USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 804 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 97 GLN : amide:sc= 0.219 K(o=0.8,f=-3!) USER MOD Set 1.2: A 101 GLN :FLIP amide:sc= 0.583 F(o=-0.27,f=0.8) USER MOD Set 2.1: A 83 SER OG : rot -170:sc= 0.0552 USER MOD Set 2.2: A 86 ASN : amide:sc= -0.119 K(o=-0.063,f=-2.2!) USER MOD Single : A 1 MET CE :methyl 180:sc= -0.014 (180deg=-0.014) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= 0.491 K(o=0.49,f=-0.19) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 130:sc= 0 USER MOD Single : A 7 THR OG1 : rot 103:sc= 0.475 USER MOD Single : A 9 ASN : amide:sc= -0.917 X(o=-0.92,f=-0.96) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.195 K(o=-0.2,f=-1.4!) USER MOD Single : A 25 ASN : amide:sc= -0.621 K(o=-0.62,f=-5.8!) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 TYR OH : rot 169:sc= -1.08! USER MOD Single : A 41 ASN : amide:sc= 0.661 K(o=0.66,f=-0.038) USER MOD Single : A 44 THR OG1 : rot 26:sc= -2.63! USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0.0998 USER MOD Single : A 63 THR OG1 : rot 29:sc= 0.0929 USER MOD Single : A 66 ASN : amide:sc= -0.934 X(o=-0.93,f=-0.57!) USER MOD Single : A 69 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 70 THR OG1 : rot -81:sc= 0.304 USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 80 GLN : amide:sc= -0.215 K(o=-0.21,f=-1.6!) USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 95 ASN :FLIP amide:sc=-0.00177 F(o=-1.1,f=-0.0018) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot -55:sc= 0.606 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -5.053 8.102 -22.372 1.00 0.00 N ATOM 2 CA MET A 1 -5.376 6.932 -21.505 1.00 0.00 C ATOM 3 C MET A 1 -5.200 7.304 -20.024 1.00 0.00 C ATOM 4 O MET A 1 -4.234 7.947 -19.657 1.00 0.00 O ATOM 5 CB MET A 1 -4.375 5.850 -21.910 1.00 0.00 C ATOM 6 CG MET A 1 -5.047 4.479 -21.838 1.00 0.00 C ATOM 7 SD MET A 1 -3.792 3.205 -21.556 1.00 0.00 S ATOM 8 CE MET A 1 -3.877 3.198 -19.748 1.00 0.00 C ATOM 0 H1 MET A 1 -5.176 7.838 -23.371 1.00 0.00 H new ATOM 0 H2 MET A 1 -5.690 8.891 -22.142 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.068 8.393 -22.209 1.00 0.00 H new ATOM 0 HA MET A 1 -6.407 6.599 -21.628 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.012 6.036 -22.921 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.508 5.877 -21.250 1.00 0.00 H new ATOM 0 HG2 MET A 1 -5.782 4.464 -21.033 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.584 4.276 -22.765 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.170 2.468 -19.353 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.626 4.188 -19.368 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.886 2.933 -19.432 1.00 0.00 H new ATOM 20 N SER A 2 -6.121 6.906 -19.169 1.00 0.00 N ATOM 21 CA SER A 2 -5.992 7.243 -17.720 1.00 0.00 C ATOM 22 C SER A 2 -6.306 6.009 -16.858 1.00 0.00 C ATOM 23 O SER A 2 -7.184 5.232 -17.185 1.00 0.00 O ATOM 24 CB SER A 2 -7.023 8.343 -17.477 1.00 0.00 C ATOM 25 OG SER A 2 -6.735 9.452 -18.318 1.00 0.00 O ATOM 0 H SER A 2 -6.950 6.365 -19.417 1.00 0.00 H new ATOM 0 HA SER A 2 -4.984 7.564 -17.458 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.026 7.968 -17.681 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.004 8.650 -16.431 1.00 0.00 H new ATOM 0 HG SER A 2 -7.396 10.159 -18.165 1.00 0.00 H new ATOM 31 N GLN A 3 -5.600 5.820 -15.761 1.00 0.00 N ATOM 32 CA GLN A 3 -5.869 4.636 -14.892 1.00 0.00 C ATOM 33 C GLN A 3 -6.158 5.089 -13.451 1.00 0.00 C ATOM 34 O GLN A 3 -5.335 4.924 -12.569 1.00 0.00 O ATOM 35 CB GLN A 3 -4.587 3.804 -14.950 1.00 0.00 C ATOM 36 CG GLN A 3 -4.428 3.207 -16.349 1.00 0.00 C ATOM 37 CD GLN A 3 -5.501 2.132 -16.573 1.00 0.00 C ATOM 38 OE1 GLN A 3 -5.295 0.982 -16.241 1.00 0.00 O ATOM 39 NE2 GLN A 3 -6.645 2.455 -17.124 1.00 0.00 N ATOM 0 H GLN A 3 -4.854 6.435 -15.437 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.738 4.067 -15.224 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.726 4.427 -14.709 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.623 3.008 -14.206 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.519 3.990 -17.102 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.434 2.773 -16.460 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -6.822 3.420 -17.404 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -7.359 1.742 -17.273 1.00 0.00 H new ATOM 48 N GLU A 4 -7.323 5.653 -13.199 1.00 0.00 N ATOM 49 CA GLU A 4 -7.648 6.101 -11.802 1.00 0.00 C ATOM 50 C GLU A 4 -8.431 5.006 -11.064 1.00 0.00 C ATOM 51 O GLU A 4 -8.206 4.770 -9.892 1.00 0.00 O ATOM 52 CB GLU A 4 -8.499 7.370 -11.947 1.00 0.00 C ATOM 53 CG GLU A 4 -7.617 8.524 -12.426 1.00 0.00 C ATOM 54 CD GLU A 4 -8.248 9.856 -12.012 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.145 10.200 -10.846 1.00 0.00 O ATOM 56 OE2 GLU A 4 -8.822 10.508 -12.867 1.00 0.00 O ATOM 0 H GLU A 4 -8.053 5.820 -13.892 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.745 6.297 -11.224 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -9.309 7.199 -12.656 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.960 7.623 -10.992 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -6.618 8.434 -11.998 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.504 8.484 -13.509 1.00 0.00 H new ATOM 63 N GLN A 5 -9.342 4.321 -11.735 1.00 0.00 N ATOM 64 CA GLN A 5 -10.116 3.225 -11.035 1.00 0.00 C ATOM 65 C GLN A 5 -9.135 2.232 -10.383 1.00 0.00 C ATOM 66 O GLN A 5 -9.366 1.759 -9.286 1.00 0.00 O ATOM 67 CB GLN A 5 -10.989 2.527 -12.100 1.00 0.00 C ATOM 68 CG GLN A 5 -10.110 1.848 -13.159 1.00 0.00 C ATOM 69 CD GLN A 5 -10.979 1.426 -14.350 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.339 2.247 -15.169 1.00 0.00 O ATOM 71 NE2 GLN A 5 -11.335 0.172 -14.487 1.00 0.00 N ATOM 0 H GLN A 5 -9.580 4.468 -12.716 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.748 3.629 -10.244 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.631 1.786 -11.623 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.644 3.257 -12.577 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.328 2.531 -13.490 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.613 0.977 -12.731 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -11.035 -0.521 -13.802 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -11.912 -0.111 -15.279 1.00 0.00 H new ATOM 80 N TYR A 6 -8.021 1.949 -11.030 1.00 0.00 N ATOM 81 CA TYR A 6 -7.013 1.027 -10.405 1.00 0.00 C ATOM 82 C TYR A 6 -6.279 1.787 -9.290 1.00 0.00 C ATOM 83 O TYR A 6 -5.958 1.225 -8.261 1.00 0.00 O ATOM 84 CB TYR A 6 -6.022 0.628 -11.511 1.00 0.00 C ATOM 85 CG TYR A 6 -6.656 -0.392 -12.425 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.458 0.029 -13.492 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.439 -1.757 -12.206 1.00 0.00 C ATOM 88 CE1 TYR A 6 -8.043 -0.917 -14.342 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.023 -2.703 -13.056 1.00 0.00 C ATOM 90 CZ TYR A 6 -7.825 -2.284 -14.124 1.00 0.00 C ATOM 91 OH TYR A 6 -8.402 -3.216 -14.962 1.00 0.00 O ATOM 0 H TYR A 6 -7.771 2.311 -11.950 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.484 0.141 -9.978 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -5.728 1.508 -12.083 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.115 0.218 -11.068 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -7.625 1.083 -13.659 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -5.821 -2.080 -11.381 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -8.662 -0.593 -15.166 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -6.855 -3.757 -12.888 1.00 0.00 H new ATOM 0 HH TYR A 6 -7.719 -3.850 -15.266 1.00 0.00 H new ATOM 101 N THR A 7 -6.021 3.067 -9.483 1.00 0.00 N ATOM 102 CA THR A 7 -5.316 3.859 -8.417 1.00 0.00 C ATOM 103 C THR A 7 -6.232 4.005 -7.193 1.00 0.00 C ATOM 104 O THR A 7 -5.780 3.901 -6.067 1.00 0.00 O ATOM 105 CB THR A 7 -5.004 5.239 -9.039 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.108 5.069 -10.132 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.361 6.171 -8.004 1.00 0.00 C ATOM 0 H THR A 7 -6.266 3.591 -10.323 1.00 0.00 H new ATOM 0 HA THR A 7 -4.401 3.370 -8.084 1.00 0.00 H new ATOM 0 HB THR A 7 -5.938 5.686 -9.380 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.604 5.136 -10.975 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.150 7.136 -8.465 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.044 6.310 -7.166 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.431 5.730 -7.645 1.00 0.00 H new ATOM 115 N GLU A 8 -7.512 4.240 -7.396 1.00 0.00 N ATOM 116 CA GLU A 8 -8.432 4.379 -6.213 1.00 0.00 C ATOM 117 C GLU A 8 -8.620 3.014 -5.544 1.00 0.00 C ATOM 118 O GLU A 8 -8.630 2.915 -4.330 1.00 0.00 O ATOM 119 CB GLU A 8 -9.772 4.911 -6.745 1.00 0.00 C ATOM 120 CG GLU A 8 -10.569 5.529 -5.594 1.00 0.00 C ATOM 121 CD GLU A 8 -11.757 6.312 -6.157 1.00 0.00 C ATOM 122 OE1 GLU A 8 -12.576 5.705 -6.828 1.00 0.00 O ATOM 123 OE2 GLU A 8 -11.827 7.504 -5.909 1.00 0.00 O ATOM 0 H GLU A 8 -7.953 4.340 -8.310 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.022 5.061 -5.469 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.597 5.656 -7.521 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.341 4.102 -7.202 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -10.921 4.747 -4.921 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.929 6.189 -5.008 1.00 0.00 H new ATOM 130 N ASN A 9 -8.745 1.957 -6.318 1.00 0.00 N ATOM 131 CA ASN A 9 -8.901 0.600 -5.691 1.00 0.00 C ATOM 132 C ASN A 9 -7.542 0.132 -5.157 1.00 0.00 C ATOM 133 O ASN A 9 -7.464 -0.467 -4.100 1.00 0.00 O ATOM 134 CB ASN A 9 -9.406 -0.347 -6.791 1.00 0.00 C ATOM 135 CG ASN A 9 -10.859 0.000 -7.138 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.129 1.068 -7.652 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.816 -0.857 -6.879 1.00 0.00 N ATOM 0 H ASN A 9 -8.746 1.973 -7.338 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.603 0.620 -4.858 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.778 -0.259 -7.678 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.339 -1.381 -6.454 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.783 -0.627 -7.109 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.594 -1.754 -6.448 1.00 0.00 H new ATOM 144 N LEU A 10 -6.464 0.419 -5.861 1.00 0.00 N ATOM 145 CA LEU A 10 -5.115 0.000 -5.351 1.00 0.00 C ATOM 146 C LEU A 10 -4.766 0.810 -4.095 1.00 0.00 C ATOM 147 O LEU A 10 -4.172 0.290 -3.169 1.00 0.00 O ATOM 148 CB LEU A 10 -4.102 0.286 -6.472 1.00 0.00 C ATOM 149 CG LEU A 10 -2.716 -0.207 -6.050 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.741 -1.728 -5.879 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.694 0.168 -7.126 1.00 0.00 C ATOM 0 H LEU A 10 -6.461 0.917 -6.751 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.102 -1.057 -5.085 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.412 -0.211 -7.391 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.070 1.355 -6.683 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.439 0.258 -5.104 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.753 -2.077 -5.579 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.469 -1.996 -5.113 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.019 -2.196 -6.823 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.706 -0.182 -6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.974 -0.297 -8.071 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.674 1.251 -7.247 1.00 0.00 H new ATOM 163 N LYS A 11 -5.139 2.077 -4.042 1.00 0.00 N ATOM 164 CA LYS A 11 -4.821 2.891 -2.814 1.00 0.00 C ATOM 165 C LYS A 11 -5.456 2.248 -1.571 1.00 0.00 C ATOM 166 O LYS A 11 -4.890 2.300 -0.494 1.00 0.00 O ATOM 167 CB LYS A 11 -5.407 4.294 -3.043 1.00 0.00 C ATOM 168 CG LYS A 11 -4.862 5.254 -1.983 1.00 0.00 C ATOM 169 CD LYS A 11 -5.938 6.279 -1.618 1.00 0.00 C ATOM 170 CE LYS A 11 -6.719 5.789 -0.398 1.00 0.00 C ATOM 171 NZ LYS A 11 -6.026 6.397 0.772 1.00 0.00 N ATOM 0 H LYS A 11 -5.639 2.573 -4.780 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.745 2.940 -2.648 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.147 4.650 -4.040 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.495 4.258 -2.991 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.559 4.698 -1.096 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.974 5.762 -2.360 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.478 7.244 -1.405 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.614 6.427 -2.460 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.762 6.102 -0.445 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.715 4.701 -0.