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 17 LYS NZ :NH3+ 167:sc= 1.17 (180deg=0) USER MOD Set 1.2: A 66 ASN : amide:sc= -1.87 K(o=-0.7,f=-21!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 33:sc= 0.0101 USER MOD Single : A 3 GLN : amide:sc=-0.00337 X(o=-0.0034,f=0) USER MOD Single : A 5 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : A 6 TYR OH : rot 165:sc= 0 USER MOD Single : A 7 THR OG1 : rot 114:sc= 1.18 USER MOD Single : A 9 ASN : amide:sc= -0.051 K(o=-0.051,f=-0.98) 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 169:sc= -4.66! USER MOD Single : A 41 ASN : amide:sc= -1.15! X(o=-1.2!,f=-0.67) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.0159 USER MOD Single : A 47 SER OG : rot 180:sc= 0 USER MOD Single : A 54 SER OG : rot 95:sc= 1.26 USER MOD Single : A 58 SER OG : rot 180:sc= 0.0911 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot -150:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc=-0.00645 K(o=-0.0065,f=-0.8) USER MOD Single : A 80 GLN : amide:sc=-0.00188 K(o=-0.0019,f=-0.71) USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 ASN : amide:sc= -0.485 K(o=-0.48,f=-3.8!) USER MOD Single : A 89 SER OG : rot -94:sc= 1.01 USER MOD Single : A 90 LYS NZ :NH3+ -171:sc= -0.0154 (180deg=-0.196) 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= -0.0393 F(o=-1.8,f=-0.039) USER MOD Single : A 97 GLN : amide:sc= -0.117 K(o=-0.12,f=-1.5!) USER MOD Single : A 98 SER OG : rot 180:sc= 0 USER MOD Single : A 101 GLN : amide:sc= 0 K(o=0,f=-1.7) USER MOD Single : A 102 SER OG : rot -90:sc= 1.17 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.664 8.647 -21.857 1.00 0.00 N ATOM 2 CA MET A 1 -5.515 7.904 -21.265 1.00 0.00 C ATOM 3 C MET A 1 -5.402 8.209 -19.762 1.00 0.00 C ATOM 4 O MET A 1 -4.578 9.006 -19.351 1.00 0.00 O ATOM 5 CB MET A 1 -4.284 8.417 -22.012 1.00 0.00 C ATOM 6 CG MET A 1 -3.106 7.472 -21.769 1.00 0.00 C ATOM 7 SD MET A 1 -3.109 6.168 -23.025 1.00 0.00 S ATOM 8 CE MET A 1 -1.846 5.118 -22.264 1.00 0.00 C ATOM 0 H1 MET A 1 -6.730 8.433 -22.873 1.00 0.00 H new ATOM 0 H2 MET A 1 -7.544 8.359 -21.385 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.520 9.669 -21.727 1.00 0.00 H new ATOM 0 HA MET A 1 -5.628 6.824 -21.361 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.495 8.484 -23.079 1.00 0.00 H new ATOM 0 HB3 MET A 1 -4.033 9.422 -21.673 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.168 8.026 -21.807 1.00 0.00 H new ATOM 0 HG3 MET A 1 -3.177 7.033 -20.774 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.684 4.236 -22.884 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.914 5.676 -22.176 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.179 4.809 -21.273 1.00 0.00 H new ATOM 20 N SER A 2 -6.219 7.586 -18.937 1.00 0.00 N ATOM 21 CA SER A 2 -6.148 7.850 -17.469 1.00 0.00 C ATOM 22 C SER A 2 -6.427 6.560 -16.681 1.00 0.00 C ATOM 23 O SER A 2 -7.351 5.832 -16.990 1.00 0.00 O ATOM 24 CB SER A 2 -7.237 8.887 -17.200 1.00 0.00 C ATOM 25 OG SER A 2 -6.659 10.186 -17.205 1.00 0.00 O ATOM 0 H SER A 2 -6.927 6.910 -19.222 1.00 0.00 H new ATOM 0 HA SER A 2 -5.164 8.202 -17.161 1.00 0.00 H new ATOM 0 HB2 SER A 2 -8.015 8.820 -17.960 1.00 0.00 H new ATOM 0 HB3 SER A 2 -7.712 8.691 -16.239 1.00 0.00 H new ATOM 0 HG SER A 2 -5.919 10.212 -17.847 1.00 0.00 H new ATOM 31 N GLN A 3 -5.638 6.269 -15.666 1.00 0.00 N ATOM 32 CA GLN A 3 -5.870 5.026 -14.870 1.00 0.00 C ATOM 33 C GLN A 3 -6.221 5.383 -13.415 1.00 0.00 C ATOM 34 O GLN A 3 -5.416 5.205 -12.520 1.00 0.00 O ATOM 35 CB GLN A 3 -4.548 4.259 -14.934 1.00 0.00 C ATOM 36 CG GLN A 3 -4.286 3.812 -16.373 1.00 0.00 C ATOM 37 CD GLN A 3 -5.011 2.487 -16.638 1.00 0.00 C ATOM 38 OE1 GLN A 3 -4.447 1.428 -16.440 1.00 0.00 O ATOM 39 NE2 GLN A 3 -6.245 2.493 -17.078 1.00 0.00 N ATOM 0 H GLN A 3 -4.849 6.839 -15.360 1.00 0.00 H new ATOM 0 HA GLN A 3 -6.700 4.436 -15.259 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -3.732 4.891 -14.584 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -4.586 3.392 -14.274 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -4.633 4.574 -17.071 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -3.215 3.692 -16.538 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -6.722 3.379 -17.246 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -6.728 1.612 -17.253 1.00 0.00 H new ATOM 48 N GLU A 4 -7.416 5.883 -13.169 1.00 0.00 N ATOM 49 CA GLU A 4 -7.800 6.242 -11.761 1.00 0.00 C ATOM 50 C GLU A 4 -8.585 5.092 -11.112 1.00 0.00 C ATOM 51 O GLU A 4 -8.404 4.806 -9.944 1.00 0.00 O ATOM 52 CB GLU A 4 -8.671 7.500 -11.864 1.00 0.00 C ATOM 53 CG GLU A 4 -8.985 8.020 -10.460 1.00 0.00 C ATOM 54 CD GLU A 4 -9.319 9.511 -10.530 1.00 0.00 C ATOM 55 OE1 GLU A 4 -8.611 10.224 -11.221 1.00 0.00 O ATOM 56 OE2 GLU A 4 -10.277 9.914 -9.891 1.00 0.00 O ATOM 0 H GLU A 4 -8.133 6.056 -13.874 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.922 6.420 -11.141 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.154 8.267 -12.440 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.596 7.272 -12.394 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.824 7.468 -10.036 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -8.131 7.858 -9.802 1.00 0.00 H new ATOM 63 N GLN A 5 -9.450 4.419 -11.852 1.00 0.00 N ATOM 64 CA GLN A 5 -10.225 3.276 -11.235 1.00 0.00 C ATOM 65 C GLN A 5 -9.249 2.265 -10.606 1.00 0.00 C ATOM 66 O GLN A 5 -9.507 1.735 -9.542 1.00 0.00 O ATOM 67 CB GLN A 5 -11.056 2.624 -12.362 1.00 0.00 C ATOM 68 CG GLN A 5 -10.136 2.020 -13.430 1.00 0.00 C ATOM 69 CD GLN A 5 -10.986 1.351 -14.517 1.00 0.00 C ATOM 70 OE1 GLN A 5 -11.968 0.703 -14.218 1.00 0.00 O ATOM 71 NE2 GLN A 5 -10.652 1.479 -15.779 1.00 0.00 N ATOM 0 H GLN A 5 -9.651 4.605 -12.835 1.00 0.00 H new ATOM 0 HA GLN A 5 -10.886 3.627 -10.443 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -11.698 1.847 -11.946 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -11.710 3.368 -12.816 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -9.511 2.798 -13.869 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -9.465 1.290 -12.977 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -9.828 2.022 -16.036 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -11.216 1.035 -16.503 1.00 0.00 H new ATOM 80 N TYR A 6 -8.112 2.030 -11.230 1.00 0.00 N ATOM 81 CA TYR A 6 -7.112 1.090 -10.619 1.00 0.00 C ATOM 82 C TYR A 6 -6.428 1.805 -9.445 1.00 0.00 C ATOM 83 O TYR A 6 -6.163 1.209 -8.418 1.00 0.00 O ATOM 84 CB TYR A 6 -6.074 0.760 -11.707 1.00 0.00 C ATOM 85 CG TYR A 6 -6.659 -0.212 -12.703 1.00 0.00 C ATOM 86 CD1 TYR A 6 -7.379 0.263 -13.805 1.00 0.00 C ATOM 87 CD2 TYR A 6 -6.471 -1.590 -12.531 1.00 0.00 C ATOM 88 CE1 TYR A 6 -7.914 -0.638 -14.734 1.00 0.00 C ATOM 89 CE2 TYR A 6 -7.005 -2.490 -13.460 1.00 0.00 C ATOM 90 CZ TYR A 6 -7.728 -2.015 -14.560 1.00 0.00 C ATOM 91 OH TYR A 6 -8.254 -2.902 -15.476 1.00 0.00 O ATOM 0 H TYR A 6 -7.837 2.442 -12.122 1.00 0.00 H new ATOM 0 HA TYR A 6 -7.585 0.177 -10.256 1.00 0.00 H new ATOM 0 HB2 TYR A 6 -5.766 1.673 -12.216 1.00 0.00 H new ATOM 0 HB3 TYR A 6 -5.181 0.333 -11.251 1.00 0.00 H new ATOM 0 HD1 TYR A 6 -7.522 1.325 -13.939 1.00 0.00 H new ATOM 0 HD2 TYR A 6 -5.914 -1.957 -11.682 1.00 0.00 H new ATOM 0 HE1 TYR A 6 -8.470 -0.271 -15.584 1.00 0.00 H new ATOM 0 HE2 TYR A 6 -6.859 -3.552 -13.328 1.00 0.00 H new ATOM 0 HH TYR A 6 -7.843 -3.783 -15.352 1.00 0.00 H new ATOM 101 N THR A 7 -6.150 3.088 -9.585 1.00 0.00 N ATOM 102 CA THR A 7 -5.493 3.842 -8.462 1.00 0.00 C ATOM 103 C THR A 7 -6.459 3.937 -7.271 1.00 0.00 C ATOM 104 O THR A 7 -6.053 3.790 -6.133 1.00 0.00 O ATOM 105 CB THR A 7 -5.174 5.248 -9.013 1.00 0.00 C ATOM 106 OG1 THR A 7 -4.252 5.132 -10.091 1.00 0.00 O ATOM 107 CG2 THR A 7 -4.562 6.132 -7.921 1.00 0.00 C ATOM 0 H THR A 7 -6.348 3.639 -10.420 1.00 0.00 H new ATOM 0 HA THR A 7 -4.587 3.345 -8.115 1.00 0.00 H new ATOM 0 HB THR A 7 -6.101 5.706 -9.357 1.00 0.00 H new ATOM 0 HG1 THR A 7 -4.685 5.415 -10.924 1.00 0.00 H new ATOM 0 HG21 THR A 7 -4.345 7.118 -8.331 1.00 0.00 H new ATOM 0 HG22 THR A 7 -5.266 6.229 -7.095 1.00 0.00 H new ATOM 0 HG23 THR A 7 -3.639 5.678 -7.560 1.00 0.00 H new ATOM 115 N GLU A 8 -7.730 4.179 -7.517 1.00 0.00 N ATOM 116 CA GLU A 8 -8.698 4.276 -6.369 1.00 0.00 C ATOM 117 C GLU A 8 -8.839 2.910 -5.692 1.00 0.00 C ATOM 118 O GLU A 8 -8.883 2.822 -4.479 1.00 0.00 O ATOM 119 CB GLU A 8 -10.046 4.731 -6.952 1.00 0.00 C ATOM 120 CG GLU A 8 -11.031 4.997 -5.812 1.00 0.00 C ATOM 121 CD GLU A 8 -12.036 6.066 -6.244 1.00 0.00 C ATOM 122 OE1 GLU A 8 -12.434 6.045 -7.397 1.00 0.00 O ATOM 123 OE2 GLU A 8 -12.390 6.887 -5.415 1.00 0.00 O ATOM 0 H GLU A 8 -8.134 4.311 -8.444 1.00 0.00 H new ATOM 0 HA GLU A 8 -8.349 4.985 -5.618 1.00 0.00 H new ATOM 0 HB2 GLU A 8 -9.911 5.634 -7.548 1.00 0.00 H new ATOM 0 HB3 GLU A 8 -10.443 3.965 -7.619 1.00 0.00 H new ATOM 0 HG2 GLU A 8 -11.553 4.078 -5.547 1.00 0.00 H new ATOM 0 HG3 GLU A 8 -10.494 5.326 -4.923 1.00 0.00 H new ATOM 130 N ASN A 9 -8.881 1.839 -6.456 1.00 0.00 N ATOM 131 CA ASN A 9 -8.988 0.484 -5.815 1.00 0.00 C ATOM 132 C ASN A 9 -7.610 0.087 -5.271 1.00 0.00 C ATOM 133 O ASN A 9 -7.502 -0.441 -4.180 1.00 0.00 O ATOM 134 CB ASN A 9 -9.443 -0.495 -6.906 1.00 0.00 C ATOM 135 CG ASN A 9 -10.954 -0.351 -7.127 1.00 0.00 C ATOM 136 OD1 ASN A 9 -11.435 0.732 -7.393 1.00 0.00 O ATOM 137 ND2 ASN A 9 -11.732 -1.402 -7.028 1.00 0.00 N ATOM 0 H ASN A 9 -8.847 1.842 -7.475 1.00 0.00 H new ATOM 0 HA ASN A 9 -9.699 0.479 -4.989 1.00 0.00 H new ATOM 0 HB2 ASN A 9 -8.908 -0.295 -7.835 1.00 0.00 H new ATOM 0 HB3 ASN A 9 -9.203 -1.518 -6.614 1.00 0.00 H new ATOM 0 HD21 ASN A 9 -12.737 -1.308 -7.174 1.00 0.00 H new ATOM 0 HD22 ASN A 9 -11.332 -2.313 -6.805 1.00 0.00 H new ATOM 144 N LEU A 10 -6.554 0.363 -6.009 1.00 0.00 N ATOM 145 CA LEU A 10 -5.184 0.021 -5.497 1.00 0.00 C ATOM 146 C LEU A 10 -4.861 0.898 -4.280 1.00 0.00 C ATOM 147 O LEU A 10 -4.233 0.444 -3.340 1.00 0.00 O ATOM 148 CB LEU A 10 -4.193 0.299 -6.639 1.00 0.00 C ATOM 149 CG LEU A 10 -2.778 -0.080 -6.195 1.00 0.00 C ATOM 150 CD1 LEU A 10 -2.709 -1.586 -5.930 1.00 0.00 C ATOM 151 CD2 LEU A 10 -1.781 0.290 -7.295 1.00 0.00 C ATOM 0 H LEU A 10 -6.581 0.803 -6.929 1.00 0.00 H new ATOM 0 HA LEU A 10 -5.123 -1.022 -5.188 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -4.473 -0.273 -7.524 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -4.228 1.353 -6.916 1.00 0.00 H new ATOM 0 HG LEU A 10 -2.529 0.460 -5.282 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -1.701 -1.854 -5.614 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -3.418 -1.850 -5.145 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -2.959 -2.128 -6.842 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -0.773 0.020 -6.979 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -2.031 -0.249 -8.209 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -1.827 1.363 -7.482 1.00 0.00 H new ATOM 163 N LYS A 11 -5.292 2.149 -4.272 1.00 0.00 N ATOM 164 CA LYS A 11 -5.001 3.025 -3.080 1.00 0.00 C ATOM 165 C LYS A 11 -5.594 2.401 -1.808 1.00 0.00 C ATOM 166 O LYS A 11 -5.019 2.513 -0.740 1.00 0.00 O ATOM 167 CB LYS A 11 -5.650 4.390 -3.356 1.00 0.00 C ATOM 168 CG LYS A 11 -5.320 5.355 -2.215 1.00 0.00 C ATOM 169 CD LYS A 11 -6.401 5.259 -1.137 1.00 0.00 C ATOM 170 CE LYS A 11 -6.468 6.577 -0.362 1.00 0.00 C ATOM 171 NZ LYS A 11 -6.976 6.204 0.988 1.00 0.00 N ATOM 0 H LYS A 11 -5.821 2.592 -5.023 1.00 0.00 H new ATOM 0 HA LYS A 11 -3.927 3.131 -2.928 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -5.287 4.792 -4.302 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -6.730 4.278 -3.450 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.346 5.113 -1.790 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -5.259 6.375 -2.594 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -7.367 5.044 -1.594 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.180 4.436 -0.457 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.487 7.048 -0.298 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -7.133 7.289 -0.