USER MOD reduce.3.24.130724 H: found=0, std=0, add=839, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 840 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 Single : A 22 GLN : amide:sc= -0.293 K(o=-0.29,f=-2.7!) USER MOD Single : A 23 MET CE :methyl 165:sc= -0.0384 (180deg=-0.357) USER MOD Single : A 26 ASN : amide:sc= -0.736 X(o=-0.74,f=-0.3) USER MOD Single : A 27 GLN :FLIP amide:sc= -0.0475 F(o=-1.3!,f=-0.048) USER MOD Single : A 32 THR OG1 : rot -76:sc= 1.26 USER MOD Single : A 35 GLN : amide:sc= 0.679 K(o=0.68,f=-3!) USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= -0.303 X(o=-0.3,f=-0.13) USER MOD Single : A 45 LYS NZ :NH3+ -166:sc= -0.0325 (180deg=-0.222) USER MOD Single : A 47 SER OG : rot 82:sc= 0.296 USER MOD Single : A 48 ASN : amide:sc= -0.07 X(o=-0.07,f=-0.062) USER MOD Single : A 52 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 GLN : amide:sc= -0.41 X(o=-0.41,f=-0.092) USER MOD Single : A 56 SER OG : rot 77:sc= 0.275 USER MOD Single : A 59 THR OG1 : rot -78:sc= 0.525 USER MOD Single : A 64 LYS NZ :NH3+ -156:sc= -0.0489 (180deg=-0.488) USER MOD Single : A 67 SER OG : rot 163:sc= 0.758 USER MOD Single : A 68 GLN : amide:sc= -0.141 K(o=-0.14,f=-2.9!) USER MOD Single : A 70 THR OG1 : rot 180:sc= -0.029 USER MOD Single : A 73 THR OG1 : rot 180:sc= 0.0316 USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot -49:sc= 0.476 USER MOD Single : A 84 ASN :FLIP amide:sc=-0.00614 F(o=-1.8!,f=-0.0061) USER MOD Single : A 85 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 LYS NZ :NH3+ -159:sc= 0.834 (180deg=0.6) USER MOD Single : A 95 THR OG1 : rot 43:sc= 0.193 USER MOD Single : A 96 HIS : no HE2:sc= 0.147 K(o=0.15,f=-0.56) USER MOD Single : A 98 ASN : amide:sc= -0.108 X(o=-0.11,f=-0.11) USER MOD Single : A 99 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000718) USER MOD Single : A 103 GLN :FLIP amide:sc= -1.68 F(o=-2.3!,f=-1.7) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 113 SER OG : rot -74:sc= 0.204 USER MOD Single : A 115 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00454) USER MOD Single : A 117 GLN :FLIP amide:sc= -0.0342 F(o=-1.3!,f=-0.034) USER MOD Single : A 124 ASN : amide:sc=-0.00444 X(o=-0.0044,f=-0.4) USER MOD Single : A 126 MET CE :methyl -114:sc= -0.511 (180deg=-0.675) USER MOD Single : A 127 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 130 THR OG1 : rot 180:sc= 0 USER MOD Single : A 131 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN A 22 3.138 -1.537 -0.044 1.00 0.00 N ATOM 2 CA GLN A 22 2.924 -0.717 -1.259 1.00 0.00 C ATOM 3 C GLN A 22 1.992 -1.466 -2.246 1.00 0.00 C ATOM 4 O GLN A 22 1.940 -1.124 -3.428 1.00 0.00 O ATOM 5 CB GLN A 22 4.308 -0.376 -1.912 1.00 0.00 C ATOM 6 CG GLN A 22 4.313 0.856 -2.841 1.00 0.00 C ATOM 7 CD GLN A 22 4.009 2.160 -2.093 1.00 0.00 C ATOM 8 OE1 GLN A 22 2.853 2.542 -1.929 1.00 0.00 O ATOM 9 NE2 GLN A 22 5.038 2.847 -1.628 1.00 0.00 N ATOM 0 HA GLN A 22 2.436 0.221 -0.992 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.036 -0.214 -1.117 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.645 -1.242 -2.482 1.00 0.00 H new ATOM 0 HG2 GLN A 22 5.286 0.938 -3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 22 3.575 0.714 -3.631 1.00 0.00 H new ATOM 0 HE21 GLN A 22 5.988 2.507 -1.778 1.00 0.00 H new ATOM 0 HE22 GLN A 22 4.882 3.717 -1.119 1.00 0.00 H new ATOM 18 N MET A 23 1.199 -2.432 -1.713 1.00 0.00 N ATOM 19 CA MET A 23 0.488 -3.466 -2.505 1.00 0.00 C ATOM 20 C MET A 23 -0.374 -2.875 -3.647 1.00 0.00 C ATOM 21 O MET A 23 -0.143 -3.191 -4.810 1.00 0.00 O ATOM 22 CB MET A 23 -0.393 -4.329 -1.564 1.00 0.00 C ATOM 23 CG MET A 23 -1.140 -5.485 -2.254 1.00 0.00 C ATOM 24 SD MET A 23 -0.031 -6.705 -3.000 1.00 0.00 S ATOM 25 CE MET A 23 0.817 -7.354 -1.558 1.00 0.00 C ATOM 0 H MET A 23 1.035 -2.514 -0.710 1.00 0.00 H new ATOM 0 HA MET A 23 1.251 -4.083 -2.981 1.00 0.00 H new ATOM 0 HB2 MET A 23 0.238 -4.742 -0.777 1.00 0.00 H new ATOM 0 HB3 MET A 23 -1.124 -3.681 -1.079 1.00 0.00 H new ATOM 0 HG2 MET A 23 -1.779 -5.983 -1.525 1.00 0.00 H new ATOM 0 HG3 MET A 23 -1.793 -5.078 -3.025 1.00 0.00 H new ATOM 0 HE1 MET A 23 1.326 -8.281 -1.822 1.00 0.00 H new ATOM 0 HE2 MET A 23 1.549 -6.626 -1.208 1.00 0.00 H new ATOM 0 HE3 MET A 23 0.093 -7.550 -0.767 1.00 0.00 H new ATOM 35 N LEU A 24 -1.336 -1.998 -3.292 1.00 0.00 N ATOM 36 CA LEU A 24 -2.289 -1.377 -4.257 1.00 0.00 C ATOM 37 C LEU A 24 -1.571 -0.562 -5.370 1.00 0.00 C ATOM 38 O LEU A 24 -2.007 -0.579 -6.533 1.00 0.00 O ATOM 39 CB LEU A 24 -3.344 -0.483 -3.521 1.00 0.00 C ATOM 40 CG LEU A 24 -2.814 0.776 -2.744 1.00 0.00 C ATOM 41 CD1 LEU A 24 -3.925 1.822 -2.532 1.00 0.00 C ATOM 42 CD2 LEU A 24 -2.159 0.410 -1.387 1.00 0.00 C ATOM 0 H LEU A 24 -1.480 -1.695 -2.329 1.00 0.00 H new ATOM 0 HA LEU A 24 -2.808 -2.202 -4.745 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -4.069 -0.141 -4.260 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -3.883 -1.113 -2.813 1.00 0.00 H new ATOM 0 HG LEU A 24 -2.040 1.212 -3.375 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.521 2.678 -1.991 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.305 2.150 -3.499 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.737 1.379 -1.955 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -1.811 1.318 -0.894 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -2.891 -0.090 -0.753 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -1.313 -0.256 -1.559 1.00 0.00 H new ATOM 54 N LEU A 25 -0.464 0.128 -5.001 1.00 0.00 N ATOM 55 CA LEU A 25 0.358 0.909 -5.954 1.00 0.00 C ATOM 56 C LEU A 25 1.046 -0.028 -6.958 1.00 0.00 C ATOM 57 O LEU A 25 1.006 0.216 -8.164 1.00 0.00 O ATOM 58 CB LEU A 25 1.433 1.777 -5.216 1.00 0.00 C ATOM 59 CG LEU A 25 0.956 3.121 -4.555 1.00 0.00 C ATOM 60 CD1 LEU A 25 0.327 4.070 -5.589 1.00 0.00 C ATOM 61 CD2 LEU A 25 0.010 2.893 -3.361 1.00 0.00 C ATOM 0 H LEU A 25 -0.119 0.158 -4.042 1.00 0.00 H new ATOM 0 HA LEU A 25 -0.312 1.584 -6.487 1.00 0.00 H new ATOM 0 HB2 LEU A 25 1.885 1.162 -4.438 1.00 0.00 H new ATOM 0 HB3 LEU A 25 2.221 2.015 -5.931 1.00 0.00 H new ATOM 0 HG LEU A 25 1.851 3.601 -4.160 1.00 0.00 H new ATOM 0 HD11 LEU A 25 0.010 4.988 -5.094 1.00 0.00 H new ATOM 0 HD12 LEU A 25 1.061 4.308 -6.359 1.00 0.00 H new ATOM 0 HD13 LEU A 25 -0.536 3.588 -6.048 1.00 0.00 H new ATOM 0 HD21 LEU A 25 -0.288 3.855 -2.944 1.00 0.00 H new ATOM 0 HD22 LEU A 25 -0.876 2.353 -3.696 1.00 0.00 H new ATOM 0 HD23 LEU A 25 0.523 2.309 -2.597 1.00 0.00 H new ATOM 73 N ASN A 26 1.649 -1.105 -6.423 1.00 0.00 N ATOM 74 CA ASN A 26 2.426 -2.088 -7.210 1.00 0.00 C ATOM 75 C ASN A 26 1.520 -2.847 -8.182 1.00 0.00 C ATOM 76 O ASN A 26 1.886 -3.057 -9.344 1.00 0.00 O ATOM 77 CB ASN A 26 3.142 -3.106 -6.284 1.00 0.00 C ATOM 78 CG ASN A 26 4.113 -2.481 -5.279 1.00 0.00 C ATOM 79 OD1 ASN A 26 4.657 -1.402 -5.503 1.00 0.00 O ATOM 80 ND2 ASN A 26 4.348 -3.163 -4.167 1.00 0.00 N ATOM 0 H ASN A 26 1.612 -1.322 -5.427 1.00 0.00 H new ATOM 0 HA ASN A 26 3.175 -1.531 -7.774 1.00 0.00 H new ATOM 0 HB2 ASN A 26 2.388 -3.672 -5.737 1.00 0.00 H new ATOM 0 HB3 ASN A 26 3.688 -3.818 -6.903 1.00 0.00 H new ATOM 0 HD21 ASN A 26 4.995 -2.795 -3.470 1.00 0.00 H new ATOM 0 HD22 ASN A 26 3.882 -4.056 -4.008 1.00 0.00 H new ATOM 87 N GLN A 27 0.332 -3.236 -7.677 1.00 0.00 N ATOM 88 CA GLN A 27 -0.662 -3.992 -8.438 1.00 0.00 C ATOM 89 C GLN A 27 -1.192 -3.173 -9.609 1.00 0.00 C ATOM 90 O GLN A 27 -1.149 -3.655 -10.741 1.00 0.00 O ATOM 91 CB GLN A 27 -1.821 -4.456 -7.542 1.00 0.00 C ATOM 92 CG GLN A 27 -1.453 -5.560 -6.525 1.00 0.00 C ATOM 93 CD GLN A 27 -2.661 -6.368 -6.055 1.00 0.00 C ATOM 94 OE1 GLN A 27 -3.609 -6.629 -6.959 1.00 0.00 O flip ATOM 95 NE2 GLN A 27 -2.720 -6.808 -4.909 1.00 0.00 N flip ATOM 0 H GLN A 27 0.041 -3.029 -6.722 1.00 0.00 H new ATOM 0 HA GLN A 27 -0.165 -4.878 -8.833 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -2.208 -3.595 -6.998 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -2.629 -4.821 -8.177 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -0.726 -6.234 -6.977 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -0.970 -5.104 -5.661 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -1.980 -6.591 -4.241 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -3.509 -7.390 -4.626 1.00 0.00 H new ATOM 104 N LEU A 28 -1.668 -1.926 -9.327 1.00 0.00 N ATOM 105 CA LEU A 28 -2.188 -1.026 -10.375 1.00 0.00 C ATOM 106 C LEU A 28 -1.112 -0.781 -11.450 1.00 0.00 C ATOM 107 O LEU A 28 -1.391 -0.906 -12.636 1.00 0.00 O ATOM 108 CB LEU A 28 -2.650 0.326 -9.785 1.00 0.00 C ATOM 109 CG LEU A 28 -3.481 1.193 -10.778 1.00 0.00 C ATOM 110 CD1 LEU A 28 -4.827 0.531 -11.086 1.00 0.00 C ATOM 111 CD2 LEU A 28 -3.677 2.618 -10.270 1.00 0.00 C ATOM 0 H LEU A 28 -1.698 -1.532 -8.387 1.00 0.00 H new ATOM 0 HA LEU A 28 -3.052 -1.513 -10.828 1.00 0.00 H new ATOM 0 HB2 LEU A 28 -3.248 0.138 -8.893 1.00 0.00 H new ATOM 0 HB3 LEU A 28 -1.774 0.892 -9.468 1.00 0.00 H new ATOM 0 HG LEU A 28 -2.910 1.259 -11.704 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -5.389 1.155 -11.781 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -4.657 -0.448 -11.533 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -5.395 0.414 -10.163 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -4.261 3.185 -10.994 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -4.204 2.595 -9.316 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -2.705 3.093 -10.136 1.00 0.00 H new ATOM 123 N ARG A 29 0.121 -0.475 -10.986 1.00 0.00 N ATOM 124 CA ARG A 29 1.316 -0.265 -11.843 1.00 0.00 C ATOM 125 C ARG A 29 1.561 -1.456 -12.780 1.00 0.00 C ATOM 126 O ARG A 29 1.928 -1.276 -13.947 1.00 0.00 O ATOM 127 CB ARG A 29 2.560 -0.052 -10.931 1.00 0.00 C ATOM 128 CG ARG A 29 3.922 0.055 -11.657 1.00 0.00 C ATOM 129 CD ARG A 29 5.096 0.320 -10.696 1.00 0.00 C ATOM 130 NE ARG A 29 6.393 0.222 -11.386 1.00 0.00 N ATOM 131 CZ ARG A 29 7.599 0.373 -10.810 1.00 0.00 C ATOM 132 NH1 ARG A 29 7.715 0.689 -9.526 1.00 0.00 N ATOM 133 NH2 ARG A 29 8.693 0.202 -11.532 1.00 0.00 N ATOM 0 H ARG A 29 0.319 -0.365 -9.992 1.00 0.00 H new ATOM 0 HA ARG A 29 1.143 0.613 -12.465 1.00 0.00 H new ATOM 0 HB2 ARG A 29 2.408 0.857 -10.349 1.00 0.00 H new ATOM 0 HB3 ARG A 29 2.612 -0.879 -10.222 1.00 0.00 H new ATOM 0 HG2 ARG A 29 4.109 -0.869 -12.205 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.873 0.858 -12.393 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.991 1.312 -10.257 1.00 0.00 H new ATOM 0 HD3 ARG A 29 5.064 -0.397 -9.876 1.00 0.00 H new ATOM 0 HE ARG A 29 6.375 0.023 -12.386 1.00 0.00 H new ATOM 0 HH11 ARG A 29 6.880 0.822 -8.956 1.00 0.00 H new ATOM 0 HH12 ARG A 29 8.640 0.799 -9.109 1.00 0.00 H new ATOM 0 HH21 ARG A 29 8.619 -0.043 -12.519 1.00 0.00 H new ATOM 0 HH22 ARG A 29 9.611 0.315 -11.102 1.00 0.00 H new ATOM 147 N GLU A 30 1.350 -2.664 -12.240 1.00 0.00 N ATOM 148 CA GLU A 30 1.591 -3.920 -12.950 1.00 0.00 C ATOM 149 C GLU A 30 0.512 -4.149 -14.034 1.00 0.00 C ATOM 150 O GLU A 30 0.820 -4.568 -15.154 1.00 0.00 O ATOM 151 CB GLU A 30 1.621 -5.109 -11.933 1.00 0.00 C ATOM 152 CG GLU A 30 2.497 -6.301 -12.368 1.00 0.00 C ATOM 153 CD GLU A 30 3.986 -5.912 -12.484 1.00 0.00 C ATOM 154 OE1 GLU A 30 4.638 -5.717 -11.435 1.00 0.00 O ATOM 155 OE2 GLU A 30 4.508 -5.781 -13.613 1.00 0.00 O ATOM 0 H GLU A 30 1.004 -2.794 -11.289 1.00 0.00 H new ATOM 0 HA GLU A 30 2.559 -3.864 -13.448 1.00 0.00 H new ATOM 0 HB2 GLU A 30 1.982 -4.740 -10.973 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.602 -5.462 -11.776 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.389 -7.112 -11.648 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.145 -6.678 -13.328 1.00 0.00 H new ATOM 162 N ILE A 31 -0.755 -3.822 -13.689 1.00 0.00 N ATOM 163 CA ILE A 31 -1.944 -4.129 -14.529 1.00 0.00 C ATOM 164 C ILE A 31 -2.409 -2.911 -15.372 1.00 0.00 C ATOM 165 O ILE A 31 -3.405 -3.004 -16.095 1.00 0.00 O ATOM 166 CB ILE A 31 -3.121 -4.701 -13.633 1.00 0.00 C ATOM 167 CG1 ILE A 31 -3.652 -3.636 -12.620 1.00 0.00 C ATOM 168 CG2 ILE A 31 -2.659 -5.987 -12.891 1.00 0.00 C ATOM 169 CD1 ILE A 31 -4.633 -4.162 -11.569 1.00 0.00 C ATOM 0 H ILE A 31 -0.985 -3.338 -12.821 1.00 0.00 H new ATOM 0 HA ILE A 31 -1.649 -4.897 -15.244 1.00 0.00 H new ATOM 0 HB ILE A 31 -3.948 -4.955 -14.296 1.00 0.00 H new ATOM 0 HG12 ILE A 31 -2.800 -3.191 -12.107 1.00 0.00 H new ATOM 0 HG13 ILE A 31 -4.139 -2.838 -13.180 1.00 0.00 H new ATOM 0 HG21 ILE A 31 -3.477 -6.368 -12.280 1.00 0.00 H new ATOM 0 HG22 ILE A 31 -2.368 -6.743 -13.620 1.00 0.00 H new ATOM 0 HG23 ILE A 31 -1.808 -5.752 -12.252 1.00 0.00 H new ATOM 0 HD11 ILE A 31 -4.940 -3.345 -10.917 1.00 0.00 H new ATOM 0 HD12 ILE A 31 -5.509 -4.579 -12.066 1.00 0.00 H new ATOM 0 HD13 ILE A 