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -6.505 6.107 1.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -5.037 6.076 0.795 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.052 7.433 0.691 1.00 0.00 H new ATOM 185 N VAL A 12 -6.616 1.632 -1.703 1.00 0.00 N ATOM 186 CA VAL A 12 -7.247 0.984 -0.499 1.00 0.00 C ATOM 187 C VAL A 12 -6.427 -0.248 -0.099 1.00 0.00 C ATOM 188 O VAL A 12 -6.059 -0.405 1.050 1.00 0.00 O ATOM 189 CB VAL A 12 -8.671 0.574 -0.911 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.371 -0.110 0.265 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.461 1.819 -1.319 1.00 0.00 C ATOM 0 H VAL A 12 -7.143 1.551 -2.573 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.277 1.661 0.355 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.619 -0.118 -1.752 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.380 -0.399 -0.030 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.810 -0.998 0.556 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.423 0.579 1.108 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.470 1.530 -1.611 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.511 2.510 -0.478 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.965 2.305 -2.159 1.00 0.00 H new ATOM 201 N ILE A 13 -6.127 -1.115 -1.040 1.00 0.00 N ATOM 202 CA ILE A 13 -5.310 -2.332 -0.694 1.00 0.00 C ATOM 203 C ILE A 13 -3.924 -1.896 -0.199 1.00 0.00 C ATOM 204 O ILE A 13 -3.380 -2.487 0.716 1.00 0.00 O ATOM 205 CB ILE A 13 -5.198 -3.172 -1.980 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.609 -3.568 -2.452 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.377 -4.435 -1.699 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.740 -3.333 -3.960 1.00 0.00 C ATOM 0 H ILE A 13 -6.406 -1.038 -2.018 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.774 -2.917 0.100 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.704 -2.588 -2.756 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.798 -4.616 -2.221 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.358 -2.983 -1.918 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.299 -5.028 -2.610 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.379 -4.153 -1.363 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.868 -5.023 -0.924 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.741 -3.615 -4.287 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.570 -2.279 -4.180 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.002 -3.937 -4.488 1.00 0.00 H new ATOM 220 N VAL A 14 -3.350 -0.854 -0.774 1.00 0.00 N ATOM 221 CA VAL A 14 -2.002 -0.391 -0.289 1.00 0.00 C ATOM 222 C VAL A 14 -2.132 0.070 1.171 1.00 0.00 C ATOM 223 O VAL A 14 -1.303 -0.254 2.001 1.00 0.00 O ATOM 224 CB VAL A 14 -1.583 0.781 -1.192 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.226 1.323 -0.737 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.478 0.295 -2.642 1.00 0.00 C ATOM 0 H VAL A 14 -3.749 -0.315 -1.543 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.257 -1.186 -0.332 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.329 1.573 -1.125 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.068 2.153 -1.379 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.300 1.670 0.294 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.522 0.532 -0.801 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.181 1.125 -3.283 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.733 -0.498 -2.707 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.445 -0.088 -2.968 1.00 0.00 H new ATOM 236 N ALA A 15 -3.178 0.806 1.497 1.00 0.00 N ATOM 237 CA ALA A 15 -3.353 1.259 2.924 1.00 0.00 C ATOM 238 C ALA A 15 -3.446 0.033 3.853 1.00 0.00 C ATOM 239 O ALA A 15 -2.995 0.077 4.982 1.00 0.00 O ATOM 240 CB ALA A 15 -4.662 2.063 2.980 1.00 0.00 C ATOM 0 H ALA A 15 -3.906 1.108 0.850 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.509 1.867 3.250 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.831 2.413 3.998 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.592 2.919 2.309 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.493 1.428 2.672 1.00 0.00 H new ATOM 246 N GLU A 16 -4.018 -1.069 3.389 1.00 0.00 N ATOM 247 CA GLU A 16 -4.116 -2.293 4.269 1.00 0.00 C ATOM 248 C GLU A 16 -2.726 -2.673 4.807 1.00 0.00 C ATOM 249 O GLU A 16 -2.591 -3.074 5.948 1.00 0.00 O ATOM 250 CB GLU A 16 -4.664 -3.427 3.386 1.00 0.00 C ATOM 251 CG GLU A 16 -4.878 -4.683 4.233 1.00 0.00 C ATOM 252 CD GLU A 16 -4.679 -5.926 3.363 1.00 0.00 C ATOM 253 OE1 GLU A 16 -5.202 -5.944 2.261 1.00 0.00 O ATOM 254 OE2 GLU A 16 -4.005 -6.839 3.813 1.00 0.00 O ATOM 0 H GLU A 16 -4.414 -1.172 2.455 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.765 -2.108 5.125 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.604 -3.122 2.927 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -3.967 -3.638 2.575 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.178 -4.695 5.068 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.882 -4.681 4.658 1.00 0.00 H new ATOM 261 N LYS A 17 -1.689 -2.539 4.001 1.00 0.00 N ATOM 262 CA LYS A 17 -0.316 -2.891 4.502 1.00 0.00 C ATOM 263 C LYS A 17 0.252 -1.719 5.319 1.00 0.00 C ATOM 264 O LYS A 17 0.692 -1.905 6.439 1.00 0.00 O ATOM 265 CB LYS A 17 0.552 -3.166 3.266 1.00 0.00 C ATOM 266 CG LYS A 17 1.474 -4.357 3.549 1.00 0.00 C ATOM 267 CD LYS A 17 0.656 -5.656 3.561 1.00 0.00 C ATOM 268 CE LYS A 17 0.458 -6.135 5.005 1.00 0.00 C ATOM 269 NZ LYS A 17 1.389 -7.289 5.161 1.00 0.00 N ATOM 0 H LYS A 17 -1.733 -2.208 3.037 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.339 -3.766 5.152 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.080 -3.378 2.403 1.00 0.00 H new ATOM 0 HB3 LYS A 17 1.143 -2.284 3.019 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.253 -4.414 2.789 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.974 -4.222 4.508 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.312 -5.491 3.087 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.168 -6.424 2.981 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.688 -5.343 5.718 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.575 -6.434 5.183 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.310 -7.671 6.125 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 1.142 -8.030 4.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.365 -6.973 4.993 1.00 0.00 H new ATOM 283 N LEU A 18 0.229 -0.508 4.790 1.00 0.00 N ATOM 284 CA LEU A 18 0.756 0.667 5.582 1.00 0.00 C ATOM 285 C LEU A 18 0.020 0.744 6.930 1.00 0.00 C ATOM 286 O LEU A 18 0.633 0.861 7.974 1.00 0.00 O ATOM 287 CB LEU A 18 0.426 1.923 4.761 1.00 0.00 C ATOM 288 CG LEU A 18 1.538 2.260 3.766 1.00 0.00 C ATOM 289 CD1 LEU A 18 1.879 1.050 2.896 1.00 0.00 C ATOM 290 CD2 LEU A 18 1.042 3.396 2.875 1.00 0.00 C ATOM 0 H LEU A 18 -0.125 -0.284 3.860 1.00 0.00 H new ATOM 0 HA LEU A 18 1.826 0.574 5.769 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.509 1.770 4.223 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.272 2.767 5.434 1.00 0.00 H new ATOM 0 HG LEU A 18 2.437 2.550 4.311 1.00 0.00 H new ATOM 0 HD11 LEU A 18 2.672 1.316 2.197 1.00 0.00 H new ATOM 0 HD12 LEU A 18 2.214 0.229 3.530 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.994 0.741 2.340 1.00 0.00 H new ATOM 0 HD21 LEU A 18 1.817 3.658 2.154 1.00 0.00 H new ATOM 0 HD22 LEU A 18 0.145 3.077 2.344 1.00 0.00 H new ATOM 0 HD23 LEU A 18 0.810 4.266 3.490 1.00 0.00 H new ATOM 302 N ALA A 19 -1.296 0.666 6.908 1.00 0.00 N ATOM 303 CA ALA A 19 -2.072 0.720 8.198 1.00 0.00 C ATOM 304 C ALA A 19 -1.757 -0.519 9.063 1.00 0.00 C ATOM 305 O ALA A 19 -1.868 -0.469 10.273 1.00 0.00 O ATOM 306 CB ALA A 19 -3.561 0.723 7.816 1.00 0.00 C ATOM 0 H ALA A 19 -1.861 0.568 6.064 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.808 1.606 8.775 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.169 0.762 8.720 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.776 1.594 7.197 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.796 -0.184 7.260 1.00 0.00 H new ATOM 312 N GLY A 20 -1.374 -1.636 8.460 1.00 0.00 N ATOM 313 CA GLY A 20 -1.071 -2.858 9.265 1.00 0.00 C ATOM 314 C GLY A 20 0.384 -2.829 9.765 1.00 0.00 C ATOM 315 O GLY A 20 0.671 -3.313 10.844 1.00 0.00 O ATOM 0 H GLY A 20 -1.262 -1.743 7.452 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -1.752 -2.919 10.114 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.236 -3.749 8.659 1.00 0.00 H new ATOM 319 N ILE A 21 1.312 -2.279 8.998 1.00 0.00 N ATOM 320 CA ILE A 21 2.754 -2.245 9.464 1.00 0.00 C ATOM 321 C ILE A 21 2.838 -1.652 10.894 1.00 0.00 C ATOM 322 O ILE A 21 2.233 -0.634 11.167 1.00 0.00 O ATOM 323 CB ILE A 21 3.511 -1.363 8.441 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.591 -2.110 7.104 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.934 -1.063 8.924 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.686 -1.108 5.946 1.00 0.00 C ATOM 0 H ILE A 21 1.140 -1.859 8.085 1.00 0.00 H new ATOM 0 HA ILE A 21 3.192 -3.242 9.513 1.00 0.00 H new ATOM 0 HB ILE A 21 2.973 -0.422 8.327 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.460 -2.769 7.098 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.711 -2.741 6.978 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.445 -0.442 8.188 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.891 -0.535 9.877 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.480 -1.998 9.051 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.742 -1.648 5.001 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.804 -0.468 5.946 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.579 -0.495 6.067 1.00 0.00 H new ATOM 338 N PRO A 22 3.573 -2.315 11.771 1.00 0.00 N ATOM 339 CA PRO A 22 3.698 -1.830 13.177 1.00 0.00 C ATOM 340 C PRO A 22 4.472 -0.499 13.268 1.00 0.00 C ATOM 341 O PRO A 22 4.311 0.235 14.226 1.00 0.00 O ATOM 342 CB PRO A 22 4.459 -2.953 13.879 1.00 0.00 C ATOM 343 CG PRO A 22 5.207 -3.646 12.791 1.00 0.00 C ATOM 344 CD PRO A 22 4.350 -3.550 11.558 1.00 0.00 C ATOM 0 HA PRO A 22 2.727 -1.621 13.626 1.00 0.00 H new ATOM 0 HB2 PRO A 22 5.137 -2.558 14.636 1.00 0.00 H new ATOM 0 HB3 PRO A 22 3.777 -3.635 14.387 1.00 0.00 H new ATOM 0 HG2 PRO A 22 6.177 -3.177 12.627 1.00 0.00 H new ATOM 0 HG3 PRO A 22 5.396 -4.687 13.052 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.955 -3.492 10.653 1.00 0.00 H new ATOM 0 HD3 PRO A 22 3.701 -4.419 11.452 1.00 0.00 H new ATOM 352 N ASN A 23 5.298 -0.169 12.295 1.00 0.00 N ATOM 353 CA ASN A 23 6.049 1.130 12.365 1.00 0.00 C ATOM 354 C ASN A 23 5.400 2.178 11.442 1.00 0.00 C ATOM 355 O ASN A 23 6.079 3.034 10.907 1.00 0.00 O ATOM 356 CB ASN A 23 7.474 0.812 11.898 1.00 0.00 C ATOM 357 CG ASN A 23 8.475 1.639 12.715 1.00 0.00 C ATOM 358 OD1 ASN A 23 8.281 1.849 13.896 1.00 0.00 O ATOM 359 ND2 ASN A 23 9.548 2.122 12.137 1.00 0.00 N ATOM 0 H ASN A 23 5.482 -0.736 11.467 1.00 0.00 H new ATOM 0 HA ASN A 23 6.040 1.545 13.373 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.679 -0.252 12.020 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.580 1.038 10.837 1.00 0.00 H new ATOM 0 HD21 ASN A 23 10.215 2.671 12.678 1.00 0.00 H new ATOM 0 HD22 ASN A 23 9.715 1.948 11.146 1.00 0.00 H new ATOM 366 N PHE A 24 4.094 2.127 11.254 1.00 0.00 N ATOM 367 CA PHE A 24 3.422 3.128 10.373 1.00 0.00 C ATOM 368 C PHE A 24 2.254 3.782 11.131 1.00 0.00 C ATOM 369 O PHE A 24 1.107 3.423 10.938 1.00 0.00 O ATOM 370 CB PHE A 24 2.912 2.326 9.164 1.00 0.00 C ATOM 371 CG PHE A 24 3.547 2.847 7.895 1.00 0.00 C ATOM 372 CD1 PHE A 24 4.839 2.443 7.542 1.00 0.00 C ATOM 373 CD2 PHE A 24 2.841 3.734 7.071 1.00 0.00 C ATOM 374 CE1 PHE A 24 5.427 2.927 6.367 1.00 0.00 C ATOM 375 CE2 PHE A 24 3.429 4.216 5.898 1.00 0.00 C ATOM 376 CZ PHE A 24 4.722 3.814 5.545 1.00 0.00 C ATOM 0 H PHE A 24 3.474 1.435 11.674 1.00 0.00 H new ATOM 0 HA PHE A 24 4.092 3.930 10.063 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.148 1.270 9.292 1.00 0.00 H new ATOM 0 HB3 PHE A 24 1.827 2.404 9.096 1.00 0.00 H new ATOM 0 HD1 PHE A 24 5.383 1.758 8.176 1.00 0.00 H new ATOM 0 HD2 PHE A 24 1.843 4.045 7.342 1.00 0.00 H new ATOM 0 HE1 PHE A 24 6.425 2.616 6.095 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.885 4.900 5.263 1.00 0.00 H new ATOM 0 HZ PHE A 24 5.176 4.188 4.639 1.00 0.00 H