470 7.343 1.00 0.00 C ATOM 1700 CG LEU A 103 -4.562 0.334 6.252 1.00 0.00 C ATOM 1701 CD1 LEU A 103 -5.185 -1.053 6.284 1.00 0.00 C ATOM 1702 CD2 LEU A 103 -5.632 1.404 6.414 1.00 0.00 C ATOM 0 H LEU A 103 -4.067 2.373 8.977 1.00 0.00 H new ATOM 0 HA LEU A 103 -4.767 -0.473 8.799 1.00 0.00 H new ATOM 0 HB2 LEU A 103 -3.044 1.457 7.258 1.00 0.00 H new ATOM 0 HB3 LEU A 103 -2.714 -0.261 7.151 1.00 0.00 H new ATOM 0 HG LEU A 103 -4.081 0.472 5.284 1.00 0.00 H new ATOM 0 HD11 LEU A 103 -5.939 -1.131 5.501 1.00 0.00 H new ATOM 0 HD12 LEU A 103 -4.412 -1.803 6.119 1.00 0.00 H new ATOM 0 HD13 LEU A 103 -5.652 -1.220 7.255 1.00 0.00 H new ATOM 0 HD21 LEU A 103 -6.380 1.292 5.629 1.00 0.00 H new ATOM 0 HD22 LEU A 103 -6.109 1.297 7.388 1.00 0.00 H new ATOM 0 HD23 LEU A 103 -5.174 2.390 6.341 1.00 0.00 H new ATOM 1714 N ALA A 104 -3.169 -0.702 10.840 1.00 0.00 N ATOM 1715 CA ALA A 104 -2.163 -1.192 11.774 1.00 0.00 C ATOM 1716 C ALA A 104 -2.211 -2.712 11.885 1.00 0.00 C ATOM 1717 O ALA A 104 -3.286 -3.304 11.974 1.00 0.00 O ATOM 1718 CB ALA A 104 -2.359 -0.554 13.142 1.00 0.00 C ATOM 0 H ALA A 104 -4.130 -0.794 11.169 1.00 0.00 H new ATOM 0 HA ALA A 104 -1.181 -0.913 11.392 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -1.601 -0.929 13.830 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -2.267 0.529 13.055 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -3.349 -0.805 13.522 1.00 0.00 H new ATOM 1724 N GLY A 105 -1.038 -3.338 11.879 1.00 0.00 N ATOM 1725 CA GLY A 105 -0.969 -4.784 11.978 1.00 0.00 C ATOM 1726 C GLY A 105 0.288 -5.258 12.680 1.00 0.00 C ATOM 1727 O GLY A 105 0.771 -4.609 13.607 1.00 0.00 O ATOM 0 H GLY A 105 -0.135 -2.870 11.807 1.00 0.00 H new ATOM 0 HA2 GLY A 105 -1.843 -5.150 12.517 1.00 0.00 H new ATOM 0 HA3 GLY A 105 -1.008 -5.216 10.978 1.00 0.00 H new ATOM 1731 N ALA A 106 0.819 -6.393 12.239 1.00 0.00 N ATOM 1732 CA ALA A 106 2.028 -6.953 12.831 1.00 0.00 C ATOM 1733 C ALA A 106 3.217 -6.812 11.887 1.00 0.00 C ATOM 1734 O ALA A 106 4.359 -7.064 12.271 1.00 0.00 O ATOM 1735 CB ALA A 106 1.810 -8.414 13.194 1.00 0.00 C ATOM 0 H ALA A 106 0.431 -6.944 11.473 1.00 0.00 H new ATOM 0 HA ALA A 106 2.251 -6.394 13.740 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.721 -8.819 13.635 1.00 0.00 H new ATOM 0 HB2 ALA A 106 0.993 -8.493 13.912 1.00 0.00 H new ATOM 0 HB3 ALA A 106 1.559 -8.979 12.296 1.00 0.00 H new ATOM 1741 N ASP A 107 2.941 -6.410 10.651 1.00 0.00 N ATOM 1742 CA ASP A 107 3.989 -6.236 9.652 1.00 0.00 C ATOM 1743 C ASP A 107 3.948 -4.831 9.060 1.00 0.00 C ATOM 1744 O ASP A 107 2.875 -4.290 8.794 1.00 0.00 O ATOM 1745 CB ASP A 107 3.841 -7.275 8.540 1.00 0.00 C ATOM 1746 CG ASP A 107 3.424 -8.634 9.068 1.00 0.00 C ATOM 1747 OD1 ASP A 107 4.160 -9.195 9.907 1.00 0.00 O ATOM 1748 OD2 ASP A 107 2.363 -9.137 8.643 1.00 0.00 O ATOM 0 H ASP A 107 2.001 -6.199 10.317 1.00 0.00 H new ATOM 0 HA ASP A 107 4.952 -6.376 10.144 1.00 0.00 H new ATOM 0 HB2 ASP A 107 3.103 -6.927 7.818 1.00 0.00 H new ATOM 0 HB3 ASP A 107 4.787 -7.370 8.008 1.00 0.00 H new ATOM 1753 N ALA A 108 5.123 -4.244 8.859 1.00 0.00 N ATOM 1754 CA ALA A 108 5.221 -2.902 8.299 1.00 0.00 C ATOM 1755 C ALA A 108 5.810 -2.936 6.892 1.00 0.00 C ATOM 1756 O ALA A 108 6.441 -1.975 6.449 1.00 0.00 O ATOM 1757 CB ALA