31 -4.149 -4.938 -10.975 1.00 0.00 H new ATOM 181 N THR A 32 -1.679 -1.774 -15.282 1.00 0.00 N ATOM 182 CA THR A 32 -1.851 -0.617 -16.203 1.00 0.00 C ATOM 183 C THR A 32 -0.594 -0.466 -17.076 1.00 0.00 C ATOM 184 O THR A 32 -0.676 -0.210 -18.283 1.00 0.00 O ATOM 185 CB THR A 32 -2.112 0.740 -15.447 1.00 0.00 C ATOM 186 OG1 THR A 32 -1.025 1.038 -14.546 1.00 0.00 O ATOM 187 CG2 THR A 32 -3.447 0.721 -14.674 1.00 0.00 C ATOM 0 H THR A 32 -0.958 -1.630 -14.575 1.00 0.00 H new ATOM 0 HA THR A 32 -2.731 -0.826 -16.812 1.00 0.00 H new ATOM 0 HB THR A 32 -2.175 1.522 -16.204 1.00 0.00 H new ATOM 0 HG1 THR A 32 -1.093 0.469 -13.751 1.00 0.00 H new ATOM 0 HG21 THR A 32 -3.588 1.676 -14.167 1.00 0.00 H new ATOM 0 HG22 THR A 32 -4.269 0.556 -15.371 1.00 0.00 H new ATOM 0 HG23 THR A 32 -3.429 -0.082 -13.937 1.00 0.00 H new ATOM 195 N GLY A 33 0.564 -0.621 -16.424 1.00 0.00 N ATOM 196 CA GLY A 33 1.878 -0.469 -17.060 1.00 0.00 C ATOM 197 C GLY A 33 2.570 0.813 -16.618 1.00 0.00 C ATOM 198 O GLY A 33 3.774 0.981 -16.838 1.00 0.00 O ATOM 0 H GLY A 33 0.616 -0.857 -15.433 1.00 0.00 H new ATOM 0 HA2 GLY A 33 2.504 -1.326 -16.811 1.00 0.00 H new ATOM 0 HA3 GLY A 33 1.760 -0.464 -18.144 1.00 0.00 H new ATOM 202 N ILE A 34 1.792 1.715 -15.983 1.00 0.00 N ATOM 203 CA ILE A 34 2.254 3.047 -15.565 1.00 0.00 C ATOM 204 C ILE A 34 3.154 2.935 -14.321 1.00 0.00 C ATOM 205 O ILE A 34 2.681 2.608 -13.227 1.00 0.00 O ATOM 206 CB ILE A 34 1.033 3.999 -15.273 1.00 0.00 C ATOM 207 CG1 ILE A 34 0.110 4.088 -16.534 1.00 0.00 C ATOM 208 CG2 ILE A 34 1.504 5.410 -14.817 1.00 0.00 C ATOM 209 CD1 ILE A 34 -1.187 4.840 -16.321 1.00 0.00 C ATOM 0 H ILE A 34 0.817 1.533 -15.746 1.00 0.00 H new ATOM 0 HA ILE A 34 2.834 3.478 -16.381 1.00 0.00 H new ATOM 0 HB ILE A 34 0.458 3.575 -14.450 1.00 0.00 H new ATOM 0 HG12 ILE A 34 0.665 4.570 -17.339 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -0.123 3.077 -16.868 1.00 0.00 H new ATOM 0 HG21 ILE A 34 0.635 6.039 -14.625 1.00 0.00 H new ATOM 0 HG22 ILE A 34 2.095 5.319 -13.906 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.112 5.861 -15.601 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -1.759 4.849 -17.249 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -1.769 4.349 -15.541 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -0.968 5.864 -16.020 1.00 0.00 H new ATOM 221 N GLN A 35 4.457 3.200 -14.527 1.00 0.00 N ATOM 222 CA GLN A 35 5.486 3.143 -13.476 1.00 0.00 C ATOM 223 C GLN A 35 5.335 4.314 -12.485 1.00 0.00 C ATOM 224 O GLN A 35 5.624 4.152 -11.298 1.00 0.00 O ATOM 225 CB GLN A 35 6.903 3.163 -14.121 1.00 0.00 C ATOM 226 CG GLN A 35 7.129 2.114 -15.233 1.00 0.00 C ATOM 227 CD GLN A 35 7.023 0.664 -14.752 1.00 0.00 C ATOM 228 OE1 GLN A 35 8.011 0.067 -14.336 1.00 0.00 O ATOM 229 NE2 GLN A 35 5.829 0.087 -14.805 1.00 0.00 N ATOM 0 H GLN A 35 4.828 3.463 -15.440 1.00 0.00 H new ATOM 0 HA GLN A 35 5.357 2.214 -12.920 1.00 0.00 H new ATOM 0 HB2 GLN A 35 7.083 4.155 -14.536 1.00 0.00 H new ATOM 0 HB3 GLN A 35 7.645 3.006 -13.338 1.00 0.00 H new ATOM 0 HG2 GLN A 35 6.399 2.277 -16.026 1.00 0.00 H new ATOM 0 HG3 GLN A 35 8.115 2.270 -15.670 1.00 0.00 H new ATOM 0 HE21 GLN A 35 5.026 0.609 -15.156 1.00 0.00 H new ATOM 0 HE22 GLN A 35 5.715 -0.878 -14.495 1.00 0.00 H new ATOM 238 N ASP A 36 4.871 5.480 -12.996 1.00 0.00 N ATOM 239 CA ASP A 36 4.733 6.725 -12.206 1.00 0.00 C ATOM 240 C ASP A 36 3.695 6.566 -11.075 1.00 0.00 C ATOM 241 O ASP A 36 2.505 6.391 -11.370 1.00 0.00 O ATOM 242 CB ASP A 36 4.332 7.919 -13.117 1.00 0.00 C ATOM 243 CG ASP A 36 5.440 8.293 -14.118 1.00 0.00 C ATOM 244 OD1 ASP A 36 6.423 8.950 -13.713 1.00 0.00 O ATOM 245 OD2 ASP A 36 5.345 7.917 -15.307 1.00 0.00 O ATOM 0 H ASP A 36 4.582 5.583 -13.969 1.00 0.00 H new ATOM 0 HA ASP A 36 5.705 6.929 -11.757 1.00 0.00 H new ATOM 0 HB2 ASP A 36 3.423 7.666 -13.663 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.100 8.784 -12.496 1.00 0.00 H new ATOM 250 N PRO A 37 4.127 6.650 -9.755 1.00 0.00 N ATOM 251 CA PRO A 37 3.219 6.511 -8.579 1.00 0.00 C ATOM 252 C PRO A 37 2.141 7.609 -8.519 1.00 0.00 C ATOM 253 O PRO A 37 1.091 7.398 -7.901 1.00 0.00 O ATOM 254 CB PRO A 37 4.182 6.579 -7.354 1.00 0.00 C ATOM 255 CG PRO A 37 5.375 7.327 -7.869 1.00 0.00 C ATOM 256 CD PRO A 37 5.531 6.893 -9.311 1.00 0.00 C ATOM 0 HA PRO A 37 2.646 5.585 -8.619 1.00 0.00 H new ATOM 0 HB2 PRO A 37 3.721 7.095 -6.512 1.00 0.00 H new ATOM 0 HB3 PRO A 37 4.456 5.583 -7.006 1.00 0.00 H new ATOM 0 HG2 PRO A 37 5.224 8.404 -7.797 1.00 0.00 H new ATOM 0 HG3 PRO A 37 6.267 7.091 -7.289 1.00 0.00 H new ATOM 0 HD2 PRO A 37 6.014 7.663 -9.912 1.00 0.00 H new ATOM 0 HD3 PRO A 37 6.140 5.993 -9.396 1.00 0.00 H new ATOM 264 N SER A 38 2.407 8.762 -9.181 1.00 0.00 N ATOM 265 CA SER A 38 1.485 9.915 -9.230 1.00 0.00 C ATOM 266 C SER A 38 0.094 9.488 -9.739 1.00 0.00 C ATOM 267 O SER A 38 -0.909 9.644 -9.026 1.00 0.00 O ATOM 268 CB SER A 38 2.088 11.011 -10.145 1.00 0.00 C ATOM 269 OG SER A 38 3.396 11.352 -9.718 1.00 0.00 O ATOM 0 H SER A 38 3.273 8.915 -9.698 1.00 0.00 H new ATOM 0 HA SER A 38 1.359 10.313 -8.223 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.117 10.657 -11.176 1.00 0.00 H new ATOM 0 HB3 SER A 38 1.452 11.896 -10.129 1.00 0.00 H new ATOM 0 HG SER A 38 3.763 12.044 -10.307 1.00 0.00 H new ATOM 275 N PHE A 39 0.091 8.833 -10.919 1.00 0.00 N ATOM 276 CA PHE A 39 -1.134 8.351 -11.593 1.00 0.00 C ATOM 277 C PHE A 39 -1.849 7.286 -10.768 1.00 0.00 C ATOM 278 O PHE A 39 -3.076 7.208 -10.792 1.00 0.00 O ATOM 279 CB PHE A 39 -0.790 7.763 -12.994 1.00 0.00 C ATOM 280 CG PHE A 39 -0.606 8.811 -14.088 1.00 0.00 C ATOM 281 CD1 PHE A 39 0.238 9.903 -13.906 1.00 0.00 C ATOM 282 CD2 PHE A 39 -1.301 8.713 -15.296 1.00 0.00 C ATOM 283 CE1 PHE A 39 0.390 10.851 -14.893 1.00 0.00 C ATOM 284 CE2 PHE A 39 -1.150 9.665 -16.278 1.00 0.00 C ATOM 285 CZ PHE A 39 -0.302 10.732 -16.078 1.00 0.00 C ATOM 0 H PHE A 39 0.945 8.622 -11.435 1.00 0.00 H new ATOM 0 HA PHE A 39 -1.798 9.208 -11.704 1.00 0.00 H new ATOM 0 HB2 PHE A 39 0.124 7.175 -12.913 1.00 0.00 H new ATOM 0 HB3 PHE A 39 -1.584 7.079 -13.293 1.00 0.00 H new ATOM 0 HD1 PHE A 39 0.781 10.008 -12.978 1.00 0.00 H new ATOM 0 HD2 PHE A 39 -1.966 7.878 -15.461 1.00 0.00 H new ATOM 0 HE1 PHE A 39 1.053 11.689 -14.738 1.00 0.00 H new ATOM 0 HE2 PHE A 39 -1.696 9.576 -17.205 1.00 0.00 H new ATOM 0 HZ PHE A 39 -0.180 11.476 -16.851 1.00 0.00 H new ATOM 295 N LEU A 40 -1.055 6.484 -10.053 1.00 0.00 N ATOM 296 CA LEU A 40 -1.535 5.302 -9.345 1.00 0.00 C ATOM 297 C LEU A 40 -2.355 5.696 -8.106 1.00 0.00 C ATOM 298 O LEU A 40 -3.468 5.180 -7.902 1.00 0.00 O ATOM 299 CB LEU A 40 -0.338 4.387 -8.988 1.00 0.00 C ATOM 300 CG LEU A 40 0.624 4.029 -10.166 1.00 0.00 C ATOM 301 CD1 LEU A 40 1.827 3.207 -9.661 1.00 0.00 C ATOM 302 CD2 LEU A 40 -0.114 3.313 -11.328 1.00 0.00 C ATOM 0 H LEU A 40 -0.052 6.642 -9.951 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.206 4.741 -9.996 1.00 0.00 H new ATOM 0 HB2 LEU A 40 0.244 4.872 -8.204 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -0.727 3.460 -8.568 1.00 0.00 H new ATOM 0 HG LEU A 40 1.005 4.966 -10.573 1.00 0.00 H new ATOM 0 HD11 LEU A 40 2.483 2.970 -10.499 1.00 0.00 H new ATOM 0 HD12 LEU A 40 2.379 3.787 -8.921 1.00 0.00 H new ATOM 0 HD13 LEU A 40 1.471 2.283 -9.206 1.00 0.00 H new ATOM 0 HD21 LEU A 40 0.595 3.084 -12.123 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -0.559 2.388 -10.961 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.898 3.963 -11.717 1.00 0.00 H new ATOM 314 N HIS A 41 -1.809 6.641 -7.309 1.00 0.00 N ATOM 315 CA HIS A 41 -2.532 7.236 -6.171 1.00 0.00 C ATOM 316 C HIS A 41 -3.797 7.947 -6.670 1.00 0.00 C ATOM 317 O HIS A 41 -4.893 7.626 -6.222 1.00 0.00 O ATOM 318 CB HIS A 41 -1.666 8.256 -5.380 1.00 0.00 C ATOM 319 CG HIS A 41 -0.486 7.688 -4.614 1.00 0.00 C ATOM 320 ND1 HIS A 41 -0.610 7.075 -3.388 1.00 0.00 N ATOM 321 CD2 HIS A 41 0.844 7.692 -4.883 1.00 0.00 C ATOM 322 CE1 HIS A 41 0.580 6.730 -2.945 1.00 0.00 C ATOM 323 NE2 HIS A 41 1.483 7.095 -3.831 1.00 0.00 N ATOM 0 H HIS A 41 -0.866 7.007 -7.437 1.00 0.00 H new ATOM 0 HA HIS A 41 -2.787 6.417 -5.498 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -1.291 9.002 -6.081 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -2.312 8.778 -4.674 1.00 0.00 H new ATOM 0 HD2 HIS A 41 1.314 8.094 -5.768 1.00 0.00 H new ATOM 0 HE1 HIS A 41 0.783 6.230 -2.009 1.00 0.00 H new ATOM 0 HE2 HIS A 41 2.490 6.956 -3.747 1.00 0.00 H new ATOM 332 N GLU A 42 -3.621 8.873 -7.636 1.00 0.00 N ATOM 333 CA GLU A 42 -4.714 9.735 -8.147 1.00 0.00 C ATOM 334 C GLU A 42 -5.873 8.916 -8.757 1.00 0.00 C ATOM 335 O GLU A 42 -7.031 9.352 -8.713 1.00 0.00 O ATOM 336 CB GLU A 42 -4.153 10.739 -9.182 1.00 0.00 C ATOM 337 CG GLU A 42 -3.158 11.763 -8.581 1.00 0.00 C ATOM 338 CD GLU A 42 -2.533 12.698 -9.627 1.00 0.00 C ATOM 339 OE1 GLU A 42 -1.797 12.205 -10.507 1.00 0.00 O ATOM 340 OE2 GLU A 42 -2.766 13.926 -9.574 1.00 0.00 O ATOM 0 H GLU A 42 -2.721 9.046 -8.084 1.00 0.00 H new ATOM 0 HA GLU A 42 -5.126 10.281 -7.298 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.655 10.186 -9.978 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -4.983 11.278 -9.639 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -3.675 12.363 -7.832 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.363 11.225 -8.065 1.00 0.00 H new ATOM 347 N ALA A 43 -5.543 7.733 -9.318 1.00 0.00 N ATOM 348 CA ALA A 43 -6.541 6.787 -9.834 1.00 0.00 C ATOM 349 C ALA A 43 -7.323 6.152 -8.675 1.00 0.00 C ATOM 350 O ALA A 43 -8.553 6.167 -8.684 1.00 0.00 O ATOM 351 CB ALA A 43 -5.862 5.715 -10.691 1.00 0.00 C ATOM 0 H ALA A 43 -4.580 7.413 -9.423 1.00 0.00 H new ATOM 0 HA ALA A 43 -7.248 7.328 -10.463 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -6.613 5.020 -11.067 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.353 6.189 -11.530 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -5.136 5.172 -10.086 1.00 0.00 H new ATOM 357 N LEU A 44 -6.576 5.638 -7.664 1.00 0.00 N ATOM 358 CA LEU A 44 -7.150 5.031 -6.428 1.00 0.00 C ATOM 359 C LEU A 44 -8.038 6.049 -5.661 1.00 0.00 C ATOM 360 O LEU A 44 -9.005 5.656 -4.997 1.00 0.00 O ATOM 361 CB LEU A 44 -5.996 4.444 -5.518 1.00 0.00 C ATOM 362 CG LEU A 44 -5.649 2.914 -5.710 1.00 0.00 C ATOM 363 CD1 LEU A 44 -6.745 2.013 -5.109 1.00 0.00 C ATOM 364 CD2 LEU A 44 -5.411 2.557 -7.181 1.00 0.00 C ATOM 0 H LEU A 44 -5.556 5.631 -7.680 1.00 0.00 H new ATOM 0 HA LEU A 44 -7.799 4.204 -6.716 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -5.091 5.024 -5.700 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -6.271 4.602 -4.475 1.00 0.00 H new ATOM 0 HG LEU A 44 -4.718 2.734 -5.172 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -6.478 0.967 -5.257 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -6.839 2.216 -4.042 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -7.695 2.218 -5.602 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -5.176 1.496 -7.264 1.00 0.00 H new ATOM 0 HD22 LEU A 44 -6.309 2.776 -7.758 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -4.579 3.145 -7.568 1.00 0.00 H new ATOM 376 N LYS A 45 -7.709 7.356 -5.779 1.00 0.00 N ATOM 377 CA LYS A 45 -8.518 8.453 -5.209 1.00 0.00 C ATOM 378 C LYS A 45 -9.825 8.612 -6.015 1.00 0.00 C ATOM 379 O LYS A 45 -10.925 8.608 -5.450 1.00 0.00 O ATOM 380 CB LYS A 45 -7.700 9.806 -5.180 1.00 0.00 C ATOM 381 CG LYS A 45 -6.900 10.133 -3.871 1.00 0.00 C ATOM 382 CD LYS A 45 -5.558 9.358 -3.664 1.00 0.00 C ATOM 383 CE LYS A 45 -5.720 7.922 -3.126 1.00 0.00 C ATOM 384 NZ LYS A 45 -6.375 7.886 -1.797 1.00 0.00 N ATOM 0 H LYS A 45 -6.876 7.677 -6.272 1.00 0.00 H new ATOM 0 HA LYS A 45 -8.771 8.203 -4.179 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -6.996 9.793 -6.012 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -8.395 10.625 -5.364 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -6.683 11.201 -3.861 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -7.546 9.932 -3.017 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -5.027 9.317 -4.615 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -4.931 9.922 -2.973 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -6.307 7.336 -3.833 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -4.740 7.450 -3.058 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -6.251 6.944 -1.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -5.945 8.603 -1.