new ATOM 386 N ASN A 25 2.532 4.740 11.993 1.00 0.00 N ATOM 387 CA ASN A 25 1.422 5.405 12.754 1.00 0.00 C ATOM 388 C ASN A 25 1.012 6.709 12.054 1.00 0.00 C ATOM 389 O ASN A 25 -0.163 7.001 11.922 1.00 0.00 O ATOM 390 CB ASN A 25 1.980 5.698 14.153 1.00 0.00 C ATOM 391 CG ASN A 25 2.282 4.377 14.872 1.00 0.00 C ATOM 392 OD1 ASN A 25 2.522 3.372 14.233 1.00 0.00 O ATOM 393 ND2 ASN A 25 2.281 4.329 16.182 1.00 0.00 N ATOM 0 H ASN A 25 3.469 5.085 12.199 1.00 0.00 H new ATOM 0 HA ASN A 25 0.536 4.772 12.808 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.887 6.298 14.076 1.00 0.00 H new ATOM 0 HB3 ASN A 25 1.261 6.281 14.728 1.00 0.00 H new ATOM 0 HD21 ASN A 25 2.481 3.451 16.660 1.00 0.00 H new ATOM 0 HD22 ASN A 25 2.080 5.170 16.723 1.00 0.00 H new ATOM 400 N GLU A 26 1.965 7.496 11.596 1.00 0.00 N ATOM 401 CA GLU A 26 1.612 8.771 10.899 1.00 0.00 C ATOM 402 C GLU A 26 1.928 8.643 9.401 1.00 0.00 C ATOM 403 O GLU A 26 2.655 7.756 8.994 1.00 0.00 O ATOM 404 CB GLU A 26 2.487 9.852 11.551 1.00 0.00 C ATOM 405 CG GLU A 26 1.604 10.996 12.062 1.00 0.00 C ATOM 406 CD GLU A 26 1.273 11.941 10.905 1.00 0.00 C ATOM 407 OE1 GLU A 26 2.103 12.781 10.597 1.00 0.00 O ATOM 408 OE2 GLU A 26 0.197 11.809 10.348 1.00 0.00 O ATOM 0 H GLU A 26 2.964 7.308 11.677 1.00 0.00 H new ATOM 0 HA GLU A 26 0.553 9.014 10.987 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.056 9.423 12.376 1.00 0.00 H new ATOM 0 HB3 GLU A 26 3.209 10.233 10.829 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.686 10.596 12.493 1.00 0.00 H new ATOM 0 HG3 GLU A 26 2.118 11.540 12.854 1.00 0.00 H new ATOM 415 N ASP A 27 1.389 9.515 8.570 1.00 0.00 N ATOM 416 CA ASP A 27 1.661 9.433 7.095 1.00 0.00 C ATOM 417 C ASP A 27 1.338 8.025 6.561 1.00 0.00 C ATOM 418 O ASP A 27 2.145 7.416 5.888 1.00 0.00 O ATOM 419 CB ASP A 27 3.154 9.741 6.937 1.00 0.00 C ATOM 420 CG ASP A 27 3.362 11.255 6.899 1.00 0.00 C ATOM 421 OD1 ASP A 27 3.186 11.831 5.838 1.00 0.00 O ATOM 422 OD2 ASP A 27 3.695 11.814 7.931 1.00 0.00 O ATOM 0 H ASP A 27 0.774 10.278 8.852 1.00 0.00 H new ATOM 0 HA ASP A 27 1.043 10.131 6.531 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.715 9.307 7.765 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.535 9.288 6.022 1.00 0.00 H new ATOM 427 N ILE A 28 0.163 7.503 6.855 1.00 0.00 N ATOM 428 CA ILE A 28 -0.196 6.136 6.352 1.00 0.00 C ATOM 429 C ILE A 28 -1.046 6.257 5.073 1.00 0.00 C ATOM 430 O ILE A 28 -0.846 5.516 4.128 1.00 0.00 O ATOM 431 CB ILE A 28 -0.939 5.443 7.525 1.00 0.00 C ATOM 432 CG1 ILE A 28 -1.047 3.927 7.285 1.00 0.00 C ATOM 433 CG2 ILE A 28 -2.339 6.023 7.738 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.952 3.611 6.079 1.00 0.00 C ATOM 0 H ILE A 28 -0.554 7.962 7.416 1.00 0.00 H new ATOM 0 HA ILE A 28 0.671 5.541 6.066 1.00 0.00 H new ATOM 0 HB ILE A 28 -0.350 5.629 8.423 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -0.053 3.513 7.114 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -1.445 3.443 8.177 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.823 5.509 8.568 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.262 7.086 7.965 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.931 5.887 6.833 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -2.006 2.532 5.938 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.952 4.004 6.262 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.539 4.074 5.183 1.00 0.00 H new ATOM 446 N LYS A 29 -1.959 7.201 5.009 1.00 0.00 N ATOM 447 CA LYS A 29 -2.770 7.360 3.753 1.00 0.00 C ATOM 448 C LYS A 29 -1.915 8.057 2.681 1.00 0.00 C ATOM 449 O LYS A 29 -2.003 7.731 1.512 1.00 0.00 O ATOM 450 CB LYS A 29 -3.989 8.223 4.115 1.00 0.00 C ATOM 451 CG LYS A 29 -5.104 7.328 4.661 1.00 0.00 C ATOM 452 CD LYS A 29 -6.171 8.194 5.334 1.00 0.00 C ATOM 453 CE LYS A 29 -5.870 8.303 6.830 1.00 0.00 C ATOM 454 NZ LYS A 29 -6.709 7.251 7.468 1.00 0.00 N ATOM 0 H LYS A 29 -2.176 7.859 5.758 1.00 0.00 H new ATOM 0 HA LYS A 29 -3.090 6.396 3.357 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.711 8.970 4.858 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.340 8.763 3.236 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.548 6.748 3.852 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.695 6.615 5.377 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -6.188 9.186 4.882 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -7.158 7.758 5.182 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.811 8.141 7.033 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.120 9.293 7.212 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -6.558 7.263 8.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -7.712 7.435 7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -6.444 6.319 7.090 1.00 0.00 H new ATOM 468 N TYR A 30 -1.076 9.003 3.065 1.00 0.00 N ATOM 469 CA TYR A 30 -0.213 9.694 2.042 1.00 0.00 C ATOM 470 C TYR A 30 0.846 8.723 1.492 1.00 0.00 C ATOM 471 O TYR A 30 1.200 8.795 0.330 1.00 0.00 O ATOM 472 CB TYR A 30 0.469 10.873 2.757 1.00 0.00 C ATOM 473 CG TYR A 30 -0.538 11.975 2.981 1.00 0.00 C ATOM 474 CD1 TYR A 30 -0.936 12.787 1.911 1.00 0.00 C ATOM 475 CD2 TYR A 30 -1.074 12.187 4.257 1.00 0.00 C ATOM 476 CE1 TYR A 30 -1.869 13.810 2.119 1.00 0.00 C ATOM 477 CE2 TYR A 30 -2.006 13.210 4.465 1.00 0.00 C ATOM 478 CZ TYR A 30 -2.404 14.021 3.395 1.00 0.00 C ATOM 479 OH TYR A 30 -3.324 15.030 3.600 1.00 0.00 O ATOM 0 H TYR A 30 -0.954 9.321 4.026 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.812 10.041 1.200 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.883 10.544 3.710 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.302 11.243 2.159 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.523 12.624 0.926 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.768 11.560 5.082 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.176 14.436 1.295 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.418 13.374 5.450 1.00 0.00 H new ATOM 0 HH TYR A 30 -3.595 15.039 4.542 1.00 0.00 H new ATOM 489 N VAL A 31 1.353 7.811 2.303 1.00 0.00 N ATOM 490 CA VAL A 31 2.386 6.847 1.774 1.00 0.00 C ATOM 491 C VAL A 31 1.725 5.882 0.769 1.00 0.00 C ATOM 492 O VAL A 31 2.326 5.530 -0.229 1.00 0.00 O ATOM 493 CB VAL A 31 2.966 6.109 3.009 1.00 0.00 C ATOM 494 CG1 VAL A 31 3.810 4.885 2.591 1.00 0.00 C ATOM 495 CG2 VAL A 31 3.854 7.084 3.787 1.00 0.00 C ATOM 0 H VAL A 31 1.104 7.694 3.285 1.00 0.00 H new ATOM 0 HA VAL A 31 3.190 7.350 1.236 1.00 0.00 H new ATOM 0 HB VAL A 31 2.138 5.757 3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.201 4.392 3.481 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.186 4.186 2.033 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.639 5.212 1.964 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.270 6.580 4.659 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.665 7.428 3.146 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.260 7.938 4.111 1.00 0.00 H new ATOM 505 N ALA A 32 0.499 5.465 1.005 1.00 0.00 N ATOM 506 CA ALA A 32 -0.168 4.533 0.022 1.00 0.00 C ATOM 507 C ALA A 32 -0.364 5.253 -1.321 1.00 0.00 C ATOM 508 O ALA A 32 -0.194 4.662 -2.371 1.00 0.00 O ATOM 509 CB ALA A 32 -1.528 4.146 0.625 1.00 0.00 C ATOM 0 H ALA A 32 -0.062 5.721 1.817 1.00 0.00 H new ATOM 0 HA ALA A 32 0.439 3.646 -0.158 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.048 3.470 -0.054 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.373 3.650 1.583 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.128 5.043 0.774 1.00 0.00 H new ATOM 515 N GLU A 33 -0.716 6.525 -1.302 1.00 0.00 N ATOM 516 CA GLU A 33 -0.911 7.264 -2.604 1.00 0.00 C ATOM 517 C GLU A 33 0.395 7.247 -3.408 1.00 0.00 C ATOM 518 O GLU A 33 0.393 6.973 -4.594 1.00 0.00 O ATOM 519 CB GLU A 33 -1.296 8.708 -2.245 1.00 0.00 C ATOM 520 CG GLU A 33 -2.816 8.810 -2.099 1.00 0.00 C ATOM 521 CD GLU A 33 -3.169 10.061 -1.292 1.00 0.00 C ATOM 522 OE1 GLU A 33 -2.556 10.266 -0.257 1.00 0.00 O ATOM 523 OE2 GLU A 33 -4.045 10.792 -1.723 1.00 0.00 O ATOM 0 H GLU A 33 -0.874 7.076 -0.458 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.687 6.798 -3.211 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.810 9.005 -1.316 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -0.948 9.392 -3.019 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.284 8.855 -3.082 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -3.204 7.922 -1.601 1.00 0.00 H new ATOM 530 N TYR A 34 1.516 7.518 -2.772 1.00 0.00 N ATOM 531 CA TYR A 34 2.823 7.490 -3.522 1.00 0.00 C ATOM 532 C TYR A 34 3.073 6.064 -4.037 1.00 0.00 C ATOM 533 O TYR A 34 3.506 5.873 -5.158 1.00 0.00 O ATOM 534 CB TYR A 34 3.917 7.920 -2.520 1.00 0.00 C ATOM 535 CG TYR A 34 5.316 7.764 -3.105 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.546 7.867 -4.491 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.390 7.527 -2.240 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.845 7.732 -4.996 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.685 7.391 -2.747 1.00 0.00 C ATOM 540 CZ TYR A 34 7.914 7.494 -4.124 1.00 0.00 C ATOM 541 OH TYR A 34 9.194 7.363 -4.621 1.00 0.00 O ATOM 0 H TYR A 34 1.585 7.754 -1.782 1.00 0.00 H new ATOM 0 HA TYR A 34 2.819 8.159 -4.382 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.758 8.959 -2.232 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.834 7.322 -1.613 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.721 8.050 -5.164 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.217 7.449 -1.177 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.022 7.811 -6.058 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.510 7.206 -2.075 1.00 0.00 H new ATOM 0 HH TYR A 34 9.836 7.378 -3.880 1.00 0.00 H new ATOM 551 N ILE A 35 2.784 5.059 -3.234 1.00 0.00 N ATOM 552 CA ILE A 35 2.988 3.638 -3.703 1.00 0.00 C ATOM 553 C ILE A 35 2.145 3.410 -4.972 1.00 0.00 C ATOM 554 O ILE A 35 2.633 2.890 -5.959 1.00 0.00 O ATOM 555 CB ILE A 35 2.529 2.737 -2.535 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.577 2.795 -1.423 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.361 1.281 -2.984 1.00 0.00 C ATOM 558 CD1 ILE A 35 2.913 2.480 -0.084 1.00 0.00 C ATOM 0 H ILE A 35 2.420 5.156 -2.286 1.00 0.00 H new ATOM 0 HA ILE A 35 4.024 3.416 -3.960 1.00 0.00 H new ATOM 0 HB ILE A 35 1.565 3.100 -2.180 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.375 2.080 -1.623 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.035 3.784 -1.391 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.037 0.674 -2.138 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.613 1.228 -3.775 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.313 0.904 -3.358 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.658 2.521 0.710 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.130 3.212 0.115 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.476 1.482 -0.120 1.00 0.00 H new ATOM 570 N VAL A 36 0.895 3.824 -4.964 1.00 0.00 N ATOM 571 CA VAL A 36 0.047 3.653 -6.198 1.00 0.00 C ATOM 572 C VAL A 36 0.661 4.475 -7.341 1.00 0.00 C ATOM 573 O VAL A 36 0.703 4.028 -8.470 1.00 0.00 O ATOM 574 CB VAL A 36 -1.362 4.163 -5.851 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.270 4.077 -7.081 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.949 3.297 -4.734 1.00 0.00 C ATOM 0 H VAL A 36 0.430 4.266 -4.171 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.002 2.612 -6.517 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.296 5.201 -5.525 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.265 4.440 -6.825 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.856 4.688 -7.883 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.336 3.041 -7.413 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.948 3.654 -4.484 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.007 2.261 -5.069 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.311 3.358 -3.853 1.00 0.00 H new ATOM 586 N LEU A 37 1.163 5.665 -7.057 1.00 0.00 N ATOM 587 CA LEU A 37 1.800 6.485 -8.153 1.00 0.00 C ATOM 588 C LEU A 37 2.967 5.681 -8.747 1.00 0.00 C ATOM 589 O LEU A 37 3.116 5.594 -9.951 1.00 0.00 O ATOM 590 CB LEU A 37 2.324 7.780 -7.508 1.00 0.00 C ATOM 591 CG LEU A 37 2.190 8.939 -8.499 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.897 9.708 -8.218 1.00 0.00 C ATOM 593 CD2 LEU A 37 3.386 9.883 -8.345 1.00 0.00 C ATOM 0 H LEU A 37 1.160 6.097 -6.133 1.00 0.00 H new ATOM 0 HA LEU A 37 1.091 6.720 -8.947 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.763 