A 108 6.061 -2.012 9.203 1.00 0.00 C ATOM 0 H ALA A 108 6.021 -4.677 9.076 1.00 0.00 H new ATOM 0 HA ALA A 108 4.215 -2.488 8.234 1.00 0.00 H new ATOM 0 HB1 ALA A 108 6.125 -1.013 8.772 1.00 0.00 H new ATOM 0 HB2 ALA A 108 5.598 -1.953 10.188 1.00 0.00 H new ATOM 0 HB3 ALA A 108 7.063 -2.431 9.298 1.00 0.00 H new ATOM 1763 N LEU A 109 5.600 -4.047 6.195 1.00 0.00 N ATOM 1764 CA LEU A 109 6.112 -4.206 4.838 1.00 0.00 C ATOM 1765 C LEU A 109 7.597 -3.865 4.772 1.00 0.00 C ATOM 1766 O LEU A 109 8.037 -3.125 3.891 1.00 0.00 O ATOM 1767 CB LEU A 109 5.329 -3.318 3.870 1.00 0.00 C ATOM 1768 CG LEU A 109 3.807 -3.464 3.906 1.00 0.00 C ATOM 1769 CD1 LEU A 109 3.207 -2.544 4.957 1.00 0.00 C ATOM 1770 CD2 LEU A 109 3.211 -3.172 2.536 1.00 0.00 C ATOM 0 H LEU A 109 5.079 -4.851 6.546 1.00 0.00 H new ATOM 0 HA LEU A 109 5.985 -5.249 4.548 1.00 0.00 H new ATOM 0 HB2 LEU A 109 5.579 -2.278 4.079 1.00 0.00 H new ATOM 0 HB3 LEU A 109 5.670 -3.530 2.857 1.00 0.00 H new ATOM 0 HG LEU A 109 3.566 -4.493 4.174 1.00 0.00 H new ATOM 0 HD11 LEU A 109 2.123 -2.662 4.968 1.00 0.00 H new ATOM 0 HD12 LEU A 109 3.610 -2.800 5.937 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.457 -1.510 4.721 1.00 0.00 H new ATOM 0 HD21 LEU A 109 2.127 -3.281 2.580 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.462 -2.154 2.240 1.00 0.00 H new ATOM 0 HD23 LEU A 109 3.616 -3.873 1.806 1.00 0.00 H new ATOM 1782 N THR A 110 8.366 -4.410 5.709 1.00 0.00 N ATOM 1783 CA THR A 110 9.802 -4.164 5.757 1.00 0.00 C ATOM 1784 C THR A 110 10.582 -5.472 5.826 1.00 0.00 C ATOM 1785 O THR A 110 10.616 -6.130 6.865 1.00 0.00 O ATOM 1786 CB THR A 110 10.182 -3.289 6.965 1.00 0.00 C ATOM 1787 OG1 THR A 110 11.595 -3.352 7.192 1.00 0.00 O ATOM 1788 CG2 THR A 110 9.443 -3.741 8.215 1.00 0.00 C ATOM 0 H THR A 110 8.018 -5.025 6.445 1.00 0.00 H new ATOM 0 HA THR A 110 10.063 -3.636 4.839 1.00 0.00 H new ATOM 0 HB THR A 110 9.895 -2.261 6.744 1.00 0.00 H new ATOM 0 HG1 THR A 110 11.828 -2.791 7.961 1.00 0.00 H new ATOM 0 HG21 THR A 110 9.728 -3.108 9.055 1.00 0.00 H new ATOM 0 HG22 THR A 110 8.368 -3.664 8.050 1.00 0.00 H new ATOM 0 HG23 THR A 110 9.702 -4.776 8.437 1.00 0.00 H new ATOM 1796 N GLU A 111 11.208 -5.843 4.713 1.00 0.00 N ATOM 1797 CA GLU A 111 11.987 -7.074 4.649 1.00 0.00 C ATOM 1798 C GLU A 111 13.464 -6.796 4.910 1.00 0.00 C ATOM 1799 O GLU A 111 14.011 -5.798 4.443 1.00 0.00 O ATOM 1800 CB GLU A 111 11.816 -7.741 3.283 1.00 0.00 C ATOM 1801 CG GLU A 111 12.405 -9.140 3.211 1.00 0.00 C ATOM 1802 CD GLU A 111 12.829 -9.523 1.806 1.00 0.00 C ATOM 1803 OE1 GLU A 111 11.959 -9.953 1.021 1.00 0.00 O ATOM 1804 OE2 GLU A 111 14.031 -9.393 1.492 1.00 0.00 O ATOM 0 H GLU A 111 11.191 -5.309 3.844 1.00 0.00 H new ATOM 0 HA GLU A 111 11.619 -7.748 5.423 1.00 0.00 H new ATOM 0 HB2 GLU A 111 10.754 -7.790 3.042 1.00 0.00 H new ATOM 0 HB3 GLU A 111 12.287 -7.118 2.522 1.00 0.00 H new ATOM 0 HG2 GLU A 111 13.266 -9.202 3.876 1.00 0.00 H new ATOM 0 HG3 GLU A 111 11.670 -9.859 3.573 1.00 0.00 H new ATOM 1811 N ASN A 112 14.104 -7.687 5.661 1.00 0.00 N ATOM 1812 CA ASN A 112 15.518 -7.538 5.986 1.00 0.00 C ATOM 1813 C ASN A 112 16.389 -7.814 4.765 1.00 0.00 C ATOM 1814 O ASN A 112 16.430 -8.936 4.257 1.00 0.00 O ATOM 1815 CB ASN A 112 15.903 -8.485 7.125 1.00 