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -7.390 8.086 -1.905 1.00 0.00 H new ATOM 398 N ALA A 46 -9.683 8.712 -7.350 1.00 0.00 N ATOM 399 CA ALA A 46 -10.814 8.932 -8.284 1.00 0.00 C ATOM 400 C ALA A 46 -11.754 7.705 -8.373 1.00 0.00 C ATOM 401 O ALA A 46 -12.865 7.806 -8.902 1.00 0.00 O ATOM 402 CB ALA A 46 -10.273 9.292 -9.675 1.00 0.00 C ATOM 0 H ALA A 46 -8.779 8.643 -7.817 1.00 0.00 H new ATOM 0 HA ALA A 46 -11.408 9.758 -7.894 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.106 9.453 -10.359 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -9.677 10.202 -9.609 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -9.652 8.477 -10.046 1.00 0.00 H new ATOM 408 N SER A 47 -11.298 6.555 -7.857 1.00 0.00 N ATOM 409 CA SER A 47 -12.050 5.288 -7.900 1.00 0.00 C ATOM 410 C SER A 47 -12.672 4.931 -6.542 1.00 0.00 C ATOM 411 O SER A 47 -13.221 3.831 -6.406 1.00 0.00 O ATOM 412 CB SER A 47 -11.099 4.169 -8.337 1.00 0.00 C ATOM 413 OG SER A 47 -10.550 4.450 -9.603 1.00 0.00 O ATOM 0 H SER A 47 -10.392 6.475 -7.395 1.00 0.00 H new ATOM 0 HA SER A 47 -12.869 5.405 -8.609 1.00 0.00 H new ATOM 0 HB2 SER A 47 -10.299 4.058 -7.605 1.00 0.00 H new ATOM 0 HB3 SER A 47 -11.636 3.221 -8.370 1.00 0.00 H new ATOM 0 HG SER A 47 -9.797 5.069 -9.503 1.00 0.00 H new ATOM 419 N ASN A 48 -12.534 5.839 -5.535 1.00 0.00 N ATOM 420 CA ASN A 48 -13.015 5.633 -4.136 1.00 0.00 C ATOM 421 C ASN A 48 -12.153 4.559 -3.381 1.00 0.00 C ATOM 422 O ASN A 48 -12.323 4.341 -2.175 1.00 0.00 O ATOM 423 CB ASN A 48 -14.553 5.291 -4.134 1.00 0.00 C ATOM 424 CG ASN A 48 -15.179 5.103 -2.746 1.00 0.00 C ATOM 425 OD1 ASN A 48 -15.652 6.054 -2.120 1.00 0.00 O ATOM 426 ND2 ASN A 48 -15.208 3.868 -2.267 1.00 0.00 N ATOM 0 H ASN A 48 -12.082 6.743 -5.672 1.00 0.00 H new ATOM 0 HA ASN A 48 -12.887 6.563 -3.582 1.00 0.00 H new ATOM 0 HB2 ASN A 48 -15.087 6.089 -4.651 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -14.707 4.379 -4.711 1.00 0.00 H new ATOM 0 HD21 ASN A 48 -15.630 3.684 -1.357 1.00 0.00 H new ATOM 0 HD22 ASN A 48 -14.808 3.101 -2.808 1.00 0.00 H new ATOM 433 N GLY A 49 -11.174 3.955 -4.089 1.00 0.00 N ATOM 434 CA GLY A 49 -10.344 2.870 -3.558 1.00 0.00 C ATOM 435 C GLY A 49 -10.443 1.593 -4.384 1.00 0.00 C ATOM 436 O GLY A 49 -9.700 0.640 -4.125 1.00 0.00 O ATOM 0 H GLY A 49 -10.942 4.213 -5.048 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -9.305 3.196 -3.525 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -10.644 2.658 -2.532 1.00 0.00 H new ATOM 440 N ASP A 50 -11.362 1.569 -5.379 1.00 0.00 N ATOM 441 CA ASP A 50 -11.580 0.391 -6.246 1.00 0.00 C ATOM 442 C ASP A 50 -10.491 0.324 -7.338 1.00 0.00 C ATOM 443 O ASP A 50 -10.513 1.102 -8.301 1.00 0.00 O ATOM 444 CB ASP A 50 -12.995 0.431 -6.879 1.00 0.00 C ATOM 445 CG ASP A 50 -13.382 -0.903 -7.536 1.00 0.00 C ATOM 446 OD1 ASP A 50 -13.825 -1.820 -6.811 1.00 0.00 O ATOM 447 OD2 ASP A 50 -13.213 -1.058 -8.758 1.00 0.00 O ATOM 0 H ASP A 50 -11.967 2.360 -5.600 1.00 0.00 H new ATOM 0 HA ASP A 50 -11.511 -0.509 -5.635 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -13.727 0.680 -6.110 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -13.034 1.225 -7.625 1.00 0.00 H new ATOM 452 N ILE A 51 -9.545 -0.616 -7.179 1.00 0.00 N ATOM 453 CA ILE A 51 -8.363 -0.719 -8.054 1.00 0.00 C ATOM 454 C ILE A 51 -8.746 -1.084 -9.518 1.00 0.00 C ATOM 455 O ILE A 51 -8.049 -0.692 -10.453 1.00 0.00 O ATOM 456 CB ILE A 51 -7.311 -1.728 -7.450 1.00 0.00 C ATOM 457 CG1 ILE A 51 -5.961 -1.687 -8.238 1.00 0.00 C ATOM 458 CG2 ILE A 51 -7.881 -3.167 -7.382 1.00 0.00 C ATOM 459 CD1 ILE A 51 -4.840 -2.500 -7.620 1.00 0.00 C ATOM 0 H ILE A 51 -9.576 -1.323 -6.445 1.00 0.00 H new ATOM 0 HA ILE A 51 -7.897 0.265 -8.098 1.00 0.00 H new ATOM 0 HB ILE A 51 -7.103 -1.409 -6.429 1.00 0.00 H new ATOM 0 HG12 ILE A 51 -6.137 -2.048 -9.251 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -5.636 -0.650 -8.321 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -7.130 -3.836 -6.961 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -8.770 -3.177 -6.752 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -8.144 -3.502 -8.385 1.00 0.00 H new ATOM 0 HD11 ILE A 51 -3.944 -2.411 -8.235 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -4.630 -2.127 -6.617 1.00 0.00 H new ATOM 0 HD13 ILE A 51 -5.139 -3.547 -7.563 1.00 0.00 H new ATOM 471 N THR A 52 -9.886 -1.784 -9.702 1.00 0.00 N ATOM 472 CA THR A 52 -10.408 -2.159 -11.035 1.00 0.00 C ATOM 473 C THR A 52 -10.828 -0.901 -11.831 1.00 0.00 C ATOM 474 O THR A 52 -10.456 -0.735 -13.013 1.00 0.00 O ATOM 475 CB THR A 52 -11.621 -3.135 -10.891 1.00 0.00 C ATOM 476 OG1 THR A 52 -11.240 -4.258 -10.078 1.00 0.00 O ATOM 477 CG2 THR A 52 -12.133 -3.641 -12.252 1.00 0.00 C ATOM 0 H THR A 52 -10.471 -2.105 -8.931 1.00 0.00 H new ATOM 0 HA THR A 52 -9.613 -2.665 -11.582 1.00 0.00 H new ATOM 0 HB THR A 52 -12.432 -2.579 -10.421 1.00 0.00 H new ATOM 0 HG1 THR A 52 -12.001 -4.869 -9.986 1.00 0.00 H new ATOM 0 HG21 THR A 52 -12.975 -4.315 -12.096 1.00 0.00 H new ATOM 0 HG22 THR A 52 -12.454 -2.794 -12.858 1.00 0.00 H new ATOM 0 HG23 THR A 52 -11.333 -4.173 -12.767 1.00 0.00 H new ATOM 485 N GLN A 53 -11.587 -0.012 -11.154 1.00 0.00 N ATOM 486 CA GLN A 53 -11.983 1.293 -11.704 1.00 0.00 C ATOM 487 C GLN A 53 -10.751 2.143 -12.012 1.00 0.00 C ATOM 488 O GLN A 53 -10.718 2.803 -13.038 1.00 0.00 O ATOM 489 CB GLN A 53 -12.944 2.044 -10.731 1.00 0.00 C ATOM 490 CG GLN A 53 -14.396 1.515 -10.724 1.00 0.00 C ATOM 491 CD GLN A 53 -15.130 1.795 -12.037 1.00 0.00 C ATOM 492 OE1 GLN A 53 -15.791 2.826 -12.193 1.00 0.00 O ATOM 493 NE2 GLN A 53 -14.998 0.902 -13.003 1.00 0.00 N ATOM 0 H GLN A 53 -11.940 -0.183 -10.212 1.00 0.00 H new ATOM 0 HA GLN A 53 -12.521 1.117 -12.636 1.00 0.00 H new ATOM 0 HB2 GLN A 53 -12.542 1.976 -9.720 1.00 0.00 H new ATOM 0 HB3 GLN A 53 -12.958 3.101 -10.999 1.00 0.00 H new ATOM 0 HG2 GLN A 53 -14.387 0.441 -10.539 1.00 0.00 H new ATOM 0 HG3 GLN A 53 -14.943 1.975 -9.901 1.00 0.00 H new ATOM 0 HE21 GLN A 53 -14.446 0.059 -12.846 1.00 0.00 H new ATOM 0 HE22 GLN A 53 -15.448 1.056 -13.905 1.00 0.00 H new ATOM 502 N ALA A 54 -9.743 2.077 -11.128 1.00 0.00 N ATOM 503 CA ALA A 54 -8.473 2.807 -11.287 1.00 0.00 C ATOM 504 C ALA A 54 -7.747 2.417 -12.586 1.00 0.00 C ATOM 505 O ALA A 54 -7.220 3.295 -13.295 1.00 0.00 O ATOM 506 CB ALA A 54 -7.596 2.568 -10.057 1.00 0.00 C ATOM 0 H ALA A 54 -9.785 1.514 -10.279 1.00 0.00 H new ATOM 0 HA ALA A 54 -8.689 3.872 -11.367 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -6.655 3.107 -10.171 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -8.113 2.925 -9.166 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -7.394 1.502 -9.956 1.00 0.00 H new ATOM 512 N VAL A 55 -7.751 1.098 -12.900 1.00 0.00 N ATOM 513 CA VAL A 55 -7.222 0.577 -14.181 1.00 0.00 C ATOM 514 C VAL A 55 -7.984 1.208 -15.349 1.00 0.00 C ATOM 515 O VAL A 55 -7.367 1.747 -16.269 1.00 0.00 O ATOM 516 CB VAL A 55 -7.319 -0.995 -14.293 1.00 0.00 C ATOM 517 CG1 VAL A 55 -6.775 -1.530 -15.651 1.00 0.00 C ATOM 518 CG2 VAL A 55 -6.618 -1.677 -13.119 1.00 0.00 C ATOM 0 H VAL A 55 -8.116 0.375 -12.280 1.00 0.00 H new ATOM 0 HA VAL A 55 -6.166 0.844 -14.217 1.00 0.00 H new ATOM 0 HB VAL A 55 -8.379 -1.246 -14.253 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -6.865 -2.616 -15.676 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -7.352 -1.099 -16.469 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -5.727 -1.250 -15.759 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -6.702 -2.759 -13.224 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -5.566 -1.394 -13.109 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -7.086 -1.366 -12.185 1.00 0.00 H new ATOM 528 N SER A 56 -9.334 1.158 -15.262 1.00 0.00 N ATOM 529 CA SER A 56 -10.245 1.685 -16.301 1.00 0.00 C ATOM 530 C SER A 56 -9.976 3.181 -16.584 1.00 0.00 C ATOM 531 O SER A 56 -9.907 3.603 -17.746 1.00 0.00 O ATOM 532 CB SER A 56 -11.716 1.465 -15.854 1.00 0.00 C ATOM 533 OG SER A 56 -11.955 0.097 -15.570 1.00 0.00 O ATOM 0 H SER A 56 -9.822 0.749 -14.465 1.00 0.00 H new ATOM 0 HA SER A 56 -10.064 1.145 -17.230 1.00 0.00 H new ATOM 0 HB2 SER A 56 -11.926 2.067 -14.970 1.00 0.00 H new ATOM 0 HB3 SER A 56 -12.394 1.802 -16.638 1.00 0.00 H new ATOM 0 HG SER A 56 -11.566 -0.129 -14.700 1.00 0.00 H new ATOM 539 N LEU A 57 -9.747 3.946 -15.503 1.00 0.00 N ATOM 540 CA LEU A 57 -9.578 5.412 -15.558 1.00 0.00 C ATOM 541 C LEU A 57 -8.212 5.810 -16.138 1.00 0.00 C ATOM 542 O LEU A 57 -8.083 6.876 -16.750 1.00 0.00 O ATOM 543 CB LEU A 57 -9.787 6.028 -14.148 1.00 0.00 C ATOM 544 CG LEU A 57 -11.218 5.842 -13.540 1.00 0.00 C ATOM 545 CD1 LEU A 57 -11.293 6.335 -12.083 1.00 0.00 C ATOM 546 CD2 LEU A 57 -12.306 6.509 -14.414 1.00 0.00 C ATOM 0 H LEU A 57 -9.673 3.564 -14.560 1.00 0.00 H new ATOM 0 HA LEU A 57 -10.337 5.811 -16.231 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -9.061 5.587 -13.466 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -9.568 7.095 -14.200 1.00 0.00 H new ATOM 0 HG LEU A 57 -11.417 4.770 -13.531 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -12.303 6.187 -11.700 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -10.588 5.772 -11.472 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -11.042 7.395 -12.044 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -13.284 6.357 -13.957 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -12.105 7.577 -14.493 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -12.297 6.064 -15.409 1.00 0.00 H new ATOM 558 N LEU A 58 -7.199 4.954 -15.932 1.00 0.00 N ATOM 559 CA LEU A 58 -5.847 5.188 -16.476 1.00 0.00 C ATOM 560 C LEU A 58 -5.704 4.704 -17.932 1.00 0.00 C ATOM 561 O LEU A 58 -4.964 5.303 -18.705 1.00 0.00 O ATOM 562 CB LEU A 58 -4.774 4.525 -15.576 1.00 0.00 C ATOM 563 CG LEU A 58 -4.583 5.160 -14.159 1.00 0.00 C ATOM 564 CD1 LEU A 58 -3.471 4.436 -13.366 1.00 0.00 C ATOM 565 CD2 LEU A 58 -4.308 6.685 -14.251 1.00 0.00 C ATOM 0 H LEU A 58 -7.288 4.093 -15.393 1.00 0.00 H new ATOM 0 HA LEU A 58 -5.690 6.267 -16.481 1.00 0.00 H new ATOM 0 HB2 LEU A 58 -5.033 3.474 -15.450 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -3.818 4.557 -16.099 1.00 0.00 H new ATOM 0 HG LEU A 58 -5.518 5.029 -13.614 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.362 4.900 -12.386 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -3.737 3.386 -13.243 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -2.529 4.511 -13.909 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -4.180 7.093 -13.248 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -3.401 6.857 -14.831 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -5.149 7.178 -14.739 1.00 0.00 H new ATOM 577 N THR A 59 -6.414 3.632 -18.311 1.00 0.00 N ATOM 578 CA THR A 59 -6.248 3.008 -19.643 1.00 0.00 C ATOM 579 C THR A 59 -7.002 3.773 -20.750 1.00 0.00 C ATOM 580 O THR A 59 -6.668 3.630 -21.928 1.00 0.00 O ATOM 581 CB THR A 59 -6.683 1.501 -19.630 1.00 0.00 C ATOM 582 OG1 THR A 59 -8.021 1.373 -19.119 1.00 0.00 O ATOM 583 CG2 THR A 59 -5.719 0.628 -18.799 1.00 0.00 C ATOM 0 H THR A 59 -7.109 3.176 -17.720 1.00 0.00 H new ATOM 0 HA THR A 59 -5.184 3.060 -19.874 1.00 0.00 H new ATOM 0 HB THR A 59 -6.650 1.145 -20.660 1.00 0.00 H new ATOM 0 HG1 THR A 59 -8.006 1.439 -18.141 1.00 0.00 H new ATOM 0 HG21 THR A 59 -6.058 -0.408 -18.817 1.00 0.00 H new ATOM 0 HG22 THR A 59 -4.716 0.689 -19.222 1.00 0.00 H new ATOM 0 HG23 THR A 59 -5.700 0.985 -17.769 1.00 0.00 H new ATOM 591 N ASP A 60 -7.988 4.617 -20.370 1.00 0.00 N ATOM 592 CA ASP A 60 -8.846 5.329 -21.353 1.00 0.00 C ATOM 593 C ASP A 60 -8.130 6.522 -22.025 1.00 0.00 C ATOM 594 O ASP A 60 -8.698 7.138 -22.935 1.00 0.00 O ATOM 595 CB ASP A 60 -10.207 5.760 -20.721 1.00 0.00 C ATOM 596 CG ASP A 60 -10.121 6.733 -19.522 1.00 0.00 C ATOM 597 OD1 ASP A 60 -9.531 7.826 -19.650 1.00 0.00 O ATOM 598 OD2 ASP A 60 -10.718 6.441 -18.470 1.00 0.00 O ATOM 0 H ASP A 60 -8.211 4.823 -19.396 1.00 0.00 H new ATOM 0 HA ASP A 60 -9.058 4.613 -22.147 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.814 6.225 -21.498 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.735 4.863 -20.398 1.00 0.00 H new ATOM 603 N GLU A 61 -6.884 6.826 -21.592 1.00 0.00 N ATOM 604 CA GLU A 61 -6.049 7.898 -22.192 1.00 0.00 C ATOM 605 C GLU A 61 -5.816 7.651 -23.706 1.00 0.00 C ATOM 606 O GLU A 61 -5.818 8.590 -24.511 1.00 0.00 O ATOM 607 CB GLU A 61 -4.682 7.985 -21.460 1.00 0.00 C ATOM 608 CG GLU A 61 -4.769 8.337 -19.958 1.00 0.00 C ATOM 609 CD GLU A 61 -3.384 8.425 -19.283 1.00 0.00 C ATOM 610 OE1 GLU A 61 -2.745 9.503 -19.349 1.00 0.00 O ATOM 611 OE2 GLU A 61 -2.910 7.412 -18.717 1.00 0.00 O ATOM 0 H GLU A 61 -6.429 6.338 -20.820 1.00 0.00 H new ATOM 0 HA GLU A 61 -6.584 8.841 -22.077 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -4.169 7.029 -21.565 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -4.066 8.734 -21.959 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -5.286 9.290 -19.842 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -5.370 