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.049 7.057 1.579 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.914 5.764 0.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -6.320 5.530 1.432 1.00 0.00 H new ATOM 185 N VAL A 12 -6.727 1.730 -1.905 1.00 0.00 N ATOM 186 CA VAL A 12 -7.316 1.097 -0.675 1.00 0.00 C ATOM 187 C VAL A 12 -6.501 -0.151 -0.314 1.00 0.00 C ATOM 188 O VAL A 12 -6.183 -0.374 0.840 1.00 0.00 O ATOM 189 CB VAL A 12 -8.766 0.718 -1.022 1.00 0.00 C ATOM 190 CG1 VAL A 12 -9.421 0.035 0.180 1.00 0.00 C ATOM 191 CG2 VAL A 12 -9.550 1.984 -1.376 1.00 0.00 C ATOM 0 H VAL A 12 -7.258 1.596 -2.765 1.00 0.00 H new ATOM 0 HA VAL A 12 -7.295 1.773 0.180 1.00 0.00 H new ATOM 0 HB VAL A 12 -8.768 0.035 -1.872 1.00 0.00 H new ATOM 0 HG11 VAL A 12 -10.448 -0.232 -0.069 1.00 0.00 H new ATOM 0 HG12 VAL A 12 -8.863 -0.866 0.435 1.00 0.00 H new ATOM 0 HG13 VAL A 12 -9.419 0.716 1.031 1.00 0.00 H new ATOM 0 HG21 VAL A 12 -10.578 1.718 -1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 12 -9.545 2.665 -0.525 1.00 0.00 H new ATOM 0 HG23 VAL A 12 -9.086 2.472 -2.233 1.00 0.00 H new ATOM 201 N ILE A 13 -6.150 -0.958 -1.290 1.00 0.00 N ATOM 202 CA ILE A 13 -5.336 -2.185 -0.981 1.00 0.00 C ATOM 203 C ILE A 13 -3.932 -1.770 -0.507 1.00 0.00 C ATOM 204 O ILE A 13 -3.359 -2.410 0.357 1.00 0.00 O ATOM 205 CB ILE A 13 -5.259 -3.007 -2.279 1.00 0.00 C ATOM 206 CG1 ILE A 13 -6.678 -3.383 -2.725 1.00 0.00 C ATOM 207 CG2 ILE A 13 -4.447 -4.282 -2.035 1.00 0.00 C ATOM 208 CD1 ILE A 13 -6.783 -3.307 -4.251 1.00 0.00 C ATOM 0 H ILE A 13 -6.386 -0.825 -2.273 1.00 0.00 H new ATOM 0 HA ILE A 13 -5.788 -2.777 -0.185 1.00 0.00 H new ATOM 0 HB ILE A 13 -4.774 -2.415 -3.055 1.00 0.00 H new ATOM 0 HG12 ILE A 13 -6.920 -4.390 -2.385 1.00 0.00 H new ATOM 0 HG13 ILE A 13 -7.403 -2.709 -2.268 1.00 0.00 H new ATOM 0 HG21 ILE A 13 -4.395 -4.862 -2.956 1.00 0.00 H new ATOM 0 HG22 ILE A 13 -3.439 -4.016 -1.716 1.00 0.00 H new ATOM 0 HG23 ILE A 13 -4.928 -4.877 -1.259 1.00 0.00 H new ATOM 0 HD11 ILE A 13 -7.793 -3.575 -4.560 1.00 0.00 H new ATOM 0 HD12 ILE A 13 -6.560 -2.292 -4.581 1.00 0.00 H new ATOM 0 HD13 ILE A 13 -6.070 -3.999 -4.700 1.00 0.00 H new ATOM 220 N VAL A 14 -3.375 -0.701 -1.046 1.00 0.00 N ATOM 221 CA VAL A 14 -2.009 -0.266 -0.584 1.00 0.00 C ATOM 222 C VAL A 14 -2.092 0.184 0.885 1.00 0.00 C ATOM 223 O VAL A 14 -1.218 -0.122 1.676 1.00 0.00 O ATOM 224 CB VAL A 14 -1.584 0.907 -1.487 1.00 0.00 C ATOM 225 CG1 VAL A 14 -0.203 1.415 -1.062 1.00 0.00 C ATOM 226 CG2 VAL A 14 -1.521 0.432 -2.942 1.00 0.00 C ATOM 0 H VAL A 14 -3.798 -0.122 -1.771 1.00 0.00 H new ATOM 0 HA VAL A 14 -1.283 -1.077 -0.649 1.00 0.00 H new ATOM 0 HB VAL A 14 -2.311 1.714 -1.393 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.093 2.245 -1.704 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -0.243 1.754 -0.027 1.00 0.00 H new ATOM 0 HG13 VAL A 14 0.525 0.609 -1.152 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.220 1.261 -3.583 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -0.795 -0.376 -3.030 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -2.503 0.073 -3.250 1.00 0.00 H new ATOM 236 N ALA A 15 -3.138 0.895 1.263 1.00 0.00 N ATOM 237 CA ALA A 15 -3.256 1.337 2.700 1.00 0.00 C ATOM 238 C ALA A 15 -3.424 0.112 3.621 1.00 0.00 C ATOM 239 O ALA A 15 -2.959 0.115 4.744 1.00 0.00 O ATOM 240 CB ALA A 15 -4.498 2.238 2.787 1.00 0.00 C ATOM 0 H ALA A 15 -3.902 1.184 0.652 1.00 0.00 H new ATOM 0 HA ALA A 15 -2.361 1.872 3.019 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.625 2.584 3.813 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -4.372 3.097 2.127 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.379 1.673 2.483 1.00 0.00 H new ATOM 246 N GLU A 16 -4.082 -0.939 3.160 1.00 0.00 N ATOM 247 CA GLU A 16 -4.265 -2.160 4.031 1.00 0.00 C ATOM 248 C GLU A 16 -2.912 -2.638 4.584 1.00 0.00 C ATOM 249 O GLU A 16 -2.826 -3.085 5.713 1.00 0.00 O ATOM 250 CB GLU A 16 -4.873 -3.251 3.133 1.00 0.00 C ATOM 251 CG GLU A 16 -5.183 -4.495 3.967 1.00 0.00 C ATOM 252 CD GLU A 16 -5.174 -5.730 3.063 1.00 0.00 C ATOM 253 OE1 GLU A 16 -4.304 -5.811 2.211 1.00 0.00 O ATOM 254 OE2 GLU A 16 -6.038 -6.574 3.237 1.00 0.00 O ATOM 0 H GLU A 16 -4.495 -1.004 2.230 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.908 -1.935 4.882 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -5.784 -2.881 2.662 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.179 -3.503 2.331 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -4.445 -4.607 4.761 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -6.155 -4.390 4.448 1.00 0.00 H new ATOM 261 N LYS A 17 -1.852 -2.546 3.803 1.00 0.00 N ATOM 262 CA LYS A 17 -0.513 -3.000 4.315 1.00 0.00 C ATOM 263 C LYS A 17 0.137 -1.880 5.139 1.00 0.00 C ATOM 264 O LYS A 17 0.714 -2.133 6.180 1.00 0.00 O ATOM 265 CB LYS A 17 0.341 -3.327 3.081 1.00 0.00 C ATOM 266 CG LYS A 17 1.411 -4.352 3.456 1.00 0.00 C ATOM 267 CD LYS A 17 0.805 -5.759 3.431 1.00 0.00 C ATOM 268 CE LYS A 17 0.379 -6.168 4.848 1.00 0.00 C ATOM 269 NZ LYS A 17 1.224 -7.349 5.185 1.00 0.00 N ATOM 0 H LYS A 17 -1.856 -2.183 2.850 1.00 0.00 H new ATOM 0 HA LYS A 17 -0.608 -3.872 4.962 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -0.290 -3.720 2.283 1.00 0.00 H new ATOM 0 HB3 LYS A 17 0.810 -2.420 2.700 1.00 0.00 H new ATOM 0 HG2 LYS A 17 2.247 -4.292 2.759 1.00 0.00 H new ATOM 0 HG3 LYS A 17 1.807 -4.133 4.448 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -0.055 -5.782 2.762 1.00 0.00 H new ATOM 0 HD3 LYS A 17 1.532 -6.471 3.040 1.00 0.00 H new ATOM 0 HE2 LYS A 17 0.538 -5.355 5.557 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -0.681 -6.419 4.883 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 1.152 -7.548 6.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 0.895 -8.176 4.647 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 2.215 -7.148 4.941 1.00 0.00 H new ATOM 283 N LEU A 18 0.041 -0.642 4.694 1.00 0.00 N ATOM 284 CA LEU A 18 0.656 0.479 5.489 1.00 0.00 C ATOM 285 C LEU A 18 -0.085 0.619 6.824 1.00 0.00 C ATOM 286 O LEU A 18 0.516 0.553 7.880 1.00 0.00 O ATOM 287 CB LEU A 18 0.485 1.757 4.659 1.00 0.00 C ATOM 288 CG LEU A 18 1.322 1.659 3.388 1.00 0.00 C ATOM 289 CD1 LEU A 18 0.727 2.575 2.315 1.00 0.00 C ATOM 290 CD2 LEU A 18 2.757 2.090 3.698 1.00 0.00 C ATOM 0 H LEU A 18 -0.427 -0.363 3.832 1.00 0.00 H new ATOM 0 HA LEU A 18 1.709 0.290 5.697 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -0.565 1.899 4.404 1.00 0.00 H new ATOM 0 HB3 LEU A 18 0.792 2.625 5.242 1.00 0.00 H new ATOM 0 HG LEU A 18 1.322 0.632 3.023 1.00 0.00 H new ATOM 0 HD11 LEU A 18 1.324 2.506 1.406 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -0.297 2.268 2.101 1.00 0.00 H new ATOM 0 HD13 LEU A 18 0.729 3.604 2.673 1.00 0.00 H new ATOM 0 HD21 LEU A 18 3.361 2.022 2.793 1.00 0.00 H new ATOM 0 HD22 LEU A 18 2.758 3.119 4.059 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.176 1.437 4.463 1.00 0.00 H new ATOM 302 N ALA A 19 -1.390 0.799 6.786 1.00 0.00 N ATOM 303 CA ALA A 19 -2.161 0.928 8.073 1.00 0.00 C ATOM 304 C ALA A 19 -1.981 -0.337 8.939 1.00 0.00 C ATOM 305 O ALA A 19 -2.121 -0.280 10.146 1.00 0.00 O ATOM 306 CB ALA A 19 -3.641 1.088 7.686 1.00 0.00 C ATOM 0 H ALA A 19 -1.948 0.861 5.934 1.00 0.00 H new ATOM 0 HA ALA A 19 -1.806 1.780 8.653 1.00 0.00 H new ATOM 0 HB1 ALA A 19 -4.245 1.186 8.588 1.00 0.00 H new ATOM 0 HB2 ALA A 19 -3.762 1.979 7.070 1.00 0.00 H new ATOM 0 HB3 ALA A 19 -3.967 0.212 7.125 1.00 0.00 H new ATOM 312 N GLY A 20 -1.683 -1.483 8.343 1.00 0.00 N ATOM 313 CA GLY A 20 -1.515 -2.728 9.152 1.00 0.00 C ATOM 314 C GLY A 20 -0.129 -2.761 9.820 1.00 0.00 C ATOM 315 O GLY A 20 0.009 -3.262 10.921 1.00 0.00 O ATOM 0 H GLY A 20 -1.552 -1.598 7.338 1.00 0.00 H new ATOM 0 HA2 GLY A 20 -2.293 -2.780 9.914 1.00 0.00 H new ATOM 0 HA3 GLY A 20 -1.637 -3.602 8.512 1.00 0.00 H new ATOM 319 N ILE A 21 0.906 -2.249 9.174 1.00 0.00 N ATOM 320 CA ILE A 21 2.279 -2.285 9.811 1.00 0.00 C ATOM 321 C ILE A 21 2.224 -1.670 11.233 1.00 0.00 C ATOM 322 O ILE A 21 1.684 -0.597 11.410 1.00 0.00 O ATOM 323 CB ILE A 21 3.213 -1.469 8.890 1.00 0.00 C ATOM 324 CG1 ILE A 21 3.371 -2.207 7.555 1.00 0.00 C ATOM 325 CG2 ILE A 21 4.594 -1.308 9.537 1.00 0.00 C ATOM 326 CD1 ILE A 21 3.554 -1.198 6.417 1.00 0.00 C ATOM 0 H ILE A 21 0.864 -1.816 8.252 1.00 0.00 H new ATOM 0 HA ILE A 21 2.643 -3.307 9.918 1.00 0.00 H new ATOM 0 HB ILE A 21 2.778 -0.483 8.729 1.00 0.00 H new ATOM 0 HG12 ILE A 21 4.230 -2.877 7.600 1.00 0.00 H new ATOM 0 HG13 ILE A 21 2.494 -2.826 7.366 1.00 0.00 H new ATOM 0 HG21 ILE A 21 5.240 -0.731 8.876 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.491 -0.787 10.489 1.00 0.00 H new ATOM 0 HG23 ILE A 21 5.033 -2.291 9.707 1.00 0.00 H new ATOM 0 HD11 ILE A 21 3.665 -1.731 5.473 1.00 0.00 H new ATOM 0 HD12 ILE A 21 2.682 -0.546 6.365 1.00 0.00 H new ATOM 0 HD13 ILE A 21 4.445 -0.598 6.602 1.00 0.00 H new ATOM 338 N PRO A 22 2.779 -2.372 12.206 1.00 0.00 N ATOM 339 CA PRO A 22 2.766 -1.864 13.604 1.00 0.00 C ATOM 340 C PRO A 22 3.749 -0.691 13.805 1.00 0.00 C ATOM 341 O PRO A 22 3.587 0.090 14.724 1.00 0.00 O ATOM 342 CB PRO A 22 3.198 -3.070 14.432 1.00 0.00 C ATOM 343 CG PRO A 22 3.991 -3.922 13.497 1.00 0.00 C ATOM 344 CD PRO A 22 3.458 -3.677 12.111 1.00 0.00 C ATOM 0 HA PRO A 22 1.788 -1.472 13.885 1.00 0.00 H new ATOM 0 HB2 PRO A 22 3.797 -2.765 15.290 1.00 0.00 H new ATOM 0 HB3 PRO A 22 2.335 -3.610 14.821 1.00 0.00 H new ATOM 0 HG2 PRO A 22 5.050 -3.671 13.552 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.899 -4.975 13.764 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.261 -3.655 11.374 1.00 0.00 H new ATOM 0 HD3 PRO A 22 2.767 -4.463 11.806 1.00 0.00 H new ATOM 352 N ASN A 23 4.759 -0.547 12.966 1.00 0.00 N ATOM 353 CA ASN A 23 5.720 0.590 13.148 1.00 0.00 C ATOM 354 C ASN A 23 5.449 1.695 12.112 1.00 0.00 C ATOM 355 O ASN A 23 6.362 2.372 11.678 1.00 0.00 O ATOM 356 CB ASN A 23 7.115 -0.009 12.940 1.00 0.00 C ATOM 357 CG ASN A 23 7.655 -0.528 14.279 1.00 0.00 C ATOM 358 OD1 ASN A 23 7.979 0.251 15.153 1.00 0.00 O ATOM 359 ND2 ASN A 23 7.768 -1.818 14.483 1.00 0.00 N ATOM 0 H ASN A 23 4.954 -1.161 12.175 1.00 0.00 H new ATOM 0 HA ASN A 23 5.621 1.046 14.133 1.00 0.00 H new ATOM 0 HB2 ASN A 23 7.069 -0.822 12.215 1.00 0.00 H new ATOM 0 HB3 ASN A 23 7.789 0.744 12.532 1.00 0.00 H new ATOM 0 HD21 ASN A 23 8.127 -2.164 15.373 1.00 0.00 H new ATOM 0 HD22 ASN A 23 7.497 -2.476 13.752 1.00 0.00 H new ATOM 366 N PHE A 24 4.206 1.891 11.717 1.00 0.00 N ATOM 367 CA PHE A 24 3.897 2.958 10.719 1.00 0.00 C ATOM 368 C PHE A 24 2.858 3.931 11.299 1.00 0.00 C ATOM 369 O PHE A 24 1.686 3.853 10.979 1.00 0.00 O ATOM 370 CB PHE A 24 3.329 2.215 9.508 1.00 0.00 C ATOM 371 CG PHE A 24 3.785 2.893 8.239 1.00 0.00 C ATOM 372 CD1 PHE A 24 3.153 4.063 7.803 1.00 0.00 C ATOM 373 CD2 PHE A 24 4.842 2.349 7.497 1.00 0.00 C ATOM 374 CE1 PHE A 24 3.577 4.690 6.625 1.00 0.00 C ATOM 375 CE2 PHE A 24 5.266 2.977 6.319 1.00 0.00 C ATOM 376 CZ PHE A 24 4.633 4.147 5.883 1.00 0.00 C ATOM 0 H PHE A 24 3.401 1.358 12.045 1.00 0.00 H new ATOM 0 HA PHE A 24 4.773 3.549 10.454 1.00 0.00 H new ATOM 0 HB2 PHE A 24 3.661 1.177 9.517 1.00 0.00 H new ATOM 0 HB3 PHE A 24 2.240 2.202 