0.00 C ATOM 1816 CG ASN A 112 15.308 -8.061 8.455 1.00 0.00 C ATOM 1817 OD1 ASN A 112 14.149 -7.653 8.527 1.00 0.00 O ATOM 1818 ND2 ASN A 112 16.102 -8.156 9.515 1.00 0.00 N ATOM 0 H ASN A 112 13.666 -8.519 6.056 1.00 0.00 H new ATOM 0 HA ASN A 112 15.685 -6.509 6.305 1.00 0.00 H new ATOM 0 HB2 ASN A 112 15.567 -9.494 6.885 1.00 0.00 H new ATOM 0 HB3 ASN A 112 16.989 -8.523 7.211 1.00 0.00 H new ATOM 0 HD21 ASN A 112 15.758 -7.885 10.436 1.00 0.00 H new ATOM 0 HD22 ASN A 112 17.056 -8.500 9.408 1.00 0.00 H new ATOM 1825 N THR A 113 17.086 -6.784 4.296 1.00 0.00 N ATOM 1826 CA THR A 113 17.956 -6.914 3.134 1.00 0.00 C ATOM 1827 C THR A 113 19.033 -5.835 3.130 1.00 0.00 C ATOM 1828 O THR A 113 18.911 -4.820 3.816 1.00 0.00 O ATOM 1829 CB THR A 113 17.155 -6.830 1.821 1.00 0.00 C ATOM 1830 OG1 THR A 113 18.035 -6.976 0.701 1.00 0.00 O ATOM 1831 CG2 THR A 113 16.416 -5.504 1.722 1.00 0.00 C ATOM 0 H THR A 113 17.065 -5.849 4.704 1.00 0.00 H new ATOM 0 HA THR A 113 18.428 -7.894 3.200 1.00 0.00 H new ATOM 0 HB THR A 113 16.423 -7.637 1.815 1.00 0.00 H new ATOM 0 HG1 THR A 113 17.518 -6.923 -0.130 1.00 0.00 H new ATOM 0 HG21 THR A 113 15.858 -5.468 0.787 1.00 0.00 H new ATOM 0 HG22 THR A 113 15.726 -5.408 2.560 1.00 0.00 H new ATOM 0 HG23 THR A 113 17.134 -4.684 1.748 1.00 0.00 H new ATOM 1839 N ASP A 114 20.085 -6.060 2.351 1.00 0.00 N ATOM 1840 CA ASP A 114 21.184 -5.105 2.256 1.00 0.00 C ATOM 1841 C ASP A 114 21.414 -4.685 0.808 1.00 0.00 C ATOM 1842 O ASP A 114 20.819 -5.244 -0.113 1.00 0.00 O ATOM 1843 CB ASP A 114 22.464 -5.709 2.835 1.00 0.00 C ATOM 1844 CG ASP A 114 22.549 -5.553 4.340 1.00 0.00 C ATOM 1845 OD1 ASP A 114 21.899 -4.632 4.878 1.00 0.00 O ATOM 1846 OD2 ASP A 114 23.266 -6.350 4.981 1.00 0.00 O ATOM 0 H ASP A 114 20.201 -6.895 1.776 1.00 0.00 H new ATOM 0 HA ASP A 114 20.916 -4.220 2.834 1.00 0.00 H new ATOM 0 HB2 ASP A 114 22.511 -6.768 2.579 1.00 0.00 H new ATOM 0 HB3 ASP A 114 23.328 -5.231 2.374 1.00 0.00 H new ATOM 1851 N ALA A 115 22.281 -3.696 0.615 1.00 0.00 N ATOM 1852 CA ALA A 115 22.590 -3.201 -0.721 1.00 0.00 C ATOM 1853 C ALA A 115 23.845 -2.334 -0.708 1.00 0.00 C ATOM 1854 O ALA A 115 24.221 -1.783 0.327 1.00 0.00 O ATOM 1855 CB ALA A 115 21.412 -2.419 -1.280 1.00 0.00 C ATOM 0 H ALA A 115 22.782 -3.222 1.367 1.00 0.00 H new ATOM 0 HA ALA A 115 22.780 -4.060 -1.365 1.00 0.00 H new ATOM 0 HB1 ALA A 115 21.657 -2.056 -2.278 1.00 0.00 H new ATOM 0 HB2 ALA A 115 20.538 -3.068 -1.335 1.00 0.00 H new ATOM 0 HB3 ALA A 115 21.195 -1.572 -0.629 1.00 0.00 H new ATOM 1861 N LYS A 116 24.490 -2.218 -1.864 1.00 0.00 N ATOM 1862 CA LYS A 116 25.703 -1.418 -1.987 1.00 0.00 C ATOM 1863 C LYS A 116 25.508 -0.287 -2.992 1.00 0.00 C ATOM 1864 O LYS A 116 25.435 -0.520 -4.198 1.00 0.00 O ATOM 1865 CB LYS A 116 26.878 -2.299 -2.415 1.00 0.00 C ATOM 1866 CG LYS A 116 28.206 -1.562 -2.456 1.00 0.00 C ATOM 1867 CD LYS A 116 28.798 -1.401 -1.066 1.00 0.00 C ATOM 1868 CE LYS A 116 30.131 -0.670 -1.109 1.00 0.00 C ATOM 1869 NZ LYS A 116 29.994 0.701 -1.673 1.00 0.00 N ATOM 0 H LYS A 116 24.193 -2.668 -2.730 1.00 0.00 H new ATOM 0 HA LYS A 116 25.921 -0.981 -1.013 1.00 0.00 H new ATOM 0 HB2 LYS A 116 26.960 -3.141 -1.727 1.00 0.00 H new ATOM 0 HB3 LYS A 116 26.671 -2.713 -3.402 1.00 0.00 H new ATOM 0 HG2 LYS A 116 28.906 -2.107 -3.090 1.00 0.00 H new ATOM 0 HG3 LYS A 116 28.064 -0.580 -2.908 1.00 0.00 H new ATOM 0 HD2 LYS A 116 28.101 -0.851 -0.434 1.00 0.00 H new ATOM 0 HD3 LYS A 116 28.935 -2.382 -0.612 1.00 0.00 H new ATOM 0 HE2 LYS A 116 30.544 -0.609 -0.102 1.00 0.00 H new ATOM 0 HE3 LYS A 116 30.839 -1.241 -1.