7.584 -19.447 1.00 0.00 H new ATOM 618 N ARG A 62 -5.645 6.360 -24.062 1.00 0.00 N ATOM 619 CA ARG A 62 -5.392 5.913 -25.459 1.00 0.00 C ATOM 620 C ARG A 62 -6.685 5.907 -26.305 1.00 0.00 C ATOM 621 O ARG A 62 -6.626 5.735 -27.525 1.00 0.00 O ATOM 622 CB ARG A 62 -4.751 4.496 -25.448 1.00 0.00 C ATOM 623 CG ARG A 62 -5.695 3.360 -24.973 1.00 0.00 C ATOM 624 CD ARG A 62 -4.938 2.105 -24.507 1.00 0.00 C ATOM 625 NE ARG A 62 -4.082 2.405 -23.333 1.00 0.00 N ATOM 626 CZ ARG A 62 -3.779 1.553 -22.334 1.00 0.00 C ATOM 627 NH1 ARG A 62 -4.254 0.309 -22.312 1.00 0.00 N ATOM 628 NH2 ARG A 62 -3.007 1.965 -21.338 1.00 0.00 N ATOM 0 H ARG A 62 -5.678 5.592 -23.391 1.00 0.00 H new ATOM 0 HA ARG A 62 -4.705 6.623 -25.919 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -4.402 4.263 -26.454 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -3.873 4.514 -24.802 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -6.315 3.728 -24.155 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -6.368 3.090 -25.787 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -5.650 1.321 -24.251 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -4.323 1.724 -25.322 1.00 0.00 H new ATOM 0 HE ARG A 62 -3.686 3.343 -23.277 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -4.862 -0.018 -23.063 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -4.010 -0.317 -21.544 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -2.648 2.920 -21.332 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -2.772 1.327 -20.577 1.00 0.00 H new ATOM 642 N VAL A 63 -7.850 6.056 -25.645 1.00 0.00 N ATOM 643 CA VAL A 63 -9.161 6.154 -26.325 1.00 0.00 C ATOM 644 C VAL A 63 -9.461 7.633 -26.668 1.00 0.00 C ATOM 645 O VAL A 63 -10.190 7.929 -27.627 1.00 0.00 O ATOM 646 CB VAL A 63 -10.307 5.546 -25.421 1.00 0.00 C ATOM 647 CG1 VAL A 63 -11.681 5.499 -26.143 1.00 0.00 C ATOM 648 CG2 VAL A 63 -9.910 4.144 -24.885 1.00 0.00 C ATOM 0 H VAL A 63 -7.911 6.112 -24.628 1.00 0.00 H new ATOM 0 HA VAL A 63 -9.123 5.577 -27.249 1.00 0.00 H new ATOM 0 HB VAL A 63 -10.424 6.220 -24.572 1.00 0.00 H new ATOM 0 HG11 VAL A 63 -12.429 5.073 -25.475 1.00 0.00 H new ATOM 0 HG12 VAL A 63 -11.979 6.509 -26.424 1.00 0.00 H new ATOM 0 HG13 VAL A 63 -11.601 4.882 -27.038 1.00 0.00 H new ATOM 0 HG21 VAL A 63 -10.716 3.749 -24.266 1.00 0.00 H new ATOM 0 HG22 VAL A 63 -9.733 3.471 -25.724 1.00 0.00 H new ATOM 0 HG23 VAL A 63 -9.002 4.226 -24.288 1.00 0.00 H new ATOM 658 N LYS A 64 -8.872 8.555 -25.881 1.00 0.00 N ATOM 659 CA LYS A 64 -9.017 10.007 -26.102 1.00 0.00 C ATOM 660 C LYS A 64 -8.140 10.438 -27.294 1.00 0.00 C ATOM 661 O LYS A 64 -6.914 10.541 -27.164 1.00 0.00 O ATOM 662 CB LYS A 64 -8.658 10.823 -24.800 1.00 0.00 C ATOM 663 CG LYS A 64 -9.853 11.569 -24.149 1.00 0.00 C ATOM 664 CD LYS A 64 -10.931 10.609 -23.596 1.00 0.00 C ATOM 665 CE LYS A 64 -10.436 9.782 -22.402 1.00 0.00 C ATOM 666 NZ LYS A 64 -11.486 8.859 -21.894 1.00 0.00 N ATOM 0 H LYS A 64 -8.287 8.317 -25.080 1.00 0.00 H new ATOM 0 HA LYS A 64 -10.059 10.225 -26.337 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -8.231 10.139 -24.066 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -7.884 11.550 -25.046 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -9.484 12.199 -23.339 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -10.307 12.231 -24.886 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.805 11.187 -23.295 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.253 9.935 -24.390 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -9.559 9.207 -22.698 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -10.123 10.452 -21.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -11.294 8.630 -20.898 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.417 9.316 -21.971 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.482 7.985 -22.457 1.00 0.00 H new ATOM 680 N GLU A 65 -8.790 10.653 -28.453 1.00 0.00 N ATOM 681 CA GLU A 65 -8.138 11.154 -29.683 1.00 0.00 C ATOM 682 C GLU A 65 -7.662 12.635 -29.502 1.00 0.00 C ATOM 683 O GLU A 65 -8.254 13.366 -28.698 1.00 0.00 O ATOM 684 CB GLU A 65 -9.133 11.014 -30.874 1.00 0.00 C ATOM 685 CG GLU A 65 -10.437 11.813 -30.699 1.00 0.00 C ATOM 686 CD GLU A 65 -11.427 11.613 -31.848 1.00 0.00 C ATOM 687 OE1 GLU A 65 -11.218 12.208 -32.926 1.00 0.00 O ATOM 688 OE2 GLU A 65 -12.411 10.859 -31.682 1.00 0.00 O ATOM 0 H GLU A 65 -9.789 10.484 -28.566 1.00 0.00 H new ATOM 0 HA GLU A 65 -7.248 10.560 -29.893 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -8.638 11.342 -31.788 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -9.380 9.960 -31.006 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -10.913 11.519 -29.763 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -10.197 12.873 -30.615 1.00 0.00 H new ATOM 695 N PRO A 66 -6.597 13.127 -30.242 1.00 0.00 N ATOM 696 CA PRO A 66 -5.850 12.363 -31.272 1.00 0.00 C ATOM 697 C PRO A 66 -4.714 11.483 -30.681 1.00 0.00 C ATOM 698 O PRO A 66 -3.581 11.940 -30.462 1.00 0.00 O ATOM 699 CB PRO A 66 -5.325 13.490 -32.194 1.00 0.00 C ATOM 700 CG PRO A 66 -5.061 14.649 -31.267 1.00 0.00 C ATOM 701 CD PRO A 66 -6.057 14.519 -30.115 1.00 0.00 C ATOM 0 HA PRO A 66 -6.465 11.629 -31.792 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.418 13.185 -32.715 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -6.058 13.752 -32.957 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -4.036 14.625 -30.898 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -5.190 15.598 -31.786 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -5.571 14.670 -29.151 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -6.851 15.262 -30.191 1.00 0.00 H new ATOM 709 N SER A 67 -5.051 10.214 -30.414 1.00 0.00 N ATOM 710 CA SER A 67 -4.147 9.238 -29.797 1.00 0.00 C ATOM 711 C SER A 67 -3.451 8.406 -30.890 1.00 0.00 C ATOM 712 O SER A 67 -2.274 8.636 -31.183 1.00 0.00 O ATOM 713 CB SER A 67 -4.965 8.360 -28.822 1.00 0.00 C ATOM 714 OG SER A 67 -6.163 7.908 -29.443 1.00 0.00 O ATOM 0 H SER A 67 -5.973 9.833 -30.624 1.00 0.00 H new ATOM 0 HA SER A 67 -3.362 9.739 -29.231 1.00 0.00 H new ATOM 0 HB2 SER A 67 -4.368 7.505 -28.505 1.00 0.00 H new ATOM 0 HB3 SER A 67 -5.206 8.930 -27.925 1.00 0.00 H new ATOM 0 HG SER A 67 -6.528 7.151 -28.938 1.00 0.00 H new ATOM 720 N GLN A 68 -4.215 7.478 -31.507 1.00 0.00 N ATOM 721 CA GLN A 68 -3.763 6.614 -32.613 1.00 0.00 C ATOM 722 C GLN A 68 -4.925 5.688 -33.023 1.00 0.00 C ATOM 723 O GLN A 68 -5.695 5.246 -32.162 1.00 0.00 O ATOM 724 CB GLN A 68 -2.509 5.756 -32.219 1.00 0.00 C ATOM 725 CG GLN A 68 -1.841 5.004 -33.392 1.00 0.00 C ATOM 726 CD GLN A 68 -1.447 5.934 -34.544 1.00 0.00 C ATOM 727 OE1 GLN A 68 -2.225 6.156 -35.471 1.00 0.00 O ATOM 728 NE2 GLN A 68 -0.262 6.512 -34.479 1.00 0.00 N ATOM 0 H GLN A 68 -5.185 7.307 -31.242 1.00 0.00 H new ATOM 0 HA GLN A 68 -3.466 7.251 -33.447 1.00 0.00 H new ATOM 0 HB2 GLN A 68 -1.769 6.411 -31.758 1.00 0.00 H new ATOM 0 HB3 GLN A 68 -2.807 5.029 -31.463 1.00 0.00 H new ATOM 0 HG2 GLN A 68 -0.953 4.487 -33.028 1.00 0.00 H new ATOM 0 HG3 GLN A 68 -2.524 4.240 -33.764 1.00 0.00 H new ATOM 0 HE21 GLN A 68 0.362 6.309 -33.698 1.00 0.00 H new ATOM 0 HE22 GLN A 68 0.029 7.162 -35.209 1.00 0.00 H new ATOM 737 N ASP A 69 -5.028 5.368 -34.335 1.00 0.00 N ATOM 738 CA ASP A 69 -6.057 4.439 -34.880 1.00 0.00 C ATOM 739 C ASP A 69 -5.600 2.959 -34.761 1.00 0.00 C ATOM 740 O ASP A 69 -5.906 2.123 -35.617 1.00 0.00 O ATOM 741 CB ASP A 69 -6.398 4.834 -36.353 1.00 0.00 C ATOM 742 CG ASP A 69 -5.175 4.845 -37.301 1.00 0.00 C ATOM 743 OD1 ASP A 69 -4.507 5.894 -37.422 1.00 0.00 O ATOM 744 OD2 ASP A 69 -4.877 3.810 -37.930 1.00 0.00 O ATOM 0 H ASP A 69 -4.403 5.744 -35.048 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.967 4.529 -34.287 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -7.140 4.137 -36.743 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.856 5.823 -36.356 1.00 0.00 H new ATOM 749 N THR A 70 -4.935 2.635 -33.638 1.00 0.00 N ATOM 750 CA THR A 70 -4.423 1.285 -33.344 1.00 0.00 C ATOM 751 C THR A 70 -5.565 0.359 -32.832 1.00 0.00 C ATOM 752 O THR A 70 -6.731 0.779 -32.764 1.00 0.00 O ATOM 753 CB THR A 70 -3.265 1.382 -32.288 1.00 0.00 C ATOM 754 OG1 THR A 70 -2.659 0.094 -32.086 1.00 0.00 O ATOM 755 CG2 THR A 70 -3.749 1.948 -30.934 1.00 0.00 C ATOM 0 H THR A 70 -4.736 3.311 -32.901 1.00 0.00 H new ATOM 0 HA THR A 70 -4.030 0.847 -34.261 1.00 0.00 H new ATOM 0 HB THR A 70 -2.527 2.075 -32.692 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.938 0.171 -31.427 1.00 0.00 H new ATOM 0 HG21 THR A 70 -2.911 1.995 -30.239 1.00 0.00 H new ATOM 0 HG22 THR A 70 -4.154 2.949 -31.082 1.00 0.00 H new ATOM 0 HG23 THR A 70 -4.524 1.300 -30.525 1.00 0.00 H new ATOM 763 N VAL A 71 -5.209 -0.903 -32.499 1.00 0.00 N ATOM 764 CA VAL A 71 -6.132 -1.917 -31.958 1.00 0.00 C ATOM 765 C VAL A 71 -6.920 -1.394 -30.717 1.00 0.00 C ATOM 766 O VAL A 71 -6.340 -1.004 -29.691 1.00 0.00 O ATOM 767 CB VAL A 71 -5.361 -3.258 -31.615 1.00 0.00 C ATOM 768 CG1 VAL A 71 -4.842 -3.949 -32.907 1.00 0.00 C ATOM 769 CG2 VAL A 71 -4.198 -3.018 -30.609 1.00 0.00 C ATOM 0 H VAL A 71 -4.254 -1.247 -32.602 1.00 0.00 H new ATOM 0 HA VAL A 71 -6.865 -2.130 -32.736 1.00 0.00 H new ATOM 0 HB VAL A 71 -6.075 -3.926 -31.133 1.00 0.00 H new ATOM 0 HG11 VAL A 71 -4.317 -4.867 -32.643 1.00 0.00 H new ATOM 0 HG12 VAL A 71 -5.685 -4.187 -33.556 1.00 0.00 H new ATOM 0 HG13 VAL A 71 -4.160 -3.278 -33.430 1.00 0.00 H new ATOM 0 HG21 VAL A 71 -3.696 -3.963 -30.401 1.00 0.00 H new ATOM 0 HG22 VAL A 71 -3.485 -2.315 -31.039 1.00 0.00 H new ATOM 0 HG23 VAL A 71 -4.598 -2.608 -29.682 1.00 0.00 H new ATOM 779 N ALA A 72 -8.253 -1.342 -30.870 1.00 0.00 N ATOM 780 CA ALA A 72 -9.177 -0.889 -29.826 1.00 0.00 C ATOM 781 C ALA A 72 -10.434 -1.773 -29.854 1.00 0.00 C ATOM 782 O ALA A 72 -11.334 -1.568 -30.671 1.00 0.00 O ATOM 783 CB ALA A 72 -9.515 0.604 -30.032 1.00 0.00 C ATOM 0 H ALA A 72 -8.721 -1.617 -31.733 1.00 0.00 H new ATOM 0 HA ALA A 72 -8.715 -0.983 -28.843 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -10.202 0.932 -29.252 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -8.600 1.194 -29.982 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -9.982 0.740 -31.008 1.00 0.00 H new ATOM 789 N THR A 73 -10.445 -2.807 -29.003 1.00 0.00 N ATOM 790 CA THR A 73 -11.586 -3.723 -28.862 1.00 0.00 C ATOM 791 C THR A 73 -12.494 -3.252 -27.699 1.00 0.00 C ATOM 792 O THR A 73 -12.160 -2.284 -26.999 1.00 0.00 O ATOM 793 CB THR A 73 -11.084 -5.190 -28.654 1.00 0.00 C ATOM 794 OG1 THR A 73 -12.188 -6.101 -28.711 1.00 0.00 O ATOM 795 CG2 THR A 73 -10.337 -5.383 -27.323 1.00 0.00 C ATOM 0 H THR A 73 -9.661 -3.033 -28.391 1.00 0.00 H new ATOM 0 HA THR A 73 -12.179 -3.711 -29.777 1.00 0.00 H new ATOM 0 HB THR A 73 -10.379 -5.395 -29.460 1.00 0.00 H new ATOM 0 HG1 THR A 73 -11.864 -7.017 -28.581 1.00 0.00 H new ATOM 0 HG21 THR A 73 -10.013 -6.420 -27.235 1.00 0.00 H new ATOM 0 HG22 THR A 73 -9.467 -4.727 -27.296 1.00 0.00 H new ATOM 0 HG23 THR A 73 -11.001 -5.139 -26.494 1.00 0.00 H new ATOM 803 N GLU A 74 -13.631 -3.944 -27.495 1.00 0.00 N ATOM 804 CA GLU A 74 -14.672 -3.534 -26.531 1.00 0.00 C ATOM 805 C GLU A 74 -14.181 -3.685 -25.064 1.00 0.00 C ATOM 806 O GLU A 74 -13.516 -4.682 -24.739 1.00 0.00 O ATOM 807 CB GLU A 74 -15.980 -4.364 -26.755 1.00 0.00 C ATOM 808 CG GLU A 74 -16.723 -4.098 -28.094 1.00 0.00 C ATOM 809 CD GLU A 74 -15.925 -4.497 -29.352 1.00 0.00 C ATOM 810 OE1 GLU A 74 -15.748 -5.708 -29.590 1.00 0.00 O ATOM 811 OE2 GLU A 74 -15.443 -3.604 -30.092 1.00 0.00 O ATOM 0 H GLU A 74 -13.855 -4.805 -27.995 1.00 0.00 H new ATOM 0 HA GLU A 74 -14.888 -2.480 -26.703 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -15.730 -5.424 -26.703 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -16.665 -4.158 -25.933 1.00 0.00 H new ATOM 0 HG2 GLU A 74 -17.666 -4.645 -28.088 1.00 0.00 H new ATOM 0 HG3 GLU A 74 -16.969 -3.038 -28.155 1.00 0.00 H new ATOM 818 N PRO A 75 -14.498 -2.693 -24.155 1.00 0.00 N ATOM 819 CA PRO A 75 -14.198 -2.797 -22.704 1.00 0.00 C ATOM 820 C PRO A 75 -15.164 -3.769 -21.994 1.00 0.00 C ATOM 821 O PRO A 75 -16.108 -4.280 -22.615 1.00 0.00 O ATOM 822 CB PRO A 75 -14.362 -1.335 -22.205 1.00 0.00 C ATOM 823 CG PRO A 75 -15.408 -0.759 -23.111 1.00 0.00 C ATOM 824 CD PRO A 75 -15.163 -1.395 -24.472 1.00 0.00 C ATOM 0 HA PRO A 75 -13.207 -3.202 -22.496 1.00 0.00 H new ATOM 0 HB2 PRO A 75 -14.675 -1.302 -21.162 1.00 0.00 H new ATOM 0 HB3 PRO A 75 -13.425 -0.782 -22.274 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -16.410 -0.985 -22.747 1.00 0.00 H new ATOM 0 HG3 PRO A 75 -15.326 0.327 -23.165 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -16.096 -1.548 -25.014 1.00 0.00 H new