USER MOD reduce.3.24.130724 H: found=0, std=0, add=804, rem=0, adj=19 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 101 GLN : amide:sc= -0.894 K(o=0.0012,f=-8.5!) USER MOD Set 1.2: A 102 SER OG : rot 113:sc= 0.895 USER MOD Set 2.1: A 60 SER OG : rot 180:sc= 0.393 USER MOD Set 2.2: A 63 THR OG1 : rot 108:sc= 0.265 USER MOD Set 3.1: A 17 LYS NZ :NH3+ -118:sc= 0.383 (180deg=0) USER MOD Set 3.2: A 66 ASN : amide:sc= 0.547 K(o=0.93,f=-0.57) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 146:sc= 0.0412 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 GLN : amide:sc= -0.504 K(o=-0.5,f=-1.1) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 TYR OH : rot 180:sc= -1.29! USER MOD Single : A 7 THR OG1 : rot 75:sc= -0.224 USER MOD Single : A 9 ASN : amide:sc= -0.155 X(o=-0.16,f=0.24) USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) 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 170:sc= -1.88! USER MOD Single : A 41 ASN : amide:sc= -0.804 X(o=-0.8,f=-0.65) USER MOD Single : A 44 THR OG1 : rot 180:sc= -0.0612 USER MOD Single : A 47 SER OG : rot -26:sc= 0.257 USER MOD Single : A 54 SER OG : rot 80:sc= 1.16 USER MOD Single : A 58 SER OG : rot 180:sc= 0.134 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.022) USER MOD Single : A 70 THR OG1 : rot -55:sc= 0.518 USER MOD Single : A 79 GLN : amide:sc= 0.774 K(o=0.77,f=0) USER MOD Single : A 80 GLN : amide:sc= -0.231 X(o=-0.23,f=-0.14) USER MOD Single : A 83 SER OG : rot 180:sc= 0.0184 USER MOD Single : A 86 ASN : amide:sc= 0 K(o=0,f=-0.59) 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 F(o=-1.6!,f=0) USER MOD Single : A 97 GLN : amide:sc= 0 K(o=0,f=-0.9) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -3.732 6.469 -22.590 1.00 0.00 N ATOM 2 CA MET A 1 -4.692 5.825 -21.647 1.00 0.00 C ATOM 3 C MET A 1 -4.402 6.274 -20.206 1.00 0.00 C ATOM 4 O MET A 1 -3.277 6.594 -19.871 1.00 0.00 O ATOM 5 CB MET A 1 -4.452 4.323 -21.802 1.00 0.00 C ATOM 6 CG MET A 1 -5.423 3.755 -22.839 1.00 0.00 C ATOM 7 SD MET A 1 -4.681 2.309 -23.634 1.00 0.00 S ATOM 8 CE MET A 1 -6.202 1.347 -23.821 1.00 0.00 C ATOM 0 H1 MET A 1 -3.520 5.815 -23.370 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.153 7.340 -22.973 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.853 6.702 -22.085 1.00 0.00 H new ATOM 0 HA MET A 1 -5.726 6.095 -21.860 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.423 4.138 -22.112 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.591 3.821 -20.845 1.00 0.00 H new ATOM 0 HG2 MET A 1 -6.362 3.478 -22.360 1.00 0.00 H new ATOM 0 HG3 MET A 1 -5.658 4.513 -23.586 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.974 0.395 -24.300 1.00 0.00 H new ATOM 0 HE2 MET A 1 -6.639 1.164 -22.840 1.00 0.00 H new ATOM 0 HE3 MET A 1 -6.910 1.902 -24.436 1.00 0.00 H new ATOM 20 N SER A 2 -5.404 6.303 -19.350 1.00 0.00 N ATOM 21 CA SER A 2 -5.169 6.735 -17.938 1.00 0.00 C ATOM 22 C SER A 2 -5.437 5.568 -16.973 1.00 0.00 C ATOM 23 O SER A 2 -6.199 4.671 -17.281 1.00 0.00 O ATOM 24 CB SER A 2 -6.164 7.869 -17.698 1.00 0.00 C ATOM 25 OG SER A 2 -5.878 8.940 -18.589 1.00 0.00 O ATOM 0 H SER A 2 -6.366 6.047 -19.571 1.00 0.00 H new ATOM 0 HA SER A 2 -4.140 7.055 -17.771 1.00 0.00 H new ATOM 0 HB2 SER A 2 -7.183 7.514 -17.853 1.00 0.00 H new ATOM 0 HB3 SER A 2 -6.100 8.212 -16.665 1.00 0.00 H new ATOM 0 HG SER A 2 -6.515 9.669 -18.439 1.00 0.00 H new ATOM 31 N GLN A 3 -4.818 5.568 -15.808 1.00 0.00 N ATOM 32 CA GLN A 3 -5.045 4.454 -14.840 1.00 0.00 C ATOM 33 C GLN A 3 -5.318 5.010 -13.431 1.00 0.00 C ATOM 34 O GLN A 3 -4.596 4.717 -12.496 1.00 0.00 O ATOM 35 CB GLN A 3 -3.747 3.644 -14.859 1.00 0.00 C ATOM 36 CG GLN A 3 -3.524 3.059 -16.257 1.00 0.00 C ATOM 37 CD GLN A 3 -4.649 2.069 -16.587 1.00 0.00 C ATOM 38 OE1 GLN A 3 -5.330 2.223 -17.582 1.00 0.00 O ATOM 39 NE2 GLN A 3 -4.879 1.051 -15.795 1.00 0.00 N ATOM 0 H GLN A 3 -4.170 6.290 -15.494 1.00 0.00 H new ATOM 0 HA GLN A 3 -5.910 3.847 -15.108 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -2.906 4.280 -14.582 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -3.797 2.842 -14.122 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -3.501 3.859 -16.997 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -2.558 2.556 -16.302 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -4.311 0.917 -14.959 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -5.626 0.393 -16.015 1.00 0.00 H new ATOM 48 N GLU A 4 -6.363 5.798 -13.264 1.00 0.00 N ATOM 49 CA GLU A 4 -6.671 6.348 -11.898 1.00 0.00 C ATOM 50 C GLU A 4 -7.660 5.421 -11.180 1.00 0.00 C ATOM 51 O GLU A 4 -7.520 5.166 -9.999 1.00 0.00 O ATOM 52 CB GLU A 4 -7.289 7.734 -12.120 1.00 0.00 C ATOM 53 CG GLU A 4 -6.988 8.627 -10.915 1.00 0.00 C ATOM 54 CD GLU A 4 -7.616 10.006 -11.128 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.756 10.183 -10.733 1.00 0.00 O ATOM 56 OE2 GLU A 4 -6.946 10.860 -11.684 1.00 0.00 O ATOM 0 H GLU A 4 -7.006 6.080 -14.003 1.00 0.00 H new ATOM 0 HA GLU A 4 -5.777 6.418 -11.278 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -6.886 8.182 -13.028 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -8.366 7.645 -12.260 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.382 8.173 -10.006 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -5.911 8.724 -10.781 1.00 0.00 H new ATOM 63 N GLN A 5 -8.650 4.894 -11.880 1.00 0.00 N ATOM 64 CA GLN A 5 -9.627 3.958 -11.204 1.00 0.00 C ATOM 65 C GLN A 5 -8.853 2.822 -10.507 1.00 0.00 C ATOM 66 O GLN A 5 -9.197 2.413 -9.414 1.00 0.00 O ATOM 67 CB GLN A 5 -10.567 3.404 -12.295 1.00 0.00 C ATOM 68 CG GLN A 5 -9.775 2.587 -13.324 1.00 0.00 C ATOM 69 CD GLN A 5 -10.737 2.023 -14.377 1.00 0.00 C ATOM 70 OE1 GLN A 5 -10.663 2.385 -15.534 1.00 0.00 O ATOM 71 NE2 GLN A 5 -11.646 1.144 -14.029 1.00 0.00 N ATOM 0 H GLN A 5 -8.823 5.066 -12.870 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.211 4.475 -10.443 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.334 2.779 -11.839 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.080 4.227 -12.793 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.023 3.215 -13.802 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.244 1.774 -12.828 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -11.713 0.836 -13.059 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -12.286 0.768 -14.729 1.00 0.00 H new ATOM 80 N TYR A 6 -7.780 2.348 -11.111 1.00 0.00 N ATOM 81 CA TYR A 6 -6.963 1.281 -10.440 1.00 0.00 C ATOM 82 C TYR A 6 -6.170 1.923 -9.291 1.00 0.00 C ATOM 83 O TYR A 6 -5.980 1.321 -8.254 1.00 0.00 O ATOM 84 CB TYR A 6 -6.003 0.718 -11.500 1.00 0.00 C ATOM 85 CG TYR A 6 -6.730 -0.285 -12.359 1.00 0.00 C ATOM 86 CD1 TYR A 6 -6.993 -1.566 -11.864 1.00 0.00 C ATOM 87 CD2 TYR A 6 -7.141 0.066 -13.650 1.00 0.00 C ATOM 88 CE1 TYR A 6 -7.667 -2.498 -12.658 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.817 -0.866 -14.445 1.00 0.00 C ATOM 90 CZ TYR A 6 -8.080 -2.149 -13.949 1.00 0.00 C ATOM 91 OH TYR A 6 -8.747 -3.068 -14.733 1.00 0.00 O ATOM 0 H TYR A 6 -7.441 2.649 -12.025 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.587 0.485 -10.034 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -5.613 1.527 -12.118 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.148 0.246 -11.017 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -6.675 -1.835 -10.868 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -6.937 1.055 -14.032 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -7.869 -3.488 -12.275 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -8.136 -0.596 -15.441 1.00 0.00 H new ATOM 0 HH TYR A 6 -8.963 -2.664 -15.599 1.00 0.00 H new ATOM 101 N THR A 7 -5.715 3.150 -9.465 1.00 0.00 N ATOM 102 CA THR A 7 -4.945 3.829 -8.364 1.00 0.00 C ATOM 103 C THR A 7 -5.857 4.031 -7.146 1.00 0.00 C ATOM 104 O THR A 7 -5.440 3.834 -6.019 1.00 0.00 O ATOM 105 CB THR A 7 -4.488 5.189 -8.933 1.00 0.00 C ATOM 106 OG1 THR A 7 -3.623 4.967 -10.044 1.00 0.00 O ATOM 107 CG2 THR A 7 -3.741 6.004 -7.872 1.00 0.00 C ATOM 0 H THR A 7 -5.842 3.704 -10.312 1.00 0.00 H new ATOM 0 HA THR A 7 -4.090 3.236 -8.040 1.00 0.00 H new ATOM 0 HB THR A 7 -5.371 5.747 -9.244 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.151 4.679 -10.817 1.00 0.00 H new ATOM 0 HG21 THR A 7 -3.430 6.958 -8.298 1.00 0.00 H new ATOM 0 HG22 THR A 7 -4.399 6.184 -7.022 1.00 0.00 H new ATOM 0 HG23 THR A 7 -2.862 5.451 -7.540 1.00 0.00 H new ATOM 115 N GLU A 8 -7.098 4.418 -7.357 1.00 0.00 N ATOM 116 CA GLU A 8 -8.019 4.622 -6.181 1.00 0.00 C ATOM 117 C GLU A 8 -8.321 3.270 -5.527 1.00 0.00 C ATOM 118 O GLU A 8 -8.328 3.157 -4.314 1.00 0.00 O ATOM 119 CB GLU A 8 -9.308 5.258 -6.725 1.00 0.00 C ATOM 120 CG GLU A 8 -9.879 6.228 -5.688 1.00 0.00 C ATOM 121 CD GLU A 8 -9.163 7.575 -5.802 1.00 0.00 C ATOM 122 OE1 GLU A 8 -8.910 7.996 -6.918 1.00 0.00 O ATOM 123 OE2 GLU A 8 -8.880 8.161 -4.770 1.00 0.00 O ATOM 0 H GLU A 8 -7.509 4.599 -8.273 1.00 0.00 H new ATOM 0 HA GLU A 8 -7.566 5.266 -5.427 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.100 5.786 -7.656 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.039 4.483 -6.954 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -10.949 6.358 -5.847 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -9.753 5.821 -4.685 1.00 0.00 H new ATOM 130 N ASN A 9 -8.549 2.240 -6.312 1.00 0.00 N ATOM 131 CA ASN A 9 -8.821 0.893 -5.701 1.00 0.00 C ATOM 132 C ASN A 9 -7.511 0.320 -5.151 1.00 0.00 C ATOM 133 O ASN A 9 -7.488 -0.254 -4.078 1.00 0.00 O ATOM 134 CB ASN A 9 -9.379 -0.002 -6.819 1.00 0.00 C ATOM 135 CG ASN A 9 -10.814 0.426 -7.149 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.027 1.489 -7.698 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.819 -0.356 -6.837 1.00 0.00 N ATOM 0 H ASN A 9 -8.559 2.270 -7.332 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.535 0.957 -4.880 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.752 0.074 -7.707 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.362 -1.046 -6.506 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.774 -0.071 -7.055 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.646 -1.249 -6.376 1.00 0.00 H new ATOM 144 N LEU A 10 -6.415 0.490 -5.862 1.00 0.00 N ATOM 145 CA LEU A 10 -5.108 -0.034 -5.340 1.00 0.00 C ATOM 146 C LEU A 10 -4.739 0.717 -4.055 1.00 0.00 C ATOM 147 O LEU A 10 -4.223 0.131 -3.122 1.00 0.00 O ATOM 148 CB LEU A 10 -4.054 0.218 -6.429 1.00 0.00 C ATOM 149 CG LEU A 10 -2.804 -0.608 -6.125 1.00 0.00 C ATOM 150 CD1 LEU A 10 -3.081 -2.083 -6.423 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.648 -0.118 -6.999 1.00 0.00 C ATOM 0 H LEU A 10 -6.369 0.961 -6.766 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.168 -1.097 -5.108 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.453 -0.052 -7.407 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -3.802 1.278 -6.469 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.539 -0.495 -5.074 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -2.190 -2.672 -6.206 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.906 -2.431 -5.801 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -3.345 -2.198 -7.474 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.755 -0.705 -6.784 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -1.913 -0.232 -8.050 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.451 0.933 -6.786 1.00 0.00 H new ATOM 163 N LYS A 11 -5.014 2.010 -3.984 1.00 0.00 N ATOM 164 CA LYS A 11 -4.680 2.773 -2.725 1.00 0.00 C ATOM 165 C LYS A 11 -5.327 2.097 -1.503 1.00 0.00 C ATOM 166 O LYS A 11 -4.786 2.148 -0.413 1.00 0.00 O ATOM 167 CB LYS A 11 -5.241 4.193 -2.903 1.00 0.00 C ATOM 168 CG LYS A 11 -4.796 5.069 -1.730 1.00 0.00 C ATOM 169 CD LYS A 11 -5.714 6.289 -1.627 1.00 0.00 C ATOM 170 CE LYS A 11 -6.846 5.995 -0.640 1.00 0.00 C ATOM 171 NZ LYS A 11 -7.846 7.074 -0.871 1.00 0.00 N ATOM 0 H LYS A 11 -5.446 2.559 -4.727 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.603 2.795 -2.558 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -4.889 4.619 -3.843 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.329 4.162 -2.955 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.828 4.497 -0.803 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -3.764 5.388 -1.872 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.145 7.158 -1.296 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.125 