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 116 30.856 1.247 -1.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 116 29.855 0.641 -2.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 116 29.175 1.174 -1.240 1.00 0.00 H new ATOM 1883 N LYS A 117 25.427 0.940 -2.487 1.00 0.00 N ATOM 1884 CA LYS A 117 25.244 2.108 -3.340 1.00 0.00 C ATOM 1885 C LYS A 117 25.702 3.377 -2.629 1.00 0.00 C ATOM 1886 O LYS A 117 25.626 3.478 -1.404 1.00 0.00 O ATOM 1887 CB LYS A 117 23.775 2.242 -3.748 1.00 0.00 C ATOM 1888 CG LYS A 117 23.574 2.971 -5.065 1.00 0.00 C ATOM 1889 CD LYS A 117 23.939 2.093 -6.251 1.00 0.00 C ATOM 1890 CE LYS A 117 22.868 1.046 -6.519 1.00 0.00 C ATOM 1891 NZ LYS A 117 21.618 1.655 -7.050 1.00 0.00 N ATOM 0 H LYS A 117 25.485 1.151 -1.491 1.00 0.00 H new ATOM 0 HA LYS A 117 25.852 1.973 -4.234 1.00 0.00 H new ATOM 0 HB2 LYS A 117 23.335 1.248 -3.822 1.00 0.00 H new ATOM 0 HB3 LYS A 117 23.235 2.772 -2.963 1.00 0.00 H new ATOM 0 HG2 LYS A 117 22.534 3.287 -5.152 1.00 0.00 H new ATOM 0 HG3 LYS A 117 24.184 3.874 -5.079 1.00 0.00 H new ATOM 0 HD2 LYS A 117 24.073 2.714 -7.137 1.00 0.00 H new ATOM 0 HD3 LYS A 117 24.892 1.600 -6.060 1.00 0.00 H new ATOM 0 HE2 LYS A 117 23.246 0.314 -7.232 1.00 0.00 H new ATOM 0 HE3 LYS A 117 22.647 0.508 -5.597 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 21.022 0.914 -7.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 21.101 2.118 -6.275 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 21.857 2.360 -7.776 1.00 0.00 H new ATOM 1905 N THR A 118 26.177 4.346 -3.406 1.00 0.00 N ATOM 1906 CA THR A 118 26.648 5.609 -2.851 1.00 0.00 C ATOM 1907 C THR A 118 25.509 6.616 -2.733 1.00 0.00 C ATOM 1908 O THR A 118 24.986 7.094 -3.739 1.00 0.00 O ATOM 1909 CB THR A 118 27.769 6.219 -3.713 1.00 0.00 C ATOM 1910 OG1 THR A 118 28.706 5.202 -4.088 1.00 0.00 O ATOM 1911 CG2 THR A 118 28.490 7.326 -2.959 1.00 0.00 C ATOM 0 H THR A 118 26.246 4.280 -4.422 1.00 0.00 H new ATOM 0 HA THR A 118 27.042 5.390 -1.858 1.00 0.00 H new ATOM 0 HB THR A 118 27.318 6.646 -4.609 1.00 0.00 H new ATOM 0 HG1 THR A 118 29.415 5.597 -4.637 1.00 0.00 H new ATOM 0 HG21 THR A 118 29.277 7.742 -3.588 1.00 0.00 H new ATOM 0 HG22 THR A 118 27.780 8.112 -2.700 1.00 0.00 H new ATOM 0 HG23 THR A 118 28.930 6.919 -2.048 1.00 0.00 H new ATOM 1919 N GLN A 119 25.131 6.933 -1.499 1.00 0.00 N ATOM 1920 CA GLN A 119 24.054 7.884 -1.251 1.00 0.00 C ATOM 1921 C GLN A 119 24.193 8.517 0.130 1.00 0.00 C ATOM 1922 O GLN A 119 23.955 7.868 1.149 1.00 0.00 O ATOM 1923 CB GLN A 119 22.696 7.191 -1.374 1.00 0.00 C ATOM 1924 CG GLN A 119 21.565 8.132 -1.756 1.00 0.00 C ATOM 1925 CD GLN A 119 20.206 7.616 -1.328 1.00 0.00 C ATOM 1926 OE1 GLN A 119 20.090 6.872 -0.354 1.00 0.00 O ATOM 1927 NE2 GLN A 119 19.166 8.009 -2.055 1.00 0.00 N ATOM 0 H GLN A 119 25.554 6.545 -0.656 1.00 0.00 H new ATOM 0 HA GLN A 119 24.120 8.673 -2.000 1.00 0.00 H new ATOM 0 HB2 GLN A 119 22.767 6.400 -2.121 1.00 