7.998 -6.600 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.367 7.657 -7.216 1.00 0.00 H new ATOM 0 HG LEU A 37 2.164 8.545 -9.515 1.00 0.00 H new ATOM 0 HD11 LEU A 37 0.803 10.533 -8.924 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.044 9.038 -8.327 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.921 10.102 -7.202 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.291 10.709 -9.050 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.411 10.275 -7.328 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.308 9.338 -8.546 1.00 0.00 H new ATOM 605 N LEU A 38 3.777 5.060 -7.906 1.00 0.00 N ATOM 606 CA LEU A 38 4.908 4.227 -8.445 1.00 0.00 C ATOM 607 C LEU A 38 4.317 3.067 -9.264 1.00 0.00 C ATOM 608 O LEU A 38 4.802 2.735 -10.327 1.00 0.00 O ATOM 609 CB LEU A 38 5.679 3.670 -7.235 1.00 0.00 C ATOM 610 CG LEU A 38 6.356 4.812 -6.478 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.933 4.278 -5.164 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.486 5.390 -7.333 1.00 0.00 C ATOM 0 H LEU A 38 3.704 5.094 -6.889 1.00 0.00 H new ATOM 0 HA LEU A 38 5.570 4.813 -9.083 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.997 3.137 -6.572 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.426 2.950 -7.569 1.00 0.00 H new ATOM 0 HG LEU A 38 5.626 5.593 -6.265 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.417 5.091 -4.622 1.00 0.00 H new ATOM 0 HD12 LEU A 38 6.129 3.864 -4.555 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.665 3.499 -5.378 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.970 6.205 -6.794 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.218 4.610 -7.545 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.077 5.767 -8.270 1.00 0.00 H new ATOM 624 N ILE A 39 3.252 2.461 -8.775 1.00 0.00 N ATOM 625 CA ILE A 39 2.606 1.329 -9.533 1.00 0.00 C ATOM 626 C ILE A 39 1.975 1.877 -10.826 1.00 0.00 C ATOM 627 O ILE A 39 2.069 1.265 -11.874 1.00 0.00 O ATOM 628 CB ILE A 39 1.519 0.761 -8.590 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.189 0.127 -7.355 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.643 -0.274 -9.317 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.906 -1.178 -7.728 1.00 0.00 C ATOM 0 H ILE A 39 2.805 2.699 -7.890 1.00 0.00 H new ATOM 0 HA ILE A 39 3.320 0.557 -9.818 1.00 0.00 H new ATOM 0 HB ILE A 39 0.872 1.578 -8.270 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.903 0.828 -6.924 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.437 -0.072 -6.591 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.113 -0.657 -8.631 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.154 0.198 -10.169 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.266 -1.097 -9.666 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.370 -1.605 -6.839 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.184 -1.886 -8.136 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.673 -0.971 -8.474 1.00 0.00 H new ATOM 643 N VAL A 40 1.339 3.025 -10.760 1.00 0.00 N ATOM 644 CA VAL A 40 0.707 3.608 -11.999 1.00 0.00 C ATOM 645 C VAL A 40 1.780 4.120 -12.980 1.00 0.00 C ATOM 646 O VAL A 40 1.522 4.234 -14.164 1.00 0.00 O ATOM 647 CB VAL A 40 -0.181 4.779 -11.535 1.00 0.00 C ATOM 648 CG1 VAL A 40 -0.924 5.366 -12.739 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.198 4.285 -10.499 1.00 0.00 C ATOM 0 H VAL A 40 1.229 3.582 -9.913 1.00 0.00 H new ATOM 0 HA VAL A 40 0.127 2.848 -12.523 1.00 0.00 H new ATOM 0 HB VAL A 40 0.447 5.546 -11.083 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.552 6.194 -12.411 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -0.202 5.726 -13.472 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.548 4.596 -13.193 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.822 5.118 -10.176 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.826 3.513 -10.945 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.670 3.872 -9.639 1.00 0.00 H new ATOM 659 N ASN A 41 2.976 4.436 -12.515 1.00 0.00 N ATOM 660 CA ASN A 41 4.028 4.941 -13.451 1.00 0.00 C ATOM 661 C ASN A 41 5.330 4.127 -13.324 1.00 0.00 C ATOM 662 O ASN A 41 6.393 4.622 -13.653 1.00 0.00 O ATOM 663 CB ASN A 41 4.281 6.394 -13.025 1.00 0.00 C ATOM 664 CG ASN A 41 2.966 7.189 -13.038 1.00 0.00 C ATOM 665 OD1 ASN A 41 2.489 7.570 -14.089 1.00 0.00 O ATOM 666 ND2 ASN A 41 2.356 7.457 -11.909 1.00 0.00 N ATOM 0 H ASN A 41 3.260 4.365 -11.538 1.00 0.00 H new ATOM 0 HA ASN A 41 3.705 4.856 -14.489 1.00 0.00 H new ATOM 0 HB2 ASN A 41 4.718 6.417 -12.027 1.00 0.00 H new ATOM 0 HB3 ASN A 41 5.001 6.858 -13.699 1.00 0.00 H new ATOM 0 HD21 ASN A 41 1.483 7.984 -11.914 1.00 0.00 H new ATOM 0 HD22 ASN A 41 2.755 7.138 -11.026 1.00 0.00 H new ATOM 673 N GLY A 42 5.276 2.890 -12.857 1.00 0.00 N ATOM 674 CA GLY A 42 6.540 2.095 -12.732 1.00 0.00 C ATOM 675 C GLY A 42 6.267 0.774 -11.998 1.00 0.00 C ATOM 676 O GLY A 42 6.742 0.569 -10.897 1.00 0.00 O ATOM 0 H GLY A 42 4.425 2.410 -12.564 1.00 0.00 H new ATOM 0 HA2 GLY A 42 6.949 1.891 -13.722 1.00 0.00 H new ATOM 0 HA3 GLY A 42 7.289 2.672 -12.190 1.00 0.00 H new ATOM 680 N GLY A 43 5.499 -0.117 -12.591 1.00 0.00 N ATOM 681 CA GLY A 43 5.196 -1.414 -11.917 1.00 0.00 C ATOM 682 C GLY A 43 6.467 -2.276 -11.838 1.00 0.00 C ATOM 683 O GLY A 43 6.594 -3.268 -12.529 1.00 0.00 O ATOM 0 H GLY A 43 5.073 0.003 -13.510 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.808 -1.231 -10.915 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.420 -1.946 -12.467 1.00 0.00 H new ATOM 687 N THR A 44 7.399 -1.913 -10.985 1.00 0.00 N ATOM 688 CA THR A 44 8.652 -2.717 -10.835 1.00 0.00 C ATOM 689 C THR A 44 9.061 -2.726 -9.351 1.00 0.00 C ATOM 690 O THR A 44 9.503 -1.724 -8.824 1.00 0.00 O ATOM 691 CB THR A 44 9.713 -2.014 -11.695 1.00 0.00 C ATOM 692 OG1 THR A 44 9.971 -0.700 -11.188 1.00 0.00 O ATOM 693 CG2 THR A 44 9.233 -1.943 -13.153 1.00 0.00 C ATOM 0 H THR A 44 7.343 -1.090 -10.385 1.00 0.00 H new ATOM 0 HA THR A 44 8.527 -3.752 -11.153 1.00 0.00 H new ATOM 0 HB THR A 44 10.641 -2.585 -11.656 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.767 -0.673 -10.230 1.00 0.00 H new ATOM 0 HG21 THR A 44 9.988 -1.444 -13.761 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.071 -2.952 -13.532 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.299 -1.383 -13.202 1.00 0.00 H new ATOM 701 N VAL A 45 8.881 -3.840 -8.667 1.00 0.00 N ATOM 702 CA VAL A 45 9.228 -3.891 -7.193 1.00 0.00 C ATOM 703 C VAL A 45 10.634 -3.314 -6.919 1.00 0.00 C ATOM 704 O VAL A 45 10.866 -2.746 -5.869 1.00 0.00 O ATOM 705 CB VAL A 45 9.151 -5.373 -6.764 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.554 -5.517 -5.292 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.712 -5.877 -6.932 1.00 0.00 C ATOM 0 H VAL A 45 8.514 -4.708 -9.056 1.00 0.00 H new ATOM 0 HA VAL A 45 8.530 -3.281 -6.621 1.00 0.00 H new ATOM 0 HB VAL A 45 9.830 -5.956 -7.386 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.496 -6.566 -5.000 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.575 -5.158 -5.157 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.878 -4.929 -4.671 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.655 -6.923 -6.630 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.043 -5.283 -6.309 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.414 -5.784 -7.976 1.00 0.00 H new ATOM 717 N GLU A 46 11.567 -3.443 -7.838 1.00 0.00 N ATOM 718 CA GLU A 46 12.938 -2.875 -7.574 1.00 0.00 C ATOM 719 C GLU A 46 12.895 -1.346 -7.682 1.00 0.00 C ATOM 720 O GLU A 46 13.454 -0.653 -6.850 1.00 0.00 O ATOM 721 CB GLU A 46 13.882 -3.467 -8.631 1.00 0.00 C ATOM 722 CG GLU A 46 15.279 -3.636 -8.030 1.00 0.00 C ATOM 723 CD GLU A 46 16.238 -4.154 -9.104 1.00 0.00 C ATOM 724 OE1 GLU A 46 15.873 -5.092 -9.794 1.00 0.00 O ATOM 725 OE2 GLU A 46 17.320 -3.602 -9.219 1.00 0.00 O ATOM 0 H GLU A 46 11.447 -3.905 -8.739 1.00 0.00 H new ATOM 0 HA GLU A 46 13.285 -3.127 -6.572 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.503 -4.430 -8.974 1.00 0.00 H new ATOM 0 HB3 GLU A 46 13.926 -2.813 -9.502 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.635 -2.683 -7.638 1.00 0.00 H new ATOM 0 HG3 GLU A 46 15.244 -4.332 -7.192 1.00 0.00 H new ATOM 732 N SER A 47 12.219 -0.809 -8.673 1.00 0.00 N ATOM 733 CA SER A 47 12.134 0.688 -8.779 1.00 0.00 C ATOM 734 C SER A 47 11.096 1.209 -7.771 1.00 0.00 C ATOM 735 O SER A 47 11.265 2.274 -7.207 1.00 0.00 O ATOM 736 CB SER A 47 11.705 1.014 -10.216 1.00 0.00 C ATOM 737 OG SER A 47 12.408 2.165 -10.665 1.00 0.00 O ATOM 0 H SER A 47 11.730 -1.330 -9.401 1.00 0.00 H new ATOM 0 HA SER A 47 13.090 1.161 -8.555 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.913 0.168 -10.871 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.630 1.191 -10.256 1.00 0.00 H new ATOM 0 HG SER A 47 12.138 2.376 -11.583 1.00 0.00 H new ATOM 743 N VAL A 48 10.035 0.464 -7.523 1.00 0.00 N ATOM 744 CA VAL A 48 9.012 0.936 -6.526 1.00 0.00 C ATOM 745 C VAL A 48 9.582 0.836 -5.099 1.00 0.00 C ATOM 746 O VAL A 48 9.264 1.655 -4.256 1.00 0.00 O ATOM 747 CB VAL A 48 7.772 0.032 -6.691 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.682 0.444 -5.695 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.226 0.179 -8.114 1.00 0.00 C ATOM 0 H VAL A 48 9.836 -0.436 -7.961 1.00 0.00 H new ATOM 0 HA VAL A 48 8.745 1.979 -6.696 1.00 0.00 H new ATOM 0 HB VAL A 48 8.060 -1.002 -6.503 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.812 -0.201 -5.821 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.062 0.346 -4.678 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.395 1.480 -5.877 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.350 -0.458 -8.235 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.947 1.218 -8.291 1.00 0.00 H new ATOM 0 HG23 VAL A 48 7.992 -0.118 -8.830 1.00 0.00 H new ATOM 759 N VAL A 49 10.432 -0.137 -4.814 1.00 0.00 N ATOM 760 CA VAL A 49 11.007 -0.220 -3.425 1.00 0.00 C ATOM 761 C VAL A 49 12.103 0.845 -3.266 1.00 0.00 C ATOM 762 O VAL A 49 12.204 1.492 -2.241 1.00 0.00 O ATOM 763 CB VAL A 49 11.554 -1.658 -3.252 1.00 0.00 C ATOM 764 CG1 VAL A 49 12.910 -1.850 -3.950 1.00 0.00 C ATOM 765 CG2 VAL A 49 11.705 -1.967 -1.762 1.00 0.00 C ATOM 0 H VAL A 49 10.744 -0.857 -5.465 1.00 0.00 H new ATOM 0 HA VAL A 49 10.261 -0.023 -2.655 1.00 0.00 H new ATOM 0 HB VAL A 49 10.842 -2.341 -3.716 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.254 -2.874 -3.801 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.801 -1.655 -5.017 1.00 0.00 H new ATOM 0 HG13 VAL A 49 13.638 -1.158 -3.527 1.00 0.00 H new ATOM 0 HG21 VAL A 49 12.090 -2.979 -1.638 1.00 0.00 H new ATOM 0 HG22 VAL A 49 12.399 -1.257 -1.312 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.734 -1.886 -1.273 1.00 0.00 H new ATOM 775 N ASP A 50 12.912 1.040 -4.285 1.00 0.00 N ATOM 776 CA ASP A 50 13.990 2.087 -4.188 1.00 0.00 C ATOM 777 C ASP A 50 13.360 3.491 -4.148 1.00 0.00 C ATOM 778 O ASP A 50 13.875 4.379 -3.492 1.00 0.00 O ATOM 779 CB ASP A 50 14.872 1.935 -5.437 1.00 0.00 C ATOM 780 CG ASP A 50 16.183 2.695 -5.232 1.00 0.00 C ATOM 781 OD1 ASP A 50 16.146 3.744 -4.609 1.00 0.00 O ATOM 782 OD2 ASP A 50 17.203 2.217 -5.701 1.00 0.00 O ATOM 0 H ASP A 50 12.876 0.529 -5.167 1.00 0.00 H new ATOM 0 HA ASP A 50 14.578 1.961 -3.279 1.00 0.00 H new ATOM 0 HB2 ASP A 50 15.076 0.881 -5.625 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.350 2.320 -6.313 1.00 0.00 H new ATOM 787 N GLU A 51 12.250 3.706 -4.831 1.00 0.00 N ATOM 788 CA GLU A 51 11.612 5.073 -4.799 1.00 0.00 C ATOM 789 C GLU A 51 10.997 5.327 -3.415 1.00 0.00 C ATOM 790 O GLU A 51 11.089 6.421 -2.889 1.00 0.00 O ATOM 791 CB GLU A 51 10.516 5.104 -5.888 1.00 0.00 C ATOM 792 CG GLU A 51 10.927 6.069 -7.005 1.00 0.00 C ATOM 793 CD GLU A 51 10.408 5.549 -8.347 1.00 0.00 C ATOM 794 OE1 GLU A 51 10.838 4.482 -8.752 1.00 0.00 O ATOM 795 OE2 GLU A 51 9.590 6.227 -8.946 1.00 0.00 O ATOM 0 H GLU A 51 11.767 3.010 -5.398 1.00 0.00 H new ATOM 0 HA GLU A 51 12.353 5.850 -4.988 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.365 4.104 -6.295 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.567 5.418 -5.454 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.524 7.063 -6.808 1.00 0.00 H new ATOM 0 HG3 GLU A 51 12.012 6.165 -7.036 1.00 0.00 H new ATOM 802 N LEU A 52 10.386 4.329 -2.809 1.00 0.00 N ATOM 803 CA LEU A 52 9.789 4.547 -1.444 1.00 0.00 C ATOM 804 C LEU A 52 10.913 4.695 -0.411 1.00 0.00 C ATOM 805 O LEU A 52 10.821 5.509 0.487 1.00 0.00 O ATOM 806 CB