6.531 -2.607 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -7.279 5.011 -0.817 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -6.486 6.004 0.389 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -8.654 6.941 -0.230 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.407 7.999 -0.688 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -8.176 7.036 -1.857 1.00 0.00 H new ATOM 185 N VAL A 12 -6.465 1.450 -1.670 1.00 0.00 N ATOM 186 CA VAL A 12 -7.100 0.764 -0.492 1.00 0.00 C ATOM 187 C VAL A 12 -6.317 -0.519 -0.184 1.00 0.00 C ATOM 188 O VAL A 12 -6.021 -0.807 0.962 1.00 0.00 O ATOM 189 CB VAL A 12 -8.548 0.438 -0.898 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.233 -0.359 0.215 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.314 1.743 -1.133 1.00 0.00 C ATOM 0 H VAL A 12 -6.971 1.369 -2.552 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.091 1.389 0.401 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.541 -0.155 -1.812 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.258 -0.587 -0.078 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.689 -1.288 0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.241 0.230 1.132 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.340 1.516 -1.421 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.316 2.334 -0.217 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -8.831 2.310 -1.929 1.00 0.00 H new ATOM 201 N ILE A 13 -5.969 -1.283 -1.196 1.00 0.00 N ATOM 202 CA ILE A 13 -5.189 -2.541 -0.935 1.00 0.00 C ATOM 203 C ILE A 13 -3.791 -2.175 -0.418 1.00 0.00 C ATOM 204 O ILE A 13 -3.275 -2.818 0.477 1.00 0.00 O ATOM 205 CB ILE A 13 -5.102 -3.298 -2.273 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.520 -3.625 -2.762 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.318 -4.599 -2.077 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.589 -3.491 -4.286 1.00 0.00 C ATOM 0 H ILE A 13 -6.186 -1.096 -2.175 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.668 -3.165 -0.181 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.593 -2.677 -3.010 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.792 -4.638 -2.464 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.239 -2.952 -2.296 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.257 -5.134 -3.025 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.312 -4.368 -1.725 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.826 -5.222 -1.341 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.598 -3.724 -4.626 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.336 -2.470 -4.573 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -5.882 -4.183 -4.744 1.00 0.00 H new ATOM 220 N VAL A 14 -3.178 -1.135 -0.952 1.00 0.00 N ATOM 221 CA VAL A 14 -1.818 -0.740 -0.443 1.00 0.00 C ATOM 222 C VAL A 14 -1.956 -0.272 1.014 1.00 0.00 C ATOM 223 O VAL A 14 -1.152 -0.622 1.858 1.00 0.00 O ATOM 224 CB VAL A 14 -1.316 0.409 -1.336 1.00 0.00 C ATOM 225 CG1 VAL A 14 0.067 0.865 -0.857 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.222 -0.073 -2.792 1.00 0.00 C ATOM 0 H VAL A 14 -3.552 -0.554 -1.703 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.114 -1.572 -0.475 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.014 1.244 -1.276 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.421 1.679 -1.490 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.001 1.211 0.174 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.765 0.030 -0.914 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -0.866 0.742 -3.423 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.526 -0.910 -2.854 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.206 -0.393 -3.134 1.00 0.00 H new ATOM 236 N ALA A 15 -2.980 0.504 1.321 1.00 0.00 N ATOM 237 CA ALA A 15 -3.160 0.965 2.744 1.00 0.00 C ATOM 238 C ALA A 15 -3.353 -0.253 3.665 1.00 0.00 C ATOM 239 O ALA A 15 -2.908 -0.249 4.795 1.00 0.00 O ATOM 240 CB ALA A 15 -4.414 1.853 2.772 1.00 0.00 C ATOM 0 H ALA A 15 -3.685 0.832 0.661 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.287 1.517 3.092 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.584 2.211 3.787 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.272 2.704 2.106 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.277 1.274 2.442 1.00 0.00 H new ATOM 246 N GLU A 16 -4.006 -1.307 3.195 1.00 0.00 N ATOM 247 CA GLU A 16 -4.204 -2.523 4.071 1.00 0.00 C ATOM 248 C GLU A 16 -2.852 -2.991 4.644 1.00 0.00 C ATOM 249 O GLU A 16 -2.778 -3.433 5.774 1.00 0.00 O ATOM 250 CB GLU A 16 -4.809 -3.620 3.172 1.00 0.00 C ATOM 251 CG GLU A 16 -5.040 -4.901 3.987 1.00 0.00 C ATOM 252 CD GLU A 16 -3.979 -5.944 3.627 1.00 0.00 C ATOM 253 OE1 GLU A 16 -4.083 -6.522 2.557 1.00 0.00 O ATOM 254 OE2 GLU A 16 -3.079 -6.147 4.427 1.00 0.00 O ATOM 0 H GLU A 16 -4.404 -1.376 2.258 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.859 -2.299 4.913 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.752 -3.275 2.748 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.140 -3.827 2.337 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.996 -4.677 5.053 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.035 -5.297 3.785 1.00 0.00 H new ATOM 261 N LYS A 17 -1.782 -2.886 3.878 1.00 0.00 N ATOM 262 CA LYS A 17 -0.444 -3.320 4.412 1.00 0.00 C ATOM 263 C LYS A 17 0.152 -2.200 5.278 1.00 0.00 C ATOM 264 O LYS A 17 0.529 -2.430 6.411 1.00 0.00 O ATOM 265 CB LYS A 17 0.443 -3.597 3.192 1.00 0.00 C ATOM 266 CG LYS A 17 1.614 -4.492 3.602 1.00 0.00 C ATOM 267 CD LYS A 17 1.197 -5.965 3.507 1.00 0.00 C ATOM 268 CE LYS A 17 0.846 -6.497 4.900 1.00 0.00 C ATOM 269 NZ LYS A 17 2.039 -7.283 5.322 1.00 0.00 N ATOM 0 H LYS A 17 -1.777 -2.525 2.924 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.526 -4.210 5.036 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.140 -4.080 2.408 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.816 -2.659 2.780 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.471 -4.304 2.956 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.925 -4.257 4.620 1.00 0.00 H new ATOM 0 HD2 LYS A 17 0.339 -6.067 2.842 1.00 0.00 H new ATOM 0 HD3 LYS A 17 2.006 -6.554 3.076 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.644 -5.682 5.595 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.048 -7.120 4.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.768 -8.277 5.461 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 2.772 -7.224 4.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.411 -6.898 6.213 1.00 0.00 H new ATOM 283 N LEU A 18 0.222 -0.980 4.773 1.00 0.00 N ATOM 284 CA LEU A 18 0.779 0.147 5.611 1.00 0.00 C ATOM 285 C LEU A 18 -0.048 0.276 6.899 1.00 0.00 C ATOM 286 O LEU A 18 0.491 0.318 7.989 1.00 0.00 O ATOM 287 CB LEU A 18 0.627 1.429 4.768 1.00 0.00 C ATOM 288 CG LEU A 18 1.831 1.654 3.836 1.00 0.00 C ATOM 289 CD1 LEU A 18 2.248 0.354 3.142 1.00 0.00 C ATOM 290 CD2 LEU A 18 1.434 2.678 2.773 1.00 0.00 C ATOM 0 H LEU A 18 -0.077 -0.719 3.833 1.00 0.00 H new ATOM 0 HA LEU A 18 1.820 -0.028 5.883 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.284 1.366 4.174 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.516 2.287 5.431 1.00 0.00 H new ATOM 0 HG LEU A 18 2.673 2.010 4.430 1.00 0.00 H new ATOM 0 HD11 LEU A 18 3.101 0.546 2.491 1.00 0.00 H new ATOM 0 HD12 LEU A 18 2.524 -0.387 3.892 1.00 0.00 H new ATOM 0 HD13 LEU A 18 1.416 -0.024 2.548 1.00 0.00 H new ATOM 0 HD21 LEU A 18 2.276 2.851 2.102 1.00 0.00 H new ATOM 0 HD22 LEU A 18 0.586 2.299 2.202 1.00 0.00 H new ATOM 0 HD23 LEU A 18 1.157 3.615 3.256 1.00 0.00 H new ATOM 302 N ALA A 19 -1.359 0.314 6.777 1.00 0.00 N ATOM 303 CA ALA A 19 -2.222 0.413 8.006 1.00 0.00 C ATOM 304 C ALA A 19 -2.138 -0.897 8.817 1.00 0.00 C ATOM 305 O ALA A 19 -2.368 -0.897 10.012 1.00 0.00 O ATOM 306 CB ALA A 19 -3.663 0.639 7.519 1.00 0.00 C ATOM 0 H ALA A 19 -1.864 0.281 5.891 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.894 1.228 8.651 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.329 0.718 8.378 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.710 1.560 6.938 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.972 -0.200 6.896 1.00 0.00 H new ATOM 312 N GLY A 20 -1.821 -2.019 8.185 1.00 0.00 N ATOM 313 CA GLY A 20 -1.740 -3.306 8.937 1.00 0.00 C ATOM 314 C GLY A 20 -0.351 -3.467 9.579 1.00 0.00 C ATOM 315 O GLY A 20 -0.238 -4.000 10.667 1.00 0.00 O ATOM 0 H GLY A 20 -1.618 -2.087 7.188 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.509 -3.332 9.709 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.935 -4.141 8.264 1.00 0.00 H new ATOM 319 N ILE A 21 0.711 -3.022 8.926 1.00 0.00 N ATOM 320 CA ILE A 21 2.085 -3.181 9.542 1.00 0.00 C ATOM 321 C ILE A 21 2.098 -2.558 10.962 1.00 0.00 C ATOM 322 O ILE A 21 1.631 -1.451 11.144 1.00 0.00 O ATOM 323 CB ILE A 21 3.068 -2.459 8.590 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.142 -3.244 7.274 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.469 -2.387 9.208 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.442 -2.292 6.112 1.00 0.00 C ATOM 0 H ILE A 21 0.690 -2.566 8.014 1.00 0.00 H new ATOM 0 HA ILE A 21 2.368 -4.227 9.656 1.00 0.00 H new ATOM 0 HB ILE A 21 2.712 -1.444 8.415 1.00 0.00 H new ATOM 0 HG12 ILE A 21 3.918 -4.007 7.339 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.200 -3.762 7.096 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.144 -1.875 8.522 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.424 -1.838 10.149 1.00 0.00 H new ATOM 0 HG23 ILE A 21 4.837 -3.396 9.394 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.493 -2.858 5.182 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.651 -1.545 6.040 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.396 -1.794 6.286 1.00 0.00 H new ATOM 338 N PRO A 22 2.610 -3.298 11.933 1.00 0.00 N ATOM 339 CA PRO A 22 2.641 -2.798 13.340 1.00 0.00 C ATOM 340 C PRO A 22 3.578 -1.584 13.527 1.00 0.00 C ATOM 341 O PRO A 22 3.480 -0.891 14.522 1.00 0.00 O ATOM 342 CB PRO A 22 3.148 -3.998 14.137 1.00 0.00 C ATOM 343 CG PRO A 22 3.905 -4.819 13.149 1.00 0.00 C ATOM 344 CD PRO A 22 3.205 -4.644 11.830 1.00 0.00 C ATOM 0 HA PRO A 22 1.662 -2.441 13.659 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.787 -3.683 14.962 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.322 -4.562 14.570 1.00 0.00 H new ATOM 0 HG2 PRO A 22 4.943 -4.491 13.085 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.920 -5.868 13.445 1.00 0.00 H new ATOM 0 HD2 PRO A 22 3.901 -4.712 10.994 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.444 -5.409 11.675 1.00 0.00 H new ATOM 352 N ASN A 23 4.470 -1.304 12.597 1.00 0.00 N ATOM 353 CA ASN A 23 5.375 -0.119 12.767 1.00 0.00 C ATOM 354 C ASN A 23 4.885 1.066 11.913 1.00 0.00 C ATOM 355 O ASN A 23 5.676 1.872 11.461 1.00 0.00 O ATOM 356 CB ASN A 23 6.760 -0.580 12.299 1.00 0.00 C ATOM 357 CG ASN A 23 7.538 -1.158 13.488 1.00 0.00 C ATOM 358 OD1 ASN A 23 7.665 -2.360 13.612 1.00 0.00 O ATOM 359 ND2 ASN A 23 8.068 -0.353 14.376 1.00 0.00 N ATOM 0 H ASN A 23 4.608 -1.839 11.739 1.00 0.00 H new ATOM 0 HA ASN A 23 5.394 0.223 13.802 1.00 0.00 H new ATOM 0 HB2 ASN A 23 6.659 -1.333 11.517 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.307 0.258 11.866 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.585 -0.736 15.168 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.964 0.657 14.276 1.00 0.00 H new ATOM 366 N PHE A 24 3.588 1.190 11.693 1.00 0.00 N ATOM 367 CA PHE A 24 3.067 2.329 10.879 1.00 0.00 C ATOM 368 C PHE A 24 1.957 3.052 11.659 1.00 0.00 C ATOM 369 O PHE A 24 0.805 2.663 11.602 1.00 0.00 O ATOM 370 CB PHE A 24 2.503 1.688 9.600 1.00 0.00 C ATOM 371 CG PHE A 24 3.181 2.273 8.379 1.00 0.00 C ATOM 372 CD1 PHE A 24 3.291 3.663 8.228 1.00 0.00 C ATOM 373 CD2 PHE A 24 3.697 1.421 7.394 1.00 0.00 C ATOM 374 CE1 PHE A 24 3.917 4.198 7.095 1.00 0.00 C ATOM 375 CE2 PHE A 24 4.322 1.957 6.261 1.00 0.00 C ATOM 376 CZ PHE A 24 4.432 3.345 6.113 1.00 0.00 C ATOM 0 H PHE A 24 2.876 0.549 12.044 1.00 0.00 H new ATOM 0 HA PHE A 24 3.836 3.066 10.650 1.00 0.00 H new ATOM 0 HB2 PHE A 24 2.655 0.609 9.628 1.00 0.00 H new ATOM 0 HB3 PHE A 24 1.428 1.857 9.544 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.893 4.321 8.986 1.00 0.00 H new ATOM 0 HD2 PHE A 24 3.613 0.350 7.508 1.00 0.00 H new ATOM 0 HE1 PHE A 24 4.002 5.268 6.980 1.00 0.00 H new ATOM 