0.00 H new ATOM 0 HB3 GLN A 119 22.454 6.712 -0.425 1.00 0.00 H new ATOM 0 HG2 GLN A 119 21.739 9.107 -1.300 1.00 0.00 H new ATOM 0 HG3 GLN A 119 21.570 8.280 -2.836 1.00 0.00 H new ATOM 0 HE21 GLN A 119 19.307 8.626 -2.855 1.00 0.00 H new ATOM 0 HE22 GLN A 119 18.227 7.693 -1.814 1.00 0.00 H new ATOM 1936 N LYS A 120 24.580 9.787 0.157 1.00 0.00 N ATOM 1937 CA LYS A 120 24.750 10.509 1.412 1.00 0.00 C ATOM 1938 C LYS A 120 23.836 11.730 1.466 1.00 0.00 C ATOM 1939 O LYS A 120 24.288 12.875 1.435 1.00 0.00 O ATOM 1940 CB LYS A 120 26.208 10.943 1.581 1.00 0.00 C ATOM 1941 CG LYS A 120 26.810 11.554 0.328 1.00 0.00 C ATOM 1942 CD LYS A 120 28.101 12.295 0.634 1.00 0.00 C ATOM 1943 CE LYS A 120 29.279 11.340 0.745 1.00 0.00 C ATOM 1944 NZ LYS A 120 29.684 10.801 -0.583 1.00 0.00 N ATOM 0 H LYS A 120 24.782 10.338 -0.677 1.00 0.00 H new ATOM 0 HA LYS A 120 24.480 9.838 2.227 1.00 0.00 H new ATOM 0 HB2 LYS A 120 26.271 11.666 2.394 1.00 0.00 H new ATOM 0 HB3 LYS A 120 26.804 10.079 1.876 1.00 0.00 H new ATOM 0 HG2 LYS A 120 27.004 10.769 -0.403 1.00 0.00 H new ATOM 0 HG3 LYS A 120 26.094 12.240 -0.124 1.00 0.00 H new ATOM 0 HD2 LYS A 120 28.297 13.026 -0.150 1.00 0.00 H new ATOM 0 HD3 LYS A 120 27.991 12.849 1.566 1.00 0.00 H new ATOM 0 HE2 LYS A 120 30.124 11.857 1.200 1.00 0.00 H new ATOM 0 HE3 LYS A 120 29.016 10.515 1.407 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 30.633 10.381 -0.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 29.005 10.073 -0.884 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 29.697 11.572 -1.281 1.00 0.00 H new ATOM 1958 N PRO A 121 22.521 11.482 1.550 1.00 0.00 N ATOM 1959 CA PRO A 121 21.517 12.548 1.613 1.00 0.00 C ATOM 1960 C PRO A 121 21.558 13.307 2.935 1.00 0.00 C ATOM 1961 O PRO A 121 22.455 13.100 3.753 1.00 0.00 O ATOM 1962 CB PRO A 121 20.191 11.796 1.469 1.00 0.00 C ATOM 1963 CG PRO A 121 20.481 10.420 1.961 1.00 0.00 C ATOM 1964 CD PRO A 121 21.912 10.142 1.592 1.00 0.00 C ATOM 0 HA PRO A 121 21.679 13.305 0.846 1.00 0.00 H new ATOM 0 HB2 PRO A 121 19.402 12.268 2.055 1.00 0.00 H new ATOM 0 HB3 PRO A 121 19.854 11.783 0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 121 20.336 10.352 3.039 1.00 0.00 H new ATOM 0 HG3 PRO A 121 19.811 9.692 1.503 1.00 0.00 H new ATOM 0 HD2 PRO A 121 22.399 9.502 2.328 1.00 0.00 H new ATOM 0 HD3 PRO A 121 21.988 9.636 0.629 1.00 0.00 H new ATOM 1972 N LEU A 122 20.583 14.186 3.138 1.00 0.00 N ATOM 1973 CA LEU A 122 20.508 14.976 4.362 1.00 0.00 C ATOM 1974 C LEU A 122 19.095 14.960 4.935 1.00 0.00 C ATOM 1975 O LEU A 122 18.205 15.652 4.439 1.00 0.00 O ATOM 1976 CB LEU A 122 20.943 16.417 4.090 1.00 0.00 C ATOM 1977 CG LEU A 122 21.411 17.218 5.305 1.00 0.00 C ATOM 1978 CD1 LEU A 122 22.269 18.396 4.871 1.00 0.00 C ATOM 1979 CD2 LEU A 122 20.217 17.698 6.119 1.00 0.00 C ATOM 0 H LEU A 122 19.833 14.370 2.471 1.00 0.00 H new ATOM 0 HA LEU A 122 21.182 14.531 5.094 1.00 0.00 H new ATOM 0 HB2 LEU A 122 21.751 16.399 3.359 1.00 0.00 H new ATOM 0 HB3 LEU A 122 20.108 16.947 3.630 1.00 0.00 H new ATOM 0 HG LEU A 122 22.017 16.566 5.934 1.00 0.00 H new ATOM 0 HD11 LEU A 122 22.592 18.954 5.750 1.00 0.00 H new ATOM 0 HD12 LEU A 122 23.143 18.031 4.331 1.00 0.00 H new ATOM 0 HD13 LEU A 122 21.688 19.049 4.220 1.00 0.00 H