LEU A 52 8.923 3.320 -1.125 1.00 0.00 C ATOM 807 CG LEU A 52 7.742 3.263 -2.094 1.00 0.00 C ATOM 808 CD1 LEU A 52 7.130 1.861 -2.072 1.00 0.00 C ATOM 809 CD2 LEU A 52 6.685 4.286 -1.671 1.00 0.00 C ATOM 0 H LEU A 52 10.276 3.390 -3.191 1.00 0.00 H new ATOM 0 HA LEU A 52 9.184 5.453 -1.417 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.518 2.411 -1.207 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.562 3.374 -0.098 1.00 0.00 H new ATOM 0 HG LEU A 52 8.089 3.493 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.288 1.821 -2.763 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.882 1.131 -2.373 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.784 1.631 -1.064 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.843 4.246 -2.362 1.00 0.00 H new ATOM 0 HD22 LEU A 52 6.339 4.056 -0.663 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.119 5.286 -1.686 1.00 0.00 H new ATOM 821 N ALA A 53 11.980 3.934 -0.536 1.00 0.00 N ATOM 822 CA ALA A 53 13.108 4.074 0.451 1.00 0.00 C ATOM 823 C ALA A 53 13.764 5.454 0.283 1.00 0.00 C ATOM 824 O ALA A 53 14.133 6.087 1.255 1.00 0.00 O ATOM 825 CB ALA A 53 14.117 2.957 0.143 1.00 0.00 C ATOM 0 H ALA A 53 12.119 3.234 -1.265 1.00 0.00 H new ATOM 0 HA ALA A 53 12.753 3.991 1.478 1.00 0.00 H new ATOM 0 HB1 ALA A 53 14.954 3.021 0.838 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.630 1.988 0.250 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.483 3.069 -0.878 1.00 0.00 H new ATOM 831 N SER A 54 13.905 5.935 -0.939 1.00 0.00 N ATOM 832 CA SER A 54 14.533 7.292 -1.142 1.00 0.00 C ATOM 833 C SER A 54 13.737 8.369 -0.380 1.00 0.00 C ATOM 834 O SER A 54 14.309 9.315 0.129 1.00 0.00 O ATOM 835 CB SER A 54 14.495 7.579 -2.651 1.00 0.00 C ATOM 836 OG SER A 54 15.288 8.725 -2.931 1.00 0.00 O ATOM 0 H SER A 54 13.617 5.455 -1.792 1.00 0.00 H new ATOM 0 HA SER A 54 15.556 7.306 -0.765 1.00 0.00 H new ATOM 0 HB2 SER A 54 14.870 6.719 -3.206 1.00 0.00 H new ATOM 0 HB3 SER A 54 13.468 7.745 -2.976 1.00 0.00 H new ATOM 0 HG SER A 54 15.267 8.910 -3.893 1.00 0.00 H new ATOM 842 N LEU A 55 12.429 8.231 -0.283 1.00 0.00 N ATOM 843 CA LEU A 55 11.622 9.253 0.466 1.00 0.00 C ATOM 844 C LEU A 55 11.408 8.768 1.904 1.00 0.00 C ATOM 845 O LEU A 55 11.584 9.515 2.849 1.00 0.00 O ATOM 846 CB LEU A 55 10.278 9.373 -0.269 1.00 0.00 C ATOM 847 CG LEU A 55 10.278 10.630 -1.139 1.00 0.00 C ATOM 848 CD1 LEU A 55 9.448 10.379 -2.400 1.00 0.00 C ATOM 849 CD2 LEU A 55 9.669 11.794 -0.353 1.00 0.00 C ATOM 0 H LEU A 55 11.892 7.463 -0.686 1.00 0.00 H new ATOM 0 HA LEU A 55 12.124 10.220 0.507 1.00 0.00 H new ATOM 0 HB2 LEU A 55 10.110 8.491 -0.887 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.461 9.417 0.451 1.00 0.00 H new ATOM 0 HG LEU A 55 11.302 10.876 -1.421 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.448 11.275 -3.020 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.880 9.550 -2.961 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.424 10.133 -2.119 1.00 0.00 H new ATOM 0 HD21 LEU A 55 9.669 12.691 -0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.645 11.547 -0.072 1.00 0.00 H new ATOM 0 HD23 LEU A 55 10.259 11.974 0.546 1.00 0.00 H new ATOM 861 N PHE A 56 11.047 7.517 2.079 1.00 0.00 N ATOM 862 CA PHE A 56 10.845 6.977 3.456 1.00 0.00 C ATOM 863 C PHE A 56 12.020 6.053 3.806 1.00 0.00 C ATOM 864 O PHE A 56 11.905 4.845 3.730 1.00 0.00 O ATOM 865 CB PHE A 56 9.529 6.180 3.415 1.00 0.00 C ATOM 866 CG PHE A 56 8.397 7.050 2.908 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.213 8.344 3.418 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.528 6.558 1.925 1.00 0.00 C ATOM 869 CE1 PHE A 56 7.163 9.141 2.946 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.479 7.355 1.454 1.00 0.00 C ATOM 871 CZ PHE A 56 6.297 8.647 1.963 1.00 0.00 C ATOM 0 H PHE A 56 10.884 6.849 1.325 1.00 0.00 H new ATOM 0 HA PHE A 56 10.798 7.766 4.207 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.644 5.310 2.769 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.291 5.808 4.412 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.882 8.726 4.175 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.668 5.562 1.530 1.00 0.00 H new ATOM 0 HE1 PHE A 56 7.021 10.136 3.340 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.809 6.974 0.697 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.488 9.262 1.597 1.00 0.00 H new ATOM 881 N ASP A 57 13.152 6.611 4.190 1.00 0.00 N ATOM 882 CA ASP A 57 14.331 5.742 4.540 1.00 0.00 C ATOM 883 C ASP A 57 14.400 5.447 6.057 1.00 0.00 C ATOM 884 O ASP A 57 15.443 5.068 6.557 1.00 0.00 O ATOM 885 CB ASP A 57 15.575 6.523 4.096 1.00 0.00 C ATOM 886 CG ASP A 57 16.732 5.549 3.863 1.00 0.00 C ATOM 887 OD1 ASP A 57 16.495 4.510 3.269 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.835 5.859 4.284 1.00 0.00 O ATOM 0 H ASP A 57 13.309 7.615 4.275 1.00 0.00 H new ATOM 0 HA ASP A 57 14.253 4.774 4.044 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.362 7.077 3.182 1.00 0.00 H new ATOM 0 HB3 ASP A 57 15.849 7.255 4.856 1.00 0.00 H new ATOM 893 N SER A 58 13.311 5.592 6.794 1.00 0.00 N ATOM 894 CA SER A 58 13.359 5.285 8.264 1.00 0.00 C ATOM 895 C SER A 58 12.848 3.852 8.549 1.00 0.00 C ATOM 896 O SER A 58 13.109 3.310 9.607 1.00 0.00 O ATOM 897 CB SER A 58 12.454 6.324 8.940 1.00 0.00 C ATOM 898 OG SER A 58 13.183 6.979 9.971 1.00 0.00 O ATOM 0 H SER A 58 12.406 5.905 6.443 1.00 0.00 H new ATOM 0 HA SER A 58 14.380 5.333 8.643 1.00 0.00 H new ATOM 0 HB2 SER A 58 12.104 7.051 8.207 1.00 0.00 H new ATOM 0 HB3 SER A 58 11.570 5.839 9.355 1.00 0.00 H new ATOM 0 HG SER A 58 12.610 7.645 10.405 1.00 0.00 H new ATOM 904 N VAL A 59 12.130 3.227 7.628 1.00 0.00 N ATOM 905 CA VAL A 59 11.629 1.835 7.883 1.00 0.00 C ATOM 906 C VAL A 59 12.537 0.818 7.174 1.00 0.00 C ATOM 907 O VAL A 59 13.108 1.109 6.139 1.00 0.00 O ATOM 908 CB VAL A 59 10.209 1.791 7.296 1.00 0.00 C ATOM 909 CG1 VAL A 59 9.592 0.408 7.518 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.341 2.849 7.984 1.00 0.00 C ATOM 0 H VAL A 59 11.875 3.621 6.722 1.00 0.00 H new ATOM 0 HA VAL A 59 11.628 1.587 8.944 1.00 0.00 H new ATOM 0 HB VAL A 59 10.259 1.993 6.226 1.00 0.00 H new ATOM 0 HG11 VAL A 59 8.586 0.387 7.099 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.206 -0.347 7.027 1.00 0.00 H new ATOM 0 HG13 VAL A 59 9.544 0.198 8.587 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.334 2.819 7.569 1.00 0.00 H new ATOM 0 HG22 VAL A 59 9.299 2.645 9.054 1.00 0.00 H new ATOM 0 HG23 VAL A 59 9.772 3.836 7.819 1.00 0.00 H new ATOM 920 N SER A 60 12.680 -0.375 7.720 1.00 0.00 N ATOM 921 CA SER A 60 13.565 -1.402 7.056 1.00 0.00 C ATOM 922 C SER A 60 13.111 -1.641 5.605 1.00 0.00 C ATOM 923 O SER A 60 11.929 -1.665 5.320 1.00 0.00 O ATOM 924 CB SER A 60 13.425 -2.699 7.869 1.00 0.00 C ATOM 925 OG SER A 60 13.245 -2.375 9.241 1.00 0.00 O ATOM 0 H SER A 60 12.230 -0.680 8.583 1.00 0.00 H new ATOM 0 HA SER A 60 14.600 -1.063 7.028 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.577 -3.280 7.506 1.00 0.00 H new ATOM 0 HB3 SER A 60 14.313 -3.319 7.743 1.00 0.00 H new ATOM 0 HG SER A 60 13.154 -3.200 9.763 1.00 0.00 H new ATOM 931 N ARG A 61 14.040 -1.820 4.684 1.00 0.00 N ATOM 932 CA ARG A 61 13.644 -2.057 3.244 1.00 0.00 C ATOM 933 C ARG A 61 12.642 -3.219 3.140 1.00 0.00 C ATOM 934 O ARG A 61 11.738 -3.189 2.325 1.00 0.00 O ATOM 935 CB ARG A 61 14.934 -2.413 2.486 1.00 0.00 C ATOM 936 CG ARG A 61 15.869 -1.200 2.468 1.00 0.00 C ATOM 937 CD ARG A 61 16.590 -1.127 1.120 1.00 0.00 C ATOM 938 NE ARG A 61 17.898 -1.804 1.347 1.00 0.00 N ATOM 939 CZ ARG A 61 19.011 -1.134 1.219 1.00 0.00 C ATOM 940 NH1 ARG A 61 19.141 0.030 1.793 1.00 0.00 N ATOM 941 NH2 ARG A 61 19.993 -1.629 0.517 1.00 0.00 N ATOM 0 H ARG A 61 15.044 -1.813 4.862 1.00 0.00 H new ATOM 0 HA ARG A 61 13.165 -1.171 2.826 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.428 -3.259 2.965 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.697 -2.718 1.467 1.00 0.00 H new ATOM 0 HG2 ARG A 61 15.299 -0.286 2.637 1.00 0.00 H new ATOM 0 HG3 ARG A 61 16.596 -1.276 3.277 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.017 -1.626 0.338 1.00 0.00 H new ATOM 0 HD3 ARG A 61 16.730 -0.094 0.802 1.00 0.00 H new ATOM 0 HE ARG A 61 17.924 -2.791 1.602 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.373 0.417 2.342 1.00 0.00 H new ATOM 0 HH12 ARG A 61 20.011 0.554 1.693 1.00 0.00 H new ATOM 0 HH21 ARG A 61 19.891 -2.539 0.068 1.00 0.00 H new ATOM 0 HH22 ARG A 61 20.863 -1.106 0.417 1.00 0.00 H new ATOM 955 N ASP A 62 12.795 -4.244 3.953 1.00 0.00 N ATOM 956 CA ASP A 62 11.834 -5.404 3.876 1.00 0.00 C ATOM 957 C ASP A 62 10.392 -4.934 4.136 1.00 0.00 C ATOM 958 O ASP A 62 9.463 -5.436 3.530 1.00 0.00 O ATOM 959 CB ASP A 62 12.268 -6.423 4.947 1.00 0.00 C ATOM 960 CG ASP A 62 12.220 -5.777 6.335 1.00 0.00 C ATOM 961 OD1 ASP A 62 11.139 -5.707 6.898 1.00 0.00 O ATOM 962 OD2 ASP A 62 13.264 -5.361 6.811 1.00 0.00 O ATOM 0 H ASP A 62 13.530 -4.330 4.656 1.00 0.00 H new ATOM 0 HA ASP A 62 11.854 -5.852 2.883 1.00 0.00 H new ATOM 0 HB2 ASP A 62 11.613 -7.294 4.919 1.00 0.00 H new ATOM 0 HB3 ASP A 62 13.277 -6.777 4.736 1.00 0.00 H new ATOM 967 N THR A 63 10.191 -3.977 5.019 1.00 0.00 N ATOM 968 CA THR A 63 8.788 -3.498 5.284 1.00 0.00 C ATOM 969 C THR A 63 8.282 -2.711 4.068 1.00 0.00 C ATOM 970 O THR A 63 7.150 -2.875 3.648 1.00 0.00 O ATOM 971 CB THR A 63 8.853 -2.593 6.527 1.00 0.00 C ATOM 972 OG1 THR A 63 9.316 -3.351 7.639 1.00 0.00 O ATOM 973 CG2 THR A 63 7.460 -2.036 6.837 1.00 0.00 C ATOM 0 H THR A 63 10.922 -3.514 5.559 1.00 0.00 H new ATOM 0 HA THR A 63 8.104 -4.329 5.455 1.00 0.00 H new ATOM 0 HB THR A 63 9.537 -1.766 6.335 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.900 -4.072 7.323 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.512 -1.396 7.718 1.00 0.00 H new ATOM 0 HG22 THR A 63 7.103 -1.455 5.987 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.773 -2.860 7.027 1.00 0.00 H new ATOM 981 N LEU A 64 9.110 -1.868 3.489 1.00 0.00 N ATOM 982 CA LEU A 64 8.653 -1.090 2.285 1.00 0.00 C ATOM 983 C LEU A 64 8.464 -2.046 1.102 1.00 0.00 C ATOM 984 O LEU A 64 7.509 -1.929 0.356 1.00 0.00 O ATOM 985 CB LEU A 64 9.749 -0.055 1.970 1.00 0.00 C ATOM 986 CG LEU A 64 9.906 0.923 3.149 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.213 0.632 3.901 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.932 2.363 2.620 1.00 0.00 C ATOM 0 H LEU A 64 10.067 -1.686 3.791 1.00 0.00 H new ATOM 0 HA LEU A 64 7.703 -0.591 2.473 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.695 -0.562 1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.493 0.494 1.064 1.00 0.00 H new ATOM 0 HG LEU A 64 9.065 0.798 3.831 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.317 1.328 4.733 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.194 -0.389 4.282 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.057 0.750 3.222 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.043 3.055 3.455 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.771 2.484 1.934 1.00 0.00 H new ATOM 0 HD23 LEU A 64 9.001 2.575 2.095 1.00 0.00 H new ATOM 1000 N ALA A 65 9.352 -3.005 0.931 1.00 0.00 N ATOM 1001 CA ALA A 65 9.185 -3.976 -0.208 1.00 0.00 C ATOM 1002 C ALA A 65 7.919 -4.820 0.012 1.00 0.00 C ATOM 1003 O ALA A 65 7.227 -5.158 -0.930 1.00 0.00 O ATOM 1004 CB ALA A 65 10.431 -4.876 -0.215 1.00 0.00 C ATOM 0 H ALA A 65 10.171 -3.156 1.519 1.00 0.00 H new ATOM 0 HA ALA A 65 9.081 -3.455 -1.160 1.00 0.00 H new ATOM 0 HB1 ALA A 65 10.353 -5.598 -1.027 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.321 -4.264 -0.358 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.503 -5.405 0.735 1.00 0.00 H new ATOM 1010 N ASN A 66 7.608 -5.169 1.247 1.00 0.00 N ATOM 1011 CA ASN A 66 6.375 -5.997 1.499 1.00 0.00 C ATOM 1012 C ASN A 66 5.124 -5.248 1.015 1.00 0.00 C ATOM 1013 O ASN A 66 4.225 -5.851 0.459 1.00 0.00 O ATOM 1014 CB ASN A 66 6.296 -6.231 3.017 1.00 0.00 C ATOM 1015 CG ASN A 66 7.101 -7.484 3.382 1.00 0.00 C ATOM 1016 OD1 ASN A 66 8.272 -7.576 3.069 1.00 0.00 O ATOM 1017 ND2 ASN A 66 6.526 -8.465 4.035 1.00 0.00 N ATOM 0 H ASN A 66 8.145 -4.921 2.078 1.00 0.00 H new ATOM 0 HA ASN A 66 6.425 -6.943 0.960 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.688 -5.365 3.550 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.257 -6.351 3.324 1.00 0.00 H new ATOM 0 HD21 ASN A 66 7.061 -9.299 4.277 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.544 -8.394 4.301 1.00 