9.554 1.00 0.00 H new ATOM 0 HD1 PHE A 24 2.338 4.482 8.375 1.00 0.00 H new ATOM 0 HD2 PHE A 24 5.329 1.446 7.833 1.00 0.00 H new ATOM 0 HE1 PHE A 24 3.089 5.593 6.289 1.00 0.00 H new ATOM 0 HE2 PHE A 24 6.081 2.559 5.747 1.00 0.00 H new ATOM 0 HZ PHE A 24 4.959 4.631 4.974 1.00 0.00 H new ATOM 386 N ASN A 25 3.272 4.851 12.149 1.00 0.00 N ATOM 387 CA ASN A 25 2.295 5.820 12.737 1.00 0.00 C ATOM 388 C ASN A 25 2.547 7.235 12.190 1.00 0.00 C ATOM 389 O ASN A 25 2.429 8.208 12.910 1.00 0.00 O ATOM 390 CB ASN A 25 2.543 5.777 14.248 1.00 0.00 C ATOM 391 CG ASN A 25 1.696 4.664 14.875 1.00 0.00 C ATOM 392 OD1 ASN A 25 1.977 3.497 14.686 1.00 0.00 O ATOM 393 ND2 ASN A 25 0.662 4.970 15.622 1.00 0.00 N ATOM 0 H ASN A 25 4.238 4.968 12.456 1.00 0.00 H new ATOM 0 HA ASN A 25 1.266 5.563 12.487 1.00 0.00 H new ATOM 0 HB2 ASN A 25 3.600 5.601 14.449 1.00 0.00 H new ATOM 0 HB3 ASN A 25 2.289 6.738 14.696 1.00 0.00 H new ATOM 0 HD21 ASN A 25 0.099 4.230 16.041 1.00 0.00 H new ATOM 0 HD22 ASN A 25 0.421 5.948 15.784 1.00 0.00 H new ATOM 400 N GLU A 26 2.888 7.362 10.922 1.00 0.00 N ATOM 401 CA GLU A 26 3.139 8.724 10.348 1.00 0.00 C ATOM 402 C GLU A 26 3.087 8.678 8.809 1.00 0.00 C ATOM 403 O GLU A 26 3.668 7.805 8.194 1.00 0.00 O ATOM 404 CB GLU A 26 4.545 9.112 10.827 1.00 0.00 C ATOM 405 CG GLU A 26 4.491 10.456 11.560 1.00 0.00 C ATOM 406 CD GLU A 26 4.297 10.214 13.058 1.00 0.00 C ATOM 407 OE1 GLU A 26 5.124 9.532 13.641 1.00 0.00 O ATOM 408 OE2 GLU A 26 3.324 10.716 13.598 1.00 0.00 O ATOM 0 H GLU A 26 3.001 6.587 10.269 1.00 0.00 H new ATOM 0 HA GLU A 26 2.387 9.445 10.668 1.00 0.00 H new ATOM 0 HB2 GLU A 26 4.939 8.341 11.490 1.00 0.00 H new ATOM 0 HB3 GLU A 26 5.224 9.178 9.977 1.00 0.00 H new ATOM 0 HG2 GLU A 26 5.412 11.013 11.387 1.00 0.00 H new ATOM 0 HG3 GLU A 26 3.673 11.062 11.170 1.00 0.00 H new ATOM 415 N ASP A 27 2.393 9.608 8.180 1.00 0.00 N ATOM 416 CA ASP A 27 2.305 9.611 6.682 1.00 0.00 C ATOM 417 C ASP A 27 1.876 8.226 6.156 1.00 0.00 C ATOM 418 O ASP A 27 2.594 7.599 5.401 1.00 0.00 O ATOM 419 CB ASP A 27 3.715 9.962 6.197 1.00 0.00 C ATOM 420 CG ASP A 27 3.989 11.445 6.451 1.00 0.00 C ATOM 421 OD1 ASP A 27 4.362 11.776 7.565 1.00 0.00 O ATOM 422 OD2 ASP A 27 3.822 12.225 5.528 1.00 0.00 O ATOM 0 H ASP A 27 1.886 10.363 8.642 1.00 0.00 H new ATOM 0 HA ASP A 27 1.562 10.322 6.321 1.00 0.00 H new ATOM 0 HB2 ASP A 27 4.452 9.351 6.718 1.00 0.00 H new ATOM 0 HB3 ASP A 27 3.811 9.741 5.134 1.00 0.00 H new ATOM 427 N ILE A 28 0.717 7.741 6.553 1.00 0.00 N ATOM 428 CA ILE A 28 0.265 6.394 6.069 1.00 0.00 C ATOM 429 C ILE A 28 -0.755 6.534 4.918 1.00 0.00 C ATOM 430 O ILE A 28 -0.775 5.718 4.014 1.00 0.00 O ATOM 431 CB ILE A 28 -0.320 5.680 7.316 1.00 0.00 C ATOM 432 CG1 ILE A 28 -0.442 4.167 7.057 1.00 0.00 C ATOM 433 CG2 ILE A 28 -1.690 6.253 7.711 1.00 0.00 C ATOM 434 CD1 ILE A 28 -1.472 3.873 5.954 1.00 0.00 C ATOM 0 H ILE A 28 0.072 8.216 7.185 1.00 0.00 H new ATOM 0 HA ILE A 28 1.082 5.809 5.647 1.00 0.00 H new ATOM 0 HB ILE A 28 0.368 5.853 8.144 1.00 0.00 H new ATOM 0 HG12 ILE A 28 0.529 3.765 6.768 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -0.735 3.660 7.977 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -2.065 5.726 8.588 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -1.588 7.314 7.941 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -2.389 6.126 6.885 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -1.536 2.797 5.794 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -2.448 4.253 6.256 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -1.164 4.360 5.029 1.00 0.00 H new ATOM 446 N LYS A 29 -1.580 7.558 4.917 1.00 0.00 N ATOM 447 CA LYS A 29 -2.549 7.718 3.780 1.00 0.00 C ATOM 448 C LYS A 29 -1.836 8.414 2.614 1.00 0.00 C ATOM 449 O LYS A 29 -2.047 8.071 1.464 1.00 0.00 O ATOM 450 CB LYS A 29 -3.711 8.576 4.301 1.00 0.00 C ATOM 451 CG LYS A 29 -4.412 7.845 5.448 1.00 0.00 C ATOM 452 CD LYS A 29 -5.809 8.434 5.652 1.00 0.00 C ATOM 453 CE LYS A 29 -6.515 7.697 6.792 1.00 0.00 C ATOM 454 NZ LYS A 29 -7.475 8.688 7.353 1.00 0.00 N ATOM 0 H LYS A 29 -1.626 8.277 5.639 1.00 0.00 H new ATOM 0 HA LYS A 29 -2.923 6.758 3.424 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -3.339 9.541 4.645 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -4.419 8.775 3.496 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -4.484 6.781 5.225 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -3.829 7.940 6.364 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -5.736 9.497 5.882 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -6.390 8.346 4.734 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -7.032 6.809 6.428 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -5.804 7.365 7.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -7.998 8.256 8.141 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -6.954 9.520 7.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -8.144 8.981 6.612 1.00 0.00 H new ATOM 468 N TYR A 30 -0.971 9.372 2.895 1.00 0.00 N ATOM 469 CA TYR A 30 -0.233 10.053 1.778 1.00 0.00 C ATOM 470 C TYR A 30 0.833 9.110 1.190 1.00 0.00 C ATOM 471 O TYR A 30 1.154 9.204 0.021 1.00 0.00 O ATOM 472 CB TYR A 30 0.433 11.302 2.380 1.00 0.00 C ATOM 473 CG TYR A 30 -0.625 12.328 2.709 1.00 0.00 C ATOM 474 CD1 TYR A 30 -1.329 12.963 1.678 1.00 0.00 C ATOM 475 CD2 TYR A 30 -0.904 12.643 4.044 1.00 0.00 C ATOM 476 CE1 TYR A 30 -2.310 13.913 1.982 1.00 0.00 C ATOM 477 CE2 TYR A 30 -1.885 13.595 4.348 1.00 0.00 C ATOM 478 CZ TYR A 30 -2.588 14.230 3.317 1.00 0.00 C ATOM 479 OH TYR A 30 -3.554 15.168 3.616 1.00 0.00 O ATOM 0 H TYR A 30 -0.749 9.705 3.833 1.00 0.00 H new ATOM 0 HA TYR A 30 -0.913 10.325 0.970 1.00 0.00 H new ATOM 0 HB2 TYR A 30 0.987 11.034 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 30 1.152 11.719 1.675 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -1.114 12.719 0.648 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -0.363 12.152 4.839 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -2.853 14.402 1.187 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -2.099 13.839 5.378 1.00 0.00 H new ATOM 0 HH TYR A 30 -3.622 15.269 4.588 1.00 0.00 H new ATOM 489 N VAL A 31 1.384 8.197 1.977 1.00 0.00 N ATOM 490 CA VAL A 31 2.420 7.267 1.404 1.00 0.00 C ATOM 491 C VAL A 31 1.758 6.263 0.439 1.00 0.00 C ATOM 492 O VAL A 31 2.339 5.898 -0.565 1.00 0.00 O ATOM 493 CB VAL A 31 3.109 6.559 2.599 1.00 0.00 C ATOM 494 CG1 VAL A 31 2.184 5.515 3.239 1.00 0.00 C ATOM 495 CG2 VAL A 31 4.388 5.872 2.109 1.00 0.00 C ATOM 0 H VAL A 31 1.166 8.061 2.964 1.00 0.00 H new ATOM 0 HA VAL A 31 3.165 7.810 0.822 1.00 0.00 H new ATOM 0 HB VAL A 31 3.347 7.310 3.352 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.697 5.037 4.073 1.00 0.00 H new ATOM 0 HG12 VAL A 31 1.279 6.004 3.601 1.00 0.00 H new ATOM 0 HG13 VAL A 31 1.917 4.762 2.498 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.876 5.373 2.946 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.136 5.137 1.345 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.063 6.617 1.687 1.00 0.00 H new ATOM 505 N ALA A 32 0.545 5.823 0.724 1.00 0.00 N ATOM 506 CA ALA A 32 -0.128 4.852 -0.214 1.00 0.00 C ATOM 507 C ALA A 32 -0.382 5.529 -1.569 1.00 0.00 C ATOM 508 O ALA A 32 -0.238 4.912 -2.607 1.00 0.00 O ATOM 509 CB ALA A 32 -1.460 4.448 0.439 1.00 0.00 C ATOM 0 H ALA A 32 0.003 6.087 1.546 1.00 0.00 H new ATOM 0 HA ALA A 32 0.496 3.976 -0.389 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -1.983 3.743 -0.207 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -1.265 3.980 1.404 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -2.078 5.334 0.584 1.00 0.00 H new ATOM 515 N GLU A 33 -0.752 6.798 -1.575 1.00 0.00 N ATOM 516 CA GLU A 33 -0.999 7.495 -2.890 1.00 0.00 C ATOM 517 C GLU A 33 0.280 7.461 -3.737 1.00 0.00 C ATOM 518 O GLU A 33 0.242 7.139 -4.911 1.00 0.00 O ATOM 519 CB GLU A 33 -1.382 8.948 -2.563 1.00 0.00 C ATOM 520 CG GLU A 33 -2.836 9.001 -2.093 1.00 0.00 C ATOM 521 CD GLU A 33 -3.330 10.448 -2.120 1.00 0.00 C ATOM 522 OE1 GLU A 33 -3.032 11.137 -3.082 1.00 0.00 O ATOM 523 OE2 GLU A 33 -3.999 10.844 -1.179 1.00 0.00 O ATOM 0 H GLU A 33 -0.891 7.371 -0.743 1.00 0.00 H new ATOM 0 HA GLU A 33 -1.793 7.006 -3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -0.724 9.343 -1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.251 9.577 -3.444 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -3.460 8.381 -2.737 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.918 8.597 -1.084 1.00 0.00 H new ATOM 530 N TYR A 34 1.415 7.769 -3.147 1.00 0.00 N ATOM 531 CA TYR A 34 2.698 7.723 -3.935 1.00 0.00 C ATOM 532 C TYR A 34 2.960 6.278 -4.379 1.00 0.00 C ATOM 533 O TYR A 34 3.357 6.033 -5.503 1.00 0.00 O ATOM 534 CB TYR A 34 3.815 8.213 -2.992 1.00 0.00 C ATOM 535 CG TYR A 34 5.184 8.140 -3.658 1.00 0.00 C ATOM 536 CD1 TYR A 34 5.329 8.283 -5.052 1.00 0.00 C ATOM 537 CD2 TYR A 34 6.318 7.949 -2.860 1.00 0.00 C ATOM 538 CE1 TYR A 34 6.601 8.234 -5.632 1.00 0.00 C ATOM 539 CE2 TYR A 34 7.588 7.896 -3.443 1.00 0.00 C ATOM 540 CZ TYR A 34 7.730 8.040 -4.828 1.00 0.00 C ATOM 541 OH TYR A 34 8.984 7.998 -5.402 1.00 0.00 O ATOM 0 H TYR A 34 1.511 8.046 -2.170 1.00 0.00 H new ATOM 0 HA TYR A 34 2.652 8.349 -4.826 1.00 0.00 H new ATOM 0 HB2 TYR A 34 3.612 9.240 -2.689 1.00 0.00 H new ATOM 0 HB3 TYR A 34 3.818 7.608 -2.085 1.00 0.00 H new ATOM 0 HD1 TYR A 34 4.458 8.431 -5.673 1.00 0.00 H new ATOM 0 HD2 TYR A 34 6.212 7.842 -1.791 1.00 0.00 H new ATOM 0 HE1 TYR A 34 6.712 8.346 -6.700 1.00 0.00 H new ATOM 0 HE2 TYR A 34 8.460 7.744 -2.824 1.00 0.00 H new ATOM 0 HH TYR A 34 9.667 8.034 -4.700 1.00 0.00 H new ATOM 551 N ILE A 35 2.719 5.314 -3.512 1.00 0.00 N ATOM 552 CA ILE A 35 2.936 3.877 -3.909 1.00 0.00 C ATOM 553 C ILE A 35 2.045 3.556 -5.122 1.00 0.00 C ATOM 554 O ILE A 35 2.494 2.960 -6.083 1.00 0.00 O ATOM 555 CB ILE A 35 2.554 3.029 -2.677 1.00 0.00 C ATOM 556 CG1 ILE A 35 3.601 3.255 -1.583 1.00 0.00 C ATOM 557 CG2 ILE A 35 2.512 1.539 -3.026 1.00 0.00 C ATOM 558 CD1 ILE A 35 3.015 2.873 -0.225 1.00 0.00 C ATOM 0 H ILE A 35 2.386 5.457 -2.559 1.00 0.00 H new ATOM 0 HA ILE A 35 3.966 3.669 -4.199 1.00 0.00 H new ATOM 0 HB ILE A 35 1.564 3.332 -2.336 1.00 0.00 H new ATOM 0 HG12 ILE A 35 4.490 2.658 -1.788 1.00 0.00 H new ATOM 0 HG13 ILE A 35 3.913 4.299 -1.575 1.00 0.00 H new ATOM 0 HG21 ILE A 35 2.240 0.965 -2.140 1.00 0.00 H new ATOM 0 HG22 ILE A 35 1.773 1.369 -3.809 1.00 0.00 H new ATOM 0 HG23 ILE A 35 3.493 1.220 -3.378 1.00 0.00 H new ATOM 0 HD11 ILE A 35 3.762 3.035 0.552 1.00 0.00 H new ATOM 0 HD12 ILE A 35 2.139 3.489 -0.020 1.00 0.00 H new ATOM 0 HD13 ILE A 35 2.725 1.822 -0.236 1.00 0.00 H new ATOM 570 N VAL A 36 0.798 3.980 -5.100 1.00 0.00 N ATOM 571 CA VAL A 36 -0.093 3.719 -6.287 1.00 0.00 C ATOM 572 C VAL A 36 0.467 4.482 -7.495 1.00 0.00 C ATOM 573 O VAL A 36 0.514 3.961 -8.594 1.00 0.00 O ATOM 574 CB VAL A 36 -1.495 4.235 -5.918 1.00 0.00 C ATOM 575 CG1 VAL A 36 -2.450 4.027 -7.097 1.00 0.00 C ATOM 576 CG2 VAL A 36 -2.015 3.463 -4.703 1.00 0.00 C ATOM 0 H VAL A 36 0.364 4.486 -4.328 1.00 0.00 H new ATOM 0 HA VAL A 36 -0.140 2.660 -6.540 1.00 0.00 H new ATOM 0 HB VAL A 36 -1.438 5.298 -5.683 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -3.441 4.394 -6.831 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -2.081 4.574 -7.965 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -2.508 2.965 -7.335 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -3.008 3.826 -4.439 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.069 2.401 -4.942 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -1.339 3.611 -3.861 