ATOM 0 HD3 PRO A 75 -14.530 -0.766 -25.098 1.00 0.00 H new ATOM 832 N SER A 76 -14.898 -4.013 -20.689 1.00 0.00 N ATOM 833 CA SER A 76 -15.619 -5.015 -19.866 1.00 0.00 C ATOM 834 C SER A 76 -15.480 -6.435 -20.478 1.00 0.00 C ATOM 835 O SER A 76 -16.352 -7.293 -20.296 1.00 0.00 O ATOM 836 CB SER A 76 -17.111 -4.617 -19.677 1.00 0.00 C ATOM 837 OG SER A 76 -17.238 -3.303 -19.149 1.00 0.00 O ATOM 0 H SER A 76 -14.172 -3.517 -20.173 1.00 0.00 H new ATOM 0 HA SER A 76 -15.161 -5.035 -18.877 1.00 0.00 H new ATOM 0 HB2 SER A 76 -17.628 -4.677 -20.634 1.00 0.00 H new ATOM 0 HB3 SER A 76 -17.596 -5.327 -19.008 1.00 0.00 H new ATOM 0 HG SER A 76 -18.187 -3.083 -19.044 1.00 0.00 H new ATOM 843 N GLU A 77 -14.347 -6.659 -21.175 1.00 0.00 N ATOM 844 CA GLU A 77 -14.047 -7.916 -21.879 1.00 0.00 C ATOM 845 C GLU A 77 -13.924 -9.076 -20.876 1.00 0.00 C ATOM 846 O GLU A 77 -14.482 -10.163 -21.082 1.00 0.00 O ATOM 847 CB GLU A 77 -12.733 -7.762 -22.680 1.00 0.00 C ATOM 848 CG GLU A 77 -12.385 -8.967 -23.581 1.00 0.00 C ATOM 849 CD GLU A 77 -10.983 -8.858 -24.200 1.00 0.00 C ATOM 850 OE1 GLU A 77 -10.811 -8.076 -25.158 1.00 0.00 O ATOM 851 OE2 GLU A 77 -10.046 -9.546 -23.727 1.00 0.00 O ATOM 0 H GLU A 77 -13.608 -5.962 -21.264 1.00 0.00 H new ATOM 0 HA GLU A 77 -14.862 -8.140 -22.567 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -12.804 -6.869 -23.301 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -11.913 -7.599 -21.980 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -12.449 -9.884 -22.995 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -13.125 -9.045 -24.378 1.00 0.00 H new ATOM 858 N VAL A 78 -13.193 -8.809 -19.781 1.00 0.00 N ATOM 859 CA VAL A 78 -12.988 -9.776 -18.693 1.00 0.00 C ATOM 860 C VAL A 78 -14.304 -9.978 -17.910 1.00 0.00 C ATOM 861 O VAL A 78 -15.098 -9.030 -17.741 1.00 0.00 O ATOM 862 CB VAL A 78 -11.823 -9.330 -17.722 1.00 0.00 C ATOM 863 CG1 VAL A 78 -10.470 -9.263 -18.477 1.00 0.00 C ATOM 864 CG2 VAL A 78 -12.141 -7.981 -17.022 1.00 0.00 C ATOM 0 H VAL A 78 -12.727 -7.915 -19.626 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.690 -10.724 -19.140 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.740 -10.086 -16.941 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -9.684 -8.954 -17.788 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.231 -10.246 -18.883 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -10.543 -8.542 -19.291 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -11.316 -7.709 -16.363 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -12.276 -7.204 -17.774 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -13.055 -8.082 -16.436 1.00 0.00 H new ATOM 874 N GLU A 79 -14.534 -11.223 -17.470 1.00 0.00 N ATOM 875 CA GLU A 79 -15.726 -11.596 -16.702 1.00 0.00 C ATOM 876 C GLU A 79 -15.634 -11.003 -15.288 1.00 0.00 C ATOM 877 O GLU A 79 -14.913 -11.528 -14.433 1.00 0.00 O ATOM 878 CB GLU A 79 -15.880 -13.140 -16.655 1.00 0.00 C ATOM 879 CG GLU A 79 -16.045 -13.792 -18.040 1.00 0.00 C ATOM 880 CD GLU A 79 -16.210 -15.315 -17.965 1.00 0.00 C ATOM 881 OE1 GLU A 79 -17.264 -15.780 -17.481 1.00 0.00 O ATOM 882 OE2 GLU A 79 -15.290 -16.057 -18.367 1.00 0.00 O ATOM 0 H GLU A 79 -13.896 -12.001 -17.638 1.00 0.00 H new ATOM 0 HA GLU A 79 -16.612 -11.191 -17.191 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -15.006 -13.568 -16.164 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -16.745 -13.391 -16.041 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -16.914 -13.361 -18.538 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -15.176 -13.555 -18.654 1.00 0.00 H new ATOM 889 N GLY A 80 -16.317 -9.860 -15.094 1.00 0.00 N ATOM 890 CA GLY A 80 -16.353 -9.161 -13.814 1.00 0.00 C ATOM 891 C GLY A 80 -17.197 -9.892 -12.775 1.00 0.00 C ATOM 892 O GLY A 80 -16.930 -9.779 -11.574 1.00 0.00 O ATOM 0 H GLY A 80 -16.858 -9.401 -15.827 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -15.337 -9.047 -13.437 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -16.753 -8.158 -13.962 1.00 0.00 H new ATOM 896 N SER A 81 -18.245 -10.619 -13.253 1.00 0.00 N ATOM 897 CA SER A 81 -19.219 -11.348 -12.396 1.00 0.00 C ATOM 898 C SER A 81 -19.936 -10.373 -11.418 1.00 0.00 C ATOM 899 O SER A 81 -20.450 -10.765 -10.359 1.00 0.00 O ATOM 900 CB SER A 81 -18.508 -12.523 -11.661 1.00 0.00 C ATOM 901 OG SER A 81 -19.421 -13.318 -10.918 1.00 0.00 O ATOM 0 H SER A 81 -18.437 -10.715 -14.250 1.00 0.00 H new ATOM 0 HA SER A 81 -19.997 -11.782 -13.024 1.00 0.00 H new ATOM 0 HB2 SER A 81 -17.994 -13.148 -12.391 1.00 0.00 H new ATOM 0 HB3 SER A 81 -17.747 -12.123 -10.991 1.00 0.00 H new ATOM 0 HG SER A 81 -19.984 -12.738 -10.364 1.00 0.00 H new ATOM 907 N ALA A 82 -19.990 -9.093 -11.826 1.00 0.00 N ATOM 908 CA ALA A 82 -20.549 -7.992 -11.044 1.00 0.00 C ATOM 909 C ALA A 82 -21.774 -7.449 -11.789 1.00 0.00 C ATOM 910 O ALA A 82 -21.685 -6.442 -12.509 1.00 0.00 O ATOM 911 CB ALA A 82 -19.472 -6.899 -10.808 1.00 0.00 C ATOM 0 H ALA A 82 -19.635 -8.795 -12.734 1.00 0.00 H new ATOM 0 HA ALA A 82 -20.863 -8.338 -10.059 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -19.902 -6.085 -10.224 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -18.630 -7.329 -10.266 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -19.127 -6.515 -11.768 1.00 0.00 H new ATOM 917 N ALA A 83 -22.902 -8.177 -11.679 1.00 0.00 N ATOM 918 CA ALA A 83 -24.188 -7.770 -12.267 1.00 0.00 C ATOM 919 C ALA A 83 -24.783 -6.607 -11.461 1.00 0.00 C ATOM 920 O ALA A 83 -25.610 -6.811 -10.559 1.00 0.00 O ATOM 921 CB ALA A 83 -25.140 -8.980 -12.348 1.00 0.00 C ATOM 0 H ALA A 83 -22.945 -9.065 -11.179 1.00 0.00 H new ATOM 0 HA ALA A 83 -24.035 -7.415 -13.286 1.00 0.00 H new ATOM 0 HB1 ALA A 83 -26.089 -8.668 -12.785 1.00 0.00 H new ATOM 0 HB2 ALA A 83 -24.692 -9.755 -12.970 1.00 0.00 H new ATOM 0 HB3 ALA A 83 -25.314 -9.374 -11.347 1.00 0.00 H new ATOM 927 N ASN A 84 -24.283 -5.385 -11.750 1.00 0.00 N ATOM 928 CA ASN A 84 -24.766 -4.156 -11.109 1.00 0.00 C ATOM 929 C ASN A 84 -26.111 -3.781 -11.740 1.00 0.00 C ATOM 930 O ASN A 84 -26.157 -3.185 -12.817 1.00 0.00 O ATOM 931 CB ASN A 84 -23.741 -2.978 -11.235 1.00 0.00 C ATOM 932 CG ASN A 84 -22.456 -3.153 -10.410 1.00 0.00 C ATOM 933 OD1 ASN A 84 -21.954 -4.375 -10.294 1.00 0.00 O flip ATOM 934 ND2 ASN A 84 -21.901 -2.179 -9.897 1.00 0.00 N flip ATOM 0 H ASN A 84 -23.539 -5.230 -12.430 1.00 0.00 H new ATOM 0 HA ASN A 84 -24.887 -4.339 -10.041 1.00 0.00 H new ATOM 0 HB2 ASN A 84 -23.470 -2.861 -12.284 1.00 0.00 H new ATOM 0 HB3 ASN A 84 -24.231 -2.054 -10.928 1.00 0.00 H new ATOM 0 HD21 ASN A 84 -22.306 -1.249 -10.000 1.00 0.00 H new ATOM 0 HD22 ASN A 84 -21.037 -2.304 -9.370 1.00 0.00 H new ATOM 941 N LYS A 85 -27.201 -4.194 -11.078 1.00 0.00 N ATOM 942 CA LYS A 85 -28.577 -3.906 -11.516 1.00 0.00 C ATOM 943 C LYS A 85 -29.099 -2.634 -10.823 1.00 0.00 C ATOM 944 O LYS A 85 -30.302 -2.493 -10.574 1.00 0.00 O ATOM 945 CB LYS A 85 -29.477 -5.133 -11.216 1.00 0.00 C ATOM 946 CG LYS A 85 -29.051 -6.431 -11.944 1.00 0.00 C ATOM 947 CD LYS A 85 -30.068 -7.585 -11.743 1.00 0.00 C ATOM 948 CE LYS A 85 -31.459 -7.255 -12.321 1.00 0.00 C ATOM 949 NZ LYS A 85 -32.446 -8.346 -12.082 1.00 0.00 N ATOM 0 H LYS A 85 -27.154 -4.741 -10.218 1.00 0.00 H new ATOM 0 HA LYS A 85 -28.594 -3.723 -12.590 1.00 0.00 H new ATOM 0 HB2 LYS A 85 -29.475 -5.316 -10.141 1.00 0.00 H new ATOM 0 HB3 LYS A 85 -30.503 -4.893 -11.496 1.00 0.00 H new ATOM 0 HG2 LYS A 85 -28.943 -6.228 -13.009 1.00 0.00 H new ATOM 0 HG3 LYS A 85 -28.073 -6.745 -11.579 1.00 0.00 H new ATOM 0 HD2 LYS A 85 -29.686 -8.488 -12.218 1.00 0.00 H new ATOM 0 HD3 LYS A 85 -30.162 -7.800 -10.679 1.00 0.00 H new ATOM 0 HE2 LYS A 85 -31.826 -6.332 -11.873 1.00 0.00 H new ATOM 0 HE3 LYS A 85 -31.371 -7.076 -13.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 85 -33.365 -8.078 -12.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 85 -32.111 -9.222 -12.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 85 -32.552 -8.501 -11.059 1.00 0.00 H new ATOM 963 N GLU A 86 -28.165 -1.696 -10.569 1.00 0.00 N ATOM 964 CA GLU A 86 -28.437 -0.428 -9.888 1.00 0.00 C ATOM 965 C GLU A 86 -29.267 0.479 -10.804 1.00 0.00 C ATOM 966 O GLU A 86 -28.732 1.083 -11.740 1.00 0.00 O ATOM 967 CB GLU A 86 -27.104 0.262 -9.465 1.00 0.00 C ATOM 968 CG GLU A 86 -26.241 -0.564 -8.484 1.00 0.00 C ATOM 969 CD GLU A 86 -26.958 -0.876 -7.154 1.00 0.00 C ATOM 970 OE1 GLU A 86 -27.026 0.015 -6.279 1.00 0.00 O ATOM 971 OE2 GLU A 86 -27.453 -2.012 -6.972 1.00 0.00 O ATOM 0 H GLU A 86 -27.187 -1.806 -10.838 1.00 0.00 H new ATOM 0 HA GLU A 86 -29.009 -0.621 -8.981 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -26.517 0.470 -10.360 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -27.336 1.223 -9.005 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -25.955 -1.500 -8.963 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -25.321 -0.019 -8.273 1.00 0.00 H new ATOM 978 N VAL A 87 -30.582 0.514 -10.537 1.00 0.00 N ATOM 979 CA VAL A 87 -31.551 1.285 -11.328 1.00 0.00 C ATOM 980 C VAL A 87 -31.255 2.789 -11.182 1.00 0.00 C ATOM 981 O VAL A 87 -31.227 3.305 -10.065 1.00 0.00 O ATOM 982 CB VAL A 87 -33.028 0.991 -10.871 1.00 0.00 C ATOM 983 CG1 VAL A 87 -34.063 1.697 -11.782 1.00 0.00 C ATOM 984 CG2 VAL A 87 -33.291 -0.533 -10.784 1.00 0.00 C ATOM 0 H VAL A 87 -31.004 0.004 -9.761 1.00 0.00 H new ATOM 0 HA VAL A 87 -31.453 0.985 -12.371 1.00 0.00 H new ATOM 0 HB VAL A 87 -33.150 1.406 -9.871 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -35.070 1.469 -11.433 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -33.902 2.775 -11.748 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -33.946 1.345 -12.807 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -34.319 -0.707 -10.466 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -33.132 -0.986 -11.763 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -32.607 -0.980 -10.062 1.00 0.00 H new ATOM 994 N LEU A 88 -31.011 3.465 -12.307 1.00 0.00 N ATOM 995 CA LEU A 88 -30.677 4.904 -12.325 1.00 0.00 C ATOM 996 C LEU A 88 -31.965 5.756 -12.303 1.00 0.00 C ATOM 997 O LEU A 88 -31.956 6.903 -11.852 1.00 0.00 O ATOM 998 CB LEU A 88 -29.772 5.199 -13.578 1.00 0.00 C ATOM 999 CG LEU A 88 -29.024 6.595 -13.667 1.00 0.00 C ATOM 1000 CD1 LEU A 88 -29.927 7.746 -14.204 1.00 0.00 C ATOM 1001 CD2 LEU A 88 -28.392 6.967 -12.299 1.00 0.00 C ATOM 0 H LEU A 88 -31.038 3.038 -13.233 1.00 0.00 H new ATOM 0 HA LEU A 88 -30.115 5.176 -11.432 1.00 0.00 H new ATOM 0 HB2 LEU A 88 -29.016 4.415 -13.631 1.00 0.00 H new ATOM 0 HB3 LEU A 88 -30.396 5.101 -14.466 1.00 0.00 H new ATOM 0 HG LEU A 88 -28.227 6.473 -14.401 1.00 0.00 H new ATOM 0 HD11 LEU A 88 -29.353 8.672 -14.239 1.00 0.00 H new ATOM 0 HD12 LEU A 88 -30.276 7.497 -15.206 1.00 0.00 H new ATOM 0 HD13 LEU A 88 -30.784 7.875 -13.543 1.00 0.00 H new ATOM 0 HD21 LEU A 88 -27.884 7.928 -12.382 1.00 0.00 H new ATOM 0 HD22 LEU A 88 -29.174 7.034 -11.543 1.00 0.00 H new ATOM 0 HD23 LEU A 88 -27.673 6.200 -12.010 1.00 0.00 H new ATOM 1013 N ALA A 89 -33.070 5.165 -12.778 1.00 0.00 N ATOM 1014 CA ALA A 89 -34.367 5.849 -12.885 1.00 0.00 C ATOM 1015 C ALA A 89 -35.075 5.915 -11.521 1.00 0.00 C ATOM 1016 O ALA A 89 -35.537 4.900 -10.990 1.00 0.00 O ATOM 1017 CB ALA A 89 -35.256 5.156 -13.931 1.00 0.00 C ATOM 0 H ALA A 89 -33.090 4.197 -13.100 1.00 0.00 H new ATOM 0 HA ALA A 89 -34.184 6.872 -13.212 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -36.212 5.675 -13.997 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -34.762 5.180 -14.902 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -35.425 4.120 -13.636 1.00 0.00 H new ATOM 1023 N LYS A 90 -35.119 7.126 -10.966 1.00 0.00 N ATOM 1024 CA LYS A 90 -35.875 7.458 -9.748 1.00 0.00 C ATOM 1025 C LYS A 90 -36.413 8.889 -9.891 1.00 0.00 C ATOM 1026 O LYS A 90 -36.034 9.609 -10.824 1.00 0.00 O ATOM 1027 CB LYS A 90 -35.003 7.300 -8.447 1.00 0.00 C ATOM 1028 CG LYS A 90 -33.910 8.374 -8.180 1.00 0.00 C ATOM 1029 CD LYS A 90 -32.817 8.440 -9.270 1.00 0.00 C ATOM 1030 CE LYS A 90 -31.656 9.376 -8.912 1.00 0.00 C ATOM 1031 NZ LYS A 90 -32.106 10.765 -8.641 1.00 0.00 N ATOM 0 H LYS A 90 -34.620 7.925 -11.356 1.00 0.00 H new ATOM 0 HA LYS A 90 -36.703 6.758 -9.639 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -35.677 7.286 -7.590 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -34.515 6.326 -8.485 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -34.387 9.351 -8.098 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -33.439 8.168 -7.219 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -32.426 7.437 -9.443 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -33.267 8.772 -10.206 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -31.138 