0 HE2 PHE A 24 4.719 1.300 5.502 1.00 0.00 H new ATOM 0 HZ PHE A 24 4.915 3.758 5.240 1.00 0.00 H new ATOM 386 N ASN A 25 2.287 4.099 12.388 1.00 0.00 N ATOM 387 CA ASN A 25 1.234 4.831 13.166 1.00 0.00 C ATOM 388 C ASN A 25 0.852 6.136 12.451 1.00 0.00 C ATOM 389 O ASN A 25 -0.317 6.426 12.275 1.00 0.00 O ATOM 390 CB ASN A 25 1.857 5.131 14.535 1.00 0.00 C ATOM 391 CG ASN A 25 1.403 4.073 15.550 1.00 0.00 C ATOM 392 OD1 ASN A 25 2.180 3.228 15.946 1.00 0.00 O ATOM 393 ND2 ASN A 25 0.170 4.081 15.996 1.00 0.00 N ATOM 0 H ASN A 25 3.232 4.473 12.476 1.00 0.00 H new ATOM 0 HA ASN A 25 0.323 4.241 13.263 1.00 0.00 H new ATOM 0 HB2 ASN A 25 2.944 5.133 14.458 1.00 0.00 H new ATOM 0 HB3 ASN A 25 1.559 6.124 14.872 1.00 0.00 H new ATOM 0 HD21 ASN A 25 -0.132 3.380 16.672 1.00 0.00 H new ATOM 0 HD22 ASN A 25 -0.487 4.789 15.667 1.00 0.00 H new ATOM 400 N GLU A 26 1.821 6.927 12.035 1.00 0.00 N ATOM 401 CA GLU A 26 1.490 8.205 11.333 1.00 0.00 C ATOM 402 C GLU A 26 1.939 8.136 9.864 1.00 0.00 C ATOM 403 O GLU A 26 2.674 7.248 9.481 1.00 0.00 O ATOM 404 CB GLU A 26 2.268 9.290 12.083 1.00 0.00 C ATOM 405 CG GLU A 26 1.382 9.893 13.174 1.00 0.00 C ATOM 406 CD GLU A 26 1.990 11.212 13.657 1.00 0.00 C ATOM 407 OE1 GLU A 26 2.802 11.168 14.565 1.00 0.00 O ATOM 408 OE2 GLU A 26 1.634 12.242 13.109 1.00 0.00 O ATOM 0 H GLU A 26 2.817 6.740 12.152 1.00 0.00 H new ATOM 0 HA GLU A 26 0.419 8.405 11.329 1.00 0.00 H new ATOM 0 HB2 GLU A 26 3.169 8.866 12.525 1.00 0.00 H new ATOM 0 HB3 GLU A 26 2.589 10.067 11.389 1.00 0.00 H new ATOM 0 HG2 GLU A 26 0.377 10.064 12.788 1.00 0.00 H new ATOM 0 HG3 GLU A 26 1.289 9.197 14.007 1.00 0.00 H new ATOM 415 N ASP A 27 1.500 9.066 9.034 1.00 0.00 N ATOM 416 CA ASP A 27 1.902 9.052 7.589 1.00 0.00 C ATOM 417 C ASP A 27 1.590 7.687 6.945 1.00 0.00 C ATOM 418 O ASP A 27 2.434 7.102 6.297 1.00 0.00 O ATOM 419 CB ASP A 27 3.410 9.320 7.578 1.00 0.00 C ATOM 420 CG ASP A 27 3.690 10.689 8.203 1.00 0.00 C ATOM 421 OD1 ASP A 27 3.027 11.638 7.821 1.00 0.00 O ATOM 422 OD2 ASP A 27 4.563 10.763 9.053 1.00 0.00 O ATOM 0 H ASP A 27 0.881 9.832 9.300 1.00 0.00 H new ATOM 0 HA ASP A 27 1.354 9.799 7.015 1.00 0.00 H new ATOM 0 HB2 ASP A 27 3.933 8.541 8.133 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.788 9.291 6.556 1.00 0.00 H new ATOM 427 N ILE A 28 0.386 7.179 7.114 1.00 0.00 N ATOM 428 CA ILE A 28 0.040 5.856 6.498 1.00 0.00 C ATOM 429 C ILE A 28 -0.775 6.066 5.205 1.00 0.00 C ATOM 430 O ILE A 28 -0.559 5.378 4.223 1.00 0.00 O ATOM 431 CB ILE A 28 -0.742 5.081 7.591 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.819 3.585 7.236 1.00 0.00 C ATOM 433 CG2 ILE A 28 -2.157 5.640 7.784 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.658 3.354 5.966 1.00 0.00 C ATOM 0 H ILE A 28 -0.363 7.620 7.647 1.00 0.00 H new ATOM 0 HA ILE A 28 0.919 5.287 6.194 1.00 0.00 H new ATOM 0 HB ILE A 28 -0.199 5.206 8.528 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.187 3.192 7.086 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -1.256 3.034 8.068 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.671 5.070 8.558 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -2.097 6.686 8.084 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.710 5.562 6.848 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.693 2.288 5.742 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.670 3.725 6.126 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.205 3.886 5.129 1.00 0.00 H new ATOM 446 N LYS A 29 -1.688 7.014 5.179 1.00 0.00 N ATOM 447 CA LYS A 29 -2.478 7.245 3.917 1.00 0.00 C ATOM 448 C LYS A 29 -1.564 7.863 2.848 1.00 0.00 C ATOM 449 O LYS A 29 -1.636 7.501 1.687 1.00 0.00 O ATOM 450 CB LYS A 29 -3.618 8.215 4.272 1.00 0.00 C ATOM 451 CG LYS A 29 -4.831 7.422 4.770 1.00 0.00 C ATOM 452 CD LYS A 29 -4.868 7.445 6.300 1.00 0.00 C ATOM 453 CE LYS A 29 -5.371 8.809 6.778 1.00 0.00 C ATOM 454 NZ LYS A 29 -5.067 8.841 8.235 1.00 0.00 N ATOM 0 H LYS A 29 -1.919 7.628 5.960 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.879 6.312 3.522 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.288 8.915 5.040 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -3.891 8.806 3.398 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -5.749 7.851 4.368 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -4.777 6.394 4.413 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.521 6.655 6.670 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -3.873 7.251 6.701 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -4.870 9.621 6.252 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -6.440 8.922 6.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -5.383 9.747 8.636 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -5.563 8.060 8.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -4.042 8.738 8.378 1.00 0.00 H new ATOM 468 N TYR A 30 -0.697 8.783 3.224 1.00 0.00 N ATOM 469 CA TYR A 30 0.224 9.398 2.202 1.00 0.00 C ATOM 470 C TYR A 30 1.200 8.335 1.671 1.00 0.00 C ATOM 471 O TYR A 30 1.518 8.319 0.497 1.00 0.00 O ATOM 472 CB TYR A 30 0.995 10.522 2.913 1.00 0.00 C ATOM 473 CG TYR A 30 0.030 11.600 3.346 1.00 0.00 C ATOM 474 CD1 TYR A 30 -0.548 12.445 2.391 1.00 0.00 C ATOM 475 CD2 TYR A 30 -0.287 11.754 4.701 1.00 0.00 C ATOM 476 CE1 TYR A 30 -1.444 13.446 2.792 1.00 0.00 C ATOM 477 CE2 TYR A 30 -1.181 12.753 5.102 1.00 0.00 C ATOM 478 CZ TYR A 30 -1.760 13.599 4.148 1.00 0.00 C ATOM 479 OH TYR A 30 -2.642 14.584 4.543 1.00 0.00 O ATOM 0 H TYR A 30 -0.588 9.130 4.177 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.336 9.791 1.353 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.524 10.123 3.779 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.748 10.940 2.245 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -0.304 12.326 1.346 1.00 0.00 H new ATOM 0 HD2 TYR A 30 0.159 11.101 5.437 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -1.890 14.099 2.056 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -1.425 12.872 6.147 1.00 0.00 H new ATOM 0 HH TYR A 30 -2.752 14.553 5.516 1.00 0.00 H new ATOM 489 N VAL A 31 1.673 7.442 2.520 1.00 0.00 N ATOM 490 CA VAL A 31 2.625 6.382 2.028 1.00 0.00 C ATOM 491 C VAL A 31 1.900 5.471 1.020 1.00 0.00 C ATOM 492 O VAL A 31 2.472 5.090 0.015 1.00 0.00 O ATOM 493 CB VAL A 31 3.095 5.602 3.281 1.00 0.00 C ATOM 494 CG1 VAL A 31 3.905 4.350 2.889 1.00 0.00 C ATOM 495 CG2 VAL A 31 3.986 6.516 4.126 1.00 0.00 C ATOM 0 H VAL A 31 1.446 7.401 3.514 1.00 0.00 H new ATOM 0 HA VAL A 31 3.486 6.804 1.510 1.00 0.00 H new ATOM 0 HB VAL A 31 2.215 5.286 3.841 1.00 0.00 H new ATOM 0 HG11 VAL A 31 4.221 3.824 3.790 1.00 0.00 H new ATOM 0 HG12 VAL A 31 3.284 3.690 2.282 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.783 4.649 2.317 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.323 5.978 5.012 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.850 6.826 3.539 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.420 7.396 4.430 1.00 0.00 H new ATOM 505 N ALA A 32 0.654 5.129 1.265 1.00 0.00 N ATOM 506 CA ALA A 32 -0.076 4.249 0.282 1.00 0.00 C ATOM 507 C ALA A 32 -0.275 5.011 -1.035 1.00 0.00 C ATOM 508 O ALA A 32 -0.104 4.457 -2.104 1.00 0.00 O ATOM 509 CB ALA A 32 -1.435 3.906 0.913 1.00 0.00 C ATOM 0 H ALA A 32 0.117 5.412 2.085 1.00 0.00 H new ATOM 0 HA ALA A 32 0.486 3.340 0.065 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.001 3.268 0.234 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.277 3.383 1.856 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -1.993 4.824 1.097 1.00 0.00 H new ATOM 515 N GLU A 33 -0.621 6.281 -0.970 1.00 0.00 N ATOM 516 CA GLU A 33 -0.811 7.066 -2.244 1.00 0.00 C ATOM 517 C GLU A 33 0.513 7.109 -3.017 1.00 0.00 C ATOM 518 O GLU A 33 0.542 6.887 -4.213 1.00 0.00 O ATOM 519 CB GLU A 33 -1.239 8.485 -1.837 1.00 0.00 C ATOM 520 CG GLU A 33 -2.735 8.497 -1.518 1.00 0.00 C ATOM 521 CD GLU A 33 -3.526 8.823 -2.786 1.00 0.00 C ATOM 522 OE1 GLU A 33 -3.562 7.983 -3.670 1.00 0.00 O ATOM 523 OE2 GLU A 33 -4.081 9.907 -2.852 1.00 0.00 O ATOM 0 H GLU A 33 -0.778 6.802 -0.107 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.564 6.609 -2.886 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.669 8.813 -0.968 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.023 9.186 -2.643 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.041 7.528 -1.125 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.947 9.236 -0.745 1.00 0.00 H new ATOM 530 N TYR A 34 1.612 7.370 -2.341 1.00 0.00 N ATOM 531 CA TYR A 34 2.937 7.394 -3.058 1.00 0.00 C ATOM 532 C TYR A 34 3.231 5.990 -3.604 1.00 0.00 C ATOM 533 O TYR A 34 3.709 5.840 -4.714 1.00 0.00 O ATOM 534 CB TYR A 34 3.993 7.813 -2.013 1.00 0.00 C ATOM 535 CG TYR A 34 5.411 7.733 -2.568 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.672 7.832 -3.949 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.476 7.576 -1.673 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.991 7.776 -4.417 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.789 7.517 -2.142 1.00 0.00 C ATOM 540 CZ TYR A 34 8.049 7.617 -3.514 1.00 0.00 C ATOM 541 OH TYR A 34 9.348 7.567 -3.973 1.00 0.00 O ATOM 0 H TYR A 34 1.652 7.565 -1.341 1.00 0.00 H new ATOM 0 HA TYR A 34 2.941 8.089 -3.898 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.791 8.832 -1.682 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.910 7.170 -1.137 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.856 7.951 -4.646 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.280 7.500 -0.614 1.00 0.00 H new ATOM 0 HE1 TYR A 34 7.192 7.856 -5.475 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.605 7.394 -1.446 1.00 0.00 H new ATOM 0 HH TYR A 34 9.965 7.618 -3.214 1.00 0.00 H new ATOM 551 N ILE A 35 2.933 4.958 -2.841 1.00 0.00 N ATOM 552 CA ILE A 35 3.183 3.562 -3.344 1.00 0.00 C ATOM 553 C ILE A 35 2.311 3.322 -4.590 1.00 0.00 C ATOM 554 O ILE A 35 2.806 2.889 -5.615 1.00 0.00 O ATOM 555 CB ILE A 35 2.821 2.616 -2.176 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.931 2.710 -1.120 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.695 1.165 -2.661 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.562 1.872 0.104 1.00 0.00 C ATOM 0 H ILE A 35 2.533 5.020 -1.905 1.00 0.00 H new ATOM 0 HA ILE A 35 4.217 3.391 -3.644 1.00 0.00 H new ATOM 0 HB ILE A 35 1.861 2.915 -1.755 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.874 2.360 -1.540 1.00 0.00 H new ATOM 0 HG13 ILE A 35 4.079 3.750 -0.828 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.440 0.521 -1.819 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.913 1.101 -3.417 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.643 0.842 -3.091 1.00 0.00 H new ATOM 0 HD11 ILE A 35 4.356 1.945 0.848 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.630 2.242 0.531 1.00 0.00 H new ATOM 0 HD13 ILE A 35 3.437 0.831 -0.192 1.00 0.00 H new ATOM 570 N VAL A 36 1.031 3.628 -4.527 1.00 0.00 N ATOM 571 CA VAL A 36 0.168 3.437 -5.748 1.00 0.00 C ATOM 572 C VAL A 36 0.671 4.370 -6.860 1.00 0.00 C ATOM 573 O VAL A 36 0.731 3.987 -8.013 1.00 0.00 O ATOM 574 CB VAL A 36 -1.276 3.797 -5.352 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.198 3.646 -6.570 1.00 0.00 C ATOM 576 CG2 VAL A 36 -1.747 2.852 -4.240 1.00 0.00 C ATOM 0 H VAL A 36 0.554 3.994 -3.703 1.00 0.00 H new ATOM 0 HA VAL A 36 0.208 2.410 -6.112 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.308 4.828 -4.998 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.219 3.901 -6.287 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.864 4.313 -7.364 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.167 2.616 -6.925 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.769 3.104 -3.957 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -1.713 1.823 -4.598 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.094 2.956 -3.373 1.00 0.00 H new ATOM 586 N LEU A 37 1.061 5.591 -6.524 1.00 0.00 N ATOM 587 CA LEU A 37 1.588 6.526 -7.585 1.00 0.00 C ATOM 588 C LEU A 37 2.758 5.847 -8.314 1.00 0.00 C ATOM 589 O LEU A 37 2.858 5.909 -9.523 1.00 0.00 O ATOM 590 CB LEU A 37 2.072 7.796 -6.867 1.00 0.00 C ATOM 591 CG LEU A 37 2.212 8.935 -7.880 1.00 0.00 C ATOM 592 CD1 LEU A 37 0.928 9.767 -7.892 1.00 0.00 C ATOM 593 CD2 LEU A 37 3.392 9.826 -7.487 1.00 0.00 C ATOM 0 H LEU A 37 1.037 5.973 -5.578 1.00 0.00 H new ATOM 0 HA LEU A 37 0.821 