1.00 0.00 H new ATOM 586 N LEU A 37 0.919 5.710 -7.299 1.00 0.00 N ATOM 587 CA LEU A 37 1.505 6.482 -8.454 1.00 0.00 C ATOM 588 C LEU A 37 2.693 5.694 -9.026 1.00 0.00 C ATOM 589 O LEU A 37 2.830 5.558 -10.227 1.00 0.00 O ATOM 590 CB LEU A 37 1.987 7.833 -7.896 1.00 0.00 C ATOM 591 CG LEU A 37 1.880 8.904 -8.984 1.00 0.00 C ATOM 592 CD1 LEU A 37 1.493 10.241 -8.349 1.00 0.00 C ATOM 593 CD2 LEU A 37 3.231 9.049 -9.691 1.00 0.00 C ATOM 0 H LEU A 37 0.908 6.202 -6.405 1.00 0.00 H new ATOM 0 HA LEU A 37 0.773 6.636 -9.247 1.00 0.00 H new ATOM 0 HB2 LEU A 37 1.386 8.116 -7.032 1.00 0.00 H new ATOM 0 HB3 LEU A 37 3.018 7.750 -7.554 1.00 0.00 H new ATOM 0 HG LEU A 37 1.119 8.611 -9.707 1.00 0.00 H new ATOM 0 HD11 LEU A 37 1.417 11.003 -9.124 1.00 0.00 H new ATOM 0 HD12 LEU A 37 0.532 10.140 -7.844 1.00 0.00 H new ATOM 0 HD13 LEU A 37 2.254 10.534 -7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 37 3.156 9.812 -10.466 1.00 0.00 H new ATOM 0 HD22 LEU A 37 3.991 9.341 -8.967 1.00 0.00 H new ATOM 0 HD23 LEU A 37 3.509 8.097 -10.144 1.00 0.00 H new ATOM 605 N LEU A 38 3.536 5.144 -8.169 1.00 0.00 N ATOM 606 CA LEU A 38 4.691 4.333 -8.688 1.00 0.00 C ATOM 607 C LEU A 38 4.131 3.096 -9.412 1.00 0.00 C ATOM 608 O LEU A 38 4.582 2.737 -10.483 1.00 0.00 O ATOM 609 CB LEU A 38 5.522 3.898 -7.469 1.00 0.00 C ATOM 610 CG LEU A 38 6.107 5.130 -6.776 1.00 0.00 C ATOM 611 CD1 LEU A 38 6.338 4.819 -5.294 1.00 0.00 C ATOM 612 CD2 LEU A 38 7.438 5.499 -7.433 1.00 0.00 C ATOM 0 H LEU A 38 3.474 5.221 -7.154 1.00 0.00 H new ATOM 0 HA LEU A 38 5.307 4.903 -9.383 1.00 0.00 H new ATOM 0 HB2 LEU A 38 4.897 3.339 -6.772 1.00 0.00 H new ATOM 0 HB3 LEU A 38 6.324 3.231 -7.783 1.00 0.00 H new ATOM 0 HG LEU A 38 5.412 5.965 -6.868 1.00 0.00 H new ATOM 0 HD11 LEU A 38 6.755 5.696 -4.799 1.00 0.00 H new ATOM 0 HD12 LEU A 38 5.390 4.554 -4.826 1.00 0.00 H new ATOM 0 HD13 LEU A 38 7.034 3.985 -5.201 1.00 0.00 H new ATOM 0 HD21 LEU A 38 7.856 6.377 -6.940 1.00 0.00 H new ATOM 0 HD22 LEU A 38 8.133 4.665 -7.340 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.274 5.719 -8.488 1.00 0.00 H new ATOM 624 N ILE A 39 3.135 2.454 -8.834 1.00 0.00 N ATOM 625 CA ILE A 39 2.524 1.244 -9.498 1.00 0.00 C ATOM 626 C ILE A 39 1.933 1.660 -10.855 1.00 0.00 C ATOM 627 O ILE A 39 2.106 0.974 -11.845 1.00 0.00 O ATOM 628 CB ILE A 39 1.419 0.749 -8.533 1.00 0.00 C ATOM 629 CG1 ILE A 39 2.070 0.183 -7.256 1.00 0.00 C ATOM 630 CG2 ILE A 39 0.539 -0.322 -9.197 1.00 0.00 C ATOM 631 CD1 ILE A 39 2.790 -1.140 -7.551 1.00 0.00 C ATOM 0 H ILE A 39 2.720 2.712 -7.938 1.00 0.00 H new ATOM 0 HA ILE A 39 3.251 0.455 -9.687 1.00 0.00 H new ATOM 0 HB ILE A 39 0.780 1.594 -8.276 1.00 0.00 H new ATOM 0 HG12 ILE A 39 2.779 0.906 -6.853 1.00 0.00 H new ATOM 0 HG13 ILE A 39 1.308 0.025 -6.493 1.00 0.00 H new ATOM 0 HG21 ILE A 39 -0.227 -0.650 -8.495 1.00 0.00 H new ATOM 0 HG22 ILE A 39 0.063 0.097 -10.084 1.00 0.00 H new ATOM 0 HG23 ILE A 39 1.156 -1.173 -9.484 1.00 0.00 H new ATOM 0 HD11 ILE A 39 3.242 -1.521 -6.635 1.00 0.00 H new ATOM 0 HD12 ILE A 39 2.073 -1.868 -7.931 1.00 0.00 H new ATOM 0 HD13 ILE A 39 3.567 -0.973 -8.297 1.00 0.00 H new ATOM 643 N VAL A 40 1.250 2.781 -10.911 1.00 0.00 N ATOM 644 CA VAL A 40 0.668 3.232 -12.227 1.00 0.00 C ATOM 645 C VAL A 40 1.805 3.508 -13.229 1.00 0.00 C ATOM 646 O VAL A 40 1.655 3.274 -14.413 1.00 0.00 O ATOM 647 CB VAL A 40 -0.130 4.520 -11.946 1.00 0.00 C ATOM 648 CG1 VAL A 40 -0.764 5.034 -13.245 1.00 0.00 C ATOM 649 CG2 VAL A 40 -1.236 4.225 -10.922 1.00 0.00 C ATOM 0 H VAL A 40 1.070 3.397 -10.118 1.00 0.00 H new ATOM 0 HA VAL A 40 0.021 2.468 -12.659 1.00 0.00 H new ATOM 0 HB VAL A 40 0.544 5.279 -11.549 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -1.327 5.945 -13.040 1.00 0.00 H new ATOM 0 HG12 VAL A 40 0.019 5.248 -13.972 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -1.436 4.275 -13.647 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -1.800 5.136 -10.723 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -1.906 3.463 -11.320 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -0.788 3.867 -9.995 1.00 0.00 H new ATOM 659 N ASN A 41 2.940 4.002 -12.769 1.00 0.00 N ATOM 660 CA ASN A 41 4.071 4.285 -13.723 1.00 0.00 C ATOM 661 C ASN A 41 4.477 3.008 -14.473 1.00 0.00 C ATOM 662 O ASN A 41 4.807 3.060 -15.644 1.00 0.00 O ATOM 663 CB ASN A 41 5.250 4.799 -12.879 1.00 0.00 C ATOM 664 CG ASN A 41 5.166 6.325 -12.756 1.00 0.00 C ATOM 665 OD1 ASN A 41 5.459 7.034 -13.699 1.00 0.00 O ATOM 666 ND2 ASN A 41 4.775 6.871 -11.630 1.00 0.00 N ATOM 0 H ASN A 41 3.130 4.218 -11.790 1.00 0.00 H new ATOM 0 HA ASN A 41 3.770 5.021 -14.468 1.00 0.00 H new ATOM 0 HB2 ASN A 41 5.229 4.342 -11.890 1.00 0.00 H new ATOM 0 HB3 ASN A 41 6.194 4.513 -13.342 1.00 0.00 H new ATOM 0 HD21 ASN A 41 4.718 7.886 -11.548 1.00 0.00 H new ATOM 0 HD22 ASN A 41 4.528 6.281 -10.836 1.00 0.00 H new ATOM 673 N GLY A 42 4.460 1.861 -13.821 1.00 0.00 N ATOM 674 CA GLY A 42 4.854 0.600 -14.536 1.00 0.00 C ATOM 675 C GLY A 42 4.602 -0.628 -13.648 1.00 0.00 C ATOM 676 O GLY A 42 3.850 -1.513 -14.012 1.00 0.00 O ATOM 0 H GLY A 42 4.195 1.746 -12.843 1.00 0.00 H new ATOM 0 HA2 GLY A 42 4.286 0.508 -15.462 1.00 0.00 H new ATOM 0 HA3 GLY A 42 5.908 0.646 -14.811 1.00 0.00 H new ATOM 680 N GLY A 43 5.222 -0.689 -12.490 1.00 0.00 N ATOM 681 CA GLY A 43 5.009 -1.861 -11.591 1.00 0.00 C ATOM 682 C GLY A 43 6.327 -2.630 -11.409 1.00 0.00 C ATOM 683 O GLY A 43 6.389 -3.822 -11.643 1.00 0.00 O ATOM 0 H GLY A 43 5.862 0.021 -12.134 1.00 0.00 H new ATOM 0 HA2 GLY A 43 4.638 -1.525 -10.623 1.00 0.00 H new ATOM 0 HA3 GLY A 43 4.249 -2.520 -12.012 1.00 0.00 H new ATOM 687 N THR A 44 7.379 -1.966 -10.973 1.00 0.00 N ATOM 688 CA THR A 44 8.677 -2.666 -10.754 1.00 0.00 C ATOM 689 C THR A 44 9.030 -2.583 -9.261 1.00 0.00 C ATOM 690 O THR A 44 9.473 -1.558 -8.786 1.00 0.00 O ATOM 691 CB THR A 44 9.689 -1.900 -11.609 1.00 0.00 C ATOM 692 OG1 THR A 44 9.543 -0.504 -11.374 1.00 0.00 O ATOM 693 CG2 THR A 44 9.435 -2.201 -13.088 1.00 0.00 C ATOM 0 H THR A 44 7.387 -0.968 -10.761 1.00 0.00 H new ATOM 0 HA THR A 44 8.656 -3.721 -11.028 1.00 0.00 H new ATOM 0 HB THR A 44 10.701 -2.209 -11.345 1.00 0.00 H new ATOM 0 HG1 THR A 44 10.191 -0.011 -11.919 1.00 0.00 H new ATOM 0 HG21 THR A 44 10.155 -1.656 -13.699 1.00 0.00 H new ATOM 0 HG22 THR A 44 9.544 -3.271 -13.266 1.00 0.00 H new ATOM 0 HG23 THR A 44 8.425 -1.890 -13.354 1.00 0.00 H new ATOM 701 N VAL A 45 8.797 -3.642 -8.506 1.00 0.00 N ATOM 702 CA VAL A 45 9.083 -3.596 -7.018 1.00 0.00 C ATOM 703 C VAL A 45 10.490 -3.036 -6.729 1.00 0.00 C ATOM 704 O VAL A 45 10.684 -2.346 -5.747 1.00 0.00 O ATOM 705 CB VAL A 45 8.956 -5.042 -6.490 1.00 0.00 C ATOM 706 CG1 VAL A 45 9.293 -5.088 -4.993 1.00 0.00 C ATOM 707 CG2 VAL A 45 7.517 -5.533 -6.684 1.00 0.00 C ATOM 0 H VAL A 45 8.425 -4.528 -8.848 1.00 0.00 H new ATOM 0 HA VAL A 45 8.377 -2.932 -6.520 1.00 0.00 H new ATOM 0 HB VAL A 45 9.648 -5.679 -7.041 1.00 0.00 H new ATOM 0 HG11 VAL A 45 9.200 -6.112 -4.631 1.00 0.00 H new ATOM 0 HG12 VAL A 45 10.314 -4.739 -4.839 1.00 0.00 H new ATOM 0 HG13 VAL A 45 8.604 -4.445 -4.445 1.00 0.00 H new ATOM 0 HG21 VAL A 45 7.427 -6.553 -6.311 1.00 0.00 H new ATOM 0 HG22 VAL A 45 6.834 -4.885 -6.135 1.00 0.00 H new ATOM 0 HG23 VAL A 45 7.265 -5.510 -7.744 1.00 0.00 H new ATOM 717 N GLU A 46 11.469 -3.320 -7.556 1.00 0.00 N ATOM 718 CA GLU A 46 12.845 -2.780 -7.270 1.00 0.00 C ATOM 719 C GLU A 46 12.856 -1.259 -7.436 1.00 0.00 C ATOM 720 O GLU A 46 13.235 -0.543 -6.526 1.00 0.00 O ATOM 721 CB GLU A 46 13.807 -3.441 -8.269 1.00 0.00 C ATOM 722 CG GLU A 46 15.223 -3.443 -7.690 1.00 0.00 C ATOM 723 CD GLU A 46 16.242 -3.408 -8.830 1.00 0.00 C ATOM 724 OE1 GLU A 46 16.082 -4.176 -9.765 1.00 0.00 O ATOM 725 OE2 GLU A 46 17.166 -2.615 -8.749 1.00 0.00 O ATOM 0 H GLU A 46 11.383 -3.888 -8.399 1.00 0.00 H new ATOM 0 HA GLU A 46 13.148 -3.001 -6.247 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.487 -4.462 -8.477 1.00 0.00 H new ATOM 0 HB3 GLU A 46 13.791 -2.902 -9.216 1.00 0.00 H new ATOM 0 HG2 GLU A 46 15.362 -2.581 -7.038 1.00 0.00 H new ATOM 0 HG3 GLU A 46 15.376 -4.333 -7.079 1.00 0.00 H new ATOM 732 N SER A 47 12.424 -0.748 -8.569 1.00 0.00 N ATOM 733 CA SER A 47 12.404 0.747 -8.735 1.00 0.00 C ATOM 734 C SER A 47 11.290 1.348 -7.861 1.00 0.00 C ATOM 735 O SER A 47 11.419 2.453 -7.371 1.00 0.00 O ATOM 736 CB SER A 47 12.140 1.039 -10.220 1.00 0.00 C ATOM 737 OG SER A 47 12.998 2.090 -10.649 1.00 0.00 O ATOM 0 H SER A 47 12.091 -1.286 -9.369 1.00 0.00 H new ATOM 0 HA SER A 47 13.351 1.190 -8.426 1.00 0.00 H new ATOM 0 HB2 SER A 47 12.316 0.143 -10.816 1.00 0.00 H new ATOM 0 HB3 SER A 47 11.098 1.321 -10.368 1.00 0.00 H new ATOM 0 HG SER A 47 12.835 2.279 -11.597 1.00 0.00 H new ATOM 743 N VAL A 48 10.202 0.629 -7.648 1.00 0.00 N ATOM 744 CA VAL A 48 9.105 1.184 -6.787 1.00 0.00 C ATOM 745 C VAL A 48 9.536 1.160 -5.316 1.00 0.00 C ATOM 746 O VAL A 48 9.265 2.091 -4.586 1.00 0.00 O ATOM 747 CB VAL A 48 7.862 0.300 -7.010 1.00 0.00 C ATOM 748 CG1 VAL A 48 6.702 0.808 -6.149 1.00 0.00 C ATOM 749 CG2 VAL A 48 7.452 0.357 -8.484 1.00 0.00 C ATOM 0 H VAL A 48 10.032 -0.302 -8.028 1.00 0.00 H new ATOM 0 HA VAL A 48 8.883 2.219 -7.047 1.00 0.00 H new ATOM 0 HB VAL A 48 8.100 -0.726 -6.731 1.00 0.00 H new ATOM 0 HG11 VAL A 48 5.826 0.179 -6.311 1.00 0.00 H new ATOM 0 HG12 VAL A 48 6.986 0.771 -5.097 1.00 0.00 H new ATOM 0 HG13 VAL A 48 6.467 1.836 -6.425 1.00 0.00 H new ATOM 0 HG21 VAL A 48 6.573 -0.268 -8.642 1.00 0.00 H new ATOM 0 HG22 VAL A 48 7.219 1.386 -8.757 1.00 0.00 H new ATOM 0 HG23 VAL A 48 8.272 -0.006 -9.104 1.00 0.00 H new ATOM 759 N VAL A 49 10.219 0.121 -4.870 1.00 0.00 N ATOM 760 CA VAL A 49 10.658 0.104 -3.428 1.00 0.00 C ATOM 761 C VAL A 49 11.747 1.171 -3.217 1.00 0.00 C ATOM 762 O VAL A 49 11.770 1.836 -2.198 1.00 0.00 O ATOM 763 CB VAL A 49 11.183 -1.319 -3.129 1.00 0.00 C ATOM 764 CG1 VAL A 49 11.868 -1.364 -1.756 1.00 0.00 C ATOM 765 CG2 VAL A 49 10.005 -2.296 -3.121 1.00 0.00 C ATOM 0 H VAL A 49 10.485 -0.693 -5.424 1.00 0.00 H new ATOM 0 HA VAL A 49 9.838 0.338 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 49 11.905 -1.594 -3.898 1.00 0.00 H new ATOM 0 HG11 VAL A 49 12.231 -2.374 -1.563 1.00 0.00 H new ATOM 0 HG12 VAL A 49 12.707 -0.668 -1.745 1.00 0.00 H new ATOM 0 HG13 VAL A 49 11.153 -1.082 -0.983 1.00 0.00 H new ATOM 0 HG21 VAL A 49 10.368 -3.302 -2.911 1.00 0.00 H new ATOM 0 HG22 VAL A 49 9.292 -2.000 -2.352 1.00 0.00 H new ATOM 0 HG23 VAL A 49 9.515 -2.283 -4.095 1.00 0.00 H new ATOM 775 N ASP A 50 12.637 1.356 -4.172 1.00 0.00 N ATOM 776 CA ASP A 50 13.701 2.409 -3.998 1.00 0.00 C ATOM 777 C ASP A 50 13.048 3.791 -3.806 1.00 0.00 C ATOM 778 O ASP A 50 13.558 4.620 -3.074 1.00 0.00 O ATOM 779 CB ASP A 50 14.553 2.400 -5.278 1.00 0.00 C ATOM 780 CG ASP A 50 15.903 3.062 -4.998 1.00 0.00 C ATOM 781 OD1 ASP A 50 15.904 4.141 -4.429 1.00 0.00 O ATOM 782 OD2 ASP A 50 16.912 2.479 -5.357 1.00 0.00 O ATOM 0 H ASP A 50 12.674 0.835 -5.048 1.00 0.00 H new ATOM 0 HA ASP A 50 14.315 2.204 -3.121 1.00 0.00 H new ATOM 0 HB2 ASP A 50 14.702 1.376 -5.621 1.00 0.00 H new ATOM 0 HB3 ASP A 50 14.034 2.931 -6.076 1.00 0.00 H new ATOM 787 N GLU A 51 11.925 4.049 -4.451 1.00 0.00 N ATOM 788 CA GLU A 51 11.261 5.394 -4.282 1.00 0.00 C ATOM 789 C GLU A 51 10.753 5.559 -2.844 1.00 0.00 C ATOM 790 O GLU A 51 10.884 6.621 -2.262 1.00 0.00 O ATOM 791 CB GLU A 51 10.083 5.447 -5.270 1.00 0.00 C ATOM 792 CG GLU A 51 10.518 6.175 -6.544 1.00 0.00 C ATOM 793 CD GLU A 51 11.037 5.159 -7.563 1.00 0.00 C ATOM 794 OE1 GLU A 51 10.235 4.662 -8.336 1.00 0.00 O ATOM 795 OE2 GLU A 51 12.228 4.895 -7.551 1.00 0.00 O