8.988 -8.035 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -30.935 9.384 -9.730 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -31.305 11.418 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -32.861 11.022 -9.309 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -32.468 10.829 -7.668 1.00 0.00 H new ATOM 1045 N VAL A 91 -37.290 9.298 -8.969 1.00 0.00 N ATOM 1046 CA VAL A 91 -37.883 10.658 -8.952 1.00 0.00 C ATOM 1047 C VAL A 91 -37.396 11.408 -7.683 1.00 0.00 C ATOM 1048 O VAL A 91 -38.033 12.330 -7.172 1.00 0.00 O ATOM 1049 CB VAL A 91 -39.466 10.560 -9.041 1.00 0.00 C ATOM 1050 CG1 VAL A 91 -40.074 9.889 -7.782 1.00 0.00 C ATOM 1051 CG2 VAL A 91 -40.127 11.937 -9.344 1.00 0.00 C ATOM 0 H VAL A 91 -37.615 8.702 -8.208 1.00 0.00 H new ATOM 0 HA VAL A 91 -37.555 11.231 -9.820 1.00 0.00 H new ATOM 0 HB VAL A 91 -39.693 9.914 -9.889 1.00 0.00 H new ATOM 0 HG11 VAL A 91 -41.158 9.841 -7.883 1.00 0.00 H new ATOM 0 HG12 VAL A 91 -39.675 8.880 -7.679 1.00 0.00 H new ATOM 0 HG13 VAL A 91 -39.817 10.473 -6.898 1.00 0.00 H new ATOM 0 HG21 VAL A 91 -41.209 11.818 -9.395 1.00 0.00 H new ATOM 0 HG22 VAL A 91 -39.877 12.643 -8.552 1.00 0.00 H new ATOM 0 HG23 VAL A 91 -39.758 12.316 -10.297 1.00 0.00 H new ATOM 1061 N ILE A 92 -36.211 11.007 -7.213 1.00 0.00 N ATOM 1062 CA ILE A 92 -35.600 11.522 -5.975 1.00 0.00 C ATOM 1063 C ILE A 92 -34.370 12.382 -6.327 1.00 0.00 C ATOM 1064 O ILE A 92 -33.222 11.911 -6.311 1.00 0.00 O ATOM 1065 CB ILE A 92 -35.220 10.357 -4.970 1.00 0.00 C ATOM 1066 CG1 ILE A 92 -36.453 9.414 -4.728 1.00 0.00 C ATOM 1067 CG2 ILE A 92 -34.689 10.938 -3.627 1.00 0.00 C ATOM 1068 CD1 ILE A 92 -36.186 8.215 -3.826 1.00 0.00 C ATOM 0 H ILE A 92 -35.639 10.307 -7.685 1.00 0.00 H new ATOM 0 HA ILE A 92 -36.335 12.143 -5.463 1.00 0.00 H new ATOM 0 HB ILE A 92 -34.422 9.764 -5.417 1.00 0.00 H new ATOM 0 HG12 ILE A 92 -37.261 10.003 -4.293 1.00 0.00 H new ATOM 0 HG13 ILE A 92 -36.807 9.051 -5.693 1.00 0.00 H new ATOM 0 HG21 ILE A 92 -34.434 10.121 -2.952 1.00 0.00 H new ATOM 0 HG22 ILE A 92 -33.801 11.541 -3.817 1.00 0.00 H new ATOM 0 HG23 ILE A 92 -35.459 11.559 -3.170 1.00 0.00 H new ATOM 0 HD11 ILE A 92 -37.098 7.628 -3.722 1.00 0.00 H new ATOM 0 HD12 ILE A 92 -35.404 7.596 -4.266 1.00 0.00 H new ATOM 0 HD13 ILE A 92 -35.864 8.563 -2.844 1.00 0.00 H new ATOM 1080 N ASP A 93 -34.662 13.612 -6.754 1.00 0.00 N ATOM 1081 CA ASP A 93 -33.677 14.691 -6.884 1.00 0.00 C ATOM 1082 C ASP A 93 -34.447 16.013 -6.962 1.00 0.00 C ATOM 1083 O ASP A 93 -34.833 16.452 -8.050 1.00 0.00 O ATOM 1084 CB ASP A 93 -32.743 14.523 -8.121 1.00 0.00 C ATOM 1085 CG ASP A 93 -31.605 15.568 -8.140 1.00 0.00 C ATOM 1086 OD1 ASP A 93 -30.576 15.337 -7.466 1.00 0.00 O ATOM 1087 OD2 ASP A 93 -31.745 16.635 -8.781 1.00 0.00 O ATOM 0 H ASP A 93 -35.605 13.892 -7.024 1.00 0.00 H new ATOM 0 HA ASP A 93 -33.017 14.669 -6.017 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -32.314 13.521 -8.116 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -33.332 14.613 -9.034 1.00 0.00 H new ATOM 1092 N LEU A 94 -34.737 16.599 -5.795 1.00 0.00 N ATOM 1093 CA LEU A 94 -35.529 17.845 -5.700 1.00 0.00 C ATOM 1094 C LEU A 94 -34.616 19.059 -5.474 1.00 0.00 C ATOM 1095 O LEU A 94 -34.927 20.157 -5.928 1.00 0.00 O ATOM 1096 CB LEU A 94 -36.623 17.743 -4.590 1.00 0.00 C ATOM 1097 CG LEU A 94 -36.191 17.841 -3.080 1.00 0.00 C ATOM 1098 CD1 LEU A 94 -37.437 17.844 -2.160 1.00 0.00 C ATOM 1099 CD2 LEU A 94 -35.207 16.720 -2.660 1.00 0.00 C ATOM 0 H LEU A 94 -34.435 16.232 -4.893 1.00 0.00 H new ATOM 0 HA LEU A 94 -36.043 17.985 -6.651 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -37.353 18.531 -4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -37.139 16.792 -4.723 1.00 0.00 H new ATOM 0 HG LEU A 94 -35.657 18.784 -2.966 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -37.121 17.912 -1.119 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -38.068 18.699 -2.404 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -38.001 16.923 -2.308 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -34.945 16.840 -1.609 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -35.678 15.748 -2.808 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -34.304 16.782 -3.268 1.00 0.00 H new ATOM 1111 N THR A 95 -33.476 18.853 -4.790 1.00 0.00 N ATOM 1112 CA THR A 95 -32.577 19.958 -4.405 1.00 0.00 C ATOM 1113 C THR A 95 -31.321 20.018 -5.306 1.00 0.00 C ATOM 1114 O THR A 95 -30.606 19.024 -5.498 1.00 0.00 O ATOM 1115 CB THR A 95 -32.199 19.894 -2.886 1.00 0.00 C ATOM 1116 OG1 THR A 95 -31.434 21.049 -2.528 1.00 0.00 O ATOM 1117 CG2 THR A 95 -31.420 18.630 -2.498 1.00 0.00 C ATOM 0 H THR A 95 -33.155 17.932 -4.492 1.00 0.00 H new ATOM 0 HA THR A 95 -33.126 20.887 -4.561 1.00 0.00 H new ATOM 0 HB THR A 95 -33.141 19.865 -2.338 1.00 0.00 H new ATOM 0 HG1 THR A 95 -31.828 21.844 -2.943 1.00 0.00 H new ATOM 0 HG21 THR A 95 -31.193 18.655 -1.432 1.00 0.00 H new ATOM 0 HG22 THR A 95 -32.022 17.749 -2.720 1.00 0.00 H new ATOM 0 HG23 THR A 95 -30.491 18.587 -3.066 1.00 0.00 H new ATOM 1125 N HIS A 96 -31.130 21.197 -5.907 1.00 0.00 N ATOM 1126 CA HIS A 96 -29.962 21.562 -6.732 1.00 0.00 C ATOM 1127 C HIS A 96 -30.036 23.082 -6.967 1.00 0.00 C ATOM 1128 O HIS A 96 -29.709 23.589 -8.040 1.00 0.00 O ATOM 1129 CB HIS A 96 -29.908 20.741 -8.072 1.00 0.00 C ATOM 1130 CG HIS A 96 -31.202 20.695 -8.851 1.00 0.00 C ATOM 1131 ND1 HIS A 96 -32.068 19.615 -8.811 1.00 0.00 N ATOM 1132 CD2 HIS A 96 -31.774 21.590 -9.691 1.00 0.00 C ATOM 1133 CE1 HIS A 96 -33.109 19.861 -9.576 1.00 0.00 C ATOM 1134 NE2 HIS A 96 -32.956 21.053 -10.122 1.00 0.00 N ATOM 0 H HIS A 96 -31.808 21.956 -5.832 1.00 0.00 H new ATOM 0 HA HIS A 96 -29.034 21.311 -6.218 1.00 0.00 H new ATOM 0 HB2 HIS A 96 -29.134 21.167 -8.710 1.00 0.00 H new ATOM 0 HB3 HIS A 96 -29.605 19.720 -7.842 1.00 0.00 H new ATOM 0 HD1 HIS A 96 -31.921 18.762 -8.272 1.00 0.00 H new ATOM 0 HD2 HIS A 96 -31.371 22.552 -9.970 1.00 0.00 H new ATOM 0 HE1 HIS A 96 -33.948 19.199 -9.731 1.00 0.00 H new ATOM 1143 N ASP A 97 -30.459 23.789 -5.896 1.00 0.00 N ATOM 1144 CA ASP A 97 -30.844 25.209 -5.929 1.00 0.00 C ATOM 1145 C ASP A 97 -29.620 26.121 -5.950 1.00 0.00 C ATOM 1146 O ASP A 97 -29.546 27.042 -6.775 1.00 0.00 O ATOM 1147 CB ASP A 97 -31.726 25.544 -4.696 1.00 0.00 C ATOM 1148 CG ASP A 97 -32.922 24.594 -4.554 1.00 0.00 C ATOM 1149 OD1 ASP A 97 -32.745 23.486 -3.997 1.00 0.00 O ATOM 1150 OD2 ASP A 97 -34.036 24.932 -5.018 1.00 0.00 O ATOM 0 H ASP A 97 -30.542 23.376 -4.967 1.00 0.00 H new ATOM 0 HA ASP A 97 -31.409 25.382 -6.845 1.00 0.00 H new ATOM 0 HB2 ASP A 97 -31.117 25.494 -3.793 1.00 0.00 H new ATOM 0 HB3 ASP A 97 -32.088 26.569 -4.780 1.00 0.00 H new ATOM 1155 N ASN A 98 -28.672 25.857 -5.028 1.00 0.00 N ATOM 1156 CA ASN A 98 -27.448 26.663 -4.898 1.00 0.00 C ATOM 1157 C ASN A 98 -26.525 26.404 -6.118 1.00 0.00 C ATOM 1158 O ASN A 98 -26.027 25.292 -6.331 1.00 0.00 O ATOM 1159 CB ASN A 98 -26.735 26.421 -3.518 1.00 0.00 C ATOM 1160 CG ASN A 98 -25.987 25.089 -3.367 1.00 0.00 C ATOM 1161 OD1 ASN A 98 -26.562 24.060 -2.991 1.00 0.00 O ATOM 1162 ND2 ASN A 98 -24.691 25.107 -3.645 1.00 0.00 N ATOM 0 H ASN A 98 -28.734 25.088 -4.361 1.00 0.00 H new ATOM 0 HA ASN A 98 -27.712 27.721 -4.902 1.00 0.00 H new ATOM 0 HB2 ASN A 98 -26.027 27.233 -3.351 1.00 0.00 H new ATOM 0 HB3 ASN A 98 -27.484 26.485 -2.729 1.00 0.00 H new ATOM 0 HD21 ASN A 98 -24.137 24.255 -3.551 1.00 0.00 H new ATOM 0 HD22 ASN A 98 -24.247 25.972 -3.953 1.00 0.00 H new ATOM 1169 N LYS A 99 -26.393 27.425 -6.969 1.00 0.00 N ATOM 1170 CA LYS A 99 -25.592 27.345 -8.201 1.00 0.00 C ATOM 1171 C LYS A 99 -24.096 27.563 -7.905 1.00 0.00 C ATOM 1172 O LYS A 99 -23.733 28.318 -6.999 1.00 0.00 O ATOM 1173 CB LYS A 99 -26.161 28.315 -9.302 1.00 0.00 C ATOM 1174 CG LYS A 99 -26.728 29.682 -8.813 1.00 0.00 C ATOM 1175 CD LYS A 99 -25.656 30.681 -8.323 1.00 0.00 C ATOM 1176 CE LYS A 99 -26.249 31.964 -7.709 1.00 0.00 C ATOM 1177 NZ LYS A 99 -27.075 32.725 -8.670 1.00 0.00 N ATOM 0 H LYS A 99 -26.837 28.332 -6.826 1.00 0.00 H new ATOM 0 HA LYS A 99 -25.673 26.338 -8.610 1.00 0.00 H new ATOM 0 HB2 LYS A 99 -25.367 28.515 -10.021 1.00 0.00 H new ATOM 0 HB3 LYS A 99 -26.953 27.792 -9.839 1.00 0.00 H new ATOM 0 HG2 LYS A 99 -27.289 30.141 -9.627 1.00 0.00 H new ATOM 0 HG3 LYS A 99 -27.434 29.499 -8.003 1.00 0.00 H new ATOM 0 HD2 LYS A 99 -25.025 30.191 -7.582 1.00 0.00 H new ATOM 0 HD3 LYS A 99 -25.013 30.952 -9.160 1.00 0.00 H new ATOM 0 HE2 LYS A 99 -26.856 31.701 -6.843 1.00 0.00 H new ATOM 0 HE3 LYS A 99 -25.439 32.599 -7.350 1.00 0.00 H new ATOM 0 HZ1 LYS A 99 -27.435 33.586 -8.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 99 -26.497 32.987 -9.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 99 -27.875 32.138 -8.981 1.00 0.00 H new ATOM 1191 N ASP A 100 -23.241 26.862 -8.668 1.00 0.00 N ATOM 1192 CA ASP A 100 -21.773 26.911 -8.500 1.00 0.00 C ATOM 1193 C ASP A 100 -21.170 28.067 -9.326 1.00 0.00 C ATOM 1194 O ASP A 100 -19.959 28.310 -9.278 1.00 0.00 O ATOM 1195 CB ASP A 100 -21.169 25.535 -8.898 1.00 0.00 C ATOM 1196 CG ASP A 100 -19.658 25.399 -8.625 1.00 0.00 C ATOM 1197 OD1 ASP A 100 -19.271 25.288 -7.438 1.00 0.00 O ATOM 1198 OD2 ASP A 100 -18.854 25.430 -9.589 1.00 0.00 O ATOM 0 H ASP A 100 -23.545 26.244 -9.420 1.00 0.00 H new ATOM 0 HA ASP A 100 -21.526 27.106 -7.456 1.00 0.00 H new ATOM 0 HB2 ASP A 100 -21.696 24.750 -8.355 1.00 0.00 H new ATOM 0 HB3 ASP A 100 -21.351 25.366 -9.959 1.00 0.00 H new ATOM 1203 N ASP A 101 -22.047 28.795 -10.059 1.00 0.00 N ATOM 1204 CA ASP A 101 -21.672 29.930 -10.927 1.00 0.00 C ATOM 1205 C ASP A 101 -20.853 30.985 -10.163 1.00 0.00 C ATOM 1206 O ASP A 101 -19.762 31.350 -10.605 1.00 0.00 O ATOM 1207 CB ASP A 101 -22.936 30.582 -11.554 1.00 0.00 C ATOM 1208 CG ASP A 101 -23.703 29.640 -12.498 1.00 0.00 C ATOM 1209 OD1 ASP A 101 -24.309 28.670 -12.005 1.00 0.00 O ATOM 1210 OD2 ASP A 101 -23.704 29.859 -13.727 1.00 0.00 O ATOM 0 H ASP A 101 -23.049 28.605 -10.061 1.00 0.00 H new ATOM 0 HA ASP A 101 -21.044 29.535 -11.726 1.00 0.00 H new ATOM 0 HB2 ASP A 101 -23.603 30.906 -10.755 1.00 0.00 H new ATOM 0 HB3 ASP A 101 -22.640 31.475 -12.105 1.00 0.00 H new ATOM 1215 N LEU A 102 -21.365 31.428 -8.992 1.00 0.00 N ATOM 1216 CA LEU A 102 -20.703 32.492 -8.186 1.00 0.00 C ATOM 1217 C LEU A 102 -19.474 31.959 -7.411 1.00 0.00 C ATOM 1218 O LEU A 102 -18.593 32.747 -7.065 1.00 0.00 O ATOM 1219 CB LEU A 102 -21.722 33.282 -7.271 1.00 0.00 C ATOM 1220 CG LEU A 102 -22.301 32.642 -5.942 1.00 0.00 C ATOM 1221 CD1 LEU A 102 -22.768 31.190 -6.140 1.00 0.00 C ATOM 1222 CD2 LEU A 102 -21.329 32.780 -4.733 1.00 0.00 C ATOM 0 H LEU A 102 -22.228 31.071 -8.582 1.00 0.00 H new ATOM 0 HA LEU A 102 -20.316 33.226 -8.893 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -21.237 34.217 -6.989 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -22.576 33.542 -7.897 1.00 0.00 H new ATOM 0 HG LEU A 102 -23.188 33.226 -5.695 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -23.155 30.801 -5.198 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -23.553 31.160 -6.895 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -21.927 30.579 -6.467 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -21.778 32.324 -3.851 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -20.389 32.278 -4.962 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -21.138 33.835 -4.538 1.00 0.00 H new ATOM 1234 N GLN A 103 -19.408 30.628 -7.145 1.00 0.00 N ATOM 1235 CA GLN A 103 -18.180 29.988 -6.596 1.00 0.00 C ATOM 1236 C GLN A 103 -17.031 30.182 -7.595 1.00 0.00 C ATOM 1237 O GLN A 103 -15.992 30.760 -7.262 1.00 0.00 O ATOM 1238 CB GLN A 103 -18.361 28.457 -6.309 1.00 0.00 C ATOM 1239 CG GLN A 103 -19.017 28.080 -4.968 1.00 0.00 C ATOM 1240 CD GLN A 103 -20.456 28.544 -4.838 1.00 0.00 C ATOM 1241 OE1 GLN A 103 -21.393 27.734 -5.304 1.00 0.00 O flip ATOM 1242 NE2 GLN A 103 -20.715 29.632 -4.336 1.00 0.00 N flip ATOM 0 H GLN A 103 -20.182 29.982 -7.299 1.00 0.00 H new ATOM 0 HA GLN A 103 -17.962 30.467 -5.642 1.00 0.00 H new ATOM 0 HB2 GLN A 103 -18.959 28.028 -7.113 1.00 0.00 H new ATOM 0 HB3 GLN A 103 -17.380 27.984 -6.353 1.00 0.00 H new ATOM 0 HG2 GLN A 103 -18.982 26.997 -4.849 1.00 0.00 H new ATOM 0 HG3 GLN A 103 -18.432 28.509 -4.155 1.00 0.00 H new ATOM 0 HE21 GLN A 103 -19.962 30.226 -3.989 1.00 0.00 H new ATOM 0 HE22 GLN A 103 -21.684 29.943 -4.265 1.00 0.00 H new ATOM 1251 N ALA A 104 -17.283 29.722 -8.836 1.00 0.00 N ATOM 1252 CA ALA A 104 -16.318 29.774 -9.942 1.00 0.00 C ATOM 1253 C ALA A 104 -15.976 31.226 -10.330 1.00 0.00 C ATOM 1254 O ALA A 104 -14.829 31.518 -10.678 1.00 0.00 O ATOM 1255 CB ALA A 104 -16.880 28.996 -11.145 1.00 0.00 C ATOM 