6.774 -8.319 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.366 8.076 -6.085 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.029 7.609 -6.380 1.00 0.00 H new ATOM 0 HG LEU A 37 2.386 8.519 -8.872 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.027 10.578 -8.613 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.086 9.133 -8.172 1.00 0.00 H new ATOM 0 HD13 LEU A 37 0.755 10.183 -6.899 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.492 10.637 -8.208 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.219 10.242 -6.495 1.00 0.00 H new ATOM 0 HD23 LEU A 37 4.307 9.234 -7.478 1.00 0.00 H new ATOM 605 N LEU A 38 3.623 5.159 -7.591 1.00 0.00 N ATOM 606 CA LEU A 38 4.745 4.440 -8.283 1.00 0.00 C ATOM 607 C LEU A 38 4.136 3.309 -9.130 1.00 0.00 C ATOM 608 O LEU A 38 4.554 3.065 -10.246 1.00 0.00 O ATOM 609 CB LEU A 38 5.654 3.857 -7.187 1.00 0.00 C ATOM 610 CG LEU A 38 6.251 4.992 -6.356 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.575 4.479 -4.949 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.535 5.491 -7.023 1.00 0.00 C ATOM 0 H LEU A 38 3.600 5.067 -6.575 1.00 0.00 H new ATOM 0 HA LEU A 38 5.320 5.101 -8.931 1.00 0.00 H new ATOM 0 HB2 LEU A 38 5.083 3.186 -6.546 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.451 3.266 -7.638 1.00 0.00 H new ATOM 0 HG LEU A 38 5.533 5.810 -6.289 1.00 0.00 H new ATOM 0 HD11 LEU A 38 7.001 5.288 -4.356 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.662 4.122 -4.473 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.293 3.662 -5.016 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.962 6.301 -6.431 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.252 4.673 -7.089 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.307 5.855 -8.025 1.00 0.00 H new ATOM 624 N ILE A 39 3.132 2.628 -8.607 1.00 0.00 N ATOM 625 CA ILE A 39 2.474 1.520 -9.389 1.00 0.00 C ATOM 626 C ILE A 39 1.787 2.108 -10.634 1.00 0.00 C ATOM 627 O ILE A 39 1.990 1.633 -11.736 1.00 0.00 O ATOM 628 CB ILE A 39 1.434 0.889 -8.429 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.169 0.177 -7.276 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.523 -0.104 -9.168 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.873 -1.094 -7.775 1.00 0.00 C ATOM 0 H ILE A 39 2.743 2.791 -7.678 1.00 0.00 H new ATOM 0 HA ILE A 39 3.190 0.774 -9.735 1.00 0.00 H new ATOM 0 HB ILE A 39 0.804 1.684 -8.029 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.901 0.853 -6.834 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.458 -0.081 -6.491 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.195 -0.529 -8.467 1.00 0.00 H new ATOM 0 HG22 ILE A 39 -0.010 0.415 -9.964 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.128 -0.903 -9.597 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.384 -1.578 -6.942 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.135 -1.778 -8.194 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.600 -0.830 -8.543 1.00 0.00 H new ATOM 643 N VAL A 40 0.978 3.133 -10.470 1.00 0.00 N ATOM 644 CA VAL A 40 0.289 3.734 -11.669 1.00 0.00 C ATOM 645 C VAL A 40 1.323 4.310 -12.668 1.00 0.00 C ATOM 646 O VAL A 40 1.047 4.407 -13.850 1.00 0.00 O ATOM 647 CB VAL A 40 -0.682 4.825 -11.135 1.00 0.00 C ATOM 648 CG1 VAL A 40 0.040 6.157 -10.872 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.797 5.046 -12.162 1.00 0.00 C ATOM 0 H VAL A 40 0.766 3.575 -9.575 1.00 0.00 H new ATOM 0 HA VAL A 40 -0.271 2.979 -12.221 1.00 0.00 H new ATOM 0 HB VAL A 40 -1.094 4.478 -10.187 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -0.675 6.891 -10.500 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.824 6.006 -10.130 1.00 0.00 H new ATOM 0 HG13 VAL A 40 0.483 6.520 -11.799 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -2.483 5.810 -11.796 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.362 5.372 -13.107 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -2.341 4.114 -12.315 1.00 0.00 H new ATOM 659 N ASN A 41 2.504 4.692 -12.213 1.00 0.00 N ATOM 660 CA ASN A 41 3.522 5.253 -13.169 1.00 0.00 C ATOM 661 C ASN A 41 4.167 4.130 -13.996 1.00 0.00 C ATOM 662 O ASN A 41 4.481 4.323 -15.156 1.00 0.00 O ATOM 663 CB ASN A 41 4.586 5.965 -12.317 1.00 0.00 C ATOM 664 CG ASN A 41 4.122 7.393 -12.004 1.00 0.00 C ATOM 665 OD1 ASN A 41 3.770 8.134 -12.900 1.00 0.00 O ATOM 666 ND2 ASN A 41 4.104 7.818 -10.764 1.00 0.00 N ATOM 0 H ASN A 41 2.801 4.640 -11.238 1.00 0.00 H new ATOM 0 HA ASN A 41 3.053 5.943 -13.870 1.00 0.00 H new ATOM 0 HB2 ASN A 41 4.753 5.415 -11.391 1.00 0.00 H new ATOM 0 HB3 ASN A 41 5.537 5.989 -12.850 1.00 0.00 H new ATOM 0 HD21 ASN A 41 3.795 8.767 -10.555 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.399 7.199 -10.008 1.00 0.00 H new ATOM 673 N GLY A 42 4.374 2.961 -13.421 1.00 0.00 N ATOM 674 CA GLY A 42 5.007 1.852 -14.208 1.00 0.00 C ATOM 675 C GLY A 42 4.745 0.498 -13.532 1.00 0.00 C ATOM 676 O GLY A 42 4.213 -0.410 -14.144 1.00 0.00 O ATOM 0 H GLY A 42 4.135 2.732 -12.456 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.607 1.843 -15.222 1.00 0.00 H new ATOM 0 HA3 GLY A 42 6.080 2.023 -14.290 1.00 0.00 H new ATOM 680 N GLY A 43 5.118 0.351 -12.279 1.00 0.00 N ATOM 681 CA GLY A 43 4.893 -0.946 -11.579 1.00 0.00 C ATOM 682 C GLY A 43 6.197 -1.752 -11.569 1.00 0.00 C ATOM 683 O GLY A 43 6.212 -2.919 -11.912 1.00 0.00 O ATOM 0 H GLY A 43 5.567 1.075 -11.717 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.555 -0.767 -10.558 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.107 -1.511 -12.080 1.00 0.00 H new ATOM 687 N THR A 44 7.294 -1.145 -11.166 1.00 0.00 N ATOM 688 CA THR A 44 8.591 -1.884 -11.118 1.00 0.00 C ATOM 689 C THR A 44 9.035 -2.021 -9.653 1.00 0.00 C ATOM 690 O THR A 44 9.412 -1.051 -9.027 1.00 0.00 O ATOM 691 CB THR A 44 9.571 -1.021 -11.916 1.00 0.00 C ATOM 692 OG1 THR A 44 9.282 0.354 -11.684 1.00 0.00 O ATOM 693 CG2 THR A 44 9.423 -1.332 -13.408 1.00 0.00 C ATOM 0 H THR A 44 7.341 -0.170 -10.870 1.00 0.00 H new ATOM 0 HA THR A 44 8.528 -2.890 -11.533 1.00 0.00 H new ATOM 0 HB THR A 44 10.592 -1.237 -11.601 1.00 0.00 H new ATOM 0 HG1 THR A 44 9.909 0.910 -12.192 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.120 -0.718 -13.978 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.640 -2.386 -13.583 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.403 -1.114 -13.726 1.00 0.00 H new ATOM 701 N VAL A 45 8.960 -3.214 -9.088 1.00 0.00 N ATOM 702 CA VAL A 45 9.350 -3.392 -7.635 1.00 0.00 C ATOM 703 C VAL A 45 10.726 -2.759 -7.346 1.00 0.00 C ATOM 704 O VAL A 45 10.934 -2.205 -6.285 1.00 0.00 O ATOM 705 CB VAL A 45 9.379 -4.911 -7.358 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.818 -5.171 -5.911 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.977 -5.496 -7.559 1.00 0.00 C ATOM 0 H VAL A 45 8.650 -4.063 -9.561 1.00 0.00 H new ATOM 0 HA VAL A 45 8.632 -2.892 -6.985 1.00 0.00 H new ATOM 0 HB VAL A 45 10.083 -5.381 -8.045 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.836 -6.245 -5.724 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.815 -4.758 -5.753 1.00 0.00 H new ATOM 0 HG13 VAL A 45 9.116 -4.695 -5.227 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.999 -6.568 -7.363 1.00 0.00 H new ATOM 0 HG22 VAL A 45 7.280 -5.016 -6.872 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.653 -5.321 -8.585 1.00 0.00 H new ATOM 717 N GLU A 46 11.659 -2.830 -8.268 1.00 0.00 N ATOM 718 CA GLU A 46 13.006 -2.213 -7.997 1.00 0.00 C ATOM 719 C GLU A 46 12.867 -0.689 -7.916 1.00 0.00 C ATOM 720 O GLU A 46 13.248 -0.084 -6.931 1.00 0.00 O ATOM 721 CB GLU A 46 13.928 -2.610 -9.161 1.00 0.00 C ATOM 722 CG GLU A 46 15.368 -2.720 -8.659 1.00 0.00 C ATOM 723 CD GLU A 46 16.332 -2.597 -9.841 1.00 0.00 C ATOM 724 OE1 GLU A 46 16.085 -1.763 -10.697 1.00 0.00 O ATOM 725 OE2 GLU A 46 17.301 -3.338 -9.870 1.00 0.00 O ATOM 0 H GLU A 46 11.554 -3.278 -9.179 1.00 0.00 H new ATOM 0 HA GLU A 46 13.418 -2.563 -7.050 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.606 -3.561 -9.585 1.00 0.00 H new ATOM 0 HB3 GLU A 46 13.865 -1.868 -9.957 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.570 -1.937 -7.928 1.00 0.00 H new ATOM 0 HG3 GLU A 46 15.516 -3.674 -8.153 1.00 0.00 H new ATOM 732 N SER A 47 12.309 -0.061 -8.929 1.00 0.00 N ATOM 733 CA SER A 47 12.140 1.435 -8.866 1.00 0.00 C ATOM 734 C SER A 47 11.119 1.791 -7.773 1.00 0.00 C ATOM 735 O SER A 47 11.268 2.786 -7.089 1.00 0.00 O ATOM 736 CB SER A 47 11.634 1.889 -10.240 1.00 0.00 C ATOM 737 OG SER A 47 12.167 3.173 -10.536 1.00 0.00 O ATOM 0 H SER A 47 11.969 -0.507 -9.781 1.00 0.00 H new ATOM 0 HA SER A 47 13.080 1.931 -8.624 1.00 0.00 H new ATOM 0 HB2 SER A 47 11.933 1.173 -11.005 1.00 0.00 H new ATOM 0 HB3 SER A 47 10.545 1.925 -10.246 1.00 0.00 H new ATOM 0 HG SER A 47 12.360 3.648 -9.701 1.00 0.00 H new ATOM 743 N VAL A 48 10.087 0.988 -7.594 1.00 0.00 N ATOM 744 CA VAL A 48 9.074 1.305 -6.528 1.00 0.00 C ATOM 745 C VAL A 48 9.705 1.142 -5.136 1.00 0.00 C ATOM 746 O VAL A 48 9.404 1.903 -4.234 1.00 0.00 O ATOM 747 CB VAL A 48 7.897 0.326 -6.713 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.804 0.629 -5.682 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.319 0.478 -8.128 1.00 0.00 C ATOM 0 H VAL A 48 9.905 0.140 -8.131 1.00 0.00 H new ATOM 0 HA VAL A 48 8.727 2.335 -6.611 1.00 0.00 H new ATOM 0 HB VAL A 48 8.254 -0.694 -6.572 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.974 -0.065 -5.817 1.00 0.00 H new ATOM 0 HG12 VAL A 48 7.211 0.518 -4.677 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.448 1.650 -5.818 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.487 -0.214 -8.258 1.00 0.00 H new ATOM 0 HG22 VAL A 48 6.966 1.500 -8.269 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.093 0.257 -8.863 1.00 0.00 H new ATOM 759 N VAL A 49 10.588 0.179 -4.947 1.00 0.00 N ATOM 760 CA VAL A 49 11.229 0.030 -3.592 1.00 0.00 C ATOM 761 C VAL A 49 12.301 1.118 -3.424 1.00 0.00 C ATOM 762 O VAL A 49 12.433 1.700 -2.363 1.00 0.00 O ATOM 763 CB VAL A 49 11.848 -1.382 -3.540 1.00 0.00 C ATOM 764 CG1 VAL A 49 12.652 -1.560 -2.246 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.731 -2.425 -3.579 1.00 0.00 C ATOM 0 H VAL A 49 10.886 -0.494 -5.653 1.00 0.00 H new ATOM 0 HA VAL A 49 10.508 0.146 -2.782 1.00 0.00 H new ATOM 0 HB VAL A 49 12.511 -1.510 -4.396 1.00 0.00 H new ATOM 0 HG11 VAL A 49 13.084 -2.560 -2.221 1.00 0.00 H new ATOM 0 HG12 VAL A 49 13.450 -0.819 -2.209 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.994 -1.427 -1.387 1.00 0.00 H new ATOM 0 HG21 VAL A 49 11.165 -3.424 -3.542 1.00 0.00 H new ATOM 0 HG22 VAL A 49 10.072 -2.284 -2.723 1.00 0.00 H new ATOM 0 HG23 VAL A 49 10.159 -2.311 -4.500 1.00 0.00 H new ATOM 775 N ASP A 50 13.054 1.412 -4.464 1.00 0.00 N ATOM 776 CA ASP A 50 14.099 2.488 -4.342 1.00 0.00 C ATOM 777 C ASP A 50 13.422 3.859 -4.190 1.00 0.00 C ATOM 778 O ASP A 50 13.914 4.714 -3.475 1.00 0.00 O ATOM 779 CB ASP A 50 14.939 2.444 -5.630 1.00 0.00 C ATOM 780 CG ASP A 50 16.178 3.324 -5.461 1.00 0.00 C ATOM 781 OD1 ASP A 50 16.843 3.188 -4.447 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.442 4.118 -6.349 1.00 0.00 O ATOM 0 H ASP A 50 12.993 0.962 -5.377 1.00 0.00 H new ATOM 0 HA ASP A 50 14.728 2.329 -3.466 1.00 0.00 H new ATOM 0 HB2 ASP A 50 15.236 1.418 -5.849 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.346 2.791 -6.476 1.00 0.00 H new ATOM 787 N GLU A 51 12.295 4.083 -4.842 1.00 0.00 N ATOM 788 CA GLU A 51 11.612 5.418 -4.698 1.00 0.00 C ATOM 789 C GLU A 51 11.017 5.549 -3.292 1.00 0.00 C ATOM 790 O GLU A 51 11.105 6.597 -2.678 1.00 0.00 O ATOM 791 CB GLU A 51 10.498 5.484 -5.762 1.00 0.00 C ATOM 792 CG GLU A 51 10.991 6.283 -6.975 1.00 0.00 C ATOM 793 CD GLU A 51 11.344 5.325 -8.117 1.00 0.00 C ATOM 794 OE1 GLU A 51 10.431 4.744 -8.680 1.00 0.00 O ATOM 795 OE2 GLU A 51 12.521 5.192 -8.410 1.00 0.00 O ATOM 0 H GLU A 51 11.828 3.414 -5.455 1.00 0.00 H new ATOM 0 HA GLU A 51 12.320 6.234 -4.840 1.00 0.00 H new ATOM 0 HB2 GLU A 51 10.214 4.477 -6.068 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.608 5.953 -5.342 1.00 0.00 H new ATOM 0 HG2 GLU A 51 10.220 6.982 -7.299 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.864 6.875 -6.702 1.00 0.00 H new ATOM 802 N LEU A 52 10.433 4.494 -2.760 1.00 0.00 N ATOM 803 CA LEU A 52 9.863 4.592 -1.371 1.00 0.00 C ATOM 804 C LEU A 52 11.010 4.651 -0.354 1.00 