0.00 H new ATOM 1024 N VAL A 67 5.051 -3.943 1.211 1.00 0.00 N ATOM 1025 CA VAL A 67 3.831 -3.202 0.732 1.00 0.00 C ATOM 1026 C VAL A 67 3.810 -3.193 -0.802 1.00 0.00 C ATOM 1027 O VAL A 67 2.774 -3.391 -1.406 1.00 0.00 O ATOM 1028 CB VAL A 67 3.914 -1.772 1.291 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.664 -0.994 0.873 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.991 -1.825 2.824 1.00 0.00 C ATOM 0 H VAL A 67 5.763 -3.374 1.669 1.00 0.00 H new ATOM 0 HA VAL A 67 2.914 -3.681 1.075 1.00 0.00 H new ATOM 0 HB VAL A 67 4.803 -1.278 0.899 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.718 0.021 1.267 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.605 -0.958 -0.215 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.778 -1.490 1.269 1.00 0.00 H new ATOM 0 HG21 VAL A 67 4.050 -0.811 3.221 1.00 0.00 H new ATOM 0 HG22 VAL A 67 3.101 -2.317 3.216 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.877 -2.384 3.125 1.00 0.00 H new ATOM 1040 N VAL A 68 4.945 -2.992 -1.447 1.00 0.00 N ATOM 1041 CA VAL A 68 4.953 -3.010 -2.959 1.00 0.00 C ATOM 1042 C VAL A 68 4.412 -4.369 -3.450 1.00 0.00 C ATOM 1043 O VAL A 68 3.687 -4.431 -4.425 1.00 0.00 O ATOM 1044 CB VAL A 68 6.416 -2.816 -3.399 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.512 -2.874 -4.926 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.914 -1.451 -2.916 1.00 0.00 C ATOM 0 H VAL A 68 5.848 -2.820 -1.005 1.00 0.00 H new ATOM 0 HA VAL A 68 4.325 -2.224 -3.378 1.00 0.00 H new ATOM 0 HB VAL A 68 7.028 -3.608 -2.968 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.549 -2.736 -5.231 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.157 -3.843 -5.276 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.898 -2.084 -5.359 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.950 -1.311 -3.226 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.296 -0.664 -3.349 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.851 -1.405 -1.829 1.00 0.00 H new ATOM 1056 N GLN A 69 4.741 -5.455 -2.771 1.00 0.00 N ATOM 1057 CA GLN A 69 4.211 -6.794 -3.210 1.00 0.00 C ATOM 1058 C GLN A 69 2.675 -6.812 -3.119 1.00 0.00 C ATOM 1059 O GLN A 69 2.018 -7.444 -3.925 1.00 0.00 O ATOM 1060 CB GLN A 69 4.810 -7.846 -2.261 1.00 0.00 C ATOM 1061 CG GLN A 69 6.185 -8.275 -2.777 1.00 0.00 C ATOM 1062 CD GLN A 69 6.032 -9.498 -3.689 1.00 0.00 C ATOM 1063 OE1 GLN A 69 5.023 -9.648 -4.351 1.00 0.00 O ATOM 1064 NE2 GLN A 69 6.990 -10.389 -3.756 1.00 0.00 N ATOM 0 H GLN A 69 5.342 -5.471 -1.947 1.00 0.00 H new ATOM 0 HA GLN A 69 4.485 -7.001 -4.244 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.899 -7.435 -1.255 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.149 -8.710 -2.195 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.651 -7.456 -3.325 1.00 0.00 H new ATOM 0 HG3 GLN A 69 6.841 -8.513 -1.940 1.00 0.00 H new ATOM 0 HE21 GLN A 69 7.838 -10.268 -3.203 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.887 -11.204 -4.361 1.00 0.00 H new ATOM 1073 N THR A 70 2.090 -6.119 -2.157 1.00 0.00 N ATOM 1074 CA THR A 70 0.588 -6.113 -2.059 1.00 0.00 C ATOM 1075 C THR A 70 0.018 -5.361 -3.251 1.00 0.00 C ATOM 1076 O THR A 70 -0.872 -5.843 -3.928 1.00 0.00 O ATOM 1077 CB THR A 70 0.198 -5.361 -0.776 1.00 0.00 C ATOM 1078 OG1 THR A 70 0.533 -3.989 -0.913 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.926 -5.941 0.430 1.00 0.00 C ATOM 0 H THR A 70 2.578 -5.569 -1.450 1.00 0.00 H new ATOM 0 HA THR A 70 0.204 -7.133 -2.044 1.00 0.00 H new ATOM 0 HB THR A 70 -0.876 -5.469 -0.621 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.488 -3.866 -0.732 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.636 -5.395 1.327 1.00 0.00 H new ATOM 0 HG22 THR A 70 0.661 -6.992 0.544 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.002 -5.852 0.283 1.00 0.00 H new ATOM 1087 N ALA A 71 0.521 -4.173 -3.515 1.00 0.00 N ATOM 1088 CA ALA A 71 -0.015 -3.394 -4.678 1.00 0.00 C ATOM 1089 C ALA A 71 0.150 -4.213 -5.972 1.00 0.00 C ATOM 1090 O ALA A 71 -0.716 -4.203 -6.828 1.00 0.00 O ATOM 1091 CB ALA A 71 0.788 -2.086 -4.768 1.00 0.00 C ATOM 0 H ALA A 71 1.265 -3.718 -2.986 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.075 -3.178 -4.546 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.424 -1.492 -5.606 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.668 -1.521 -3.844 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.843 -2.316 -4.918 1.00 0.00 H new ATOM 1097 N PHE A 72 1.247 -4.939 -6.116 1.00 0.00 N ATOM 1098 CA PHE A 72 1.432 -5.770 -7.358 1.00 0.00 C ATOM 1099 C PHE A 72 0.319 -6.822 -7.423 1.00 0.00 C ATOM 1100 O PHE A 72 -0.345 -6.963 -8.433 1.00 0.00 O ATOM 1101 CB PHE A 72 2.805 -6.457 -7.235 1.00 0.00 C ATOM 1102 CG PHE A 72 3.881 -5.561 -7.799 1.00 0.00 C ATOM 1103 CD1 PHE A 72 3.997 -4.234 -7.363 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.770 -6.059 -8.760 1.00 0.00 C ATOM 1105 CE1 PHE A 72 4.998 -3.410 -7.887 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.769 -5.232 -9.283 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.881 -3.908 -8.847 1.00 0.00 C ATOM 0 H PHE A 72 2.008 -4.990 -5.438 1.00 0.00 H new ATOM 0 HA PHE A 72 1.387 -5.162 -8.261 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.017 -6.681 -6.189 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.795 -7.408 -7.768 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.313 -3.848 -6.622 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.684 -7.081 -9.097 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.088 -2.388 -7.549 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.454 -5.616 -10.024 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.652 -3.270 -9.253 1.00 0.00 H new ATOM 1117 N PHE A 73 0.090 -7.548 -6.344 1.00 0.00 N ATOM 1118 CA PHE A 73 -1.013 -8.573 -6.363 1.00 0.00 C ATOM 1119 C PHE A 73 -2.356 -7.857 -6.572 1.00 0.00 C ATOM 1120 O PHE A 73 -3.211 -8.338 -7.293 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.991 -9.280 -4.999 1.00 0.00 C ATOM 1122 CG PHE A 73 -0.046 -10.457 -5.058 1.00 0.00 C ATOM 1123 CD1 PHE A 73 -0.355 -11.564 -5.858 1.00 0.00 C ATOM 1124 CD2 PHE A 73 1.138 -10.442 -4.312 1.00 0.00 C ATOM 1125 CE1 PHE A 73 0.520 -12.654 -5.912 1.00 0.00 C ATOM 1126 CE2 PHE A 73 2.014 -11.533 -4.367 1.00 0.00 C ATOM 1127 CZ PHE A 73 1.705 -12.639 -5.168 1.00 0.00 C ATOM 0 H PHE A 73 0.608 -7.477 -5.468 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.879 -9.296 -7.168 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -0.675 -8.584 -4.222 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -1.993 -9.617 -4.736 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.269 -11.576 -6.433 1.00 0.00 H new ATOM 0 HD2 PHE A 73 1.376 -9.589 -3.694 1.00 0.00 H new ATOM 0 HE1 PHE A 73 0.281 -13.508 -6.528 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.928 -11.521 -3.792 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.381 -13.480 -5.212 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.550 -6.704 -5.954 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.850 -5.966 -6.145 1.00 0.00 C ATOM 1139 C ALA A 74 -4.052 -5.637 -7.630 1.00 0.00 C ATOM 1140 O ALA A 74 -5.153 -5.727 -8.140 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.754 -4.671 -5.323 1.00 0.00 C ATOM 0 H ALA A 74 -1.876 -6.250 -5.337 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.696 -6.571 -5.819 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.677 -4.102 -5.432 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.601 -4.917 -4.272 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.915 -4.074 -5.681 1.00 0.00 H new ATOM 1147 N LEU A 75 -3.001 -5.257 -8.337 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.172 -4.932 -9.802 1.00 0.00 C ATOM 1149 C LEU A 75 -3.757 -6.143 -10.543 1.00 0.00 C ATOM 1150 O LEU A 75 -4.622 -5.997 -11.387 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.775 -4.593 -10.366 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.573 -3.071 -10.432 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.644 -2.436 -11.327 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.660 -2.476 -9.022 1.00 0.00 C ATOM 0 H LEU A 75 -2.053 -5.159 -7.973 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.854 -4.092 -9.933 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.005 -5.041 -9.738 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.664 -5.023 -11.361 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.589 -2.862 -10.853 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.492 -1.357 -11.367 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.570 -2.850 -12.332 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.632 -2.648 -10.919 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.516 -1.397 -9.073 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.640 -2.692 -8.596 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.886 -2.916 -8.393 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.306 -7.338 -10.226 1.00 0.00 N ATOM 1167 CA GLU A 76 -3.868 -8.550 -10.919 1.00 0.00 C ATOM 1168 C GLU A 76 -5.315 -8.774 -10.458 1.00 0.00 C ATOM 1169 O GLU A 76 -6.177 -9.095 -11.254 1.00 0.00 O ATOM 1170 CB GLU A 76 -2.987 -9.745 -10.521 1.00 0.00 C ATOM 1171 CG GLU A 76 -1.706 -9.736 -11.358 1.00 0.00 C ATOM 1172 CD GLU A 76 -0.598 -9.014 -10.589 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -0.155 -9.547 -9.585 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -0.211 -7.939 -11.017 1.00 0.00 O ATOM 0 H GLU A 76 -2.585 -7.526 -9.529 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.872 -8.425 -12.002 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.741 -9.692 -9.460 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.529 -10.678 -10.676 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -1.400 -10.757 -11.584 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -1.885 -9.238 -12.311 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.593 -8.593 -9.184 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.004 -8.786 -8.696 1.00 0.00 C ATOM 1183 C ALA A 77 -7.908 -7.700 -9.294 1.00 0.00 C ATOM 1184 O ALA A 77 -9.033 -7.969 -9.674 1.00 0.00 O ATOM 1185 CB ALA A 77 -6.970 -8.668 -7.163 1.00 0.00 C ATOM 0 H ALA A 77 -4.916 -8.324 -8.470 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.398 -9.757 -8.997 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -7.976 -8.802 -6.765 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.313 -9.435 -6.754 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.597 -7.683 -6.882 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.428 -6.475 -9.396 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.287 -5.390 -9.992 1.00 0.00 C ATOM 1193 C LEU A 78 -8.603 -5.729 -11.457 1.00 0.00 C ATOM 1194 O LEU A 78 -9.710 -5.517 -11.917 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.480 -4.083 -9.912 1.00 0.00 C ATOM 1196 CG LEU A 78 -7.771 -3.387 -8.582 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -6.784 -2.234 -8.384 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -9.202 -2.839 -8.594 1.00 0.00 C ATOM 0 H LEU A 78 -6.497 -6.183 -9.099 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.231 -5.293 -9.455 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.414 -4.295 -9.999 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.744 -3.429 -10.743 1.00 0.00 H new ATOM 0 HG LEU A 78 -7.663 -4.102 -7.766 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -6.990 -1.737 -7.436 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -5.766 -2.624 -8.375 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -6.892 -1.519 -9.200 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.410 -2.343 -7.646 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -9.311 -2.124 -9.409 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.905 -3.660 -8.735 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.646 -6.260 -12.196 1.00 0.00 N ATOM 1211 CA GLN A 79 -7.924 -6.612 -13.636 1.00 0.00 C ATOM 1212 C GLN A 79 -9.095 -7.609 -13.737 1.00 0.00 C ATOM 1213 O GLN A 79 -9.836 -7.592 -14.702 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.641 -7.248 -14.194 1.00 0.00 C ATOM 1215 CG GLN A 79 -5.619 -6.153 -14.499 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.269 -6.793 -14.845 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.223 -7.799 -15.525 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -3.157 -6.255 -14.405 1.00 0.00 N ATOM 0 H GLN A 79 -6.700 -6.462 -11.871 