0 H ALA A 104 -18.174 29.300 -9.097 1.00 0.00 H new ATOM 0 HA ALA A 104 -15.388 29.308 -9.616 1.00 0.00 H new ATOM 0 HB1 ALA A 104 -16.166 29.033 -11.968 1.00 0.00 H new ATOM 0 HB2 ALA A 104 -17.051 27.958 -10.859 1.00 0.00 H new ATOM 0 HB3 ALA A 104 -17.821 29.445 -11.461 1.00 0.00 H new ATOM 1261 N ALA A 105 -16.976 32.124 -10.237 1.00 0.00 N ATOM 1262 CA ALA A 105 -16.835 33.538 -10.626 1.00 0.00 C ATOM 1263 C ALA A 105 -15.913 34.301 -9.652 1.00 0.00 C ATOM 1264 O ALA A 105 -14.899 34.874 -10.075 1.00 0.00 O ATOM 1265 CB ALA A 105 -18.215 34.209 -10.719 1.00 0.00 C ATOM 0 H ALA A 105 -17.905 31.887 -9.889 1.00 0.00 H new ATOM 0 HA ALA A 105 -16.368 33.572 -11.610 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -18.093 35.253 -11.007 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -18.820 33.695 -11.466 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -18.712 34.156 -9.750 1.00 0.00 H new ATOM 1271 N ILE A 106 -16.262 34.269 -8.345 1.00 0.00 N ATOM 1272 CA ILE A 106 -15.507 34.977 -7.286 1.00 0.00 C ATOM 1273 C ILE A 106 -14.080 34.393 -7.160 1.00 0.00 C ATOM 1274 O ILE A 106 -13.120 35.149 -7.010 1.00 0.00 O ATOM 1275 CB ILE A 106 -16.250 34.906 -5.889 1.00 0.00 C ATOM 1276 CG1 ILE A 106 -17.684 35.543 -5.972 1.00 0.00 C ATOM 1277 CG2 ILE A 106 -15.418 35.575 -4.754 1.00 0.00 C ATOM 1278 CD1 ILE A 106 -17.723 37.044 -6.244 1.00 0.00 C ATOM 0 H ILE A 106 -17.071 33.754 -7.996 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.441 36.026 -7.575 1.00 0.00 H new ATOM 0 HB ILE A 106 -16.359 33.850 -5.641 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -18.243 35.035 -6.758 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -18.204 35.348 -5.034 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -15.964 35.504 -3.813 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -14.459 35.065 -4.657 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -15.248 36.624 -4.997 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -18.759 37.380 -6.281 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -17.199 37.572 -5.447 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -17.239 37.254 -7.198 1.00 0.00 H new ATOM 1290 N ALA A 107 -13.965 33.045 -7.254 1.00 0.00 N ATOM 1291 CA ALA A 107 -12.671 32.329 -7.149 1.00 0.00 C ATOM 1292 C ALA A 107 -11.723 32.700 -8.303 1.00 0.00 C ATOM 1293 O ALA A 107 -10.561 33.024 -8.065 1.00 0.00 O ATOM 1294 CB ALA A 107 -12.893 30.809 -7.094 1.00 0.00 C ATOM 0 H ALA A 107 -14.763 32.427 -7.404 1.00 0.00 H new ATOM 0 HA ALA A 107 -12.196 32.643 -6.219 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -11.930 30.303 -7.017 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -13.503 30.562 -6.225 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -13.403 30.483 -8.000 1.00 0.00 H new ATOM 1300 N LEU A 108 -12.241 32.688 -9.550 1.00 0.00 N ATOM 1301 CA LEU A 108 -11.442 33.034 -10.755 1.00 0.00 C ATOM 1302 C LEU A 108 -11.025 34.521 -10.719 1.00 0.00 C ATOM 1303 O LEU A 108 -9.950 34.891 -11.211 1.00 0.00 O ATOM 1304 CB LEU A 108 -12.238 32.709 -12.051 1.00 0.00 C ATOM 1305 CG LEU A 108 -11.488 32.937 -13.411 1.00 0.00 C ATOM 1306 CD1 LEU A 108 -10.211 32.062 -13.516 1.00 0.00 C ATOM 1307 CD2 LEU A 108 -12.431 32.699 -14.615 1.00 0.00 C ATOM 0 H LEU A 108 -13.210 32.443 -9.753 1.00 0.00 H new ATOM 0 HA LEU A 108 -10.536 32.428 -10.756 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -12.552 31.666 -12.006 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -13.144 33.315 -12.056 1.00 0.00 H new ATOM 0 HG LEU A 108 -11.169 33.979 -13.436 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -9.720 32.248 -14.471 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -9.530 32.313 -12.703 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -10.485 31.009 -13.448 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -11.884 32.864 -15.543 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -12.802 31.674 -14.590 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -13.272 33.391 -14.561 1.00 0.00 H new ATOM 1319 N SER A 109 -11.889 35.355 -10.110 1.00 0.00 N ATOM 1320 CA SER A 109 -11.617 36.784 -9.882 1.00 0.00 C ATOM 1321 C SER A 109 -10.545 36.972 -8.785 1.00 0.00 C ATOM 1322 O SER A 109 -9.738 37.904 -8.853 1.00 0.00 O ATOM 1323 CB SER A 109 -12.932 37.501 -9.500 1.00 0.00 C ATOM 1324 OG SER A 109 -12.760 38.907 -9.393 1.00 0.00 O ATOM 0 H SER A 109 -12.799 35.054 -9.761 1.00 0.00 H new ATOM 0 HA SER A 109 -11.226 37.224 -10.799 1.00 0.00 H new ATOM 0 HB2 SER A 109 -13.694 37.285 -10.249 1.00 0.00 H new ATOM 0 HB3 SER A 109 -13.297 37.107 -8.552 1.00 0.00 H new ATOM 0 HG SER A 109 -13.614 39.324 -9.152 1.00 0.00 H new ATOM 1330 N LEU A 110 -10.541 36.066 -7.790 1.00 0.00 N ATOM 1331 CA LEU A 110 -9.610 36.105 -6.644 1.00 0.00 C ATOM 1332 C LEU A 110 -8.181 35.738 -7.081 1.00 0.00 C ATOM 1333 O LEU A 110 -7.214 36.406 -6.688 1.00 0.00 O ATOM 1334 CB LEU A 110 -10.119 35.164 -5.518 1.00 0.00 C ATOM 1335 CG LEU A 110 -9.249 35.080 -4.219 1.00 0.00 C ATOM 1336 CD1 LEU A 110 -9.005 36.473 -3.589 1.00 0.00 C ATOM 1337 CD2 LEU A 110 -9.881 34.114 -3.191 1.00 0.00 C ATOM 0 H LEU A 110 -11.189 35.279 -7.757 1.00 0.00 H new ATOM 0 HA LEU A 110 -9.576 37.122 -6.253 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -11.122 35.485 -5.235 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -10.211 34.159 -5.931 1.00 0.00 H new ATOM 0 HG LEU A 110 -8.276 34.684 -4.511 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -8.397 36.365 -2.691 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -8.485 37.110 -4.304 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -9.961 36.927 -3.328 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -9.257 34.074 -2.298 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -10.876 34.468 -2.923 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -9.956 33.118 -3.626 1.00 0.00 H new ATOM 1349 N LEU A 111 -8.059 34.680 -7.897 1.00 0.00 N ATOM 1350 CA LEU A 111 -6.773 34.290 -8.516 1.00 0.00 C ATOM 1351 C LEU A 111 -6.384 35.304 -9.603 1.00 0.00 C ATOM 1352 O LEU A 111 -5.189 35.523 -9.820 1.00 0.00 O ATOM 1353 CB LEU A 111 -6.828 32.848 -9.119 1.00 0.00 C ATOM 1354 CG LEU A 111 -6.732 31.640 -8.114 1.00 0.00 C ATOM 1355 CD1 LEU A 111 -5.437 31.708 -7.268 1.00 0.00 C ATOM 1356 CD2 LEU A 111 -7.978 31.534 -7.211 1.00 0.00 C ATOM 0 H LEU A 111 -8.839 34.072 -8.148 1.00 0.00 H new ATOM 0 HA LEU A 111 -6.016 34.288 -7.732 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -7.760 32.751 -9.675 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -6.016 32.753 -9.839 1.00 0.00 H new ATOM 0 HG LEU A 111 -6.692 30.733 -8.717 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -5.403 30.859 -6.585 1.00 0.00 H new ATOM 0 HD12 LEU A 111 -4.570 31.678 -7.927 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -5.425 32.635 -6.695 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -7.866 30.686 -6.535 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -8.085 32.450 -6.630 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -8.864 31.390 -7.829 1.00 0.00 H new ATOM 1368 N GLU A 112 -7.420 35.883 -10.286 1.00 0.00 N ATOM 1369 CA GLU A 112 -7.318 36.911 -11.376 1.00 0.00 C ATOM 1370 C GLU A 112 -6.314 36.546 -12.501 1.00 0.00 C ATOM 1371 O GLU A 112 -5.900 37.404 -13.293 1.00 0.00 O ATOM 1372 CB GLU A 112 -7.068 38.346 -10.794 1.00 0.00 C ATOM 1373 CG GLU A 112 -5.674 38.609 -10.176 1.00 0.00 C ATOM 1374 CD GLU A 112 -5.543 40.010 -9.562 1.00 0.00 C ATOM 1375 OE1 GLU A 112 -5.169 40.954 -10.282 1.00 0.00 O ATOM 1376 OE2 GLU A 112 -5.805 40.171 -8.350 1.00 0.00 O ATOM 0 H GLU A 112 -8.389 35.637 -10.085 1.00 0.00 H new ATOM 0 HA GLU A 112 -8.292 36.918 -11.866 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -7.229 39.070 -11.592 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -7.821 38.540 -10.031 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -5.477 37.862 -9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -4.912 38.483 -10.945 1.00 0.00 H new ATOM 1383 N SER A 113 -6.004 35.248 -12.609 1.00 0.00 N ATOM 1384 CA SER A 113 -5.045 34.707 -13.579 1.00 0.00 C ATOM 1385 C SER A 113 -5.728 33.552 -14.344 1.00 0.00 C ATOM 1386 O SER A 113 -6.203 32.599 -13.708 1.00 0.00 O ATOM 1387 CB SER A 113 -3.769 34.227 -12.840 1.00 0.00 C ATOM 1388 OG SER A 113 -4.084 33.367 -11.758 1.00 0.00 O ATOM 0 H SER A 113 -6.420 34.532 -12.014 1.00 0.00 H new ATOM 0 HA SER A 113 -4.742 35.473 -14.293 1.00 0.00 H new ATOM 0 HB2 SER A 113 -3.116 33.707 -13.541 1.00 0.00 H new ATOM 0 HB3 SER A 113 -3.216 35.090 -12.470 1.00 0.00 H new ATOM 0 HG SER A 113 -4.460 33.893 -11.021 1.00 0.00 H new ATOM 1394 N PRO A 114 -5.848 33.640 -15.712 1.00 0.00 N ATOM 1395 CA PRO A 114 -6.389 32.537 -16.539 1.00 0.00 C ATOM 1396 C PRO A 114 -5.375 31.374 -16.661 1.00 0.00 C ATOM 1397 O PRO A 114 -4.659 31.259 -17.664 1.00 0.00 O ATOM 1398 CB PRO A 114 -6.678 33.218 -17.907 1.00 0.00 C ATOM 1399 CG PRO A 114 -5.695 34.354 -17.975 1.00 0.00 C ATOM 1400 CD PRO A 114 -5.509 34.833 -16.546 1.00 0.00 C ATOM 0 HA PRO A 114 -7.280 32.077 -16.112 1.00 0.00 H new ATOM 0 HB2 PRO A 114 -6.539 32.522 -18.734 1.00 0.00 H new ATOM 0 HB3 PRO A 114 -7.705 33.578 -17.962 1.00 0.00 H new ATOM 0 HG2 PRO A 114 -4.748 34.025 -18.403 1.00 0.00 H new ATOM 0 HG3 PRO A 114 -6.070 35.157 -18.610 1.00 0.00 H new ATOM 0 HD2 PRO A 114 -4.487 35.166 -16.368 1.00 0.00 H new ATOM 0 HD3 PRO A 114 -6.163 35.675 -16.320 1.00 0.00 H new ATOM 1408 N LYS A 115 -5.259 30.591 -15.563 1.00 0.00 N ATOM 1409 CA LYS A 115 -4.389 29.392 -15.459 1.00 0.00 C ATOM 1410 C LYS A 115 -2.873 29.751 -15.523 1.00 0.00 C ATOM 1411 O LYS A 115 -2.001 28.868 -15.543 1.00 0.00 O ATOM 1412 CB LYS A 115 -4.810 28.322 -16.526 1.00 0.00 C ATOM 1413 CG LYS A 115 -4.166 26.913 -16.384 1.00 0.00 C ATOM 1414 CD LYS A 115 -4.367 26.280 -14.977 1.00 0.00 C ATOM 1415 CE LYS A 115 -5.846 26.084 -14.586 1.00 0.00 C ATOM 1416 NZ LYS A 115 -6.556 25.179 -15.522 1.00 0.00 N ATOM 0 H LYS A 115 -5.778 30.778 -14.705 1.00 0.00 H new ATOM 0 HA LYS A 115 -4.536 28.949 -14.474 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -5.893 28.208 -16.487 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -4.566 28.711 -17.515 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -4.592 26.250 -17.137 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -3.099 26.987 -16.592 1.00 0.00 H new ATOM 0 HD2 LYS A 115 -3.863 25.314 -14.948 1.00 0.00 H new ATOM 0 HD3 LYS A 115 -3.885 26.913 -14.232 1.00 0.00 H new ATOM 0 HE2 LYS A 115 -5.903 25.677 -13.576 1.00 0.00 H new ATOM 0 HE3 LYS A 115 -6.347 27.052 -14.568 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 -7.537 25.049 -15.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 -6.555 25.595 -16.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -6.075 24.257 -15.546 1.00 0.00 H new ATOM 1430 N ILE A 116 -2.559 31.059 -15.490 1.00 0.00 N ATOM 1431 CA ILE A 116 -1.176 31.544 -15.500 1.00 0.00 C ATOM 1432 C ILE A 116 -0.606 31.424 -14.072 1.00 0.00 C ATOM 1433 O ILE A 116 -0.841 32.282 -13.214 1.00 0.00 O ATOM 1434 CB ILE A 116 -1.073 33.029 -16.035 1.00 0.00 C ATOM 1435 CG1 ILE A 116 -1.757 33.170 -17.440 1.00 0.00 C ATOM 1436 CG2 ILE A 116 0.404 33.502 -16.091 1.00 0.00 C ATOM 1437 CD1 ILE A 116 -1.143 32.313 -18.543 1.00 0.00 C ATOM 0 H ILE A 116 -3.257 31.802 -15.456 1.00 0.00 H new ATOM 0 HA ILE A 116 -0.589 30.933 -16.186 1.00 0.00 H new ATOM 0 HB ILE A 116 -1.605 33.672 -15.334 1.00 0.00 H new ATOM 0 HG12 ILE A 116 -2.811 32.910 -17.342 1.00 0.00 H new ATOM 0 HG13 ILE A 116 -1.714 34.215 -17.746 1.00 0.00 H new ATOM 0 HG21 ILE A 116 0.444 34.526 -16.462 1.00 0.00 H new ATOM 0 HG22 ILE A 116 0.837 33.461 -15.092 1.00 0.00 H new ATOM 0 HG23 ILE A 116 0.969 32.852 -16.758 1.00 0.00 H new ATOM 0 HD11 ILE A 116 -1.683 32.479 -19.475 1.00 0.00 H new ATOM 0 HD12 ILE A 116 -0.096 32.586 -18.676 1.00 0.00 H new ATOM 0 HD13 ILE A 116 -1.211 31.261 -18.267 1.00 0.00 H new ATOM 1449 N GLN A 117 0.102 30.312 -13.822 1.00 0.00 N ATOM 1450 CA GLN A 117 0.677 29.989 -12.504 1.00 0.00 C ATOM 1451 C GLN A 117 2.195 29.801 -12.637 1.00 0.00 C ATOM 1452 O GLN A 117 2.723 28.705 -12.429 1.00 0.00 O ATOM 1453 CB GLN A 117 -0.039 28.735 -11.913 1.00 0.00 C ATOM 1454 CG GLN A 117 -0.098 27.511 -12.859 1.00 0.00 C ATOM 1455 CD GLN A 117 -0.881 26.337 -12.275 1.00 0.00 C ATOM 1456 OE1 GLN A 117 -2.183 26.339 -12.477 1.00 0.00 O flip ATOM 1457 NE2 GLN A 117 -0.326 25.453 -11.616 1.00 0.00 N flip ATOM 0 H GLN A 117 0.294 29.606 -14.533 1.00 0.00 H new ATOM 0 HA GLN A 117 0.515 30.810 -11.805 1.00 0.00 H new ATOM 0 HB2 GLN A 117 0.471 28.442 -10.995 1.00 0.00 H new ATOM 0 HB3 GLN A 117 -1.057 29.012 -11.637 1.00 0.00 H new ATOM 0 