USER MOD reduce.3.24.130724 H: found=0, std=0, add=823, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 744 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 44 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 114 SER OG : rot 50:sc= -0.188 USER MOD Set 2.1: A 39 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 55 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 18 SER OG : rot 69:sc= 0.647 USER MOD Set 3.2: A 112 SER OG : rot 125:sc= 0.245 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot -160:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot -6:sc= 0.518 USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 27 SER OG : rot -156:sc= 1.15 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot 180:sc= -0.0589 USER MOD Single : A 36 SER OG : rot 81:sc= 0.0324 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 48 SER OG : rot 79:sc= 0.0518 USER MOD Single : A 53 SER OG : rot 48:sc= 0.232 USER MOD Single : A 63 GLN : amide:sc= 0 X(o=0,f=-0.0056) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 TYR OH : rot -19:sc= 0.276 USER MOD Single : A 79 ASN : amide:sc= -0.21 K(o=-0.21,f=-1.3) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot -4:sc= 0.404 USER MOD Single : A 92 GLN : amide:sc= -0.16 X(o=-0.16,f=-0.16) USER MOD Single : A 96 ASN : amide:sc= -0.219 X(o=-0.22,f=-0.22) USER MOD Single : A 99 ASN : amide:sc= -0.314 X(o=-0.31,f=-0.043) USER MOD Single : A 101 SER OG : rot 180:sc= 0.011 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= -0.0285 X(o=-0.029,f=0) USER MOD Single : A 124 TYR OH : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 130 ASN : amide:sc= -0.0173 K(o=-0.017,f=-2.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 12.684 -12.863 -9.890 1.00 0.00 N ATOM 2 CA SER A 2 11.792 -11.691 -9.905 1.00 0.00 C ATOM 3 C SER A 2 11.633 -11.054 -8.525 1.00 0.00 C ATOM 4 O SER A 2 11.941 -9.873 -8.371 1.00 0.00 O ATOM 5 CB SER A 2 10.419 -12.093 -10.473 1.00 0.00 C ATOM 6 OG SER A 2 10.210 -11.476 -11.732 1.00 0.00 O ATOM 0 HA SER A 2 12.251 -10.938 -10.545 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.364 -13.177 -10.577 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.631 -11.799 -9.780 1.00 0.00 H new ATOM 0 HG SER A 2 9.335 -11.740 -12.084 1.00 0.00 H new ATOM 11 N TYR A 3 11.203 -11.838 -7.525 1.00 0.00 N ATOM 12 CA TYR A 3 10.996 -11.489 -6.104 1.00 0.00 C ATOM 13 C TYR A 3 10.013 -10.327 -5.855 1.00 0.00 C ATOM 14 O TYR A 3 8.947 -10.548 -5.286 1.00 0.00 O ATOM 15 CB TYR A 3 12.347 -11.290 -5.385 1.00 0.00 C ATOM 16 CG TYR A 3 13.512 -12.079 -5.960 1.00 0.00 C ATOM 17 CD1 TYR A 3 13.529 -13.486 -5.872 1.00 0.00 C ATOM 18 CD2 TYR A 3 14.547 -11.404 -6.637 1.00 0.00 C ATOM 19 CE1 TYR A 3 14.576 -14.215 -6.468 1.00 0.00 C ATOM 20 CE2 TYR A 3 15.596 -12.131 -7.229 1.00 0.00 C ATOM 21 CZ TYR A 3 15.613 -13.539 -7.148 1.00 0.00 C ATOM 22 OH