0.00 C ATOM 805 O LEU A 52 10.950 5.394 0.608 1.00 0.00 O ATOM 806 CB LEU A 52 9.006 3.338 -1.145 1.00 0.00 C ATOM 807 CG LEU A 52 7.741 3.427 -2.000 1.00 0.00 C ATOM 808 CD1 LEU A 52 7.214 2.017 -2.279 1.00 0.00 C ATOM 809 CD2 LEU A 52 6.673 4.231 -1.251 1.00 0.00 C ATOM 0 H LEU A 52 10.328 3.588 -3.216 1.00 0.00 H new ATOM 0 HA LEU A 52 9.257 5.490 -1.251 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.573 2.445 -1.407 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.741 3.250 -0.091 1.00 0.00 H new ATOM 0 HG LEU A 52 7.974 3.922 -2.943 1.00 0.00 H new ATOM 0 HD11 LEU A 52 6.312 2.080 -2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 52 7.973 1.444 -2.812 1.00 0.00 H new ATOM 0 HD13 LEU A 52 6.981 1.522 -1.336 1.00 0.00 H new ATOM 0 HD21 LEU A 52 5.771 4.294 -1.860 1.00 0.00 H new ATOM 0 HD22 LEU A 52 6.440 3.736 -0.308 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.047 5.235 -1.051 1.00 0.00 H new ATOM 821 N ALA A 53 12.066 3.889 -0.565 1.00 0.00 N ATOM 822 CA ALA A 53 13.220 3.938 0.401 1.00 0.00 C ATOM 823 C ALA A 53 13.864 5.332 0.361 1.00 0.00 C ATOM 824 O ALA A 53 14.256 5.864 1.384 1.00 0.00 O ATOM 825 CB ALA A 53 14.230 2.871 -0.053 1.00 0.00 C ATOM 0 H ALA A 53 12.178 3.247 -1.349 1.00 0.00 H new ATOM 0 HA ALA A 53 12.892 3.746 1.422 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.087 2.871 0.621 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.755 1.890 -0.037 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.565 3.095 -1.066 1.00 0.00 H new ATOM 831 N SER A 54 13.969 5.937 -0.808 1.00 0.00 N ATOM 832 CA SER A 54 14.584 7.313 -0.883 1.00 0.00 C ATOM 833 C SER A 54 13.701 8.336 -0.145 1.00 0.00 C ATOM 834 O SER A 54 14.202 9.293 0.416 1.00 0.00 O ATOM 835 CB SER A 54 14.682 7.675 -2.373 1.00 0.00 C ATOM 836 OG SER A 54 15.494 6.716 -3.037 1.00 0.00 O ATOM 0 H SER A 54 13.662 5.546 -1.699 1.00 0.00 H new ATOM 0 HA SER A 54 15.566 7.326 -0.411 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.688 7.698 -2.819 1.00 0.00 H new ATOM 0 HB3 SER A 54 15.107 8.672 -2.490 1.00 0.00 H new ATOM 0 HG SER A 54 14.965 5.912 -3.223 1.00 0.00 H new ATOM 842 N LEU A 55 12.395 8.146 -0.129 1.00 0.00 N ATOM 843 CA LEU A 55 11.505 9.120 0.591 1.00 0.00 C ATOM 844 C LEU A 55 11.321 8.672 2.047 1.00 0.00 C ATOM 845 O LEU A 55 11.346 9.483 2.955 1.00 0.00 O ATOM 846 CB LEU A 55 10.160 9.102 -0.152 1.00 0.00 C ATOM 847 CG LEU A 55 9.541 10.501 -0.131 1.00 0.00 C ATOM 848 CD1 LEU A 55 10.361 11.439 -1.020 1.00 0.00 C ATOM 849 CD2 LEU A 55 8.104 10.427 -0.656 1.00 0.00 C ATOM 0 H LEU A 55 11.914 7.367 -0.579 1.00 0.00 H new ATOM 0 HA LEU A 55 11.930 10.124 0.605 1.00 0.00 H new ATOM 0 HB2 LEU A 55 10.306 8.774 -1.181 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.484 8.387 0.317 1.00 0.00 H new ATOM 0 HG LEU A 55 9.539 10.882 0.890 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.918 12.435 -1.004 1.00 0.00 H new ATOM 0 HD12 LEU A 55 11.384 11.490 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 55 10.365 11.060 -2.042 1.00 0.00 H new ATOM 0 HD21 LEU A 55 7.660 11.422 -0.642 1.00 0.00 H new ATOM 0 HD22 LEU A 55 8.109 10.046 -1.677 1.00 0.00 H new ATOM 0 HD23 LEU A 55 7.519 9.760 -0.023 1.00 0.00 H new ATOM 861 N PHE A 56 11.153 7.388 2.280 1.00 0.00 N ATOM 862 CA PHE A 56 10.986 6.898 3.682 1.00 0.00 C ATOM 863 C PHE A 56 12.240 6.117 4.106 1.00 0.00 C ATOM 864 O PHE A 56 12.217 4.905 4.202 1.00 0.00 O ATOM 865 CB PHE A 56 9.753 5.981 3.660 1.00 0.00 C ATOM 866 CG PHE A 56 8.537 6.751 3.182 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.259 8.030 3.692 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.685 6.183 2.227 1.00 0.00 C ATOM 869 CE1 PHE A 56 7.135 8.733 3.246 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.560 6.888 1.782 1.00 0.00 C ATOM 871 CZ PHE A 56 6.285 8.163 2.291 1.00 0.00 C ATOM 0 H PHE A 56 11.125 6.665 1.561 1.00 0.00 H new ATOM 0 HA PHE A 56 10.854 7.714 4.393 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.935 5.130 3.003 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.570 5.581 4.657 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.914 8.471 4.429 1.00 0.00 H new ATOM 0 HD2 PHE A 56 7.896 5.200 1.833 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.923 9.716 3.639 1.00 0.00 H new ATOM 0 HE2 PHE A 56 5.904 6.448 1.046 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.417 8.706 1.947 1.00 0.00 H new ATOM 881 N ASP A 57 13.340 6.801 4.354 1.00 0.00 N ATOM 882 CA ASP A 57 14.599 6.074 4.767 1.00 0.00 C ATOM 883 C ASP A 57 14.524 5.548 6.221 1.00 0.00 C ATOM 884 O ASP A 57 15.385 4.793 6.635 1.00 0.00 O ATOM 885 CB ASP A 57 15.759 7.081 4.620 1.00 0.00 C ATOM 886 CG ASP A 57 15.577 8.248 5.598 1.00 0.00 C ATOM 887 OD1 ASP A 57 14.760 9.110 5.316 1.00 0.00 O ATOM 888 OD2 ASP A 57 16.259 8.259 6.610 1.00 0.00 O ATOM 0 H ASP A 57 13.423 7.816 4.290 1.00 0.00 H new ATOM 0 HA ASP A 57 14.742 5.197 4.136 1.00 0.00 H new ATOM 0 HB2 ASP A 57 16.709 6.582 4.811 1.00 0.00 H new ATOM 0 HB3 ASP A 57 15.796 7.457 3.597 1.00 0.00 H new ATOM 893 N SER A 58 13.524 5.920 7.005 1.00 0.00 N ATOM 894 CA SER A 58 13.460 5.398 8.418 1.00 0.00 C ATOM 895 C SER A 58 12.927 3.960 8.414 1.00 0.00 C ATOM 896 O SER A 58 13.531 3.071 8.984 1.00 0.00 O ATOM 897 CB SER A 58 12.505 6.320 9.190 1.00 0.00 C ATOM 898 OG SER A 58 11.613 6.945 8.274 1.00 0.00 O ATOM 0 H SER A 58 12.767 6.548 6.734 1.00 0.00 H new ATOM 0 HA SER A 58 14.446 5.388 8.883 1.00 0.00 H new ATOM 0 HB2 SER A 58 11.944 5.746 9.928 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.071 7.074 9.736 1.00 0.00 H new ATOM 0 HG SER A 58 11.001 7.533 8.763 1.00 0.00 H new ATOM 904 N VAL A 59 11.806 3.721 7.770 1.00 0.00 N ATOM 905 CA VAL A 59 11.247 2.320 7.733 1.00 0.00 C ATOM 906 C VAL A 59 12.267 1.364 7.090 1.00 0.00 C ATOM 907 O VAL A 59 13.117 1.785 6.326 1.00 0.00 O ATOM 908 CB VAL A 59 9.954 2.380 6.893 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.272 2.857 5.470 1.00 0.00 C ATOM 910 CG2 VAL A 59 9.319 0.986 6.835 1.00 0.00 C ATOM 0 H VAL A 59 11.257 4.423 7.273 1.00 0.00 H new ATOM 0 HA VAL A 59 11.038 1.950 8.737 1.00 0.00 H new ATOM 0 HB VAL A 59 9.260 3.081 7.356 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.353 2.896 4.885 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.719 3.851 5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.971 2.164 5.002 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.405 1.027 6.242 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.018 0.286 6.377 1.00 0.00 H new ATOM 0 HG23 VAL A 59 9.081 0.652 7.845 1.00 0.00 H new ATOM 920 N SER A 60 12.187 0.086 7.390 1.00 0.00 N ATOM 921 CA SER A 60 13.164 -0.885 6.779 1.00 0.00 C ATOM 922 C SER A 60 12.777 -1.175 5.321 1.00 0.00 C ATOM 923 O SER A 60 11.609 -1.208 4.983 1.00 0.00 O ATOM 924 CB SER A 60 13.091 -2.170 7.616 1.00 0.00 C ATOM 925 OG SER A 60 11.853 -2.206 8.314 1.00 0.00 O ATOM 0 H SER A 60 11.499 -0.325 8.022 1.00 0.00 H new ATOM 0 HA SER A 60 14.175 -0.478 6.777 1.00 0.00 H new ATOM 0 HB2 SER A 60 13.183 -3.044 6.971 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.921 -2.206 8.322 1.00 0.00 H new ATOM 0 HG SER A 60 11.802 -3.026 8.848 1.00 0.00 H new ATOM 931 N ARG A 61 13.746 -1.387 4.451 1.00 0.00 N ATOM 932 CA ARG A 61 13.412 -1.676 3.005 1.00 0.00 C ATOM 933 C ARG A 61 12.455 -2.874 2.899 1.00 0.00 C ATOM 934 O ARG A 61 11.583 -2.897 2.049 1.00 0.00 O ATOM 935 CB ARG A 61 14.740 -2.005 2.300 1.00 0.00 C ATOM 936 CG ARG A 61 15.341 -0.724 1.711 1.00 0.00 C ATOM 937 CD ARG A 61 15.964 -1.029 0.347 1.00 0.00 C ATOM 938 NE ARG A 61 17.064 -0.037 0.196 1.00 0.00 N ATOM 939 CZ ARG A 61 18.290 -0.445 0.010 1.00 0.00 C ATOM 940 NH1 ARG A 61 18.769 -1.421 0.732 1.00 0.00 N ATOM 941 NH2 ARG A 61 19.036 0.122 -0.899 1.00 0.00 N ATOM 0 H ARG A 61 14.741 -1.373 4.673 1.00 0.00 H new ATOM 0 HA ARG A 61 12.919 -0.819 2.546 1.00 0.00 H new ATOM 0 HB2 ARG A 61 15.437 -2.454 3.007 1.00 0.00 H new ATOM 0 HB3 ARG A 61 14.572 -2.737 1.510 1.00 0.00 H new ATOM 0 HG2 ARG A 61 14.568 0.038 1.607 1.00 0.00 H new ATOM 0 HG3 ARG A 61 16.097 -0.321 2.385 1.00 0.00 H new ATOM 0 HD2 ARG A 61 16.344 -2.050 0.306 1.00 0.00 H new ATOM 0 HD3 ARG A 61 15.230 -0.930 -0.453 1.00 0.00 H new ATOM 0 HE ARG A 61 16.860 0.961 0.238 1.00 0.00 H new ATOM 0 HH11 ARG A 61 18.185 -1.865 1.441 1.00 0.00 H new ATOM 0 HH12 ARG A 61 19.727 -1.740 0.587 1.00 0.00 H new ATOM 0 HH21 ARG A 61 18.661 0.884 -1.464 1.00 0.00 H new ATOM 0 HH22 ARG A 61 19.994 -0.197 -1.044 1.00 0.00 H new ATOM 955 N ASP A 62 12.608 -3.871 3.747 1.00 0.00 N ATOM 956 CA ASP A 62 11.687 -5.064 3.668 1.00 0.00 C ATOM 957 C ASP A 62 10.229 -4.624 3.853 1.00 0.00 C ATOM 958 O ASP A 62 9.343 -5.117 3.179 1.00 0.00 O ATOM 959 CB ASP A 62 12.100 -6.023 4.797 1.00 0.00 C ATOM 960 CG ASP A 62 13.256 -6.905 4.321 1.00 0.00 C ATOM 961 OD1 ASP A 62 13.021 -7.746 3.468 1.00 0.00 O ATOM 962 OD2 ASP A 62 14.356 -6.726 4.817 1.00 0.00 O ATOM 0 H ASP A 62 13.317 -3.913 4.479 1.00 0.00 H new ATOM 0 HA ASP A 62 11.764 -5.550 2.696 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.400 -5.456 5.678 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.253 -6.643 5.090 1.00 0.00 H new ATOM 967 N THR A 63 9.968 -3.697 4.752 1.00 0.00 N ATOM 968 CA THR A 63 8.547 -3.239 4.946 1.00 0.00 C ATOM 969 C THR A 63 8.044 -2.576 3.658 1.00 0.00 C ATOM 970 O THR A 63 6.921 -2.797 3.245 1.00 0.00 O ATOM 971 CB THR A 63 8.557 -2.227 6.106 1.00 0.00 C ATOM 972 OG1 THR A 63 9.026 -2.866 7.285 1.00 0.00 O ATOM 973 CG2 THR A 63 7.141 -1.693 6.343 1.00 0.00 C ATOM 0 H THR A 63 10.661 -3.245 5.349 1.00 0.00 H new ATOM 0 HA THR A 63 7.885 -4.074 5.175 1.00 0.00 H new ATOM 0 HB THR A 63 9.215 -1.396 5.853 1.00 0.00 H new ATOM 0 HG1 THR A 63 9.929 -2.547 7.493 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.155 -0.977 7.165 1.00 0.00 H new ATOM 0 HG22 THR A 63 6.782 -1.201 5.439 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.477 -2.521 6.593 1.00 0.00 H new ATOM 981 N LEU A 64 8.869 -1.780 3.010 1.00 0.00 N ATOM 982 CA LEU A 64 8.410 -1.131 1.734 1.00 0.00 C ATOM 983 C LEU A 64 8.262 -2.214 0.662 1.00 0.00 C ATOM 984 O LEU A 64 7.241 -2.312 0.008 1.00 0.00 O ATOM 985 CB LEU A 64 9.495 -0.122 1.315 1.00 0.00 C ATOM 986 CG LEU A 64 9.770 0.868 2.460 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.285 1.033 2.648 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.144 2.227 2.124 1.00 0.00 C ATOM 0 H LEU A 64 9.820 -1.555 3.301 1.00 0.00 H new ATOM 0 HA LEU A 64 7.454 -0.624 1.863 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.412 -0.650 1.053 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.174 0.420 0.425 1.00 0.00 H new ATOM 0 HG LEU A 64 9.332 0.484 3.381 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.477 1.735 3.460 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.729 0.067 2.891 1.00 0.00 H new ATOM 0 HD13 LEU A 64 11.727 1.414 1.727 1.00 0.00 H new ATOM 0 HD21 LEU A 64 9.339 2.928 2.936 1.00 0.00 H new ATOM 0 HD22 LEU A 64 9.579 2.610 1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.068 2.110 1.996 1.00 0.00 H new ATOM 1000 N ALA A 65 9.273 -3.038 0.486 1.00 0.00 N ATOM 1001 CA ALA A 65 9.176 -4.132 -0.548 1.00 0.00 C ATOM 1002 C ALA A 65 7.964 -5.036 -0.263 1.00 0.00 C ATOM 1003 O ALA A 65 7.350 -5.550 -1.180 1.00 0.00 O ATOM 1004 CB ALA A 65 10.475 -4.948 -0.454 1.00 0.00 C ATOM 0 H ALA A 65 10.151 -3.004 1.004 1.00 0.00 H new ATOM 0 HA ALA A 65 9.046 -3.711 -1.545 1.00 0.00 H new ATOM 0 HB1 ALA A 65 10.452 -5.755 -1.186 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.327 -4.299 -0.656 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.569 -5.369 0.547 1.00 0.00 H new ATOM 1010 N ASN A 66 7.611 -5.242 0.993 1.00 0.00 N ATOM 1011 CA ASN A 66 6.428 -6.125 1.292 1.00 0.00 C ATOM 1012 C ASN A 66 5.137 -5.456 0.803 1.00 0.00 C ATOM 1013 O ASN A 66 4.283 -6.110 0.232 1.00 0.00 O ATOM 1014 CB ASN A 66 6.386 -6.318 2.817 1.00 0.00 C ATOM 1015 CG ASN A 66 5.569 -7.571 3.152 1.00 0.00 C ATOM 1016 OD1 ASN A 66 4.421 -7.471 3.536 1.00 0.00 O ATOM 1017 ND2 ASN A 66 6.111 -8.758 3.024 1.00 0.00 N ATOM 0 H ASN A 66 8.080 -4.846 1.807 1.00 0.00 H new ATOM 0 HA ASN A 66 6.517 -7.085 0.784 1.00 0.00 H new ATOM 0 HB2 ASN A 66 7.398 -6.415 3.210 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.942 -5.444 3.293 1.00 0.00 H new ATOM 0 HD21 ASN A 66 5.569 -9.593 3.247 