new ATOM 0 HD21 LEU A 122 20.569 18.266 6.980 1.00 0.00 H new ATOM 0 HD22 LEU A 122 19.585 18.333 5.498 1.00 0.00 H new ATOM 0 HD23 LEU A 122 19.641 16.838 6.462 1.00 0.00 H new ATOM 1991 N ILE A 123 18.896 14.166 5.982 1.00 0.00 N ATOM 1992 CA ILE A 123 17.591 14.062 6.624 1.00 0.00 C ATOM 1993 C ILE A 123 17.727 14.022 8.142 1.00 0.00 C ATOM 1994 O ILE A 123 18.385 13.139 8.692 1.00 0.00 O ATOM 1995 CB ILE A 123 16.831 12.807 6.155 1.00 0.00 C ATOM 1996 CG1 ILE A 123 16.727 12.788 4.628 1.00 0.00 C ATOM 1997 CG2 ILE A 123 15.447 12.760 6.786 1.00 0.00 C ATOM 1998 CD1 ILE A 123 16.010 11.572 4.087 1.00 0.00 C ATOM 0 H ILE A 123 19.621 13.586 6.404 1.00 0.00 H new ATOM 0 HA ILE A 123 17.026 14.948 6.335 1.00 0.00 H new ATOM 0 HB ILE A 123 17.385 11.924 6.474 1.00 0.00 H new ATOM 0 HG12 ILE A 123 16.205 13.685 4.296 1.00 0.00 H new ATOM 0 HG13 ILE A 123 17.730 12.827 4.203 1.00 0.00 H new ATOM 0 HG21 ILE A 123 14.922 11.868 6.445 1.00 0.00 H new ATOM 0 HG22 ILE A 123 15.543 12.732 7.871 1.00 0.00 H new ATOM 0 HG23 ILE A 123 14.884 13.646 6.494 1.00 0.00 H new ATOM 0 HD11 ILE A 123 15.973 11.625 2.999 1.00 0.00 H new ATOM 0 HD12 ILE A 123 16.544 10.671 4.388 1.00 0.00 H new ATOM 0 HD13 ILE A 123 14.995 11.542 4.483 1.00 0.00 H new ATOM 2010 N GLN A 124 17.100 14.983 8.813 1.00 0.00 N ATOM 2011 CA GLN A 124 17.151 15.057 10.268 1.00 0.00 C ATOM 2012 C GLN A 124 15.862 15.647 10.829 1.00 0.00 C ATOM 2013 O GLN A 124 15.571 16.826 10.631 1.00 0.00 O ATOM 2014 CB GLN A 124 18.348 15.898 10.715 1.00 0.00 C ATOM 2015 CG GLN A 124 18.586 15.868 12.217 1.00 0.00 C ATOM 2016 CD GLN A 124 19.818 16.649 12.628 1.00 0.00 C ATOM 2017 OE1 GLN A 124 19.972 17.819 12.277 1.00 0.00 O ATOM 2018 NE2 GLN A 124 20.705 16.004 13.377 1.00 0.00 N ATOM 0 H GLN A 124 16.551 15.721 8.372 1.00 0.00 H new ATOM 0 HA GLN A 124 17.263 14.044 10.654 1.00 0.00 H new ATOM 0 HB2 GLN A 124 19.243 15.540 10.206 1.00 0.00 H new ATOM 0 HB3 GLN A 124 18.194 16.930 10.400 1.00 0.00 H new ATOM 0 HG2 GLN A 124 17.714 16.277 12.727 1.00 0.00 H new ATOM 0 HG3 GLN A 124 18.690 14.833 12.544 1.00 0.00 H new ATOM 0 HE21 GLN A 124 20.537 15.034 13.645 1.00 0.00 H new ATOM 0 HE22 GLN A 124 21.554 16.478 13.684 1.00 0.00 H new ATOM 2027 N GLU A 125 15.092 14.818 11.528 1.00 0.00 N ATOM 2028 CA GLU A 125 13.833 15.259 12.116 1.00 0.00 C ATOM 2029 C GLU A 125 13.460 14.394 13.316 1.00 0.00 C ATOM 2030 O GLU A 125 14.039 13.329 13.531 1.00 0.00 O ATOM 2031 CB GLU A 125 12.714 15.213 11.073 1.00 0.00 C ATOM 2032 CG GLU A 125 11.621 16.242 11.307 1.00 0.00 C ATOM 2033 CD GLU A 125 10.956 16.690 10.020 1.00 0.00 C ATOM 2034 OE1 GLU A 125 10.846 15.865 9.090 1.00 0.00 O ATOM 2035 OE2 GLU A 125 10.545 17.867 9.944 1.00 0.00 O ATOM 0 H GLU A 125 15.318 13.838 11.700 1.00 0.00 H new ATOM 0 HA GLU A 125 13.961 16.286 12.457 1.00 0.00 H new ATOM 0 HB2 GLU A 125 13.144 15.371 10.084 1.00 0.00 H new ATOM 0 HB3 GLU A 125 12.270 14.218 11.072 1.00 0.00 H new ATOM 0 HG2 GLU A 125 10.868 15.821 11.973 1.00 0.00 H new ATOM 0 HG3 GLU A 125 12.046 17.109 11.813 1.00 0.00 H new ATOM 2042 N VAL A 126 12.490 14.860 14.096 1.00 0.00 N ATOM 2043 CA VAL A 126 12.039 14.130 15.274 1.00 0.00 C ATOM 2044 C VAL A 126 10.564 13.762 15.162 1.00 0.00 C ATOM 2045 O VAL A 126 9.688 14.602 15.362 