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.203 -5.723 -14.201 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -6.229 -7.954 -13.473 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -6.866 -7.812 -15.099 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -5.966 -5.539 -15.330 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.510 -5.493 -13.639 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -3.190 -5.411 -13.834 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -2.259 -6.681 -14.634 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.273 -8.477 -12.757 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.410 -9.461 -12.833 1.00 0.00 C ATOM 1229 C GLN A 80 -11.695 -8.833 -12.277 1.00 0.00 C ATOM 1230 O GLN A 80 -12.766 -9.026 -12.824 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.994 -10.673 -11.986 1.00 0.00 C ATOM 1232 CG GLN A 80 -10.877 -11.871 -12.342 1.00 0.00 C ATOM 1233 CD GLN A 80 -10.992 -12.801 -11.127 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -11.067 -12.340 -10.006 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -11.007 -14.101 -11.297 1.00 0.00 N ATOM 0 H GLN A 80 -8.690 -8.545 -11.923 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.612 -9.754 -13.863 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.946 -10.914 -12.166 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -10.090 -10.439 -10.926 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -11.866 -11.529 -12.647 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -10.452 -12.411 -13.188 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -10.944 -14.493 -12.236 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.081 -14.720 -10.490 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.604 -8.083 -11.201 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.829 -7.448 -10.628 1.00 0.00 C ATOM 1246 C GLY A 81 -12.915 -7.740 -9.122 1.00 0.00 C ATOM 1247 O GLY A 81 -13.644 -8.619 -8.701 1.00 0.00 O ATOM 0 H GLY A 81 -10.738 -7.886 -10.700 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.804 -6.372 -10.798 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.717 -7.830 -11.132 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.183 -7.011 -8.305 1.00 0.00 N ATOM 1252 CA GLU A 82 -12.238 -7.252 -6.830 1.00 0.00 C ATOM 1253 C GLU A 82 -12.736 -5.989 -6.110 1.00 0.00 C ATOM 1254 O GLU A 82 -12.861 -4.940 -6.716 1.00 0.00 O ATOM 1255 CB GLU A 82 -10.798 -7.571 -6.426 1.00 0.00 C ATOM 1256 CG GLU A 82 -10.799 -8.360 -5.115 1.00 0.00 C ATOM 1257 CD GLU A 82 -9.500 -9.160 -5.000 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -8.472 -8.552 -4.757 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -9.557 -10.369 -5.158 1.00 0.00 O ATOM 0 H GLU A 82 -11.554 -6.264 -8.599 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.920 -8.060 -6.566 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -10.308 -8.149 -7.210 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.229 -6.649 -6.307 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.896 -7.680 -4.269 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -11.657 -9.032 -5.083 1.00 0.00 H new ATOM 1266 N SER A 83 -13.019 -6.070 -4.825 1.00 0.00 N ATOM 1267 CA SER A 83 -13.503 -4.860 -4.090 1.00 0.00 C ATOM 1268 C SER A 83 -12.435 -4.370 -3.103 1.00 0.00 C ATOM 1269 O SER A 83 -11.834 -5.155 -2.394 1.00 0.00 O ATOM 1270 CB SER A 83 -14.755 -5.306 -3.334 1.00 0.00 C ATOM 1271 OG SER A 83 -14.663 -6.698 -3.054 1.00 0.00 O ATOM 0 H SER A 83 -12.935 -6.916 -4.262 1.00 0.00 H new ATOM 0 HA SER A 83 -13.715 -4.036 -4.772 1.00 0.00 H new ATOM 0 HB2 SER A 83 -14.854 -4.742 -2.406 1.00 0.00 H new ATOM 0 HB3 SER A 83 -15.645 -5.101 -3.928 1.00 0.00 H new ATOM 0 HG SER A 83 -15.523 -7.021 -2.713 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.196 -3.076 -3.045 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.164 -2.547 -2.091 1.00 0.00 C ATOM 1279 C ALA A 84 -11.826 -2.023 -0.797 1.00 0.00 C ATOM 1280 O ALA A 84 -11.243 -2.109 0.268 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.448 -1.407 -2.832 1.00 0.00 C ATOM 0 H ALA A 84 -12.667 -2.370 -3.612 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.467 -3.329 -1.791 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.681 -0.979 -2.187 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.984 -1.797 -3.738 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.171 -0.636 -3.098 1.00 0.00 H new ATOM 1287 N GLU A 85 -13.030 -1.481 -0.869 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.694 -0.959 0.384 1.00 0.00 C ATOM 1289 C GLU A 85 -13.777 -2.062 1.451 1.00 0.00 C ATOM 1290 O GLU A 85 -13.612 -1.800 2.628 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.109 -0.510 -0.017 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.022 0.779 -0.839 1.00 0.00 C ATOM 1293 CD GLU A 85 -15.167 1.987 0.089 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -14.390 2.089 1.023 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -16.053 2.791 -0.152 1.00 0.00 O ATOM 0 H GLU A 85 -13.574 -1.378 -1.726 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.122 -0.134 0.808 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.599 -1.292 -0.597 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.716 -0.346 0.873 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.068 0.824 -1.365 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -15.805 0.793 -1.597 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.028 -3.293 1.056 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.114 -4.404 2.075 1.00 0.00 C ATOM 1304 C ASN A 86 -12.805 -4.493 2.880 1.00 0.00 C ATOM 1305 O ASN A 86 -12.828 -4.764 4.066 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.343 -5.708 1.295 1.00 0.00 C ATOM 1307 CG ASN A 86 -15.833 -5.850 0.958 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.672 -5.287 1.632 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -16.206 -6.583 -0.063 1.00 0.00 N ATOM 0 H ASN A 86 -14.176 -3.577 0.088 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.925 -4.222 2.780 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.751 -5.705 0.380 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -14.011 -6.561 1.887 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.196 -6.678 -0.288 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.506 -7.058 -0.633 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.666 -4.261 2.255 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.372 -4.331 3.023 1.00 0.00 C ATOM 1318 C ILE A 87 -10.340 -3.216 4.088 1.00 0.00 C ATOM 1319 O ILE A 87 -9.846 -3.422 5.181 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.230 -4.146 1.998 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.238 -5.303 0.984 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.877 -4.118 2.720 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -9.071 -6.647 1.703 1.00 0.00 C ATOM 0 H ILE A 87 -11.577 -4.031 1.265 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.265 -5.284 3.540 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.383 -3.203 1.473 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -10.173 -5.297 0.424 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -8.433 -5.167 0.262 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.078 -3.987 1.990 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.860 -3.290 3.429 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.730 -5.057 3.255 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.079 -7.455 0.971 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.124 -6.656 2.243 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -9.891 -6.787 2.407 1.00 0.00 H new ATOM 1335 N VAL A 88 -10.862 -2.041 3.785 1.00 0.00 N ATOM 1336 CA VAL A 88 -10.844 -0.934 4.811 1.00 0.00 C ATOM 1337 C VAL A 88 -11.607 -1.370 6.074 1.00 0.00 C ATOM 1338 O VAL A 88 -11.210 -1.046 7.178 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.524 0.291 4.169 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.544 1.455 5.165 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.737 0.712 2.926 1.00 0.00 C ATOM 0 H VAL A 88 -11.291 -1.803 2.891 1.00 0.00 H new ATOM 0 HA VAL A 88 -9.823 -0.695 5.107 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.546 0.031 3.893 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.026 2.318 4.706 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.098 1.162 6.057 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.522 1.714 5.442 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.215 1.578 2.469 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.717 0.969 3.211 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.718 -0.111 2.211 1.00 0.00 H new ATOM 1351 N SER A 89 -12.695 -2.104 5.931 1.00 0.00 N ATOM 1352 CA SER A 89 -13.459 -2.549 7.157 1.00 0.00 C ATOM 1353 C SER A 89 -12.527 -3.341 8.086 1.00 0.00 C ATOM 1354 O SER A 89 -12.548 -3.158 9.290 1.00 0.00 O ATOM 1355 CB SER A 89 -14.607 -3.445 6.667 1.00 0.00 C ATOM 1356 OG SER A 89 -15.718 -2.631 6.313 1.00 0.00 O ATOM 0 H SER A 89 -13.082 -2.410 5.038 1.00 0.00 H new ATOM 0 HA SER A 89 -13.846 -1.696 7.714 1.00 0.00 H new ATOM 0 HB2 SER A 89 -14.284 -4.033 5.808 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.892 -4.150 7.447 1.00 0.00 H new ATOM 0 HG SER A 89 -16.452 -3.199 5.998 1.00 0.00 H new ATOM 1362 N LYS A 90 -11.693 -4.202 7.538 1.00 0.00 N ATOM 1363 CA LYS A 90 -10.745 -4.977 8.415 1.00 0.00 C ATOM 1364 C LYS A 90 -9.680 -4.032 8.993 1.00 0.00 C ATOM 1365 O LYS A 90 -9.237 -4.212 10.112 1.00 0.00 O ATOM 1366 CB LYS A 90 -10.087 -6.046 7.527 1.00 0.00 C ATOM 1367 CG LYS A 90 -9.562 -7.188 8.400 1.00 0.00 C ATOM 1368 CD LYS A 90 -10.588 -8.327 8.433 1.00 0.00 C ATOM 1369 CE LYS A 90 -11.437 -8.222 9.704 1.00 0.00 C ATOM 1370 NZ LYS A 90 -10.852 -9.222 10.640 1.00 0.00 N ATOM 0 H LYS A 90 -11.627 -4.400 6.540 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.269 -5.440 9.251 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.809 -6.429 6.806 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.269 -5.606 6.956 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.613 -7.552 8.007 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.372 -6.828 9.411 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.228 -8.278 7.552 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.078 -9.290 8.404 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -11.397 -7.217 10.124 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -12.485 -8.440 9.498 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -11.381 -9.210 11.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.910 -10.170 10.216 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -9.856 -8.985 10.823 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.269 -3.017 8.253 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.238 -2.069 8.804 1.00 0.00 C ATOM 1386 C ILE A 91 -8.872 -1.198 9.897 1.00 0.00 C ATOM 1387 O ILE A 91 -8.252 -0.927 10.908 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.750 -1.200 7.626 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.135 -2.088 6.531 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.695 -0.207 8.120 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -5.997 -2.937 7.113 1.00 0.00 C ATOM 0 H ILE A 91 -9.597 -2.809 7.310 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.401 -2.605 9.251 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.601 -0.658 7.214 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.901 -2.736 6.106 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.756 -1.467 5.719 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.353 0.405 7.286 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.130 0.435 8.886 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.850 -0.753 8.540 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.570 -3.561 6.328 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.224 -2.282 7.516 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.387 -3.572 7.909 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.104 -0.767 9.716 1.00 0.00 N ATOM 1404 CA ARG A 92 -10.754 0.078 10.778 1.00 0.00 C ATOM 1405 C ARG A 92 -10.938 -0.750 12.057 1.00 0.00 C ATOM 1406 O ARG A 92 -10.744 -0.251 13.150 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.118 0.526 10.227 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.700 1.615 11.129 1.00 0.00 C ATOM 1409 CD ARG A 92 -13.625 0.980 12.169 1.00 0.00 C ATOM 1410 