1.00 0.00 H new ATOM 0 HD22 ASN A 66 7.075 -8.847 2.702 1.00 0.00 H new ATOM 1024 N VAL A 67 4.985 -4.160 1.004 1.00 0.00 N ATOM 1025 CA VAL A 67 3.731 -3.487 0.516 1.00 0.00 C ATOM 1026 C VAL A 67 3.767 -3.417 -1.018 1.00 0.00 C ATOM 1027 O VAL A 67 2.769 -3.656 -1.670 1.00 0.00 O ATOM 1028 CB VAL A 67 3.701 -2.080 1.129 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.418 -1.365 0.694 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.727 -2.191 2.659 1.00 0.00 C ATOM 0 H VAL A 67 5.658 -3.554 1.473 1.00 0.00 H new ATOM 0 HA VAL A 67 2.837 -4.037 0.810 1.00 0.00 H new ATOM 0 HB VAL A 67 4.569 -1.514 0.789 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.394 -0.365 1.128 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.394 -1.290 -0.393 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.552 -1.931 1.037 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.706 -1.193 3.097 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.858 -2.754 2.998 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.636 -2.705 2.971 1.00 0.00 H new ATOM 1040 N VAL A 68 4.913 -3.118 -1.607 1.00 0.00 N ATOM 1041 CA VAL A 68 4.980 -3.074 -3.116 1.00 0.00 C ATOM 1042 C VAL A 68 4.578 -4.452 -3.676 1.00 0.00 C ATOM 1043 O VAL A 68 3.890 -4.536 -4.677 1.00 0.00 O ATOM 1044 CB VAL A 68 6.439 -2.737 -3.491 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.604 -2.757 -5.015 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.790 -1.339 -2.963 1.00 0.00 C ATOM 0 H VAL A 68 5.785 -2.907 -1.122 1.00 0.00 H new ATOM 0 HA VAL A 68 4.303 -2.328 -3.531 1.00 0.00 H new ATOM 0 HB VAL A 68 7.103 -3.478 -3.047 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.636 -2.518 -5.272 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.355 -3.748 -5.395 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.938 -2.019 -5.463 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.820 -1.099 -3.227 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.120 -0.603 -3.408 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.679 -1.321 -1.879 1.00 0.00 H new ATOM 1056 N GLN A 69 4.979 -5.535 -3.028 1.00 0.00 N ATOM 1057 CA GLN A 69 4.577 -6.891 -3.540 1.00 0.00 C ATOM 1058 C GLN A 69 3.047 -7.026 -3.494 1.00 0.00 C ATOM 1059 O GLN A 69 2.450 -7.604 -4.383 1.00 0.00 O ATOM 1060 CB GLN A 69 5.234 -7.932 -2.620 1.00 0.00 C ATOM 1061 CG GLN A 69 4.962 -9.337 -3.161 1.00 0.00 C ATOM 1062 CD GLN A 69 6.006 -9.685 -4.228 1.00 0.00 C ATOM 1063 OE1 GLN A 69 7.164 -9.876 -3.914 1.00 0.00 O ATOM 1064 NE2 GLN A 69 5.650 -9.778 -5.486 1.00 0.00 N ATOM 0 H GLN A 69 5.554 -5.536 -2.186 1.00 0.00 H new ATOM 0 HA GLN A 69 4.897 -7.036 -4.572 1.00 0.00 H new ATOM 0 HB2 GLN A 69 6.308 -7.755 -2.562 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.840 -7.838 -1.608 1.00 0.00 H new ATOM 0 HG2 GLN A 69 4.999 -10.064 -2.350 1.00 0.00 H new ATOM 0 HG3 GLN A 69 3.960 -9.386 -3.588 1.00 0.00 H new ATOM 0 HE21 GLN A 69 4.679 -9.619 -5.754 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.344 -10.010 -6.197 1.00 0.00 H new ATOM 1073 N THR A 70 2.404 -6.485 -2.476 1.00 0.00 N ATOM 1074 CA THR A 70 0.904 -6.581 -2.413 1.00 0.00 C ATOM 1075 C THR A 70 0.304 -5.696 -3.494 1.00 0.00 C ATOM 1076 O THR A 70 -0.647 -6.075 -4.145 1.00 0.00 O ATOM 1077 CB THR A 70 0.459 -6.056 -1.041 1.00 0.00 C ATOM 1078 OG1 THR A 70 0.738 -4.667 -0.954 1.00 0.00 O ATOM 1079 CG2 THR A 70 1.191 -6.789 0.074 1.00 0.00 C ATOM 0 H THR A 70 2.845 -5.990 -1.700 1.00 0.00 H new ATOM 0 HA THR A 70 0.578 -7.611 -2.560 1.00 0.00 H new ATOM 0 HB THR A 70 -0.612 -6.227 -0.930 1.00 0.00 H new ATOM 0 HG1 THR A 70 1.687 -4.512 -1.141 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.863 -6.404 1.039 1.00 0.00 H new ATOM 0 HG22 THR A 70 0.970 -7.855 0.015 1.00 0.00 H new ATOM 0 HG23 THR A 70 2.265 -6.634 -0.032 1.00 0.00 H new ATOM 1087 N ALA A 71 0.843 -4.510 -3.689 1.00 0.00 N ATOM 1088 CA ALA A 71 0.265 -3.619 -4.744 1.00 0.00 C ATOM 1089 C ALA A 71 0.395 -4.296 -6.121 1.00 0.00 C ATOM 1090 O ALA A 71 -0.489 -4.189 -6.950 1.00 0.00 O ATOM 1091 CB ALA A 71 1.055 -2.299 -4.722 1.00 0.00 C ATOM 0 H ALA A 71 1.638 -4.131 -3.175 1.00 0.00 H new ATOM 0 HA ALA A 71 -0.792 -3.429 -4.556 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.658 -1.625 -5.481 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.961 -1.835 -3.740 1.00 0.00 H new ATOM 0 HB3 ALA A 71 2.106 -2.500 -4.929 1.00 0.00 H new ATOM 1097 N PHE A 72 1.483 -5.009 -6.369 1.00 0.00 N ATOM 1098 CA PHE A 72 1.630 -5.700 -7.697 1.00 0.00 C ATOM 1099 C PHE A 72 0.567 -6.801 -7.799 1.00 0.00 C ATOM 1100 O PHE A 72 -0.200 -6.845 -8.742 1.00 0.00 O ATOM 1101 CB PHE A 72 3.037 -6.325 -7.723 1.00 0.00 C ATOM 1102 CG PHE A 72 4.056 -5.306 -8.182 1.00 0.00 C ATOM 1103 CD1 PHE A 72 4.123 -4.045 -7.573 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.946 -5.629 -9.215 1.00 0.00 C ATOM 1105 CE1 PHE A 72 5.074 -3.113 -7.997 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.895 -4.693 -9.638 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.958 -3.436 -9.028 1.00 0.00 C ATOM 0 H PHE A 72 2.259 -5.138 -5.720 1.00 0.00 H new ATOM 0 HA PHE A 72 1.502 -5.008 -8.530 1.00 0.00 H new ATOM 0 HB2 PHE A 72 3.299 -6.689 -6.730 1.00 0.00 H new ATOM 0 HB3 PHE A 72 3.047 -7.186 -8.391 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.439 -3.794 -6.776 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.899 -6.601 -9.684 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.125 -2.142 -7.527 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.579 -4.941 -10.436 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.692 -2.714 -9.355 1.00 0.00 H new ATOM 1117 N PHE A 73 0.499 -7.681 -6.817 1.00 0.00 N ATOM 1118 CA PHE A 73 -0.547 -8.764 -6.859 1.00 0.00 C ATOM 1119 C PHE A 73 -1.938 -8.106 -6.799 1.00 0.00 C ATOM 1120 O PHE A 73 -2.845 -8.502 -7.507 1.00 0.00 O ATOM 1121 CB PHE A 73 -0.293 -9.655 -5.622 1.00 0.00 C ATOM 1122 CG PHE A 73 -1.406 -10.665 -5.453 1.00 0.00 C ATOM 1123 CD1 PHE A 73 -1.803 -11.466 -6.531 1.00 0.00 C ATOM 1124 CD2 PHE A 73 -2.039 -10.797 -4.213 1.00 0.00 C ATOM 1125 CE1 PHE A 73 -2.834 -12.398 -6.368 1.00 0.00 C ATOM 1126 CE2 PHE A 73 -3.071 -11.728 -4.048 1.00 0.00 C ATOM 1127 CZ PHE A 73 -3.468 -12.529 -5.126 1.00 0.00 C ATOM 0 H PHE A 73 1.112 -7.696 -6.002 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.500 -9.362 -7.769 1.00 0.00 H new ATOM 0 HB2 PHE A 73 0.661 -10.172 -5.730 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -0.220 -9.034 -4.729 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -1.313 -11.364 -7.488 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -1.731 -10.180 -3.382 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.141 -13.016 -7.199 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.561 -11.829 -3.091 1.00 0.00 H new ATOM 0 HZ PHE A 73 -4.264 -13.248 -5.000 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.107 -7.098 -5.965 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.444 -6.415 -5.880 1.00 0.00 C ATOM 1139 C ALA A 74 -3.806 -5.789 -7.233 1.00 0.00 C ATOM 1140 O ALA A 74 -4.962 -5.749 -7.601 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.320 -5.321 -4.810 1.00 0.00 C ATOM 0 H ALA A 74 -1.386 -6.724 -5.348 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.228 -7.127 -5.622 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.271 -4.797 -4.714 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.057 -5.775 -3.854 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -2.544 -4.614 -5.101 1.00 0.00 H new ATOM 1147 N LEU A 75 -2.837 -5.295 -7.982 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.182 -4.678 -9.312 1.00 0.00 C ATOM 1149 C LEU A 75 -3.737 -5.754 -10.250 1.00 0.00 C ATOM 1150 O LEU A 75 -4.707 -5.524 -10.950 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.891 -4.072 -9.891 1.00 0.00 C ATOM 1152 CG LEU A 75 -2.203 -2.712 -10.517 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -0.898 -2.042 -10.952 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -3.109 -2.908 -11.736 1.00 0.00 C ATOM 0 H LEU A 75 -1.847 -5.292 -7.737 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.941 -3.904 -9.198 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -1.145 -3.960 -9.105 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.467 -4.741 -10.640 1.00 0.00 H new ATOM 0 HG LEU A 75 -2.710 -2.081 -9.787 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -1.118 -1.072 -11.399 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.253 -1.904 -10.084 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -0.392 -2.672 -11.684 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -3.332 -1.939 -12.183 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.603 -3.538 -12.468 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -4.038 -3.387 -11.426 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.152 -6.932 -10.260 1.00 0.00 N ATOM 1167 CA GLU A 76 -3.694 -8.015 -11.150 1.00 0.00 C ATOM 1168 C GLU A 76 -4.945 -8.614 -10.498 1.00 0.00 C ATOM 1169 O GLU A 76 -5.928 -8.878 -11.166 1.00 0.00 O ATOM 1170 CB GLU A 76 -2.591 -9.076 -11.292 1.00 0.00 C ATOM 1171 CG GLU A 76 -2.799 -9.857 -12.591 1.00 0.00 C ATOM 1172 CD GLU A 76 -1.982 -9.214 -13.713 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -0.775 -9.394 -13.719 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -2.577 -8.553 -14.547 1.00 0.00 O ATOM 0 H GLU A 76 -2.338 -7.188 -9.702 1.00 0.00 H new ATOM 0 HA GLU A 76 -3.972 -7.632 -12.132 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -1.611 -8.599 -11.295 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -2.613 -9.755 -10.439 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -2.496 -10.895 -12.456 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.856 -9.866 -12.856 1.00 0.00 H new ATOM 1181 N ALA A 77 -4.930 -8.807 -9.195 1.00 0.00 N ATOM 1182 CA ALA A 77 -6.150 -9.364 -8.516 1.00 0.00 C ATOM 1183 C ALA A 77 -7.289 -8.334 -8.574 1.00 0.00 C ATOM 1184 O ALA A 77 -8.440 -8.700 -8.698 1.00 0.00 O ATOM 1185 CB ALA A 77 -5.762 -9.651 -7.056 1.00 0.00 C ATOM 0 H ALA A 77 -4.140 -8.607 -8.582 1.00 0.00 H new ATOM 0 HA ALA A 77 -6.494 -10.275 -9.006 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -6.622 -10.058 -6.524 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -4.945 -10.372 -7.032 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -5.443 -8.726 -6.576 1.00 0.00 H new ATOM 1191 N LEU A 78 -6.988 -7.048 -8.504 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.094 -6.025 -8.581 1.00 0.00 C ATOM 1193 C LEU A 78 -8.840 -6.180 -9.916 1.00 0.00 C ATOM 1194 O LEU A 78 -10.049 -6.060 -9.968 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.435 -4.638 -8.490 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.515 -3.552 -8.496 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -9.392 -3.688 -7.247 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -7.849 -2.174 -8.499 1.00 0.00 C ATOM 0 H LEU A 78 -6.046 -6.670 -8.399 1.00 0.00 H new ATOM 0 HA LEU A 78 -8.814 -6.156 -7.773 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.839 -4.567 -7.580 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -6.754 -4.492 -9.329 1.00 0.00 H new ATOM 0 HG LEU A 78 -9.134 -3.664 -9.386 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -10.159 -2.914 -7.255 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -9.867 -4.669 -7.241 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -8.775 -3.578 -6.355 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -8.616 -1.399 -8.503 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -7.230 -2.067 -7.608 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -7.226 -2.073 -9.388 1.00 0.00 H new ATOM 1210 N GLN A 79 -8.134 -6.465 -10.997 1.00 0.00 N ATOM 1211 CA GLN A 79 -8.839 -6.649 -12.315 1.00 0.00 C ATOM 1212 C GLN A 79 -9.700 -7.930 -12.299 1.00 0.00 C ATOM 1213 O GLN A 79 -10.646 -8.045 -13.055 1.00 0.00 O ATOM 1214 CB GLN A 79 -7.748 -6.770 -13.392 1.00 0.00 C ATOM 1215 CG GLN A 79 -6.964 -5.460 -13.488 1.00 0.00 C ATOM 1216 CD GLN A 79 -5.729 -5.669 -14.373 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -5.854 -5.863 -15.566 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -4.530 -5.640 -13.842 1.00 0.00 N ATOM 0 H GLN A 79 -7.120 -6.576 -11.023 1.00 0.00 H new ATOM 0 HA GLN A 79 -9.502 -5.807 -12.513 