1.00 0.00 O ATOM 2046 CB VAL A 126 12.255 14.950 16.560 1.00 0.00 C ATOM 2047 CG1 VAL A 126 11.821 14.154 17.781 1.00 0.00 C ATOM 2048 CG2 VAL A 126 13.711 15.376 16.681 1.00 0.00 C ATOM 0 H VAL A 126 12.001 15.740 13.933 1.00 0.00 H new ATOM 0 HA VAL A 126 12.635 13.219 15.328 1.00 0.00 H new ATOM 0 HB VAL A 126 11.640 15.848 16.505 1.00 0.00 H new ATOM 0 HG11 VAL A 126 11.981 14.750 18.680 1.00 0.00 H new ATOM 0 HG12 VAL A 126 10.764 13.904 17.695 1.00 0.00 H new ATOM 0 HG13 VAL A 126 12.407 13.237 17.845 1.00 0.00 H new ATOM 0 HG21 VAL A 126 13.846 15.954 17.595 1.00 0.00 H new ATOM 0 HG22 VAL A 126 14.347 14.492 16.714 1.00 0.00 H new ATOM 0 HG23 VAL A 126 13.984 15.988 15.821 1.00 0.00 H new ATOM 2058 N GLU A 127 10.297 12.499 14.841 1.00 0.00 N ATOM 2059 CA GLU A 127 8.927 12.021 14.701 1.00 0.00 C ATOM 2060 C GLU A 127 8.755 10.661 15.372 1.00 0.00 C ATOM 2061 O GLU A 127 9.733 9.985 15.693 1.00 0.00 O ATOM 2062 CB GLU A 127 8.545 11.924 13.222 1.00 0.00 C ATOM 2063 CG GLU A 127 7.047 11.987 12.975 1.00 0.00 C ATOM 2064 CD GLU A 127 6.705 12.179 11.511 1.00 0.00 C ATOM 2065 OE1 GLU A 127 7.113 13.210 10.936 1.00 0.00 O ATOM 2066 OE2 GLU A 127 6.029 11.298 10.939 1.00 0.00 O ATOM 0 H GLU A 127 11.011 11.790 14.673 1.00 0.00 H new ATOM 0 HA GLU A 127 8.268 12.736 15.193 1.00 0.00 H new ATOM 0 HB2 GLU A 127 9.029 12.734 12.677 1.00 0.00 H new ATOM 0 HB3 GLU A 127 8.933 10.990 12.816 1.00 0.00 H new ATOM 0 HG2 GLU A 127 6.584 11.068 13.335 1.00 0.00 H new ATOM 0 HG3 GLU A 127 6.621 12.806 13.554 1.00 0.00 H new ATOM 2073 N THR A 128 7.503 10.266 15.583 1.00 0.00 N ATOM 2074 CA THR A 128 7.201 8.989 16.217 1.00 0.00 C ATOM 2075 C THR A 128 5.787 8.529 15.881 1.00 0.00 C ATOM 2076 O THR A 128 4.915 9.343 15.578 1.00 0.00 O ATOM 2077 CB THR A 128 7.351 9.072 17.748 1.00 0.00 C ATOM 2078 OG1 THR A 128 8.420 9.963 18.087 1.00 0.00 O ATOM 2079 CG2 THR A 128 7.622 7.698 18.341 1.00 0.00 C ATOM 0 H THR A 128 6.682 10.813 15.324 1.00 0.00 H new ATOM 0 HA THR A 128 7.918 8.266 15.828 1.00 0.00 H new ATOM 0 HB THR A 128 6.417 9.451 18.163 1.00 0.00 H new ATOM 0 HG1 THR A 128 8.508 10.012 19.062 1.00 0.00 H new ATOM 0 HG21 THR A 128 7.724 7.782 19.423 1.00 0.00 H new ATOM 0 HG22 THR A 128 6.793 7.030 18.106 1.00 0.00 H new ATOM 0 HG23 THR A 128 8.543 7.295 17.920 1.00 0.00 H new ATOM 2087 N ASP A 129 5.567 7.220 15.938 1.00 0.00 N ATOM 2088 CA ASP A 129 4.257 6.651 15.641 1.00 0.00 C ATOM 2089 C ASP A 129 3.695 5.919 16.855 1.00 0.00 C ATOM 2090 O ASP A 129 4.420 5.619 17.802 1.00 0.00 O ATOM 2091 CB ASP A 129 4.351 5.695 14.451 1.00 0.00 C ATOM 2092 CG ASP A 129 4.827 6.386 13.188 1.00 0.00 C ATOM 2093 OD1 ASP A 129 4.776 7.633 13.140 1.00 0.00 O ATOM 2094 OD2 ASP A 129 5.248 5.681 12.248 1.00 0.00 O ATOM 0 H ASP A 129 6.279 6.533 16.187 1.00 0.00 H new ATOM 0 HA ASP A 129 3.582 7.468 15.388 1.00 0.00 H new ATOM 0 HB2 ASP A 129 5.034 4.881 14.696 1.00 0.00 H new ATOM 0 HB3 ASP A 129 3.374 5.248 14.270 1.00 0.00 H new ATOM 2099 N GLY A 130 2.397 5.634 16.819 1.00 0.00 N ATOM 2100 CA GLY A 130 1.759 4.940 17.923 1.00 0.00 C ATOM 2101 C GLY A 130 0.856 3.815 17.456 1.00 0.00 C ATOM 2102 O GLY A 130 1.077 3.232 16.395 1.00 0.00 O ATOM 0 H GLY A 130 1.776 5.871 16.045 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.525 