ATOM 0 H GLU A 51 11.447 3.400 -5.076 1.00 0.00 H new ATOM 0 HA GLU A 51 11.968 6.200 -4.479 1.00 0.00 H new ATOM 0 HB2 GLU A 51 9.751 4.437 -5.511 1.00 0.00 H new ATOM 0 HB3 GLU A 51 9.236 5.961 -4.816 1.00 0.00 H new ATOM 0 HG2 GLU A 51 9.678 6.729 -6.963 1.00 0.00 H new ATOM 0 HG3 GLU A 51 11.296 6.902 -6.312 1.00 0.00 H new ATOM 802 N LEU A 52 10.186 4.527 -2.257 1.00 0.00 N ATOM 803 CA LEU A 52 9.695 4.664 -0.841 1.00 0.00 C ATOM 804 C LEU A 52 10.906 4.743 0.092 1.00 0.00 C ATOM 805 O LEU A 52 10.926 5.536 1.009 1.00 0.00 O ATOM 806 CB LEU A 52 8.852 3.414 -0.506 1.00 0.00 C ATOM 807 CG LEU A 52 7.417 3.536 -1.054 1.00 0.00 C ATOM 808 CD1 LEU A 52 6.755 4.836 -0.579 1.00 0.00 C ATOM 809 CD2 LEU A 52 7.446 3.504 -2.581 1.00 0.00 C ATOM 0 H LEU A 52 10.043 3.612 -2.686 1.00 0.00 H new ATOM 0 HA LEU A 52 9.090 5.563 -0.720 1.00 0.00 H new ATOM 0 HB2 LEU A 52 9.329 2.529 -0.927 1.00 0.00 H new ATOM 0 HB3 LEU A 52 8.819 3.275 0.575 1.00 0.00 H new ATOM 0 HG LEU A 52 6.834 2.696 -0.678 1.00 0.00 H new ATOM 0 HD11 LEU A 52 5.743 4.897 -0.980 1.00 0.00 H new ATOM 0 HD12 LEU A 52 6.715 4.847 0.510 1.00 0.00 H new ATOM 0 HD13 LEU A 52 7.336 5.689 -0.929 1.00 0.00 H new ATOM 0 HD21 LEU A 52 6.430 3.590 -2.966 1.00 0.00 H new ATOM 0 HD22 LEU A 52 8.046 4.335 -2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 52 7.883 2.563 -2.917 1.00 0.00 H new ATOM 821 N ALA A 53 11.922 3.938 -0.139 1.00 0.00 N ATOM 822 CA ALA A 53 13.136 4.003 0.750 1.00 0.00 C ATOM 823 C ALA A 53 13.770 5.400 0.666 1.00 0.00 C ATOM 824 O ALA A 53 14.246 5.924 1.656 1.00 0.00 O ATOM 825 CB ALA A 53 14.122 2.940 0.239 1.00 0.00 C ATOM 0 H ALA A 53 11.965 3.250 -0.891 1.00 0.00 H new ATOM 0 HA ALA A 53 12.872 3.817 1.791 1.00 0.00 H new ATOM 0 HB1 ALA A 53 15.021 2.951 0.856 1.00 0.00 H new ATOM 0 HB2 ALA A 53 13.656 1.956 0.293 1.00 0.00 H new ATOM 0 HB3 ALA A 53 14.389 3.159 -0.795 1.00 0.00 H new ATOM 831 N SER A 54 13.778 6.014 -0.502 1.00 0.00 N ATOM 832 CA SER A 54 14.387 7.391 -0.617 1.00 0.00 C ATOM 833 C SER A 54 13.683 8.369 0.342 1.00 0.00 C ATOM 834 O SER A 54 14.314 9.244 0.904 1.00 0.00 O ATOM 835 CB SER A 54 14.188 7.845 -2.071 1.00 0.00 C ATOM 836 OG SER A 54 14.849 6.936 -2.941 1.00 0.00 O ATOM 0 H SER A 54 13.397 5.631 -1.367 1.00 0.00 H new ATOM 0 HA SER A 54 15.444 7.371 -0.353 1.00 0.00 H new ATOM 0 HB2 SER A 54 13.125 7.887 -2.309 1.00 0.00 H new ATOM 0 HB3 SER A 54 14.585 8.851 -2.208 1.00 0.00 H new ATOM 0 HG SER A 54 14.210 6.266 -3.261 1.00 0.00 H new ATOM 842 N LEU A 55 12.387 8.231 0.536 1.00 0.00 N ATOM 843 CA LEU A 55 11.667 9.166 1.467 1.00 0.00 C ATOM 844 C LEU A 55 11.473 8.510 2.843 1.00 0.00 C ATOM 845 O LEU A 55 11.652 9.144 3.866 1.00 0.00 O ATOM 846 CB LEU A 55 10.310 9.451 0.812 1.00 0.00 C ATOM 847 CG LEU A 55 10.512 10.339 -0.417 1.00 0.00 C ATOM 848 CD1 LEU A 55 9.390 10.084 -1.423 1.00 0.00 C ATOM 849 CD2 LEU A 55 10.489 11.809 0.010 1.00 0.00 C ATOM 0 H LEU A 55 11.803 7.520 0.095 1.00 0.00 H new ATOM 0 HA LEU A 55 12.233 10.084 1.628 1.00 0.00 H new ATOM 0 HB2 LEU A 55 9.830 8.516 0.523 1.00 0.00 H new ATOM 0 HB3 LEU A 55 9.647 9.943 1.524 1.00 0.00 H new ATOM 0 HG LEU A 55 11.472 10.107 -0.879 1.00 0.00 H new ATOM 0 HD11 LEU A 55 9.535 10.717 -2.298 1.00 0.00 H new ATOM 0 HD12 LEU A 55 9.404 9.037 -1.726 1.00 0.00 H new ATOM 0 HD13 LEU A 55 8.429 10.315 -0.963 1.00 0.00 H new ATOM 0 HD21 LEU A 55 10.633 12.444 -0.864 1.00 0.00 H new ATOM 0 HD22 LEU A 55 9.529 12.039 0.472 1.00 0.00 H new ATOM 0 HD23 LEU A 55 11.289 11.992 0.727 1.00 0.00 H new ATOM 861 N PHE A 56 11.117 7.245 2.879 1.00 0.00 N ATOM 862 CA PHE A 56 10.922 6.550 4.189 1.00 0.00 C ATOM 863 C PHE A 56 12.083 5.573 4.424 1.00 0.00 C ATOM 864 O PHE A 56 11.925 4.373 4.292 1.00 0.00 O ATOM 865 CB PHE A 56 9.592 5.786 4.069 1.00 0.00 C ATOM 866 CG PHE A 56 8.482 6.734 3.675 1.00 0.00 C ATOM 867 CD1 PHE A 56 8.046 7.717 4.570 1.00 0.00 C ATOM 868 CD2 PHE A 56 7.895 6.632 2.407 1.00 0.00 C ATOM 869 CE1 PHE A 56 7.021 8.597 4.199 1.00 0.00 C ATOM 870 CE2 PHE A 56 6.874 7.511 2.037 1.00 0.00 C ATOM 871 CZ PHE A 56 6.435 8.492 2.932 1.00 0.00 C ATOM 0 H PHE A 56 10.954 6.666 2.055 1.00 0.00 H new ATOM 0 HA PHE A 56 10.899 7.248 5.026 1.00 0.00 H new ATOM 0 HB2 PHE A 56 9.685 4.993 3.326 1.00 0.00 H new ATOM 0 HB3 PHE A 56 9.352 5.307 5.018 1.00 0.00 H new ATOM 0 HD1 PHE A 56 8.500 7.797 5.547 1.00 0.00 H new ATOM 0 HD2 PHE A 56 8.232 5.874 1.715 1.00 0.00 H new ATOM 0 HE1 PHE A 56 6.683 9.356 4.890 1.00 0.00 H new ATOM 0 HE2 PHE A 56 6.423 7.433 1.059 1.00 0.00 H new ATOM 0 HZ PHE A 56 5.644 9.169 2.646 1.00 0.00 H new ATOM 881 N ASP A 57 13.251 6.073 4.779 1.00 0.00 N ATOM 882 CA ASP A 57 14.412 5.154 5.024 1.00 0.00 C ATOM 883 C ASP A 57 14.623 4.924 6.535 1.00 0.00 C ATOM 884 O ASP A 57 15.727 4.649 6.966 1.00 0.00 O ATOM 885 CB ASP A 57 15.632 5.853 4.415 1.00 0.00 C ATOM 886 CG ASP A 57 16.604 4.803 3.873 1.00 0.00 C ATOM 887 OD1 ASP A 57 16.220 4.078 2.972 1.00 0.00 O ATOM 888 OD2 ASP A 57 17.717 4.742 4.371 1.00 0.00 O ATOM 0 H ASP A 57 13.446 7.066 4.908 1.00 0.00 H new ATOM 0 HA ASP A 57 14.242 4.174 4.578 1.00 0.00 H new ATOM 0 HB2 ASP A 57 15.319 6.522 3.614 1.00 0.00 H new ATOM 0 HB3 ASP A 57 16.126 6.467 5.168 1.00 0.00 H new ATOM 893 N SER A 58 13.581 5.015 7.343 1.00 0.00 N ATOM 894 CA SER A 58 13.756 4.780 8.816 1.00 0.00 C ATOM 895 C SER A 58 13.388 3.327 9.175 1.00 0.00 C ATOM 896 O SER A 58 13.994 2.736 10.051 1.00 0.00 O ATOM 897 CB SER A 58 12.810 5.762 9.518 1.00 0.00 C ATOM 898 OG SER A 58 11.673 5.989 8.695 1.00 0.00 O ATOM 0 H SER A 58 12.631 5.239 7.047 1.00 0.00 H new ATOM 0 HA SER A 58 14.790 4.935 9.125 1.00 0.00 H new ATOM 0 HB2 SER A 58 12.500 5.360 10.483 1.00 0.00 H new ATOM 0 HB3 SER A 58 13.324 6.703 9.715 1.00 0.00 H new ATOM 0 HG SER A 58 11.066 6.615 9.142 1.00 0.00 H new ATOM 904 N VAL A 59 12.412 2.741 8.510 1.00 0.00 N ATOM 905 CA VAL A 59 12.034 1.322 8.829 1.00 0.00 C ATOM 906 C VAL A 59 12.778 0.349 7.899 1.00 0.00 C ATOM 907 O VAL A 59 13.179 0.712 6.810 1.00 0.00 O ATOM 908 CB VAL A 59 10.505 1.217 8.641 1.00 0.00 C ATOM 909 CG1 VAL A 59 10.111 1.447 7.174 1.00 0.00 C ATOM 910 CG2 VAL A 59 10.040 -0.175 9.072 1.00 0.00 C ATOM 0 H VAL A 59 11.867 3.180 7.768 1.00 0.00 H new ATOM 0 HA VAL A 59 12.311 1.057 9.849 1.00 0.00 H new ATOM 0 HB VAL A 59 10.029 1.984 9.252 1.00 0.00 H new ATOM 0 HG11 VAL A 59 9.029 1.367 7.071 1.00 0.00 H new ATOM 0 HG12 VAL A 59 10.433 2.441 6.862 1.00 0.00 H new ATOM 0 HG13 VAL A 59 10.591 0.697 6.546 1.00 0.00 H new ATOM 0 HG21 VAL A 59 8.961 -0.255 8.941 1.00 0.00 H new ATOM 0 HG22 VAL A 59 10.536 -0.930 8.462 1.00 0.00 H new ATOM 0 HG23 VAL A 59 10.291 -0.334 10.121 1.00 0.00 H new ATOM 920 N SER A 60 12.974 -0.884 8.324 1.00 0.00 N ATOM 921 CA SER A 60 13.711 -1.876 7.453 1.00 0.00 C ATOM 922 C SER A 60 13.082 -1.950 6.048 1.00 0.00 C ATOM 923 O SER A 60 11.880 -1.854 5.899 1.00 0.00 O ATOM 924 CB SER A 60 13.595 -3.242 8.147 1.00 0.00 C ATOM 925 OG SER A 60 14.618 -3.359 9.127 1.00 0.00 O ATOM 0 H SER A 60 12.661 -1.246 9.225 1.00 0.00 H new ATOM 0 HA SER A 60 14.751 -1.575 7.329 1.00 0.00 H new ATOM 0 HB2 SER A 60 12.615 -3.344 8.614 1.00 0.00 H new ATOM 0 HB3 SER A 60 13.684 -4.044 7.414 1.00 0.00 H new ATOM 0 HG SER A 60 14.546 -4.229 9.573 1.00 0.00 H new ATOM 931 N ARG A 61 13.889 -2.125 5.016 1.00 0.00 N ATOM 932 CA ARG A 61 13.324 -2.207 3.617 1.00 0.00 C ATOM 933 C ARG A 61 12.207 -3.266 3.530 1.00 0.00 C ATOM 934 O ARG A 61 11.291 -3.132 2.740 1.00 0.00 O ATOM 935 CB ARG A 61 14.497 -2.577 2.685 1.00 0.00 C ATOM 936 CG ARG A 61 15.067 -3.948 3.063 1.00 0.00 C ATOM 937 CD ARG A 61 14.285 -5.048 2.337 1.00 0.00 C ATOM 938 NE ARG A 61 15.235 -5.602 1.332 1.00 0.00 N ATOM 939 CZ ARG A 61 15.690 -6.818 1.466 1.00 0.00 C ATOM 940 NH1 ARG A 61 16.371 -7.146 2.530 1.00 0.00 N ATOM 941 NH2 ARG A 61 15.466 -7.705 0.535 1.00 0.00 N ATOM 0 H ARG A 61 14.903 -2.214 5.080 1.00 0.00 H new ATOM 0 HA ARG A 61 12.877 -1.256 3.328 1.00 0.00 H new ATOM 0 HB2 ARG A 61 14.157 -2.590 1.650 1.00 0.00 H new ATOM 0 HB3 ARG A 61 15.278 -1.820 2.754 1.00 0.00 H new ATOM 0 HG2 ARG A 61 16.122 -4.001 2.795 1.00 0.00 H new ATOM 0 HG3 ARG A 61 15.004 -4.094 4.141 1.00 0.00 H new ATOM 0 HD2 ARG A 61 13.952 -5.819 3.032 1.00 0.00 H new ATOM 0 HD3 ARG A 61 13.393 -4.646 1.856 1.00 0.00 H new ATOM 0 HE ARG A 61 15.530 -5.031 0.540 1.00 0.00 H new ATOM 0 HH11 ARG A 61 16.547 -6.452 3.257 1.00 0.00 H new ATOM 0 HH12 ARG A 61 16.727 -8.096 2.635 1.00 0.00 H new ATOM 0 HH21 ARG A 61 14.935 -7.448 -0.297 1.00 0.00 H new ATOM 0 HH22 ARG A 61 15.822 -8.655 0.640 1.00 0.00 H new ATOM 955 N ASP A 62 12.269 -4.314 4.328 1.00 0.00 N ATOM 956 CA ASP A 62 11.187 -5.366 4.262 1.00 0.00 C ATOM 957 C ASP A 62 9.810 -4.737 4.529 1.00 0.00 C ATOM 958 O ASP A 62 8.829 -5.117 3.917 1.00 0.00 O ATOM 959 CB ASP A 62 11.511 -6.407 5.346 1.00 0.00 C ATOM 960 CG ASP A 62 10.585 -7.615 5.187 1.00 0.00 C ATOM 961 OD1 ASP A 62 10.917 -8.492 4.406 1.00 0.00 O ATOM 962 OD2 ASP A 62 9.560 -7.643 5.848 1.00 0.00 O ATOM 0 H ASP A 62 13.007 -4.487 5.011 1.00 0.00 H new ATOM 0 HA ASP A 62 11.154 -5.825 3.274 1.00 0.00 H new ATOM 0 HB2 ASP A 62 12.552 -6.720 5.265 1.00 0.00 H new ATOM 0 HB3 ASP A 62 11.387 -5.968 6.336 1.00 0.00 H new ATOM 967 N THR A 63 9.725 -3.776 5.425 1.00 0.00 N ATOM 968 CA THR A 63 8.390 -3.136 5.700 1.00 0.00 C ATOM 969 C THR A 63 7.945 -2.333 4.470 1.00 0.00 C ATOM 970 O THR A 63 6.793 -2.381 4.080 1.00 0.00 O ATOM 971 CB THR A 63 8.577 -2.211 6.921 1.00 0.00 C ATOM 972 OG1 THR A 63 8.948 -2.994 8.051 1.00 0.00 O ATOM 973 CG2 THR A 63 7.268 -1.477 7.223 1.00 0.00 C ATOM 0 H THR A 63 10.507 -3.411 5.970 1.00 0.00 H new ATOM 0 HA THR A 63 7.622 -3.882 5.906 1.00 0.00 H new ATOM 0 HB THR A 63 9.357 -1.481 6.703 1.00 0.00 H new ATOM 0 HG1 THR A 63 8.619 -2.565 8.868 1.00 0.00 H new ATOM 0 HG21 THR A 63 7.407 -0.826 8.086 1.00 0.00 H new ATOM 0 HG22 THR A 63 6.979 -0.878 6.359 1.00 0.00 H new ATOM 0 HG23 THR A 63 6.485 -2.204 7.439 1.00 0.00 H new ATOM 981 N LEU A 64 8.848 -1.609 3.844 1.00 0.00 N ATOM 982 CA LEU A 64 8.451 -0.825 2.623 1.00 0.00 C ATOM 983 C LEU A 64 8.142 -1.802 1.483 1.00 0.00 C ATOM 984 O LEU A 64 7.161 -1.648 0.779 1.00 0.00 O ATOM 985 CB LEU A 64 9.646 0.071 2.252 1.00 0.00 C ATOM 986 CG LEU A 64 10.023 0.965 3.448 1.00 0.00 C ATOM 987 CD1 LEU A 64 11.460 0.668 3.885 1.00 0.00 C ATOM 988 CD2 LEU A 64 9.917 2.440 3.047 1.00 0.00 C ATOM 0 H LEU A 64 9.827 -1.527 4.119 1.00 0.00 H new ATOM 0 HA LEU A 64 7.565 -0.216 2.806 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.498 -0.545 1.965 1.00 0.00 H new ATOM 0 HB3 LEU A 64 9.394 0.689 1.390 1.00 0.00 H new ATOM 0 HG LEU A 64 9.340 0.759 4.272 1.00 0.00 H new ATOM 0 HD11 LEU A 64 11.722 1.303 4.731 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.542 -0.379 4.178 1.00 0.00 H new ATOM 0 HD13 LEU A 64 12.141 0.868 3.057 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.185 3.068 3.897 1.00 0.00 H new ATOM 0 HD22 LEU A 64 10.596 2.642 2.218 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.895 2.661 2.740 1.00 0.00 H new ATOM 1000 N ALA A 65 8.961 -2.819 1.307 1.00 0.00 N ATOM 1001 CA ALA A 65 8.682 -3.816 0.211 1.00 0.00 C ATOM 1002 C ALA A 65 7.322 -4.491 0.451 1.00 0.00 C ATOM 1003 O ALA A 65 6.601 -4.780 -0.486 1.00 0.00 O ATOM 1004 CB ALA A 65 9.809 -4.861 0.263 1.00 0.00 C ATOM 0 H ALA A 65 9.796 -3.002 1.863 1.00 0.00 H new ATOM 0 HA ALA A 65 8.647 -3.330 -0.764 1.00 0.00 H new ATOM 0 HB1 ALA A 65 9.650 -5.607 -0.515 1.00 0.00 H new ATOM 0 HB2 ALA A 65 10.769 -4.369 0.103 1.00 0.00 H new ATOM 0 HB3 ALA A 65 9.809 -5.348 1.238 1.00 0.00 H new ATOM 1010 N ASN A 66 6.958 -4.744 1.695 