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -7.073 -7.591 -13.148 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -8.200 -7.005 -14.356 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -7.595 -4.675 -13.905 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -6.661 -5.131 -12.494 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -4.419 -5.478 -12.841 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -3.708 -5.780 -14.430 1.00 0.00 H new ATOM 1227 N GLN A 80 -9.381 -8.904 -11.460 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.185 -10.164 -11.429 1.00 0.00 C ATOM 1229 C GLN A 80 -10.281 -10.706 -9.992 1.00 0.00 C ATOM 1230 O GLN A 80 -9.973 -11.858 -9.742 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.400 -11.142 -12.307 1.00 0.00 C ATOM 1232 CG GLN A 80 -9.607 -10.794 -13.784 1.00 0.00 C ATOM 1233 CD GLN A 80 -11.078 -11.012 -14.161 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -11.745 -10.090 -14.588 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -11.621 -12.198 -14.024 1.00 0.00 N ATOM 0 H GLN A 80 -8.601 -8.872 -10.803 1.00 0.00 H new ATOM 0 HA GLN A 80 -11.206 -10.011 -11.780 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.340 -11.097 -12.059 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.730 -12.163 -12.115 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -9.324 -9.758 -13.967 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -8.965 -11.415 -14.408 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.065 -12.975 -13.666 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -12.599 -12.343 -14.275 1.00 0.00 H new ATOM 1244 N GLY A 81 -10.694 -9.893 -9.042 1.00 0.00 N ATOM 1245 CA GLY A 81 -10.787 -10.385 -7.634 1.00 0.00 C ATOM 1246 C GLY A 81 -12.055 -9.836 -6.963 1.00 0.00 C ATOM 1247 O GLY A 81 -13.041 -10.537 -6.839 1.00 0.00 O ATOM 0 H GLY A 81 -10.967 -8.920 -9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -10.803 -11.475 -7.622 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -9.906 -10.073 -7.073 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.037 -8.595 -6.518 1.00 0.00 N ATOM 1252 CA GLU A 82 -13.253 -8.029 -5.843 1.00 0.00 C ATOM 1253 C GLU A 82 -13.127 -6.502 -5.667 1.00 0.00 C ATOM 1254 O GLU A 82 -12.302 -5.872 -6.304 1.00 0.00 O ATOM 1255 CB GLU A 82 -13.303 -8.730 -4.477 1.00 0.00 C ATOM 1256 CG GLU A 82 -14.717 -9.259 -4.216 1.00 0.00 C ATOM 1257 CD GLU A 82 -14.700 -10.182 -2.997 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -13.849 -11.056 -2.952 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -15.538 -10.002 -2.129 1.00 0.00 O ATOM 0 H GLU A 82 -11.243 -7.959 -6.592 1.00 0.00 H new ATOM 0 HA GLU A 82 -14.159 -8.194 -6.427 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -12.587 -9.552 -4.453 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -13.014 -8.033 -3.690 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -15.402 -8.428 -4.047 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -15.081 -9.800 -5.090 1.00 0.00 H new ATOM 1266 N SER A 83 -13.933 -5.902 -4.812 1.00 0.00 N ATOM 1267 CA SER A 83 -13.838 -4.413 -4.614 1.00 0.00 C ATOM 1268 C SER A 83 -12.772 -4.081 -3.558 1.00 0.00 C ATOM 1269 O SER A 83 -12.404 -4.922 -2.761 1.00 0.00 O ATOM 1270 CB SER A 83 -15.219 -3.949 -4.131 1.00 0.00 C ATOM 1271 OG SER A 83 -16.214 -4.831 -4.635 1.00 0.00 O ATOM 0 H SER A 83 -14.643 -6.372 -4.250 1.00 0.00 H new ATOM 0 HA SER A 83 -13.552 -3.912 -5.539 1.00 0.00 H new ATOM 0 HB2 SER A 83 -15.249 -3.933 -3.042 1.00 0.00 H new ATOM 0 HB3 SER A 83 -15.413 -2.932 -4.471 1.00 0.00 H new ATOM 0 HG SER A 83 -17.097 -4.538 -4.327 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.278 -2.859 -3.543 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.238 -2.483 -2.525 1.00 0.00 C ATOM 1279 C ALA A 84 -11.884 -1.769 -1.321 1.00 0.00 C ATOM 1280 O ALA A 84 -11.437 -1.931 -0.202 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.258 -1.546 -3.250 1.00 0.00 C ATOM 0 H ALA A 84 -12.547 -2.114 -4.185 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.731 -3.364 -2.131 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.474 -1.235 -2.560 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.811 -2.070 -4.095 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -10.793 -0.667 -3.610 1.00 0.00 H new ATOM 1287 N GLU A 85 -12.932 -0.985 -1.527 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.586 -0.272 -0.362 1.00 0.00 C ATOM 1289 C GLU A 85 -13.899 -1.263 0.772 1.00 0.00 C ATOM 1290 O GLU A 85 -13.789 -0.928 1.937 1.00 0.00 O ATOM 1291 CB GLU A 85 -14.890 0.344 -0.894 1.00 0.00 C ATOM 1292 CG GLU A 85 -14.596 1.715 -1.507 1.00 0.00 C ATOM 1293 CD GLU A 85 -15.848 2.590 -1.424 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -16.768 2.346 -2.187 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -15.863 3.490 -0.601 1.00 0.00 O ATOM 0 H GLU A 85 -13.358 -0.810 -2.437 1.00 0.00 H new ATOM 0 HA GLU A 85 -12.923 0.492 0.043 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.336 -0.312 -1.642 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.614 0.443 -0.085 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -13.770 2.192 -0.979 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.287 1.602 -2.546 1.00 0.00 H new ATOM 1302 N ASN A 86 -14.278 -2.482 0.445 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.580 -3.486 1.531 1.00 0.00 C ATOM 1304 C ASN A 86 -13.346 -3.673 2.427 1.00 0.00 C ATOM 1305 O ASN A 86 -13.467 -3.794 3.632 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.932 -4.809 0.831 1.00 0.00 C ATOM 1307 CG ASN A 86 -15.894 -5.614 1.713 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -15.795 -5.576 2.923 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -16.829 -6.349 1.161 1.00 0.00 N ATOM 0 H ASN A 86 -14.391 -2.823 -0.510 1.00 0.00 H new ATOM 0 HA ASN A 86 -15.404 -3.149 2.160 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -15.390 -4.610 -0.138 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -14.026 -5.385 0.642 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.469 -6.885 1.747 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -16.917 -6.385 0.145 1.00 0.00 H new ATOM 1316 N ILE A 87 -12.157 -3.685 1.855 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.925 -3.852 2.705 1.00 0.00 C ATOM 1318 C ILE A 87 -10.832 -2.698 3.725 1.00 0.00 C ATOM 1319 O ILE A 87 -10.396 -2.899 4.842 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.718 -3.831 1.744 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.808 -5.030 0.793 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -8.409 -3.918 2.538 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -9.266 -4.634 -0.582 1.00 0.00 C ATOM 0 H ILE A 87 -11.988 -3.588 0.854 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.951 -4.785 3.268 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.732 -2.901 1.176 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -9.237 -5.868 1.193 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -10.843 -5.362 0.706 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.564 -3.902 1.850 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -8.339 -3.069 3.218 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -8.392 -4.845 3.112 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -9.330 -5.487 -1.258 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -9.856 -3.809 -0.982 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -8.225 -4.324 -0.487 1.00 0.00 H new ATOM 1335 N VAL A 88 -11.238 -1.492 3.361 1.00 0.00 N ATOM 1336 CA VAL A 88 -11.157 -0.348 4.347 1.00 0.00 C ATOM 1337 C VAL A 88 -11.960 -0.685 5.612 1.00 0.00 C ATOM 1338 O VAL A 88 -11.537 -0.383 6.714 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.749 0.898 3.656 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.691 2.093 4.614 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.939 1.222 2.396 1.00 0.00 C ATOM 0 H VAL A 88 -11.614 -1.253 2.444 1.00 0.00 H new ATOM 0 HA VAL A 88 -10.124 -0.167 4.644 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.785 0.698 3.383 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.109 2.972 4.124 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.268 1.868 5.511 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.655 2.289 4.888 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.359 2.102 1.910 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.903 1.419 2.670 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.978 0.375 1.710 1.00 0.00 H new ATOM 1351 N SER A 89 -13.113 -1.311 5.474 1.00 0.00 N ATOM 1352 CA SER A 89 -13.923 -1.660 6.700 1.00 0.00 C ATOM 1353 C SER A 89 -13.079 -2.535 7.639 1.00 0.00 C ATOM 1354 O SER A 89 -13.076 -2.334 8.840 1.00 0.00 O ATOM 1355 CB SER A 89 -15.156 -2.435 6.215 1.00 0.00 C ATOM 1356 OG SER A 89 -16.227 -2.231 7.128 1.00 0.00 O ATOM 0 H SER A 89 -13.524 -1.592 4.584 1.00 0.00 H new ATOM 0 HA SER A 89 -14.222 -0.766 7.247 1.00 0.00 H new ATOM 0 HB2 SER A 89 -15.443 -2.098 5.219 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.925 -3.498 6.138 1.00 0.00 H new ATOM 0 HG SER A 89 -17.017 -2.723 6.821 1.00 0.00 H new ATOM 1362 N LYS A 90 -12.348 -3.490 7.101 1.00 0.00 N ATOM 1363 CA LYS A 90 -11.487 -4.352 7.988 1.00 0.00 C ATOM 1364 C LYS A 90 -10.339 -3.518 8.580 1.00 0.00 C ATOM 1365 O LYS A 90 -9.921 -3.755 9.698 1.00 0.00 O ATOM 1366 CB LYS A 90 -10.928 -5.482 7.108 1.00 0.00 C ATOM 1367 CG LYS A 90 -12.061 -6.431 6.713 1.00 0.00 C ATOM 1368 CD LYS A 90 -11.632 -7.261 5.502 1.00 0.00 C ATOM 1369 CE LYS A 90 -12.531 -8.493 5.383 1.00 0.00 C ATOM 1370 NZ LYS A 90 -13.734 -8.020 4.642 1.00 0.00 N ATOM 0 H LYS A 90 -12.309 -3.708 6.105 1.00 0.00 H new ATOM 0 HA LYS A 90 -12.064 -4.758 8.819 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.461 -5.065 6.216 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.154 -6.028 7.647 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -12.308 -7.087 7.548 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -12.961 -5.862 6.477 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -11.698 -6.661 4.595 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.591 -7.566 5.607 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -12.029 -9.298 4.847 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -12.800 -8.882 6.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -14.400 -8.810 4.520 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -14.195 -7.258 5.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -13.448 -7.661 3.709 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.829 -2.538 7.855 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.714 -1.703 8.424 1.00 0.00 C ATOM 1386 C ILE A 91 -9.263 -0.799 9.534 1.00 0.00 C ATOM 1387 O ILE A 91 -8.614 -0.599 10.544 1.00 0.00 O ATOM 1388 CB ILE A 91 -8.144 -0.857 7.265 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.618 -1.772 6.145 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.997 0.015 7.780 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -6.571 -2.746 6.697 1.00 0.00 C ATOM 0 H ILE A 91 -10.130 -2.286 6.914 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.932 -2.327 8.858 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.940 -0.226 6.869 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -8.445 -2.329 5.703 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -7.179 -1.169 5.350 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.597 0.611 6.960 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.367 0.677 8.563 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -6.210 -0.621 8.184 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -6.209 -3.386 5.892 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.737 -2.184 7.117 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -7.022 -3.362 7.475 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.451 -0.256 9.369 1.00 0.00 N ATOM 1404 CA ARG A 92 -11.014 0.628 10.450 1.00 0.00 C ATOM 1405 C ARG A 92 -11.195 -0.180 11.741 1.00 0.00 C ATOM 1406 O ARG A 92 -10.925 0.313 12.820 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.370 1.147 9.946 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.832 2.310 10.824 1.00 0.00 C ATOM 1409 CD ARG A 92 -14.353 2.447 10.730 1.00 0.00 C ATOM 1410 NE ARG A 92 -14.787 2.858 12.093 1.00 0.00 N ATOM 1411 CZ ARG A 92 -15.313 1.981 12.903 