HG2 GLN A 117 -0.555 27.811 -13.802 1.00 0.00 H new ATOM 0 HG3 GLN A 117 0.917 27.186 -13.085 1.00 0.00 H new ATOM 0 HE21 GLN A 117 0.684 25.479 -11.477 1.00 0.00 H new ATOM 0 HE22 GLN A 117 -0.878 24.697 -11.211 1.00 0.00 H new ATOM 1466 N ALA A 118 2.873 30.897 -13.056 1.00 0.00 N ATOM 1467 CA ALA A 118 4.346 30.959 -13.263 1.00 0.00 C ATOM 1468 C ALA A 118 4.813 30.253 -14.566 1.00 0.00 C ATOM 1469 O ALA A 118 5.852 30.612 -15.120 1.00 0.00 O ATOM 1470 CB ALA A 118 5.138 30.450 -12.036 1.00 0.00 C ATOM 0 H ALA A 118 2.406 31.780 -13.264 1.00 0.00 H new ATOM 0 HA ALA A 118 4.573 32.018 -13.383 1.00 0.00 H new ATOM 0 HB1 ALA A 118 6.207 30.517 -12.240 1.00 0.00 H new ATOM 0 HB2 ALA A 118 4.895 31.062 -11.167 1.00 0.00 H new ATOM 0 HB3 ALA A 118 4.871 29.412 -11.835 1.00 0.00 H new ATOM 1476 N ASP A 119 4.027 29.275 -15.064 1.00 0.00 N ATOM 1477 CA ASP A 119 4.386 28.446 -16.236 1.00 0.00 C ATOM 1478 C ASP A 119 3.991 29.118 -17.569 1.00 0.00 C ATOM 1479 O ASP A 119 4.561 28.781 -18.612 1.00 0.00 O ATOM 1480 CB ASP A 119 3.691 27.060 -16.133 1.00 0.00 C ATOM 1481 CG ASP A 119 4.019 26.330 -14.826 1.00 0.00 C ATOM 1482 OD1 ASP A 119 5.167 25.858 -14.671 1.00 0.00 O ATOM 1483 OD2 ASP A 119 3.139 26.235 -13.949 1.00 0.00 O ATOM 0 H ASP A 119 3.120 29.036 -14.662 1.00 0.00 H new ATOM 0 HA ASP A 119 5.470 28.327 -16.230 1.00 0.00 H new ATOM 0 HB2 ASP A 119 2.612 27.193 -16.209 1.00 0.00 H new ATOM 0 HB3 ASP A 119 3.997 26.441 -16.977 1.00 0.00 H new ATOM 1488 N GLY A 120 3.013 30.054 -17.528 1.00 0.00 N ATOM 1489 CA GLY A 120 2.454 30.662 -18.746 1.00 0.00 C ATOM 1490 C GLY A 120 3.303 31.813 -19.295 1.00 0.00 C ATOM 1491 O GLY A 120 4.493 31.635 -19.558 1.00 0.00 O ATOM 0 H GLY A 120 2.599 30.400 -16.662 1.00 0.00 H new ATOM 0 HA2 GLY A 120 2.355 29.895 -19.514 1.00 0.00 H new ATOM 0 HA3 GLY A 120 1.451 31.030 -18.532 1.00 0.00 H new ATOM 1495 N ARG A 121 2.682 33.007 -19.445 1.00 0.00 N ATOM 1496 CA ARG A 121 3.343 34.231 -19.983 1.00 0.00 C ATOM 1497 C ARG A 121 4.378 34.840 -19.004 1.00 0.00 C ATOM 1498 O ARG A 121 5.046 35.825 -19.337 1.00 0.00 O ATOM 1499 CB ARG A 121 2.252 35.276 -20.394 1.00 0.00 C ATOM 1500 CG ARG A 121 1.150 35.610 -19.339 1.00 0.00 C ATOM 1501 CD ARG A 121 1.639 36.428 -18.126 1.00 0.00 C ATOM 1502 NE ARG A 121 2.316 37.669 -18.535 1.00 0.00 N ATOM 1503 CZ ARG A 121 3.152 38.399 -17.769 1.00 0.00 C ATOM 1504 NH1 ARG A 121 3.460 38.023 -16.526 1.00 0.00 N ATOM 1505 NH2 ARG A 121 3.682 39.508 -18.257 1.00 0.00 N ATOM 0 H ARG A 121 1.704 33.154 -19.196 1.00 0.00 H new ATOM 0 HA ARG A 121 3.913 33.941 -20.865 1.00 0.00 H new ATOM 0 HB2 ARG A 121 2.757 36.204 -20.660 1.00 0.00 H new ATOM 0 HB3 ARG A 121 1.758 34.912 -21.295 1.00 0.00 H new ATOM 0 HG2 ARG A 121 0.350 36.162 -19.833 1.00 0.00 H new ATOM 0 HG3 ARG A 121 0.717 34.677 -18.979 1.00 0.00 H new ATOM 0 HD2 ARG A 121 0.790 36.672 -17.487 1.00 0.00 H new ATOM 0 HD3 ARG A 121 2.322 35.821 -17.531 1.00 0.00 H new ATOM 0 HE ARG A 121 2.137 38.007 -19.481 1.00 0.00 H new ATOM 0 HH11 ARG A 121 3.061 37.168 -16.138 1.00 0.00 H new ATOM 0 HH12 ARG A 121 4.095 38.590 -15.964 1.00 0.00 H new ATOM 0 HH21 ARG A 121 3.458 39.806 -19.206 1.00 0.00 H new ATOM 0 HH22 ARG A 121 4.315 40.066 -17.684 1.00 0.00 H new ATOM 1519 N ASP A 122 4.473 34.245 -17.802 1.00 0.00 N ATOM 1520 CA ASP A 122 5.366 34.674 -16.716 1.00 0.00 C ATOM 1521 C ASP A 122 6.862 34.497 -17.093 1.00 0.00 C ATOM 1522 O ASP A 122 7.725 35.168 -16.508 1.00 0.00 O ATOM 1523 CB ASP A 122 5.008 33.846 -15.458 1.00 0.00 C ATOM 1524 CG ASP A 122 5.757 34.277 -14.184 1.00 0.00 C ATOM 1525 OD1 ASP A 122 5.284 35.200 -13.491 1.00 0.00 O ATOM 1526 OD2 ASP A 122 6.808 33.684 -13.864 1.00 0.00 O ATOM 0 H ASP A 122 3.914 33.429 -17.554 1.00 0.00 H new ATOM 0 HA ASP A 122 5.225 35.738 -16.525 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.936 33.923 -15.279 1.00 0.00 H new ATOM 0 HB3 ASP A 122 5.223 32.796 -15.655 1.00 0.00 H new ATOM 1531 N LEU A 123 7.127 33.602 -18.089 1.00 0.00 N ATOM 1532 CA LEU A 123 8.482 33.231 -18.566 1.00 0.00 C ATOM 1533 C LEU A 123 9.175 32.392 -17.471 1.00 0.00 C ATOM 1534 O LEU A 123 9.677 32.938 -16.484 1.00 0.00 O ATOM 1535 CB LEU A 123 9.348 34.478 -18.986 1.00 0.00 C ATOM 1536 CG LEU A 123 10.481 34.265 -20.061 1.00 0.00 C ATOM 1537 CD1 LEU A 123 11.260 35.577 -20.300 1.00 0.00 C ATOM 1538 CD2 LEU A 123 11.453 33.112 -19.709 1.00 0.00 C ATOM 0 H LEU A 123 6.385 33.112 -18.589 1.00 0.00 H new ATOM 0 HA LEU A 123 8.380 32.638 -19.475 1.00 0.00 H new ATOM 0 HB2 LEU A 123 8.670 35.244 -19.363 1.00 0.00 H new ATOM 0 HB3 LEU A 123 9.813 34.880 -18.086 1.00 0.00 H new ATOM 0 HG LEU A 123 9.977 33.972 -20.982 1.00 0.00 H new ATOM 0 HD11 LEU A 123 12.037 35.408 -21.045 1.00 0.00 H new ATOM 0 HD12 LEU A 123 10.576 36.346 -20.657 1.00 0.00 H new ATOM 0 HD13 LEU A 123 11.718 35.904 -19.366 1.00 0.00 H new ATOM 0 HD21 LEU A 123 12.207 33.020 -20.491 1.00 0.00 H new ATOM 0 HD22 LEU A 123 11.940 33.325 -18.758 1.00 0.00 H new ATOM 0 HD23 LEU A 123 10.896 32.178 -19.631 1.00 0.00 H new ATOM 1550 N ASN A 124 9.184 31.071 -17.662 1.00 0.00 N ATOM 1551 CA ASN A 124 9.810 30.111 -16.742 1.00 0.00 C ATOM 1552 C ASN A 124 10.195 28.855 -17.529 1.00 0.00 C ATOM 1553 O ASN A 124 9.520 28.507 -18.498 1.00 0.00 O ATOM 1554 CB ASN A 124 8.843 29.749 -15.583 1.00 0.00 C ATOM 1555 CG ASN A 124 9.452 28.796 -14.546 1.00 0.00 C ATOM 1556 OD1 ASN A 124 10.645 28.856 -14.248 1.00 0.00 O ATOM 1557 ND2 ASN A 124 8.649 27.908 -13.994 1.00 0.00 N ATOM 0 H ASN A 124 8.750 30.628 -18.472 1.00 0.00 H new ATOM 0 HA ASN A 124 10.701 30.558 -16.302 1.00 0.00 H new ATOM 0 HB2 ASN A 124 8.531 30.666 -15.082 1.00 0.00 H new ATOM 0 HB3 ASN A 124 7.945 29.292 -16.000 1.00 0.00 H new ATOM 0 HD21 ASN A 124 9.013 27.251 -13.304 1.00 0.00 H new ATOM 0 HD22 ASN A 124 7.664 27.878 -14.257 1.00 0.00 H new ATOM 1564 N ARG A 125 11.294 28.194 -17.116 1.00 0.00 N ATOM 1565 CA ARG A 125 11.728 26.904 -17.694 1.00 0.00 C ATOM 1566 C ARG A 125 10.809 25.785 -17.168 1.00 0.00 C ATOM 1567 O ARG A 125 11.093 25.139 -16.154 1.00 0.00 O ATOM 1568 CB ARG A 125 13.232 26.607 -17.378 1.00 0.00 C ATOM 1569 CG ARG A 125 14.254 27.401 -18.228 1.00 0.00 C ATOM 1570 CD ARG A 125 14.179 28.927 -18.036 1.00 0.00 C ATOM 1571 NE ARG A 125 15.076 29.628 -18.971 1.00 0.00 N ATOM 1572 CZ ARG A 125 15.234 30.960 -19.055 1.00 0.00 C ATOM 1573 NH1 ARG A 125 14.571 31.783 -18.250 1.00 0.00 N ATOM 1574 NH2 ARG A 125 16.062 31.466 -19.961 1.00 0.00 N ATOM 0 H ARG A 125 11.905 28.537 -16.375 1.00 0.00 H new ATOM 0 HA ARG A 125 11.646 26.955 -18.780 1.00 0.00 H new ATOM 0 HB2 ARG A 125 13.415 26.822 -16.325 1.00 0.00 H new ATOM 0 HB3 ARG A 125 13.413 25.542 -17.522 1.00 0.00 H new ATOM 0 HG2 ARG A 125 15.260 27.063 -17.978 1.00 0.00 H new ATOM 0 HG3 ARG A 125 14.093 27.169 -19.281 1.00 0.00 H new ATOM 0 HD2 ARG A 125 13.154 29.265 -18.189 1.00 0.00 H new ATOM 0 HD3 ARG A 125 14.449 29.181 -17.011 1.00 0.00 H new ATOM 0 HE ARG A 125 15.625 29.053 -19.610 1.00 0.00 H new ATOM 0 HH11 ARG A 125 13.929 31.407 -17.553 1.00 0.00 H new ATOM 0 HH12 ARG A 125 14.704 32.791 -18.329 1.00 0.00 H new ATOM 0 HH21 ARG A 125 16.573 30.845 -20.588 1.00 0.00 H new ATOM 0 HH22 ARG A 125 16.187 32.476 -20.030 1.00 0.00 H new ATOM 1588 N MET A 126 9.667 25.635 -17.847 1.00 0.00 N ATOM 1589 CA MET A 126 8.622 24.644 -17.518 1.00 0.00 C ATOM 1590 C MET A 126 8.548 23.568 -18.611 1.00 0.00 C ATOM 1591 O MET A 126 8.185 22.423 -18.346 1.00 0.00 O ATOM 1592 CB MET A 126 7.254 25.366 -17.314 1.00 0.00 C ATOM 1593 CG MET A 126 6.751 26.219 -18.501 1.00 0.00 C ATOM 1594 SD MET A 126 6.145 25.244 -19.899 1.00 0.00 S ATOM 1595 CE MET A 126 4.775 24.346 -19.161 1.00 0.00 C ATOM 0 H MET A 126 9.433 26.208 -18.658 1.00 0.00 H new ATOM 0 HA MET A 126 8.875 24.141 -16.584 1.00 0.00 H new ATOM 0 HB2 MET A 126 6.499 24.613 -17.089 1.00 0.00 H new ATOM 0 HB3 MET A 126 7.333 26.010 -16.438 1.00 0.00 H new ATOM 0 HG2 MET A 126 5.951 26.873 -18.153 1.00 0.00 H new ATOM 0 HG3 MET A 126 7.562 26.862 -18.843 1.00 0.00 H new ATOM 0 HE1 MET A 126 5.005 23.281 -19.144 1.00 0.00 H new ATOM 0 HE2 MET A 126 4.615 24.699 -18.142 1.00 0.00 H new ATOM 0 HE3 MET A 126 3.872 24.513 -19.748 1.00 0.00 H new ATOM 1605 N HIS A 127 8.896 23.962 -19.841 1.00 0.00 N ATOM 1606 CA HIS A 127 8.935 23.070 -21.008 1.00 0.00 C ATOM 1607 C HIS A 127 10.375 22.569 -21.183 1.00 0.00 C ATOM 1608 O HIS A 127 11.205 23.240 -21.808 1.00 0.00 O ATOM 1609 CB HIS A 127 8.423 23.842 -22.258 1.00 0.00 C ATOM 1610 CG HIS A 127 8.352 23.018 -23.530 1.00 0.00 C ATOM 1611 ND1 HIS A 127 7.182 22.472 -24.008 1.00 0.00 N ATOM 1612 CD2 HIS A 127 9.303 22.690 -24.444 1.00 0.00 C ATOM 1613 CE1 HIS A 127 7.421 21.837 -25.138 1.00 0.00 C ATOM 1614 NE2 HIS A 127 8.697 21.960 -25.426 1.00 0.00 N ATOM 0 H HIS A 127 9.162 24.922 -20.058 1.00 0.00 H new ATOM 0 HA HIS A 127 8.286 22.205 -20.871 1.00 0.00 H new ATOM 0 HB2 HIS A 127 7.430 24.237 -22.042 1.00 0.00 H new ATOM 0 HB3 HIS A 127 9.076 24.697 -22.432 1.00 0.00 H new ATOM 0 HD2 HIS A 127 10.348 22.958 -24.401 1.00 0.00 H new ATOM 0 HE1 HIS A 127 6.690 21.305 -25.729 1.00 0.00 H new ATOM 0 HE2 HIS A 127 9.159 21.573 -26.249 1.00 0.00 H new ATOM 1623 N GLU A 128 10.675 21.411 -20.573 1.00 0.00 N ATOM 1624 CA GLU A 128 12.020 20.812 -20.604 1.00 0.00 C ATOM 1625 C GLU A 128 12.282 20.157 -21.979 1.00 0.00 C ATOM 1626 O GLU A 128 11.733 19.092 -22.287 1.00 0.00 O ATOM 1627 CB GLU A 128 12.178 19.791 -19.443 1.00 0.00 C ATOM 1628 CG GLU A 128 13.588 19.168 -19.305 1.00 0.00 C ATOM 1629 CD GLU A 128 14.695 20.212 -19.058 1.00 0.00 C ATOM 1630 OE1 GLU A 128 14.850 20.667 -17.906 1.00 0.00 O ATOM 1631 OE2 GLU A 128 15.407 20.588 -20.018 1.00 0.00 O ATOM 0 H GLU A 128 9.994 20.864 -20.046 1.00 0.00 H new ATOM 0 HA GLU A 128 12.765 21.595 -20.463 1.00 0.00 H new ATOM 0 HB2 GLU A 128 11.923 20.287 -18.506 1.00 0.00 H new ATOM 0 HB3 GLU A 128 11.455 18.988 -19.585 1.00 0.00 H new ATOM 0 HG2 GLU A 128 13.583 18.453 -18.482 1.00 0.00 H new ATOM 0 HG3 GLU A 128 13.821 18.609 -20.211 1.00 0.00 H new ATOM 1638 N ALA A 129 13.097 20.825 -22.810 1.00 0.00 N ATOM 1639 CA ALA A 129 13.432 20.349 -24.163 1.00 0.00 C ATOM 1640 C ALA A 129 14.441 19.179 -24.094 1.00 0.00 C ATOM 1641 O ALA A 129 15.617 19.385 -23.788 1.00 0.00 O ATOM 1642 CB ALA A 129 13.989 21.505 -25.010 1.00 0.00 C ATOM 0 H ALA A 129 13.542 21.709 -22.564 1.00 0.00 H new ATOM 0 HA ALA A 129 12.523 19.981 -24.639 1.00 0.00 H new ATOM 0 HB1 ALA A 129 14.233 21.140 -26.008 1.00 0.00 H new ATOM 0 HB2 ALA A 129 13.241 22.294 -25.085 1.00 0.00 H new ATOM 0 HB3 ALA A 129 14.889 21.901 -24.539 1.00 0.00 H new ATOM 1648 N THR A 130 13.960 17.952 -24.338 1.00 0.00 N ATOM 1649 CA THR A 130 14.806 16.750 -24.388 1.00 0.00 C ATOM 1650 C THR A 130 15.345 16.551 -25.822 1.00 0.00 C ATOM 1651 O THR A 130 14.569 16.553 -26.786 1.00 0.00 O ATOM 1652 CB THR A 130 13.997 15.496 -23.933 1.00 0.00 C ATOM 1653 OG1 THR A 130 13.340 15.783 -22.683 1.00 0.00 O ATOM 1654 CG2 THR A 130 14.899 14.254 -23.758 1.00 0.00 C ATOM 0 H THR A 130 12.972 17.764 -24.507 1.00 0.00 H new ATOM 0 HA THR A 130 15.647 16.880 -23.707 1.00 0.00 H new ATOM 0 HB THR A 130 13.267 15.271 -24.711 1.00 0.00 H new ATOM 0 HG1 THR A 130 12.829 14.998 -22.394 1.00 0.00 H new ATOM 0 HG21 THR A 130 14.293 13.406 -23.441 1.00 0.00 H new ATOM 0 HG22 THR A 130 15.383 14.019 -24.706 1.00 0.00 H new ATOM 0 HG23 THR A 130 15.659 14.459 -23.004 1.00 0.00 H new ATOM 1662 N SER A 131 16.672 16.407 -25.948 1.00 0.00 N ATOM 1663 CA SER A 131 17.340 16.235 -27.245 1.00 0.00 C ATOM 1664 C SER A 131 17.284 14.758 -27.685 1.00 0.00 C ATOM 1665 O SER A 131 17.143 14.461 -28.876 1.00 0.00 O ATOM 1666 CB SER A 131 18.797 16.736 -27.142 1.00 0.00 C ATOM 1667 OG SER A 131 19.460 16.698 -28.397 1.00 0.00 O ATOM 0 H SER A 131 17.312 16.407 -25.154 1.00 0.00 H new ATOM 0 HA SER A 131 16.824 16.824 -28.003 1.00 0.00 H new ATOM 0 HB2 SER A 131 18.804 17.756 -26.759 1.00 0.00 H new ATOM 0 HB3 SER A 131 19.342 16.122 -26.425 1.00 0.00 H new ATOM 0 HG SER A 131 20.378 17.024 -28.292 1.00 0.00 H new ATOM 1673 N ALA A 132 17.362 13.849 -26.696 1.00 0.00 N ATOM 1674 CA ALA A 132 17.387 12.393 -26.909 1.00 0.00 C ATOM 1675 C ALA A 132 17.025 11.682 -25.584 1.00 0.00 C ATOM 1676 O ALA A 132 15.863 11.253 -25.419 1.00 0.00 O ATOM 1677 CB ALA A 132 18.768 11.942 -27.442 1.00 0.00 C ATOM 1678 OXT ALA A 132 17.889 11.625 -24.680 1.00 0.00 O ATOM 0 H ALA A 132 17.410 14.111 -25.711 1.00 0.00 H new ATOM 0 HA ALA A 132 16.650 12.119 -27.664 1.00 0.00 H new ATOM 0 HB1 ALA A 132 18.765 10.862 -27.593 1.00 0.00 H new ATOM 0 HB2 ALA A 132 18.973 12.440 -28.390 1.00 0.00 H new ATOM 0 HB3 ALA A 132 19.541 12.205 -26.720 1.00 0.00 H new TER 1684 ALA A 132