1.00 0.00 N ATOM 1011 CA ASN A 66 5.628 -5.404 1.965 1.00 0.00 C ATOM 1012 C ASN A 66 4.486 -4.541 1.402 1.00 0.00 C ATOM 1013 O ASN A 66 3.532 -5.060 0.853 1.00 0.00 O ATOM 1014 CB ASN A 66 5.493 -5.527 3.491 1.00 0.00 C ATOM 1015 CG ASN A 66 4.344 -6.485 3.828 1.00 0.00 C ATOM 1016 OD1 ASN A 66 3.352 -6.079 4.398 1.00 0.00 O ATOM 1017 ND2 ASN A 66 4.432 -7.752 3.502 1.00 0.00 N ATOM 0 H ASN A 66 7.514 -4.526 2.522 1.00 0.00 H new ATOM 0 HA ASN A 66 5.574 -6.382 1.488 1.00 0.00 H new ATOM 0 HB2 ASN A 66 6.425 -5.895 3.921 1.00 0.00 H new ATOM 0 HB3 ASN A 66 5.304 -4.547 3.930 1.00 0.00 H new ATOM 0 HD21 ASN A 66 3.669 -8.391 3.727 1.00 0.00 H new ATOM 0 HD22 ASN A 66 5.263 -8.099 3.023 1.00 0.00 H new ATOM 1024 N VAL A 67 4.573 -3.229 1.523 1.00 0.00 N ATOM 1025 CA VAL A 67 3.472 -2.360 0.970 1.00 0.00 C ATOM 1026 C VAL A 67 3.520 -2.369 -0.568 1.00 0.00 C ATOM 1027 O VAL A 67 2.492 -2.354 -1.218 1.00 0.00 O ATOM 1028 CB VAL A 67 3.702 -0.943 1.520 1.00 0.00 C ATOM 1029 CG1 VAL A 67 2.604 -0.008 1.006 1.00 0.00 C ATOM 1030 CG2 VAL A 67 3.658 -0.983 3.051 1.00 0.00 C ATOM 0 H VAL A 67 5.342 -2.731 1.971 1.00 0.00 H new ATOM 0 HA VAL A 67 2.489 -2.726 1.267 1.00 0.00 H new ATOM 0 HB VAL A 67 4.674 -0.577 1.188 1.00 0.00 H new ATOM 0 HG11 VAL A 67 2.769 0.996 1.397 1.00 0.00 H new ATOM 0 HG12 VAL A 67 2.629 0.018 -0.083 1.00 0.00 H new ATOM 0 HG13 VAL A 67 1.632 -0.372 1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 67 3.821 0.020 3.446 1.00 0.00 H new ATOM 0 HG22 VAL A 67 2.684 -1.348 3.378 1.00 0.00 H new ATOM 0 HG23 VAL A 67 4.438 -1.649 3.420 1.00 0.00 H new ATOM 1040 N VAL A 68 4.696 -2.416 -1.164 1.00 0.00 N ATOM 1041 CA VAL A 68 4.759 -2.459 -2.667 1.00 0.00 C ATOM 1042 C VAL A 68 4.272 -3.836 -3.157 1.00 0.00 C ATOM 1043 O VAL A 68 3.659 -3.938 -4.203 1.00 0.00 O ATOM 1044 CB VAL A 68 6.229 -2.236 -3.061 1.00 0.00 C ATOM 1045 CG1 VAL A 68 6.358 -2.238 -4.586 1.00 0.00 C ATOM 1046 CG2 VAL A 68 6.705 -0.885 -2.516 1.00 0.00 C ATOM 0 H VAL A 68 5.597 -2.426 -0.686 1.00 0.00 H new ATOM 0 HA VAL A 68 4.125 -1.695 -3.117 1.00 0.00 H new ATOM 0 HB VAL A 68 6.839 -3.036 -2.642 1.00 0.00 H new ATOM 0 HG11 VAL A 68 7.400 -2.080 -4.863 1.00 0.00 H new ATOM 0 HG12 VAL A 68 6.020 -3.197 -4.979 1.00 0.00 H new ATOM 0 HG13 VAL A 68 5.746 -1.439 -5.004 1.00 0.00 H new ATOM 0 HG21 VAL A 68 7.747 -0.727 -2.795 1.00 0.00 H new ATOM 0 HG22 VAL A 68 6.092 -0.087 -2.935 1.00 0.00 H new ATOM 0 HG23 VAL A 68 6.615 -0.879 -1.430 1.00 0.00 H new ATOM 1056 N GLN A 69 4.531 -4.900 -2.411 1.00 0.00 N ATOM 1057 CA GLN A 69 4.061 -6.259 -2.861 1.00 0.00 C ATOM 1058 C GLN A 69 2.527 -6.316 -2.862 1.00 0.00 C ATOM 1059 O GLN A 69 1.932 -6.877 -3.764 1.00 0.00 O ATOM 1060 CB GLN A 69 4.630 -7.281 -1.865 1.00 0.00 C ATOM 1061 CG GLN A 69 6.080 -7.602 -2.233 1.00 0.00 C ATOM 1062 CD GLN A 69 6.496 -8.923 -1.572 1.00 0.00 C ATOM 1063 OE1 GLN A 69 7.001 -8.925 -0.467 1.00 0.00 O ATOM 1064 NE2 GLN A 69 6.305 -10.058 -2.201 1.00 0.00 N ATOM 0 H GLN A 69 5.038 -4.884 -1.526 1.00 0.00 H new ATOM 0 HA GLN A 69 4.401 -6.473 -3.874 1.00 0.00 H new ATOM 0 HB2 GLN A 69 4.581 -6.883 -0.852 1.00 0.00 H new ATOM 0 HB3 GLN A 69 4.030 -8.191 -1.879 1.00 0.00 H new ATOM 0 HG2 GLN A 69 6.184 -7.676 -3.316 1.00 0.00 H new ATOM 0 HG3 GLN A 69 6.737 -6.796 -1.905 1.00 0.00 H new ATOM 0 HE21 GLN A 69 5.881 -10.062 -3.129 1.00 0.00 H new ATOM 0 HE22 GLN A 69 6.580 -10.937 -1.762 1.00 0.00 H new ATOM 1073 N THR A 70 1.876 -5.743 -1.868 1.00 0.00 N ATOM 1074 CA THR A 70 0.367 -5.785 -1.856 1.00 0.00 C ATOM 1075 C THR A 70 -0.208 -4.965 -3.027 1.00 0.00 C ATOM 1076 O THR A 70 -1.276 -5.274 -3.524 1.00 0.00 O ATOM 1077 CB THR A 70 -0.107 -5.229 -0.498 1.00 0.00 C ATOM 1078 OG1 THR A 70 -1.524 -5.289 -0.437 1.00 0.00 O ATOM 1079 CG2 THR A 70 0.346 -3.780 -0.322 1.00 0.00 C ATOM 0 H THR A 70 2.310 -5.259 -1.082 1.00 0.00 H new ATOM 0 HA THR A 70 0.012 -6.808 -1.981 1.00 0.00 H new ATOM 0 HB THR A 70 0.328 -5.831 0.300 1.00 0.00 H new ATOM 0 HG1 THR A 70 -1.829 -4.938 0.425 1.00 0.00 H new ATOM 0 HG21 THR A 70 0.002 -3.406 0.642 1.00 0.00 H new ATOM 0 HG22 THR A 70 1.434 -3.731 -0.363 1.00 0.00 H new ATOM 0 HG23 THR A 70 -0.074 -3.168 -1.120 1.00 0.00 H new ATOM 1087 N ALA A 71 0.490 -3.945 -3.500 1.00 0.00 N ATOM 1088 CA ALA A 71 -0.049 -3.160 -4.667 1.00 0.00 C ATOM 1089 C ALA A 71 0.128 -3.978 -5.960 1.00 0.00 C ATOM 1090 O ALA A 71 -0.693 -3.905 -6.855 1.00 0.00 O ATOM 1091 CB ALA A 71 0.756 -1.849 -4.750 1.00 0.00 C ATOM 0 H ALA A 71 1.389 -3.630 -3.136 1.00 0.00 H new ATOM 0 HA ALA A 71 -1.110 -2.945 -4.541 1.00 0.00 H new ATOM 0 HB1 ALA A 71 0.393 -1.252 -5.586 1.00 0.00 H new ATOM 0 HB2 ALA A 71 0.634 -1.288 -3.823 1.00 0.00 H new ATOM 0 HB3 ALA A 71 1.811 -2.079 -4.899 1.00 0.00 H new ATOM 1097 N PHE A 72 1.182 -4.775 -6.062 1.00 0.00 N ATOM 1098 CA PHE A 72 1.367 -5.603 -7.305 1.00 0.00 C ATOM 1099 C PHE A 72 0.260 -6.662 -7.356 1.00 0.00 C ATOM 1100 O PHE A 72 -0.360 -6.868 -8.381 1.00 0.00 O ATOM 1101 CB PHE A 72 2.745 -6.281 -7.191 1.00 0.00 C ATOM 1102 CG PHE A 72 3.824 -5.349 -7.694 1.00 0.00 C ATOM 1103 CD1 PHE A 72 3.946 -4.057 -7.165 1.00 0.00 C ATOM 1104 CD2 PHE A 72 4.710 -5.782 -8.688 1.00 0.00 C ATOM 1105 CE1 PHE A 72 4.949 -3.203 -7.629 1.00 0.00 C ATOM 1106 CE2 PHE A 72 5.713 -4.925 -9.152 1.00 0.00 C ATOM 1107 CZ PHE A 72 5.832 -3.635 -8.621 1.00 0.00 C ATOM 0 H PHE A 72 1.906 -4.884 -5.351 1.00 0.00 H new ATOM 0 HA PHE A 72 1.315 -4.997 -8.209 1.00 0.00 H new ATOM 0 HB2 PHE A 72 2.941 -6.552 -6.154 1.00 0.00 H new ATOM 0 HB3 PHE A 72 2.753 -7.205 -7.769 1.00 0.00 H new ATOM 0 HD1 PHE A 72 3.264 -3.721 -6.398 1.00 0.00 H new ATOM 0 HD2 PHE A 72 4.619 -6.778 -9.096 1.00 0.00 H new ATOM 0 HE1 PHE A 72 5.042 -2.208 -7.220 1.00 0.00 H new ATOM 0 HE2 PHE A 72 6.396 -5.258 -9.920 1.00 0.00 H new ATOM 0 HZ PHE A 72 6.607 -2.974 -8.979 1.00 0.00 H new ATOM 1117 N PHE A 73 -0.010 -7.324 -6.244 1.00 0.00 N ATOM 1118 CA PHE A 73 -1.107 -8.355 -6.243 1.00 0.00 C ATOM 1119 C PHE A 73 -2.443 -7.663 -6.550 1.00 0.00 C ATOM 1120 O PHE A 73 -3.255 -8.184 -7.292 1.00 0.00 O ATOM 1121 CB PHE A 73 -1.137 -8.972 -4.835 1.00 0.00 C ATOM 1122 CG PHE A 73 -0.009 -9.966 -4.697 1.00 0.00 C ATOM 1123 CD1 PHE A 73 0.057 -11.073 -5.552 1.00 0.00 C ATOM 1124 CD2 PHE A 73 0.972 -9.779 -3.715 1.00 0.00 C ATOM 1125 CE1 PHE A 73 1.104 -11.994 -5.425 1.00 0.00 C ATOM 1126 CE2 PHE A 73 2.019 -10.701 -3.588 1.00 0.00 C ATOM 1127 CZ PHE A 73 2.085 -11.808 -4.443 1.00 0.00 C ATOM 0 H PHE A 73 0.473 -7.197 -5.355 1.00 0.00 H new ATOM 0 HA PHE A 73 -0.938 -9.126 -6.994 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -1.041 -8.190 -4.082 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -2.094 -9.465 -4.663 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -0.700 -11.216 -6.309 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.921 -8.925 -3.056 1.00 0.00 H new ATOM 0 HE1 PHE A 73 1.155 -12.848 -6.084 1.00 0.00 H new ATOM 0 HE2 PHE A 73 2.775 -10.558 -2.831 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.893 -12.518 -4.345 1.00 0.00 H new ATOM 1137 N ALA A 74 -2.676 -6.485 -5.998 1.00 0.00 N ATOM 1138 CA ALA A 74 -3.969 -5.765 -6.287 1.00 0.00 C ATOM 1139 C ALA A 74 -4.120 -5.547 -7.801 1.00 0.00 C ATOM 1140 O ALA A 74 -5.208 -5.649 -8.335 1.00 0.00 O ATOM 1141 CB ALA A 74 -3.899 -4.411 -5.562 1.00 0.00 C ATOM 0 H ALA A 74 -2.037 -5.998 -5.370 1.00 0.00 H new ATOM 0 HA ALA A 74 -4.826 -6.345 -5.944 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -4.818 -3.853 -5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -3.781 -4.577 -4.491 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -3.048 -3.841 -5.936 1.00 0.00 H new ATOM 1147 N LEU A 75 -3.039 -5.252 -8.503 1.00 0.00 N ATOM 1148 CA LEU A 75 -3.153 -5.039 -9.995 1.00 0.00 C ATOM 1149 C LEU A 75 -3.790 -6.274 -10.650 1.00 0.00 C ATOM 1150 O LEU A 75 -4.628 -6.152 -11.524 1.00 0.00 O ATOM 1151 CB LEU A 75 -1.724 -4.829 -10.542 1.00 0.00 C ATOM 1152 CG LEU A 75 -1.458 -3.335 -10.789 1.00 0.00 C ATOM 1153 CD1 LEU A 75 -2.469 -2.775 -11.804 1.00 0.00 C ATOM 1154 CD2 LEU A 75 -1.567 -2.569 -9.465 1.00 0.00 C ATOM 0 H LEU A 75 -2.100 -5.151 -8.117 1.00 0.00 H new ATOM 0 HA LEU A 75 -3.779 -4.175 -10.216 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.995 -5.222 -9.833 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -1.598 -5.386 -11.471 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.454 -3.214 -11.195 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -2.270 -1.716 -11.970 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -2.375 -3.314 -12.747 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -3.480 -2.897 -11.416 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -1.378 -1.510 -9.641 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -2.568 -2.696 -9.053 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -0.832 -2.956 -8.759 1.00 0.00 H new ATOM 1166 N GLU A 76 -3.414 -7.461 -10.224 1.00 0.00 N ATOM 1167 CA GLU A 76 -4.031 -8.696 -10.826 1.00 0.00 C ATOM 1168 C GLU A 76 -5.496 -8.795 -10.380 1.00 0.00 C ATOM 1169 O GLU A 76 -6.367 -9.113 -11.168 1.00 0.00 O ATOM 1170 CB GLU A 76 -3.228 -9.899 -10.306 1.00 0.00 C ATOM 1171 CG GLU A 76 -3.658 -11.162 -11.055 1.00 0.00 C ATOM 1172 CD GLU A 76 -2.789 -12.340 -10.612 1.00 0.00 C ATOM 1173 OE1 GLU A 76 -3.066 -12.891 -9.559 1.00 0.00 O ATOM 1174 OE2 GLU A 76 -1.863 -12.672 -11.333 1.00 0.00 O ATOM 0 H GLU A 76 -2.718 -7.629 -9.497 1.00 0.00 H new ATOM 0 HA GLU A 76 -4.007 -8.667 -11.915 1.00 0.00 H new ATOM 0 HB2 GLU A 76 -2.161 -9.726 -10.446 1.00 0.00 H new ATOM 0 HB3 GLU A 76 -3.392 -10.024 -9.236 1.00 0.00 H new ATOM 0 HG2 GLU A 76 -4.708 -11.376 -10.855 1.00 0.00 H new ATOM 0 HG3 GLU A 76 -3.562 -11.010 -12.130 1.00 0.00 H new ATOM 1181 N ALA A 77 -5.779 -8.509 -9.126 1.00 0.00 N ATOM 1182 CA ALA A 77 -7.205 -8.573 -8.650 1.00 0.00 C ATOM 1183 C ALA A 77 -8.034 -7.487 -9.353 1.00 0.00 C ATOM 1184 O ALA A 77 -9.173 -7.714 -9.717 1.00 0.00 O ATOM 1185 CB ALA A 77 -7.184 -8.329 -7.133 1.00 0.00 C ATOM 0 H ALA A 77 -5.095 -8.238 -8.420 1.00 0.00 H new ATOM 0 HA ALA A 77 -7.654 -9.540 -8.877 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -8.202 -8.367 -6.744 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -6.582 -9.098 -6.649 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -6.754 -7.349 -6.928 1.00 0.00 H new ATOM 1191 N LEU A 78 -7.473 -6.310 -9.558 1.00 0.00 N ATOM 1192 CA LEU A 78 -8.257 -5.226 -10.257 1.00 0.00 C ATOM 1193 C LEU A 78 -8.507 -5.635 -11.717 1.00 0.00 C ATOM 1194 O LEU A 78 -9.586 -5.431 -12.242 1.00 0.00 O ATOM 1195 CB LEU A 78 -7.410 -3.935 -10.207 1.00 0.00 C ATOM 1196 CG LEU A 78 -8.041 -2.940 -9.231 1.00 0.00 C ATOM 1197 CD1 LEU A 78 -6.951 -2.032 -8.658 1.00 0.00 C ATOM 1198 CD2 LEU A 78 -9.084 -2.092 -9.970 1.00 0.00 C ATOM 0 H LEU A 78 -6.526 -6.055 -9.278 1.00 0.00 H new ATOM 0 HA LEU A 78 -9.221 -5.068 -9.773 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -6.392 -4.169 -9.895 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -7.345 -3.493 -11.201 1.00 0.00 H new ATOM 0 HG LEU A 78 -8.526 -3.481 -8.418 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -7.398 -1.322 -7.962 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -6.211 -2.637 -8.134 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -6.466 -1.489 -9.469 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -9.534 -1.383 -9.276 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -8.602 -1.548 -10.782 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -9.858 -2.742 -10.378 1.00 0.00 H new ATOM 1210 N GLN A 79 -7.523 -6.212 -12.378 1.00 0.00 N ATOM 1211 CA GLN A 79 -7.734 -6.631 -13.811 1.00 0.00 C ATOM 1212 C GLN A 79 -8.818 -7.721 -13.914 1.00 0.00 C ATOM 1213 O GLN A 79 -9.492 -7.823 -14.923 1.00 0.00 O ATOM 1214 CB GLN A 79 -6.388 -7.177 -14.315 1.00 0.00 C ATOM 1215 CG GLN A 79 -5.437 -6.011 -14.599 1.00 0.00 C ATOM 1216 CD GLN A 79 -4.166 -6.540 -15.275 1.00 0.00 C ATOM 1217 OE1 GLN A 79 -4.238 -7.394 -16.137 1.00 0.00 O ATOM 1218 NE2 GLN A 79 -2.994 -6.070 -14.924 1.00 0.00 N ATOM 0 H GLN A 79 -6.598 -6.409 -11.996 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.070 -5.785 -14.410 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -5.952 -7.843 -13.570 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -6.538 -7.766 -15.220 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -5.925 -5.278 -15.241 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -5.182 -5.501 -13.670 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -2.928 -5.353 -14.201 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -2.148 -6.421 -15.374 1.00 0.00 H new ATOM 1227 N GLN A 80 -8.998 -8.538 -12.892 1.00 0.00 N ATOM 1228 CA GLN A 80 -10.051 -9.611 -12.972 1.00 0.00 C ATOM 1229 C GLN A 80 -11.387 -9.091 -12.423 1.00 0.00 C ATOM 1230 O GLN A 80 -12.435 -9.372 -12.975 1.00 0.00 O ATOM 1231 CB GLN A 80 -9.537 -10.780 -12.121 1.00 0.00 C ATOM 1232 CG GLN A 80 -10.377 -12.027 -12.402 1.00 0.00 C ATOM 1233 CD GLN A 80 -10.396 -12.923 -11.157 1.00 0.00 C ATOM 1234 OE1 GLN A 80 -9.471 -12.898 -10.369 1.00 0.00 O ATOM 1235 NE2 GLN A 80 -11.414 -13.720 -10.939 1.00 0.00 N ATOM 0 H GLN A 80 -8.470 -8.509 -12.020 1.00 0.00 H new ATOM 0 HA GLN A 80 -10.226 -9.920 -14.002 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -8.489 -10.976 -12.349 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.590 -10.524 -11.063 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -11.393 -11.740 -12.672 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -9.964 -12.573 -13.250 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -12.193 -13.745 -11.597 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -11.427 -14.315 -10.111 1.00 0.00 H new ATOM 1244 N GLY A 81 -11.365 -8.336 -11.346 1.00 0.00 N ATOM 1245 CA GLY A 81 -12.642 -7.805 -10.779 1.00 0.00 C ATOM 1246 C GLY A 81 -12.702 -8.087 -9.271 1.00 0.00 C ATOM 1247 O GLY A 81 -13.348 -9.025 -8.840 1.00 0.00 O ATOM 0 H GLY A 81 -10.521 -8.068 -10.840 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -12.712 -6.732 -10.960 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -13.492 -8.269 -11.279 1.00 0.00 H new ATOM 1251 N GLU A 82 -12.044 -7.283 -8.461 1.00 0.00 N ATOM 1252 CA GLU A 82 -12.077 -7.512 -6.984 1.00 0.00 C ATOM 1253 C GLU A 82 -12.625 -6.267 -6.270 1.00 0.00 C ATOM 1254 O GLU A 82 -12.903 -5.263 -6.901 1.00 0.00 O ATOM 1255 CB GLU A 82 -10.621 -7.761 -6.587 1.00 0.00 C ATOM 1256 CG GLU A 82 -10.370 -9.265 -6.465 1.00 0.00 C ATOM 1257 CD GLU A 82 -10.998 -9.784 -5.170 1.00 0.00 C ATOM 1258 OE1 GLU A 82 -10.350 -9.688 -4.141 1.00 0.00 O ATOM 1259 OE2 GLU A 82 -12.117 -10.269 -5.229 1.00 0.00 O ATOM 0 H GLU A 82 -11.489 -6.482 -8.762 1.00 0.00 H new ATOM 0 HA GLU A 82 -12.721 -8.347 -6.709 1.00 0.00 H new ATOM 0 HB2 GLU A 82 -9.952 -7.330 -7.332 1.00 0.00 H new ATOM 0 HB3 GLU A 82 -10.403 -7.268 -5.640 1.00 0.00 H new ATOM 0 HG2 GLU A 82 -10.796 -9.786 -7.322 1.00 0.00 H new ATOM 0 HG3 GLU A 82 -9.299 -9.467 -6.469 1.00 0.00 H new ATOM 1266 N SER A 83 -12.787 -6.317 -4.961 1.00 0.00 N ATOM 1267 CA SER A 83 -13.317 -5.128 -4.228 1.00 0.00 C ATOM 1268 C SER A 83 -12.267 -4.591 -3.244 1.00 0.00 C ATOM 1269 O SER A 83 -11.626 -5.351 -2.542 1.00 0.00 O ATOM 1270 CB SER A 83 -14.542 -5.636 -3.471 1.00 0.00 C ATOM 1271 OG SER A 83 -15.578 -5.936 -4.397 1.00 0.00 O ATOM 0 H SER A 83 -12.575 -7.127 -4.379 1.00 0.00 H new ATOM 0 HA SER A 83 -13.565 -4.311 -4.905 1.00 0.00 H new ATOM 0 HB2 SER A 83 -14.285 -6.525 -2.896 1.00 0.00 H new ATOM 0 HB3 SER A 83 -14.882 -4.883 -2.760 1.00 0.00 H new ATOM 0 HG SER A 83 -16.365 -6.264 -3.913 1.00 0.00 H new ATOM 1277 N ALA A 84 -12.086 -3.288 -3.183 1.00 0.00 N ATOM 1278 CA ALA A 84 -11.073 -2.714 -2.232 1.00 0.00 C ATOM 1279 C ALA A 84 -11.746 -2.207 -0.937 1.00 0.00 C ATOM 1280 O ALA A 84 -11.149 -2.253 0.123 1.00 0.00 O ATOM 1281 CB ALA A 84 -10.404 -1.553 -2.984 1.00 0.00 C ATOM 0 H ALA A 84 -12.591 -2.603 -3.745 1.00 0.00 H new ATOM 0 HA ALA A 84 -10.348 -3.469 -1.927 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -9.653 -1.090 -2.344 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -9.927 -1.932 -3.888 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -11.157 -0.812 -3.254 1.00 0.00 H new ATOM 1287 N GLU A 85 -12.973 -1.719 -1.003 1.00 0.00 N ATOM 1288 CA GLU A 85 -13.646 -1.211 0.251 1.00 0.00 C ATOM 1289 C GLU A 85 -13.712 -2.318 1.314 1.00 0.00 C ATOM 1290 O GLU A 85 -13.522 -2.061 2.489 1.00 0.00 O ATOM 1291 CB GLU A 85 -15.067 -0.781 -0.150 1.00 0.00 C ATOM 1292 CG GLU A 85 -15.000 0.520 -0.952 1.00 0.00 C ATOM 1293 CD GLU A 85 -16.366 1.210 -0.920 1.00 0.00 C ATOM 1294 OE1 GLU A 85 -17.322 0.609 -1.378 1.00 0.00 O ATOM 1295 OE2 GLU A 85 -16.430 2.329 -0.437 1.00 0.00 O ATOM 0 H GLU A 85 -13.530 -1.651 -1.855 1.00 0.00 H new ATOM 0 HA GLU A 85 -13.087 -0.378 0.678 1.00 0.00 H new ATOM 0 HB2 GLU A 85 -15.541 -1.563 -0.744 1.00 0.00 H new ATOM 0 HB3 GLU A 85 -15.681 -0.641 0.740 1.00 0.00 H new ATOM 0 HG2 GLU A 85 -14.238 1.178 -0.534 1.00 0.00 H new ATOM 0 HG3 GLU A 85 -14.710 0.310 -1.982 1.00 0.00 H new ATOM 1302 N ASN A 86 -13.976 -3.547 0.920 1.00 0.00 N ATOM 1303 CA ASN A 86 -14.046 -4.663 1.938 1.00 0.00 C ATOM 1304 C ASN A 86 -12.733 -4.745 2.732 1.00 0.00 C ATOM 1305 O ASN A 86 -12.744 -5.031 3.916 1.00 0.00 O ATOM 1306 CB ASN A 86 -14.271 -5.967 1.153 1.00 0.00 C ATOM 1307 CG ASN A 86 -15.614 -5.905 0.411 1.00 0.00 C ATOM 1308 OD1 ASN A 86 -16.220 -4.854 0.313 1.00 0.00 O ATOM 1309 ND2 ASN A 86 -16.115 -6.992 -0.125 1.00 0.00 N ATOM 0 H ASN A 86 -14.144 -3.827 -0.046 1.00 0.00 H new ATOM 0 HA ASN A 86 -14.852 -4.489 2.650 1.00 0.00 H new ATOM 0 HB2 ASN A 86 -13.459 -6.118 0.442 1.00 0.00 H new ATOM 0 HB3 ASN A 86 -14.261 -6.818 1.834 1.00 0.00 H new ATOM 0 HD21 ASN A 86 -17.006 -6.953 -0.620 1.00 0.00 H new ATOM 0 HD22 ASN A 86 -15.613 -7.877 -0.047 1.00 0.00 H new ATOM 1316 N ILE A 87 -11.603 -4.489 2.103 1.00 0.00 N ATOM 1317 CA ILE A 87 -10.304 -4.551 2.864 1.00 0.00 C ATOM 1318 C ILE A 87 -10.285 -3.453 3.948 1.00 0.00 C ATOM 1319 O ILE A 87 -9.755 -3.659 5.024 1.00 0.00 O ATOM 1320 CB ILE A 87 -9.171 -4.329 1.836 1.00 0.00 C ATOM 1321 CG1 ILE A 87 -9.168 -5.468 0.799 1.00 0.00 C ATOM 1322 CG2 ILE A 87 -7.816 -4.299 2.552 1.00 0.00 C ATOM 1323 CD1 ILE A 87 -8.983 -6.824 1.493 1.00 0.00 C ATOM 0 H ILE A 87 -11.523 -4.245 1.116 1.00 0.00 H new ATOM 0 HA ILE A 87 -10.179 -5.511 3.365 1.00 0.00 H new ATOM 0 HB ILE A 87 -9.340 -3.378 1.331 1.00 0.00 H new ATOM 0 HG12 ILE A 87 -10.104 -5.463 0.241 1.00 0.00 H new ATOM 0 HG13 ILE A 87 -8.366 -5.309 0.078 1.00 0.00 H new ATOM 0 HG21 ILE A 87 -7.022 -4.142 1.822 1.00 0.00 H new ATOM 0 HG22 ILE A 87 -7.806 -3.487 3.279 1.00 0.00 H new ATOM 0 HG23 ILE A 87 -7.655 -5.247 3.065 1.00 0.00 H new ATOM 0 HD11 ILE A 87 -8.983 -7.618 0.746 1.00 0.00 H new ATOM 0 HD12 ILE A 87 -8.035 -6.831 2.030 1.00 0.00 H new ATOM 0 HD13 ILE A 87 -9.800 -6.987 2.196 1.00 0.00 H new ATOM 1335 N VAL A 88 -10.860 -2.292 3.684 1.00 0.00 N ATOM 1336 CA VAL A 88 -10.859 -1.205 4.733 1.00 0.00 C ATOM 1337 C VAL A 88 -11.586 -1.695 5.995 1.00 0.00 C ATOM 1338 O VAL A 88 -11.171 -1.398 7.100 1.00 0.00 O ATOM 1339 CB VAL A 88 -11.587 0.011 4.127 1.00 0.00 C ATOM 1340 CG1 VAL A 88 -11.635 1.150 5.152 1.00 0.00 C ATOM 1341 CG2 VAL A 88 -10.836 0.485 2.878 1.00 0.00 C ATOM 0 H VAL A 88 -11.321 -2.053 2.806 1.00 0.00 H new ATOM 0 HA VAL A 88 -9.842 -0.937 5.019 1.00 0.00 H new ATOM 0 HB VAL A 88 -12.603 -0.276 3.858 1.00 0.00 H new ATOM 0 HG11 VAL A 88 -12.150 2.007 4.719 1.00 0.00 H new ATOM 0 HG12 VAL A 88 -12.169 0.817 6.042 1.00 0.00 H new ATOM 0 HG13 VAL A 88 -10.619 1.437 5.425 1.00 0.00 H new ATOM 0 HG21 VAL A 88 -11.350 1.345 2.449 1.00 0.00 H new ATOM 0 HG22 VAL A 88 -9.819 0.769 3.150 1.00 0.00 H new ATOM 0 HG23 VAL A 88 -10.803 -0.321 2.145 1.00 0.00 H new ATOM 1351 N SER A 89 -12.660 -2.450 5.852 1.00 0.00 N ATOM 1352 CA SER A 89 -13.387 -2.954 7.076 1.00 0.00 C ATOM 1353 C SER A 89 -12.401 -3.709 7.982 1.00 0.00 C ATOM 1354 O SER A 89 -12.411 -3.546 9.187 1.00 0.00 O ATOM 1355 CB SER A 89 -14.488 -3.904 6.583 1.00 0.00 C ATOM 1356 OG SER A 89 -13.910 -5.159 6.249 1.00 0.00 O ATOM 0 H SER A 89 -13.060 -2.735 4.958 1.00 0.00 H new ATOM 0 HA SER A 89 -13.816 -2.133 7.650 1.00 0.00 H new ATOM 0 HB2 SER A 89 -15.246 -4.034 7.356 1.00 0.00 H new ATOM 0 HB3 SER A 89 -14.989 -3.478 5.714 1.00 0.00 H new ATOM 0 HG SER A 89 -13.707 -5.181 5.291 1.00 0.00 H new ATOM 1362 N LYS A 90 -11.530 -4.514 7.404 1.00 0.00 N ATOM 1363 CA LYS A 90 -10.525 -5.247 8.252 1.00 0.00 C ATOM 1364 C LYS A 90 -9.514 -4.249 8.840 1.00 0.00 C ATOM 1365 O LYS A 90 -9.067 -4.411 9.960 1.00 0.00 O ATOM 1366 CB LYS A 90 -9.810 -6.251 7.331 1.00 0.00 C ATOM 1367 CG LYS A 90 -9.231 -7.405 8.164 1.00 0.00 C ATOM 1368 CD LYS A 90 -9.961 -8.709 7.828 1.00 0.00 C ATOM 1369 CE LYS A 90 -9.176 -9.475 6.760 1.00 0.00 C ATOM 1370 NZ LYS A 90 -9.733 -9.004 5.460 1.00 0.00 N ATOM 0 H LYS A 90 -11.472 -4.693 6.401 1.00 0.00 H new ATOM 0 HA LYS A 90 -11.009 -5.762 9.082 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -10.509 -6.640 6.591 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.012 -5.750 6.783 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.165 -7.512 7.961 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.333 -7.185 9.227 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -10.067 -9.320 8.724 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -10.967 -8.493 7.469 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.108 -9.268 6.830 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -9.300 -10.552 6.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -9.356 -9.590 4.