NE ARG A 92 -14.756 1.936 12.314 1.00 0.00 N ATOM 1411 CZ ARG A 92 -15.969 1.565 12.007 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -16.691 0.912 12.877 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -16.460 1.847 10.832 1.00 0.00 N ATOM 0 H ARG A 92 -10.678 -0.959 8.895 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.139 0.944 11.025 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.005 0.903 9.210 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -12.799 -0.323 10.179 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.896 2.158 11.626 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -13.252 2.340 10.531 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -13.975 0.001 11.841 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -13.109 0.832 13.118 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.583 2.882 12.654 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -16.307 0.692 13.796 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -17.639 0.622 12.638 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.896 2.358 10.153 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -17.408 1.557 10.592 1.00 0.00 H new ATOM 1427 N MET A 93 -11.292 -2.014 11.937 1.00 0.00 N ATOM 1428 CA MET A 93 -11.458 -2.854 13.174 1.00 0.00 C ATOM 1429 C MET A 93 -10.078 -3.175 13.763 1.00 0.00 C ATOM 1430 O MET A 93 -9.900 -3.165 14.967 1.00 0.00 O ATOM 1431 CB MET A 93 -12.176 -4.144 12.745 1.00 0.00 C ATOM 1432 CG MET A 93 -12.812 -4.805 13.970 1.00 0.00 C ATOM 1433 SD MET A 93 -14.287 -3.877 14.457 1.00 0.00 S ATOM 1434 CE MET A 93 -15.152 -5.239 15.276 1.00 0.00 C ATOM 0 H MET A 93 -11.470 -2.492 11.054 1.00 0.00 H new ATOM 0 HA MET A 93 -12.036 -2.333 13.937 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.941 -3.917 12.002 1.00 0.00 H new ATOM 0 HB3 MET A 93 -11.469 -4.828 12.276 1.00 0.00 H new ATOM 0 HG2 MET A 93 -13.077 -5.838 13.743 1.00 0.00 H new ATOM 0 HG3 MET A 93 -12.098 -4.833 14.793 1.00 0.00 H new ATOM 0 HE1 MET A 93 -16.108 -4.884 15.661 1.00 0.00 H new ATOM 0 HE2 MET A 93 -15.325 -6.043 14.560 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.545 -5.612 16.101 1.00 0.00 H new ATOM 1444 N MET A 94 -9.094 -3.442 12.927 1.00 0.00 N ATOM 1445 CA MET A 94 -7.722 -3.741 13.467 1.00 0.00 C ATOM 1446 C MET A 94 -7.095 -2.457 14.027 1.00 0.00 C ATOM 1447 O MET A 94 -6.428 -2.488 15.046 1.00 0.00 O ATOM 1448 CB MET A 94 -6.886 -4.281 12.296 1.00 0.00 C ATOM 1449 CG MET A 94 -5.783 -5.195 12.834 1.00 0.00 C ATOM 1450 SD MET A 94 -4.606 -5.562 11.510 1.00 0.00 S ATOM 1451 CE MET A 94 -5.190 -7.236 11.144 1.00 0.00 C ATOM 0 H MET A 94 -9.179 -3.466 11.911 1.00 0.00 H new ATOM 0 HA MET A 94 -7.765 -4.472 14.275 1.00 0.00 H new ATOM 0 HB2 MET A 94 -7.523 -4.831 11.604 1.00 0.00 H new ATOM 0 HB3 MET A 94 -6.447 -3.454 11.737 1.00 0.00 H new ATOM 0 HG2 MET A 94 -5.271 -4.714 13.667 1.00 0.00 H new ATOM 0 HG3 MET A 94 -6.216 -6.119 13.217 1.00 0.00 H new ATOM 0 HE1 MET A 94 -4.592 -7.662 10.339 1.00 0.00 H new ATOM 0 HE2 MET A 94 -5.095 -7.857 12.035 1.00 0.00 H new ATOM 0 HE3 MET A 94 -6.235 -7.198 10.838 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.312 -1.323 13.388 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.724 -0.047 13.930 1.00 0.00 C ATOM 1463 C ASN A 95 -7.479 0.363 15.202 1.00 0.00 C ATOM 1464 O ASN A 95 -6.881 0.838 16.150 1.00 0.00 O ATOM 1465 CB ASN A 95 -6.880 1.027 12.839 1.00 0.00 C ATOM 1466 CG ASN A 95 -5.624 1.051 11.956 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.519 0.225 10.942 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -4.724 1.832 12.191 1.00 0.00 N flip ATOM 0 H ASN A 95 -7.859 -1.226 12.533 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.672 -0.173 14.187 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -7.760 0.817 12.231 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.034 2.004 13.296 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -4.800 2.476 12.978 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -3.892 1.844 11.601 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.783 0.170 15.246 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.546 0.541 16.489 1.00 0.00 C ATOM 1477 C ALA A 96 -9.162 -0.412 17.630 1.00 0.00 C ATOM 1478 O ALA A 96 -9.025 0.003 18.766 1.00 0.00 O ATOM 1479 CB ALA A 96 -11.040 0.404 16.157 1.00 0.00 C ATOM 0 H ALA A 96 -9.343 -0.221 14.489 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.317 1.558 16.807 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.633 0.664 17.034 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.293 1.074 15.336 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -11.255 -0.624 15.866 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.975 -1.687 17.341 1.00 0.00 N ATOM 1486 CA GLN A 97 -8.586 -2.647 18.434 1.00 0.00 C ATOM 1487 C GLN A 97 -7.236 -2.231 19.034 1.00 0.00 C ATOM 1488 O GLN A 97 -7.041 -2.303 20.234 1.00 0.00 O ATOM 1489 CB GLN A 97 -8.475 -4.039 17.790 1.00 0.00 C ATOM 1490 CG GLN A 97 -9.837 -4.734 17.837 1.00 0.00 C ATOM 1491 CD GLN A 97 -9.635 -6.249 17.963 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -8.626 -6.694 18.474 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -10.554 -7.071 17.520 1.00 0.00 N ATOM 0 H GLN A 97 -9.073 -2.097 16.412 1.00 0.00 H new ATOM 0 HA GLN A 97 -9.324 -2.651 19.236 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -8.137 -3.948 16.758 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -7.732 -4.637 18.317 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -10.418 -4.363 18.681 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -10.405 -4.506 16.935 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -11.403 -6.703 17.090 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -10.421 -8.079 17.605 1.00 0.00 H new ATOM 1502 N SER A 98 -6.300 -1.790 18.215 1.00 0.00 N ATOM 1503 CA SER A 98 -4.964 -1.366 18.773 1.00 0.00 C ATOM 1504 C SER A 98 -5.151 -0.208 19.765 1.00 0.00 C ATOM 1505 O SER A 98 -4.481 -0.147 20.781 1.00 0.00 O ATOM 1506 CB SER A 98 -4.109 -0.908 17.581 1.00 0.00 C ATOM 1507 OG SER A 98 -2.785 -0.647 18.026 1.00 0.00 O ATOM 0 H SER A 98 -6.399 -1.706 17.203 1.00 0.00 H new ATOM 0 HA SER A 98 -4.484 -2.187 19.305 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.100 -1.677 16.808 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.538 -0.011 17.134 1.00 0.00 H new ATOM 0 HG SER A 98 -2.236 -0.356 17.268 1.00 0.00 H new ATOM 1513 N LEU A 99 -6.054 0.709 19.487 1.00 0.00 N ATOM 1514 CA LEU A 99 -6.276 1.852 20.422 1.00 0.00 C ATOM 1515 C LEU A 99 -7.710 1.818 20.982 1.00 0.00 C ATOM 1516 O LEU A 99 -8.325 2.851 21.167 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.067 3.103 19.570 1.00 0.00 C ATOM 1518 CG LEU A 99 -4.615 3.159 19.090 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -4.551 3.855 17.730 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -3.775 3.942 20.103 1.00 0.00 C ATOM 0 H LEU A 99 -6.643 0.711 18.654 1.00 0.00 H new ATOM 0 HA LEU A 99 -5.602 1.819 21.278 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.743 3.090 18.715 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.304 3.995 20.151 1.00 0.00 H new ATOM 0 HG LEU A 99 -4.224 2.146 18.997 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -3.516 3.894 17.390 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -5.150 3.299 17.008 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -4.941 4.869 17.821 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -2.740 3.983 19.763 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -4.167 4.955 20.195 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -3.819 3.446 21.073 1.00 0.00 H new ATOM 1532 N GLY A 100 -8.250 0.645 21.251 1.00 0.00 N ATOM 1533 CA GLY A 100 -9.644 0.573 21.796 1.00 0.00 C ATOM 1534 C GLY A 100 -9.867 -0.768 22.516 1.00 0.00 C ATOM 1535 O GLY A 100 -10.913 -1.375 22.387 1.00 0.00 O ATOM 0 H GLY A 100 -7.788 -0.254 21.117 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -9.814 1.398 22.488 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -10.365 0.683 20.986 1.00 0.00 H new ATOM 1539 N GLN A 101 -8.895 -1.236 23.273 1.00 0.00 N ATOM 1540 CA GLN A 101 -9.065 -2.535 23.992 1.00 0.00 C ATOM 1541 C GLN A 101 -8.879 -2.337 25.504 1.00 0.00 C ATOM 1542 O GLN A 101 -7.778 -2.129 25.974 1.00 0.00 O ATOM 1543 CB GLN A 101 -7.969 -3.443 23.432 1.00 0.00 C ATOM 1544 CG GLN A 101 -8.505 -4.870 23.297 1.00 0.00 C ATOM 1545 CD GLN A 101 -7.878 -5.540 22.069 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -6.755 -6.207 22.189 1.00 0.00 O flip ATOM 1547 NE2 GLN A 101 -8.415 -5.456 20.983 1.00 0.00 N flip ATOM 0 H GLN A 101 -7.998 -0.773 23.420 1.00 0.00 H new ATOM 0 HA GLN A 101 -10.059 -2.958 23.849 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -7.638 -3.075 22.461 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -7.100 -3.431 24.091 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -8.273 -5.443 24.195 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -9.591 -4.854 23.201 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -9.288 -4.938 20.885 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -7.993 -5.903 20.169 1.00 0.00 H new ATOM 1556 N SER A 102 -9.950 -2.397 26.278 1.00 0.00 N ATOM 1557 CA SER A 102 -9.831 -2.212 27.763 1.00 0.00 C ATOM 1558 C SER A 102 -9.078 -0.910 28.093 1.00 0.00 C ATOM 1559 O SER A 102 -8.134 -0.916 28.860 1.00 0.00 O ATOM 1560 CB SER A 102 -9.047 -3.429 28.262 1.00 0.00 C ATOM 1561 OG SER A 102 -8.911 -3.353 29.675 1.00 0.00 O ATOM 0 H SER A 102 -10.898 -2.566 25.941 1.00 0.00 H new ATOM 0 HA SER A 102 -10.808 -2.135 28.239 1.00 0.00 H new ATOM 0 HB2 SER A 102 -9.563 -4.348 27.984 1.00 0.00 H new ATOM 0 HB3 SER A 102 -8.064 -3.461 27.792 1.00 0.00 H new ATOM 0 HG SER A 102 -8.494 -2.500 29.918 1.00 0.00 H new ATOM 1567 N ASP A 103 -9.487 0.205 27.522 1.00 0.00 N ATOM 1568 CA ASP A 103 -8.788 1.494 27.811 1.00 0.00 C ATOM 1569 C ASP A 103 -9.781 2.520 28.379 1.00 0.00 C ATOM 1570 O ASP A 103 -10.975 2.407 28.173 1.00 0.00 O ATOM 1571 CB ASP A 103 -8.246 1.962 26.460 1.00 0.00 C ATOM 1572 CG ASP A 103 -6.875 1.329 26.213 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -5.890 1.915 26.629 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -6.834 0.268 25.613 1.00 0.00 O ATOM 0 H ASP A 103 -10.271 0.273 26.873 1.00 0.00 H new ATOM 0 HA ASP A 103 -7.995 1.378 28.550 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -8.936 1.684 25.663 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -8.164 3.049 26.446 1.00 0.00 H new ATOM 1579 N ILE A 104 -9.303 3.520 29.090 1.00 0.00 N ATOM 1580 CA ILE A 104 -10.229 4.544 29.662 1.00 0.00 C ATOM 1581 C ILE A 104 -9.686 5.959 29.401 1.00 0.00 C ATOM 1582 O ILE A 104 -9.631 6.779 30.299 1.00 0.00 O ATOM 1583 CB ILE A 104 -10.278 4.251 31.167 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -8.869 4.337 31.763 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -10.838 2.845 31.392 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -8.960 4.334 33.290 1.00 0.00 C ATOM 0 H ILE A 104 -8.315 3.667 29.296 1.00 0.00 H new ATOM 0 HA ILE A 104 -11.220 4.498 29.211 1.00 0.00 H new ATOM 0 HB ILE A 104 -10.919 4.986 31.654 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -8.266 3.495 31.422 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -8.372 5.244 31.419 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -10.874 2.634 32.461 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -11.844 2.783 30.976 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -10.196 2.115 30.900 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -7.958 4.395 33.714 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -9.547 5.191 33.621 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -9.440 3.414 33.624 1.00 0.00 H new ATOM 1598 N ALA A 105 -9.285 6.255 28.181 1.00 0.00 N ATOM 1599 CA ALA A 105 -8.750 7.617 27.877 1.00 0.00 C ATOM 1600 C ALA A 105 -9.597 8.289 26.794 1.00 0.00 C ATOM 1601 O ALA A 105 -9.637 9.508 26.772 1.00 0.00 O ATOM 1602 CB ALA A 105 -7.326 7.380 27.376 1.00 0.00 C ATOM 1603 OXT ALA A 105 -10.189 7.572 26.003 1.00 0.00 O ATOM 0 H ALA A 105 -9.307 5.612 27.390 1.00 0.00 H new ATOM 0 HA ALA A 105 -8.771 8.273 28.747 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -6.863 8.336 27.131 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.745 6.884 28.153 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -7.353 6.751 26.486 1.00 0.00 H new TER 1609 ALA A 105