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -14.579 1.016 13.386 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -16.573 2.068 13.230 1.00 0.00 N ATOM 0 H ARG A 92 -11.046 -0.382 8.550 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.343 1.459 10.669 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.284 1.473 8.909 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -13.109 0.346 9.968 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -12.535 2.139 11.859 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -12.352 3.235 10.503 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -14.637 3.190 9.984 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -14.817 1.506 10.435 1.00 0.00 H new ATOM 0 HE ARG A 92 -14.673 3.826 12.394 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.594 0.947 13.130 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.990 0.330 14.019 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -17.147 2.822 12.852 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.984 1.382 13.863 1.00 0.00 H new ATOM 1427 N MET A 93 -11.630 -1.420 11.646 1.00 0.00 N ATOM 1428 CA MET A 93 -11.795 -2.240 12.897 1.00 0.00 C ATOM 1429 C MET A 93 -10.412 -2.662 13.408 1.00 0.00 C ATOM 1430 O MET A 93 -10.150 -2.626 14.595 1.00 0.00 O ATOM 1431 CB MET A 93 -12.632 -3.472 12.518 1.00 0.00 C ATOM 1432 CG MET A 93 -13.176 -4.131 13.787 1.00 0.00 C ATOM 1433 SD MET A 93 -13.510 -5.880 13.460 1.00 0.00 S ATOM 1434 CE MET A 93 -14.442 -6.220 14.974 1.00 0.00 C ATOM 0 H MET A 93 -11.874 -1.892 10.775 1.00 0.00 H new ATOM 0 HA MET A 93 -12.290 -1.676 13.687 1.00 0.00 H new ATOM 0 HB2 MET A 93 -13.455 -3.179 11.866 1.00 0.00 H new ATOM 0 HB3 MET A 93 -12.021 -4.182 11.960 1.00 0.00 H new ATOM 0 HG2 MET A 93 -12.455 -4.033 14.599 1.00 0.00 H new ATOM 0 HG3 MET A 93 -14.089 -3.629 14.108 1.00 0.00 H new ATOM 0 HE1 MET A 93 -14.754 -7.264 14.983 1.00 0.00 H new ATOM 0 HE2 MET A 93 -13.812 -6.022 15.841 1.00 0.00 H new ATOM 0 HE3 MET A 93 -15.322 -5.578 15.011 1.00 0.00 H new ATOM 1444 N MET A 94 -9.518 -3.045 12.519 1.00 0.00 N ATOM 1445 CA MET A 94 -8.142 -3.445 12.977 1.00 0.00 C ATOM 1446 C MET A 94 -7.389 -2.209 13.491 1.00 0.00 C ATOM 1447 O MET A 94 -6.660 -2.289 14.463 1.00 0.00 O ATOM 1448 CB MET A 94 -7.422 -4.045 11.757 1.00 0.00 C ATOM 1449 CG MET A 94 -6.409 -5.093 12.223 1.00 0.00 C ATOM 1450 SD MET A 94 -5.921 -6.126 10.819 1.00 0.00 S ATOM 1451 CE MET A 94 -5.258 -7.513 11.773 1.00 0.00 C ATOM 0 H MET A 94 -9.677 -3.098 11.513 1.00 0.00 H new ATOM 0 HA MET A 94 -8.188 -4.170 13.790 1.00 0.00 H new ATOM 0 HB2 MET A 94 -8.147 -4.500 11.082 1.00 0.00 H new ATOM 0 HB3 MET A 94 -6.915 -3.258 11.198 1.00 0.00 H new ATOM 0 HG2 MET A 94 -5.534 -4.604 12.650 1.00 0.00 H new ATOM 0 HG3 MET A 94 -6.844 -5.711 13.009 1.00 0.00 H new ATOM 0 HE1 MET A 94 -4.894 -8.282 11.092 1.00 0.00 H new ATOM 0 HE2 MET A 94 -4.437 -7.164 12.399 1.00 0.00 H new ATOM 0 HE3 MET A 94 -6.044 -7.929 12.404 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.565 -1.062 12.861 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.851 0.169 13.358 1.00 0.00 C ATOM 1463 C ASN A 95 -7.377 0.547 14.751 1.00 0.00 C ATOM 1464 O ASN A 95 -6.623 0.987 15.598 1.00 0.00 O ATOM 1465 CB ASN A 95 -7.136 1.299 12.354 1.00 0.00 C ATOM 1466 CG ASN A 95 -6.021 1.345 11.301 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.706 0.261 10.632 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -5.426 2.381 11.082 1.00 0.00 N flip ATOM 0 H ASN A 95 -8.158 -0.926 12.043 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.778 -0.007 13.439 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.100 1.136 11.871 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.198 2.255 12.875 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.667 3.227 11.599 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.686 2.405 10.381 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.662 0.377 15.003 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.207 0.734 16.363 1.00 0.00 C ATOM 1477 C ALA A 96 -8.511 -0.106 17.442 1.00 0.00 C ATOM 1478 O ALA A 96 -8.184 0.394 18.502 1.00 0.00 O ATOM 1479 CB ALA A 96 -10.713 0.420 16.338 1.00 0.00 C ATOM 0 H ALA A 96 -9.346 0.013 14.339 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.033 1.785 16.592 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.152 0.664 17.306 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.195 1.013 15.561 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -10.860 -0.640 16.129 1.00 0.00 H new ATOM 1485 N GLN A 97 -8.270 -1.376 17.183 1.00 0.00 N ATOM 1486 CA GLN A 97 -7.579 -2.226 18.218 1.00 0.00 C ATOM 1487 C GLN A 97 -6.168 -1.678 18.479 1.00 0.00 C ATOM 1488 O GLN A 97 -5.715 -1.635 19.607 1.00 0.00 O ATOM 1489 CB GLN A 97 -7.496 -3.650 17.647 1.00 0.00 C ATOM 1490 CG GLN A 97 -8.762 -4.424 18.018 1.00 0.00 C ATOM 1491 CD GLN A 97 -8.522 -5.206 19.316 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -7.822 -4.741 20.193 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -9.074 -6.384 19.481 1.00 0.00 N ATOM 0 H GLN A 97 -8.516 -1.854 16.316 1.00 0.00 H new ATOM 0 HA GLN A 97 -8.125 -2.220 19.161 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.384 -3.613 16.563 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -6.617 -4.160 18.040 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -9.598 -3.736 18.145 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -9.032 -5.108 17.213 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -9.663 -6.779 18.747 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -8.915 -6.906 20.343 1.00 0.00 H new ATOM 1502 N SER A 98 -5.468 -1.256 17.445 1.00 0.00 N ATOM 1503 CA SER A 98 -4.079 -0.709 17.652 1.00 0.00 C ATOM 1504 C SER A 98 -4.106 0.482 18.626 1.00 0.00 C ATOM 1505 O SER A 98 -3.194 0.657 19.413 1.00 0.00 O ATOM 1506 CB SER A 98 -3.573 -0.250 16.275 1.00 0.00 C ATOM 1507 OG SER A 98 -3.549 -1.362 15.391 1.00 0.00 O ATOM 0 H SER A 98 -5.792 -1.266 16.478 1.00 0.00 H new ATOM 0 HA SER A 98 -3.426 -1.469 18.081 1.00 0.00 H new ATOM 0 HB2 SER A 98 -4.221 0.531 15.878 1.00 0.00 H new ATOM 0 HB3 SER A 98 -2.575 0.179 16.366 1.00 0.00 H new ATOM 0 HG SER A 98 -3.229 -1.073 14.511 1.00 0.00 H new ATOM 1513 N LEU A 99 -5.137 1.302 18.585 1.00 0.00 N ATOM 1514 CA LEU A 99 -5.194 2.475 19.524 1.00 0.00 C ATOM 1515 C LEU A 99 -6.004 2.118 20.778 1.00 0.00 C ATOM 1516 O LEU A 99 -5.645 2.496 21.878 1.00 0.00 O ATOM 1517 CB LEU A 99 -5.874 3.610 18.748 1.00 0.00 C ATOM 1518 CG LEU A 99 -4.846 4.304 17.852 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -4.834 3.635 16.476 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -5.220 5.779 17.696 1.00 0.00 C ATOM 0 H LEU A 99 -5.931 1.211 17.951 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.198 2.766 19.858 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -6.690 3.214 18.144 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.311 4.328 19.442 1.00 0.00 H new ATOM 0 HG LEU A 99 -3.858 4.224 18.304 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -4.102 4.129 15.838 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -4.569 2.583 16.585 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -5.823 3.715 16.024 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.488 6.274 17.058 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -6.209 5.858 17.244 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -5.230 6.257 18.675 1.00 0.00 H new ATOM 1532 N GLY A 100 -7.092 1.394 20.629 1.00 0.00 N ATOM 1533 CA GLY A 100 -7.913 1.020 21.820 1.00 0.00 C ATOM 1534 C GLY A 100 -9.132 1.947 21.918 1.00 0.00 C ATOM 1535 O GLY A 100 -9.403 2.508 22.963 1.00 0.00 O ATOM 0 H GLY A 100 -7.443 1.049 19.735 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -8.238 -0.017 21.739 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.312 1.096 22.726 1.00 0.00 H new ATOM 1539 N GLN A 101 -9.877 2.111 20.843 1.00 0.00 N ATOM 1540 CA GLN A 101 -11.078 2.998 20.892 1.00 0.00 C ATOM 1541 C GLN A 101 -12.352 2.160 20.710 1.00 0.00 C ATOM 1542 O GLN A 101 -12.614 1.653 19.636 1.00 0.00 O ATOM 1543 CB GLN A 101 -10.904 3.976 19.726 1.00 0.00 C ATOM 1544 CG GLN A 101 -11.973 5.066 19.808 1.00 0.00 C ATOM 1545 CD GLN A 101 -13.254 4.580 19.118 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -14.294 4.501 19.740 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -13.228 4.247 17.850 1.00 0.00 N ATOM 0 H GLN A 101 -9.701 1.669 19.941 1.00 0.00 H new ATOM 0 HA GLN A 101 -11.170 3.521 21.844 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -9.911 4.423 19.758 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -10.984 3.445 18.777 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -12.179 5.310 20.850 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -11.614 5.978 19.331 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -12.357 4.312 17.323 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -14.079 3.923 17.390 1.00 0.00 H new ATOM 1556 N SER A 102 -13.150 1.999 21.753 1.00 0.00 N ATOM 1557 CA SER A 102 -14.405 1.182 21.635 1.00 0.00 C ATOM 1558 C SER A 102 -14.088 -0.213 21.066 1.00 0.00 C ATOM 1559 O SER A 102 -14.251 -0.453 19.884 1.00 0.00 O ATOM 1560 CB SER A 102 -15.312 1.961 20.679 1.00 0.00 C ATOM 1561 OG SER A 102 -15.631 3.220 21.256 1.00 0.00 O ATOM 0 H SER A 102 -12.982 2.399 22.676 1.00 0.00 H new ATOM 0 HA SER A 102 -14.880 1.027 22.604 1.00 0.00 H new ATOM 0 HB2 SER A 102 -14.813 2.103 19.721 1.00 0.00 H new ATOM 0 HB3 SER A 102 -16.224 1.396 20.483 1.00 0.00 H new ATOM 0 HG SER A 102 -15.217 3.935 20.729 1.00 0.00 H new ATOM 1567 N ASP A 103 -13.634 -1.134 21.894 1.00 0.00 N ATOM 1568 CA ASP A 103 -13.311 -2.502 21.387 1.00 0.00 C ATOM 1569 C ASP A 103 -13.982 -3.570 22.266 1.00 0.00 C ATOM 1570 O ASP A 103 -14.657 -3.249 23.227 1.00 0.00 O ATOM 1571 CB ASP A 103 -11.782 -2.609 21.465 1.00 0.00 C ATOM 1572 CG ASP A 103 -11.313 -2.429 22.913 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -11.464 -1.336 23.432 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -10.811 -3.388 23.475 1.00 0.00 O ATOM 0 H ASP A 103 -13.476 -0.993 22.892 1.00 0.00 H new ATOM 0 HA ASP A 103 -13.674 -2.662 20.372 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -11.458 -3.579 21.088 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -11.324 -1.851 20.830 1.00 0.00 H new ATOM 1579 N ILE A 104 -13.805 -4.837 21.950 1.00 0.00 N ATOM 1580 CA ILE A 104 -14.439 -5.911 22.773 1.00 0.00 C ATOM 1581 C ILE A 104 -13.503 -7.130 22.875 1.00 0.00 C ATOM 1582 O ILE A 104 -12.610 -7.294 22.065 1.00 0.00 O ATOM 1583 CB ILE A 104 -15.733 -6.269 22.030 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -16.479 -7.365 22.797 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -15.407 -6.767 20.618 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -17.863 -7.568 22.178 1.00 0.00 C ATOM 0 H ILE A 104 -13.250 -5.167 21.160 1.00 0.00 H new ATOM 0 HA ILE A 104 -14.638 -5.588 23.795 1.00 0.00 H new ATOM 0 HB ILE A 104 -16.360 -5.380 21.960 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -15.914 -8.296 22.764 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -16.575 -7.088 23.847 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -16.332 -7.019 20.098 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -14.883 -5.985 20.068 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -14.774 -7.652 20.681 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -18.395 -8.348 22.723 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -18.427 -6.637 22.234 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -17.755 -7.864 21.135 1.00 0.00 H new ATOM 1598 N ALA A 105 -13.699 -7.983 23.859 1.00 0.00 N ATOM 1599 CA ALA A 105 -12.818 -9.181 24.000 1.00 0.00 C ATOM 1600 C ALA A 105 -13.662 -10.426 24.288 1.00 0.00 C ATOM 1601 O ALA A 105 -14.181 -10.523 25.388 1.00 0.00 O ATOM 1602 CB ALA A 105 -11.905 -8.866 25.184 1.00 0.00 C ATOM 1603 OXT ALA A 105 -13.774 -11.260 23.405 1.00 0.00 O ATOM 0 H ALA A 105 -14.430 -7.897 24.565 1.00 0.00 H new ATOM 0 HA ALA A 105 -12.250 -9.385 23.092 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -11.225 -9.702 25.352 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -11.328 -7.966 24.969 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -12.509 -8.705 26.077 1.00 0.00 H new TER 1609 ALA A 105