4.536 18.585 1.00 0.00 H new ATOM 0 HA3 GLY A 130 1.175 5.652 18.507 1.00 0.00 H new ATOM 2106 N VAL A 131 -0.163 3.508 18.252 1.00 0.00 N ATOM 2107 CA VAL A 131 -1.102 2.444 17.915 1.00 0.00 C ATOM 2108 C VAL A 131 -2.512 2.788 18.381 1.00 0.00 C ATOM 2109 O VAL A 131 -2.709 3.267 19.497 1.00 0.00 O ATOM 2110 CB VAL A 131 -0.679 1.103 18.543 1.00 0.00 C ATOM 2111 CG1 VAL A 131 -0.634 1.213 20.059 1.00 0.00 C ATOM 2112 CG2 VAL A 131 -1.622 -0.009 18.108 1.00 0.00 C ATOM 0 H VAL A 131 -0.360 3.981 19.134 1.00 0.00 H new ATOM 0 HA VAL A 131 -1.094 2.347 16.829 1.00 0.00 H new ATOM 0 HB VAL A 131 0.323 0.857 18.192 1.00 0.00 H new ATOM 0 HG11 VAL A 131 -0.333 0.256 20.484 1.00 0.00 H new ATOM 0 HG12 VAL A 131 0.085 1.980 20.347 1.00 0.00 H new ATOM 0 HG13 VAL A 131 -1.621 1.482 20.434 1.00 0.00 H new ATOM 0 HG21 VAL A 131 -1.309 -0.950 18.561 1.00 0.00 H new ATOM 0 HG22 VAL A 131 -2.636 0.228 18.429 1.00 0.00 H new ATOM 0 HG23 VAL A 131 -1.597 -0.103 17.022 1.00 0.00 H new ATOM 2122 N SER A 132 -3.492 2.540 17.517 1.00 0.00 N ATOM 2123 CA SER A 132 -4.885 2.827 17.838 1.00 0.00 C ATOM 2124 C SER A 132 -5.655 1.539 18.112 1.00 0.00 C ATOM 2125 O SER A 132 -5.132 0.440 17.933 1.00 0.00 O ATOM 2126 CB SER A 132 -5.546 3.597 16.693 1.00 0.00 C ATOM 2127 OG SER A 132 -4.645 4.526 16.116 1.00 0.00 O ATOM 0 H SER A 132 -3.347 2.141 16.590 1.00 0.00 H new ATOM 0 HA SER A 132 -4.906 3.441 18.738 1.00 0.00 H new ATOM 0 HB2 SER A 132 -5.890 2.898 15.931 1.00 0.00 H new ATOM 0 HB3 SER A 132 -6.426 4.122 17.064 1.00 0.00 H new ATOM 0 HG SER A 132 -5.091 5.004 15.386 1.00 0.00 H new ATOM 2133 N ASN A 133 -6.903 1.684 18.547 1.00 0.00 N ATOM 2134 CA ASN A 133 -7.747 0.533 18.846 1.00 0.00 C ATOM 2135 C ASN A 133 -9.027 0.567 18.017 1.00 0.00 C ATOM 2136 O ASN A 133 -9.417 1.613 17.501 1.00 0.00 O ATOM 2137 CB ASN A 133 -8.092 0.501 20.336 1.00 0.00 C ATOM 2138 CG ASN A 133 -8.735 1.790 20.809 1.00 0.00 C ATOM 2139 OD1 ASN A 133 -9.853 2.121 20.414 1.00 0.00 O ATOM 2140 ND2 ASN A 133 -8.029 2.526 21.659 1.00 0.00 N ATOM 0 H ASN A 133 -7.352 2.587 18.700 1.00 0.00 H new ATOM 0 HA ASN A 133 -7.192 -0.369 18.589 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -8.767 -0.332 20.532 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -7.185 0.318 20.912 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -8.410 3.404 22.011 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -7.106 2.213 21.960 1.00 0.00 H new ATOM 2147 N ASN A 134 -9.677 -0.586 17.895 1.00 0.00 N ATOM 2148 CA ASN A 134 -10.914 -0.689 17.129 1.00 0.00 C ATOM 2149 C ASN A 134 -10.727 -0.138 15.718 1.00 0.00 C ATOM 2150 O ASN A 134 -11.605 0.541 15.186 1.00 0.00 O ATOM 2151 CB ASN A 134 -12.041 0.065 17.837 1.00 0.00 C ATOM 2152 CG ASN A 134 -12.370 -0.528 19.194 1.00 0.00 C ATOM 2153 OD1 ASN A 134 -11.500 -0.657 20.055 1.00 0.00 O ATOM 2154 ND2 ASN A 134 -13.632 -0.894 19.389 1.00 0.00 N ATOM 0 H ASN A 134 -9.368 -1.462 18.317 1.00 0.00 H new ATOM 0 HA ASN A 134 -11.181 -1.743 17.057 1.00 0.00 H new ATOM 0 HB2 ASN A 134 -11.755 1.110 17.960 1.00 0.00 H new ATOM 0 HB3 ASN A 134 -12.933 0.051 17.211 1.00 0.00 H new ATOM 0 HD21 ASN A 134 -13.913 -1.301 20.281 1.00 0.00 H new ATOM 0 HD22 ASN A 134 -14.320 -0.768 18.647 1.00 0.00 H new TER 2161 ASN A 134