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -10.770 -9.081 5.478 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -9.462 -8.012 5.305 1.00 0.00 H new ATOM 1384 N ILE A 91 -9.156 -3.211 8.106 1.00 0.00 N ATOM 1385 CA ILE A 91 -8.180 -2.211 8.664 1.00 0.00 C ATOM 1386 C ILE A 91 -8.851 -1.406 9.786 1.00 0.00 C ATOM 1387 O ILE A 91 -8.227 -1.108 10.789 1.00 0.00 O ATOM 1388 CB ILE A 91 -7.762 -1.292 7.496 1.00 0.00 C ATOM 1389 CG1 ILE A 91 -7.082 -2.120 6.394 1.00 0.00 C ATOM 1390 CG2 ILE A 91 -6.786 -0.225 7.998 1.00 0.00 C ATOM 1391 CD1 ILE A 91 -5.884 -2.886 6.971 1.00 0.00 C ATOM 0 H ILE A 91 -9.491 -3.017 7.162 1.00 0.00 H new ATOM 0 HA ILE A 91 -7.304 -2.700 9.090 1.00 0.00 H new ATOM 0 HB ILE A 91 -8.653 -0.811 7.092 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -7.797 -2.820 5.961 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -6.750 -1.465 5.589 1.00 0.00 H new ATOM 0 HG21 ILE A 91 -6.495 0.420 7.169 1.00 0.00 H new ATOM 0 HG22 ILE A 91 -7.267 0.373 8.772 1.00 0.00 H new ATOM 0 HG23 ILE A 91 -5.900 -0.708 8.411 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -5.410 -3.469 6.181 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -5.164 -2.179 7.382 1.00 0.00 H new ATOM 0 HD13 ILE A 91 -6.226 -3.555 7.760 1.00 0.00 H new ATOM 1403 N ARG A 92 -10.114 -1.062 9.640 1.00 0.00 N ATOM 1404 CA ARG A 92 -10.797 -0.284 10.734 1.00 0.00 C ATOM 1405 C ARG A 92 -10.830 -1.121 12.018 1.00 0.00 C ATOM 1406 O ARG A 92 -10.623 -0.603 13.100 1.00 0.00 O ATOM 1407 CB ARG A 92 -12.225 0.015 10.250 1.00 0.00 C ATOM 1408 CG ARG A 92 -12.198 1.196 9.277 1.00 0.00 C ATOM 1409 CD ARG A 92 -12.191 2.508 10.065 1.00 0.00 C ATOM 1410 NE ARG A 92 -13.073 3.425 9.291 1.00 0.00 N ATOM 1411 CZ ARG A 92 -14.168 3.888 9.830 1.00 0.00 C ATOM 1412 NH1 ARG A 92 -14.133 4.418 11.022 1.00 0.00 N ATOM 1413 NH2 ARG A 92 -15.295 3.821 9.176 1.00 0.00 N ATOM 0 H ARG A 92 -10.692 -1.280 8.829 1.00 0.00 H new ATOM 0 HA ARG A 92 -10.266 0.643 10.951 1.00 0.00 H new ATOM 0 HB2 ARG A 92 -12.646 -0.863 9.761 1.00 0.00 H new ATOM 0 HB3 ARG A 92 -12.868 0.245 11.100 1.00 0.00 H new ATOM 0 HG2 ARG A 92 -11.315 1.137 8.641 1.00 0.00 H new ATOM 0 HG3 ARG A 92 -13.067 1.159 8.620 1.00 0.00 H new ATOM 0 HD2 ARG A 92 -12.565 2.362 11.078 1.00 0.00 H new ATOM 0 HD3 ARG A 92 -11.182 2.911 10.153 1.00 0.00 H new ATOM 0 HE ARG A 92 -12.821 3.691 8.339 1.00 0.00 H new ATOM 0 HH11 ARG A 92 -13.251 4.470 11.531 1.00 0.00 H new ATOM 0 HH12 ARG A 92 -14.988 4.780 11.444 1.00 0.00 H new ATOM 0 HH21 ARG A 92 -15.320 3.407 8.244 1.00 0.00 H new ATOM 0 HH22 ARG A 92 -16.151 4.183 9.597 1.00 0.00 H new ATOM 1427 N MET A 93 -11.067 -2.414 11.915 1.00 0.00 N ATOM 1428 CA MET A 93 -11.081 -3.263 13.157 1.00 0.00 C ATOM 1429 C MET A 93 -9.641 -3.451 13.652 1.00 0.00 C ATOM 1430 O MET A 93 -9.377 -3.382 14.838 1.00 0.00 O ATOM 1431 CB MET A 93 -11.699 -4.616 12.770 1.00 0.00 C ATOM 1432 CG MET A 93 -12.524 -5.154 13.940 1.00 0.00 C ATOM 1433 SD MET A 93 -14.075 -4.228 14.062 1.00 0.00 S ATOM 1434 CE MET A 93 -15.142 -5.627 14.484 1.00 0.00 C ATOM 0 H MET A 93 -11.248 -2.910 11.042 1.00 0.00 H new ATOM 0 HA MET A 93 -11.659 -2.799 13.956 1.00 0.00 H new ATOM 0 HB2 MET A 93 -12.330 -4.501 11.889 1.00 0.00 H new ATOM 0 HB3 MET A 93 -10.913 -5.325 12.509 1.00 0.00 H new ATOM 0 HG2 MET A 93 -12.732 -6.214 13.795 1.00 0.00 H new ATOM 0 HG3 MET A 93 -11.960 -5.063 14.868 1.00 0.00 H new ATOM 0 HE1 MET A 93 -16.167 -5.278 14.608 1.00 0.00 H new ATOM 0 HE2 MET A 93 -15.105 -6.367 13.685 1.00 0.00 H new ATOM 0 HE3 MET A 93 -14.798 -6.080 15.414 1.00 0.00 H new ATOM 1444 N MET A 94 -8.702 -3.665 12.753 1.00 0.00 N ATOM 1445 CA MET A 94 -7.274 -3.830 13.195 1.00 0.00 C ATOM 1446 C MET A 94 -6.745 -2.491 13.730 1.00 0.00 C ATOM 1447 O MET A 94 -6.017 -2.458 14.704 1.00 0.00 O ATOM 1448 CB MET A 94 -6.469 -4.267 11.960 1.00 0.00 C ATOM 1449 CG MET A 94 -6.842 -5.705 11.591 1.00 0.00 C ATOM 1450 SD MET A 94 -5.921 -6.855 12.640 1.00 0.00 S ATOM 1451 CE MET A 94 -6.130 -8.324 11.603 1.00 0.00 C ATOM 0 H MET A 94 -8.859 -3.732 11.747 1.00 0.00 H new ATOM 0 HA MET A 94 -7.187 -4.570 13.990 1.00 0.00 H new ATOM 0 HB2 MET A 94 -6.676 -3.600 11.123 1.00 0.00 H new ATOM 0 HB3 MET A 94 -5.401 -4.198 12.166 1.00 0.00 H new ATOM 0 HG2 MET A 94 -7.914 -5.858 11.719 1.00 0.00 H new ATOM 0 HG3 MET A 94 -6.616 -5.893 10.541 1.00 0.00 H new ATOM 0 HE1 MET A 94 -5.630 -9.173 12.069 1.00 0.00 H new ATOM 0 HE2 MET A 94 -7.192 -8.544 11.494 1.00 0.00 H new ATOM 0 HE3 MET A 94 -5.694 -8.141 10.621 1.00 0.00 H new ATOM 1461 N ASN A 95 -7.115 -1.382 13.115 1.00 0.00 N ATOM 1462 CA ASN A 95 -6.625 -0.053 13.629 1.00 0.00 C ATOM 1463 C ASN A 95 -7.214 0.211 15.023 1.00 0.00 C ATOM 1464 O ASN A 95 -6.543 0.738 15.890 1.00 0.00 O ATOM 1465 CB ASN A 95 -7.100 1.024 12.636 1.00 0.00 C ATOM 1466 CG ASN A 95 -6.003 1.279 11.593 1.00 0.00 C ATOM 1467 OD1 ASN A 95 -5.651 0.325 10.764 1.00 0.00 O flip ATOM 1468 ND2 ASN A 95 -5.458 2.363 11.528 1.00 0.00 N flip ATOM 0 H ASN A 95 -7.722 -1.339 12.297 1.00 0.00 H new ATOM 0 HA ASN A 95 -5.538 -0.041 13.713 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -8.017 0.700 12.143 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -7.333 1.947 13.168 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -5.727 3.109 12.170 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -4.731 2.527 10.832 1.00 0.00 H new ATOM 1475 N ALA A 96 -8.461 -0.155 15.252 1.00 0.00 N ATOM 1476 CA ALA A 96 -9.068 0.081 16.611 1.00 0.00 C ATOM 1477 C ALA A 96 -8.296 -0.717 17.671 1.00 0.00 C ATOM 1478 O ALA A 96 -8.035 -0.224 18.752 1.00 0.00 O ATOM 1479 CB ALA A 96 -10.526 -0.402 16.541 1.00 0.00 C ATOM 0 H ALA A 96 -9.075 -0.599 14.570 1.00 0.00 H new ATOM 0 HA ALA A 96 -9.023 1.135 16.884 1.00 0.00 H new ATOM 0 HB1 ALA A 96 -11.007 -0.250 17.507 1.00 0.00 H new ATOM 0 HB2 ALA A 96 -11.060 0.163 15.777 1.00 0.00 H new ATOM 0 HB3 ALA A 96 -10.546 -1.462 16.289 1.00 0.00 H new ATOM 1485 N GLN A 97 -7.919 -1.944 17.370 1.00 0.00 N ATOM 1486 CA GLN A 97 -7.151 -2.755 18.382 1.00 0.00 C ATOM 1487 C GLN A 97 -5.825 -2.054 18.713 1.00 0.00 C ATOM 1488 O GLN A 97 -5.410 -2.016 19.856 1.00 0.00 O ATOM 1489 CB GLN A 97 -6.880 -4.127 17.743 1.00 0.00 C ATOM 1490 CG GLN A 97 -6.828 -5.197 18.835 1.00 0.00 C ATOM 1491 CD GLN A 97 -6.031 -6.407 18.331 1.00 0.00 C ATOM 1492 OE1 GLN A 97 -5.056 -6.247 17.624 1.00 0.00 O ATOM 1493 NE2 GLN A 97 -6.402 -7.620 18.663 1.00 0.00 N ATOM 0 H GLN A 97 -8.105 -2.413 16.484 1.00 0.00 H new ATOM 0 HA GLN A 97 -7.715 -2.864 19.309 1.00 0.00 H new ATOM 0 HB2 GLN A 97 -7.662 -4.365 17.022 1.00 0.00 H new ATOM 0 HB3 GLN A 97 -5.938 -4.105 17.195 1.00 0.00 H new ATOM 0 HG2 GLN A 97 -6.364 -4.792 19.734 1.00 0.00 H new ATOM 0 HG3 GLN A 97 -7.838 -5.502 19.108 1.00 0.00 H new ATOM 0 HE21 GLN A 97 -7.220 -7.759 19.256 1.00 0.00 H new ATOM 0 HE22 GLN A 97 -5.873 -8.425 18.328 1.00 0.00 H new ATOM 1502 N SER A 98 -5.158 -1.492 17.725 1.00 0.00 N ATOM 1503 CA SER A 98 -3.853 -0.788 18.005 1.00 0.00 C ATOM 1504 C SER A 98 -4.050 0.324 19.052 1.00 0.00 C ATOM 1505 O SER A 98 -3.167 0.582 19.850 1.00 0.00 O ATOM 1506 CB SER A 98 -3.384 -0.177 16.675 1.00 0.00 C ATOM 1507 OG SER A 98 -2.371 0.786 16.932 1.00 0.00 O ATOM 0 H SER A 98 -5.454 -1.489 16.749 1.00 0.00 H new ATOM 0 HA SER A 98 -3.117 -1.487 18.402 1.00 0.00 H new ATOM 0 HB2 SER A 98 -3.001 -0.958 16.018 1.00 0.00 H new ATOM 0 HB3 SER A 98 -4.224 0.290 16.160 1.00 0.00 H new ATOM 0 HG SER A 98 -2.069 1.177 16.086 1.00 0.00 H new ATOM 1513 N LEU A 99 -5.194 0.980 19.066 1.00 0.00 N ATOM 1514 CA LEU A 99 -5.414 2.069 20.081 1.00 0.00 C ATOM 1515 C LEU A 99 -5.983 1.476 21.379 1.00 0.00 C ATOM 1516 O LEU A 99 -5.612 1.886 22.463 1.00 0.00 O ATOM 1517 CB LEU A 99 -6.417 3.050 19.455 1.00 0.00 C ATOM 1518 CG LEU A 99 -5.812 3.656 18.187 1.00 0.00 C ATOM 1519 CD1 LEU A 99 -6.935 4.089 17.242 1.00 0.00 C ATOM 1520 CD2 LEU A 99 -4.964 4.874 18.560 1.00 0.00 C ATOM 0 H LEU A 99 -5.973 0.812 18.429 1.00 0.00 H new ATOM 0 HA LEU A 99 -4.480 2.571 20.334 1.00 0.00 H new ATOM 0 HB2 LEU A 99 -7.347 2.534 19.217 1.00 0.00 H new ATOM 0 HB3 LEU A 99 -6.663 3.838 20.166 1.00 0.00 H new ATOM 0 HG LEU A 99 -5.186 2.913 17.692 1.00 0.00 H new ATOM 0 HD11 LEU A 99 -6.504 4.521 16.339 1.00 0.00 H new ATOM 0 HD12 LEU A 99 -7.541 3.223 16.977 1.00 0.00 H new ATOM 0 HD13 LEU A 99 -7.560 4.832 17.737 1.00 0.00 H new ATOM 0 HD21 LEU A 99 -4.532 5.307 17.658 1.00 0.00 H new ATOM 0 HD22 LEU A 99 -5.591 5.616 19.054 1.00 0.00 H new ATOM 0 HD23 LEU A 99 -4.164 4.568 19.234 1.00 0.00 H new ATOM 1532 N GLY A 100 -6.877 0.515 21.282 1.00 0.00 N ATOM 1533 CA GLY A 100 -7.455 -0.095 22.516 1.00 0.00 C ATOM 1534 C GLY A 100 -8.954 -0.360 22.311 1.00 0.00 C ATOM 1535 O GLY A 100 -9.452 -1.412 22.658 1.00 0.00 O ATOM 0 H GLY A 100 -7.227 0.132 20.404 1.00 0.00 H new ATOM 0 HA2 GLY A 100 -6.940 -1.027 22.748 1.00 0.00 H new ATOM 0 HA3 GLY A 100 -7.307 0.571 23.366 1.00 0.00 H new ATOM 1539 N GLN A 101 -9.687 0.591 21.755 1.00 0.00 N ATOM 1540 CA GLN A 101 -11.160 0.389 21.540 1.00 0.00 C ATOM 1541 C GLN A 101 -11.835 -0.061 22.848 1.00 0.00 C ATOM 1542 O GLN A 101 -12.685 -0.930 22.848 1.00 0.00 O ATOM 1543 CB GLN A 101 -11.271 -0.700 20.470 1.00 0.00 C ATOM 1544 CG GLN A 101 -12.703 -0.743 19.930 1.00 0.00 C ATOM 1545 CD GLN A 101 -12.963 -2.107 19.278 1.00 0.00 C ATOM 1546 OE1 GLN A 101 -12.255 -2.499 18.372 1.00 0.00 O ATOM 1547 NE2 GLN A 101 -13.956 -2.853 19.698 1.00 0.00 N ATOM 0 H GLN A 101 -9.326 1.493 21.444 1.00 0.00 H new ATOM 0 HA GLN A 101 -11.656 1.308 21.229 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -10.571 -0.500 19.659 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -11.001 -1.668 20.892 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -13.413 -0.573 20.739 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -12.853 0.054 19.202 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -14.553 -2.527 20.458 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -14.132 -3.759 19.264 1.00 0.00 H new ATOM 1556 N SER A 102 -11.453 0.526 23.966 1.00 0.00 N ATOM 1557 CA SER A 102 -12.066 0.132 25.285 1.00 0.00 C ATOM 1558 C SER A 102 -11.477 0.974 26.433 1.00 0.00 C ATOM 1559 O SER A 102 -12.202 1.529 27.236 1.00 0.00 O ATOM 1560 CB SER A 102 -11.708 -1.345 25.487 1.00 0.00 C ATOM 1561 OG SER A 102 -10.364 -1.560 25.076 1.00 0.00 O ATOM 0 H SER A 102 -10.745 1.259 24.022 1.00 0.00 H new ATOM 0 HA SER A 102 -13.144 0.296 25.283 1.00 0.00 H new ATOM 0 HB2 SER A 102 -11.829 -1.621 26.534 1.00 0.00 H new ATOM 0 HB3 SER A 102 -12.383 -1.977 24.910 1.00 0.00 H new ATOM 0 HG SER A 102 -10.347 -1.806 24.127 1.00 0.00 H new ATOM 1567 N ASP A 103 -10.167 1.073 26.509 1.00 0.00 N ATOM 1568 CA ASP A 103 -9.536 1.883 27.603 1.00 0.00 C ATOM 1569 C ASP A 103 -9.231 3.302 27.101 1.00 0.00 C ATOM 1570 O ASP A 103 -8.493 3.479 26.149 1.00 0.00 O ATOM 1571 CB ASP A 103 -8.236 1.156 27.970 1.00 0.00 C ATOM 1572 CG ASP A 103 -8.548 0.000 28.924 1.00 0.00 C ATOM 1573 OD1 ASP A 103 -9.393 -0.810 28.585 1.00 0.00 O ATOM 1574 OD2 ASP A 103 -7.935 -0.053 29.978 1.00 0.00 O ATOM 0 H ASP A 103 -9.512 0.630 25.864 1.00 0.00 H new ATOM 0 HA ASP A 103 -10.196 1.978 28.465 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -7.752 0.778 27.070 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -7.539 1.850 28.439 1.00 0.00 H new ATOM 1579 N ILE A 104 -9.790 4.318 27.729 1.00 0.00 N ATOM 1580 CA ILE A 104 -9.523 5.717 27.277 1.00 0.00 C ATOM 1581 C ILE A 104 -8.903 6.531 28.426 1.00 0.00 C ATOM 1582 O ILE A 104 -7.813 7.056 28.296 1.00 0.00 O ATOM 1583 CB ILE A 104 -10.896 6.280 26.890 1.00 0.00 C ATOM 1584 CG1 ILE A 104 -11.497 5.439 25.760 1.00 0.00 C ATOM 1585 CG2 ILE A 104 -10.745 7.727 26.412 1.00 0.00 C ATOM 1586 CD1 ILE A 104 -13.008 5.673 25.697 1.00 0.00 C ATOM 0 H ILE A 104 -10.415 4.233 28.530 1.00 0.00 H new ATOM 0 HA ILE A 104 -8.821 5.759 26.444 1.00 0.00 H new ATOM 0 HB ILE A 104 -11.552 6.249 27.760 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -11.037 5.707 24.809 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -11.289 4.382 25.928 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -11.723 8.124 26.138 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -10.319 8.332 27.213 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -10.085 7.757 25.545 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -13.436 5.074 24.893 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -13.461 5.383 26.645 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -13.205 6.728 25.508 1.00 0.00 H new ATOM 1598 N ALA A 105 -9.585 6.641 29.548 1.00 0.00 N ATOM 1599 CA ALA A 105 -9.025 7.421 30.692 1.00 0.00 C ATOM 1600 C ALA A 105 -8.906 6.531 31.931 1.00 0.00 C ATOM 1601 O ALA A 105 -8.761 7.074 33.015 1.00 0.00 O ATOM 1602 CB ALA A 105 -10.031 8.547 30.934 1.00 0.00 C ATOM 1603 OXT ALA A 105 -8.961 5.322 31.776 1.00 0.00 O ATOM 0 H ALA A 105 -10.501 6.224 29.715 1.00 0.00 H new ATOM 0 HA ALA A 105 -8.027 7.805 30.481 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -9.690 9.168 31.763 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -10.117 9.157 30.035 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -11.004 8.120 31.177 1.00 0.00 H new TER 1609 ALA A 105