TYR A 3 16.622 -14.236 -7.738 1.00 0.00 O ATOM 0 H TYR A 3 10.970 -12.816 -7.700 1.00 0.00 H new ATOM 0 HA TYR A 3 10.493 -12.348 -5.660 1.00 0.00 H new ATOM 0 HB2 TYR A 3 12.600 -10.230 -5.410 1.00 0.00 H new ATOM 0 HB3 TYR A 3 12.226 -11.564 -4.337 1.00 0.00 H new ATOM 0 HD1 TYR A 3 12.740 -14.004 -5.348 1.00 0.00 H new ATOM 0 HD2 TYR A 3 14.535 -10.326 -6.702 1.00 0.00 H new ATOM 0 HE1 TYR A 3 14.586 -15.293 -6.405 1.00 0.00 H new ATOM 0 HE2 TYR A 3 16.389 -11.611 -7.746 1.00 0.00 H new ATOM 0 HH TYR A 3 17.247 -13.611 -8.161 1.00 0.00 H new ATOM 31 N SER A 4 10.302 -9.122 -6.353 1.00 0.00 N ATOM 32 CA SER A 4 9.392 -7.971 -6.387 1.00 0.00 C ATOM 33 C SER A 4 8.142 -8.243 -7.234 1.00 0.00 C ATOM 34 O SER A 4 7.036 -7.938 -6.800 1.00 0.00 O ATOM 35 CB SER A 4 10.142 -6.752 -6.934 1.00 0.00 C ATOM 36 OG SER A 4 9.339 -5.591 -6.832 1.00 0.00 O ATOM 0 H SER A 4 11.213 -8.912 -6.760 1.00 0.00 H new ATOM 0 HA SER A 4 9.053 -7.780 -5.369 1.00 0.00 H new ATOM 0 HB2 SER A 4 11.070 -6.610 -6.380 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.415 -6.922 -7.975 1.00 0.00 H new ATOM 0 HG SER A 4 9.673 -4.907 -7.449 1.00 0.00 H new ATOM 41 N SER A 5 8.275 -8.887 -8.406 1.00 0.00 N ATOM 42 CA SER A 5 7.112 -9.270 -9.232 1.00 0.00 C ATOM 43 C SER A 5 6.281 -10.391 -8.590 1.00 0.00 C ATOM 44 O SER A 5 5.055 -10.373 -8.663 1.00 0.00 O ATOM 45 CB SER A 5 7.546 -9.707 -10.635 1.00 0.00 C ATOM 46 OG SER A 5 6.447 -9.652 -11.530 1.00 0.00 O ATOM 0 H SER A 5 9.175 -9.154 -8.805 1.00 0.00 H new ATOM 0 HA SER A 5 6.488 -8.379 -9.305 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.348 -9.061 -10.993 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.945 -10.721 -10.600 1.00 0.00 H new ATOM 0 HG SER A 5 6.738 -9.932 -12.423 1.00 0.00 H new ATOM 51 N ALA A 6 6.929 -11.345 -7.905 1.00 0.00 N ATOM 52 CA ALA A 6 6.255 -12.399 -7.142 1.00 0.00 C ATOM 53 C ALA A 6 5.451 -11.807 -5.971 1.00 0.00 C ATOM 54 O ALA A 6 4.262 -12.086 -5.815 1.00 0.00 O ATOM 55 CB ALA A 6 7.318 -13.396 -6.656 1.00 0.00 C ATOM 0 H ALA A 6 7.947 -11.405 -7.867 1.00 0.00 H new ATOM 0 HA ALA A 6 5.537 -12.918 -7.777 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.838 -14.190 -6.085 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.832 -13.827 -7.515 1.00 0.00 H new ATOM 0 HB3 ALA A 6 8.039 -12.879 -6.023 1.00 0.00 H new ATOM 61 N PHE A 7 6.081 -10.925 -5.194 1.00 0.00 N ATOM 62 CA PHE A 7 5.462 -10.132 -4.135 1.00 0.00 C ATOM 63 C PHE A 7 4.287 -9.307 -4.674 1.00 0.00 C ATOM 64 O PHE A 7 3.172 -9.406 -4.164 1.00 0.00 O ATOM 65 CB PHE A 7 6.576 -9.268 -3.536 1.00 0.00 C ATOM 66 CG PHE A 7 6.205 -8.444 -2.329 1.00 0.00 C ATOM 67 CD1 PHE A 7 6.388 -8.973 -1.038 1.00 0.00 C ATOM 68 CD2 PHE A 7 5.756 -7.122 -2.492 1.00 0.00 C ATOM 69 CE1 PHE A 7 6.117 -8.185 0.091 1.00 0.00 C ATOM 70 CE2 PHE A 7 5.497 -6.328 -1.365 1.00 0.00 C ATOM 71 CZ PHE A 7 5.669 -6.868 -0.078 1.00 0.00 C ATOM 0 H PHE A 7 7.079 -10.737 -5.291 1.00 0.00 H new ATOM 0 HA PHE A 7 5.027 -10.764 -3.360 1.00 0.00 H new ATOM 0 HB2 PHE A 7 7.406 -9.920 -3.263 1.00 0.00 H new ATOM 0 HB3 PHE A 7 6.941 -8.594 -4.311 1.00 0.00 H new ATOM 0 HD1 PHE A 7 6.738 -9.987 -0.916 1.00 0.00 H new ATOM 0 HD2 PHE A 7 5.611 -6.718 -3.483 1.00 0.00 H new ATOM 0 HE1 PHE A 7 6.253 -8.590 1.083 1.00 0.00 H new ATOM 0 HE2 PHE A 7 5.167 -5.307 -1.485 1.00 0.00 H new ATOM 0 HZ PHE A 7 5.454 -6.261 0.789 1.00 0.00 H new ATOM 80 N ALA A 8 4.489 -8.582 -5.775 1.00 0.00 N ATOM 81 CA ALA A 8 3.433 -7.875 -6.488 1.00 0.00 C ATOM 82 C ALA A 8 2.339 -8.789 -7.071 1.00 0.00 C ATOM 83 O ALA A 8 1.245 -8.296 -7.308 1.00 0.00 O ATOM 84 CB ALA A 8 4.049 -6.961 -7.554 1.00 0.00 C ATOM 0 H ALA A 8 5.409 -8.470 -6.201 1.00 0.00 H new ATOM 0 HA ALA A 8 2.908 -7.267 -5.751 1.00 0.00 H new ATOM 0 HB1 ALA A 8 3.256 -6.435 -8.084 1.00 0.00 H new ATOM 0 HB2 ALA A 8 4.708 -6.237 -7.075 1.00 0.00 H new ATOM 0 HB3 ALA A 8 4.622 -7.561 -8.261 1.00 0.00 H new ATOM 90 N GLN A 9 2.561 -10.096 -7.255 1.00 0.00 N ATOM 91 CA GLN A 9 1.527 -11.039 -7.702 1.00 0.00 C ATOM 92 C GLN A 9 0.528 -11.352 -6.581 1.00 0.00 C ATOM 93 O GLN A 9 -0.668 -11.128 -6.751 1.00 0.00 O ATOM 94 CB GLN A 9 2.161 -12.338 -8.249 1.00 0.00 C ATOM 95 CG GLN A 9 1.895 -12.568 -9.745 1.00 0.00 C ATOM 96 CD GLN A 9 0.447 -12.948 -10.068 1.00 0.00 C ATOM 97 OE1 GLN A 9 -0.507 -12.251 -9.755 1.00 0.00 O ATOM 98 NE2 GLN A 9 0.215 -14.070 -10.720 1.00 0.00 N ATOM 0 H GLN A 9 3.469 -10.533 -7.097 1.00 0.00 H new ATOM 0 HA GLN A 9 0.977 -10.560 -8.512 1.00 0.00 H new ATOM 0 HB2 GLN A 9 3.237 -12.306 -8.080 1.00 0.00 H new ATOM 0 HB3 GLN A 9 1.775 -13.187 -7.685 1.00 0.00 H new ATOM 0 HG2 GLN A 9 2.153 -11.662 -10.293 1.00 0.00 H new ATOM 0 HG3 GLN A 9 2.556 -13.357 -10.104 1.00 0.00 H new ATOM 0 HE21 GLN A 9 0.992 -14.671 -10.994 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -0.742 -14.337 -10.951 1.00 0.00 H new ATOM 105 N ALA A 10 0.990 -11.805 -5.410 1.00 0.00 N ATOM 106 CA ALA A 10 0.092 -12.042 -4.275 1.00 0.00 C ATOM 107 C ALA A 10 -0.480 -10.732 -3.721 1.00 0.00 C ATOM 108 O ALA A 10 -1.658 -10.674 -3.364 1.00 0.00 O ATOM 109 CB ALA A 10 0.837 -12.767 -3.167 1.00 0.00 C ATOM 0 H ALA A 10 1.971 -12.013 -5.224 1.00 0.00 H new ATOM 0 HA ALA A 10 -0.736 -12.653 -4.634 1.00 0.00 H new ATOM 0 HB1 ALA A 10 0.163 -12.939 -2.328 1.00 0.00 H new ATOM 0 HB2 ALA A 10 1.204 -13.723 -3.540 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.680 -12.159 -2.837 1.00 0.00 H new ATOM 115 N ALA A 11 0.335 -9.669 -3.694 1.00 0.00 N ATOM 116 CA ALA A 11 -0.150 -8.345 -3.350 1.00 0.00 C ATOM 117 C ALA A 11 -1.232 -7.900 -4.338 1.00 0.00 C ATOM 118 O ALA A 11 -2.326 -7.610 -3.889 1.00 0.00 O ATOM 119 CB ALA A 11 1.004 -7.344 -3.240 1.00 0.00 C ATOM 0 H ALA A 11 1.332 -9.710 -3.908 1.00 0.00 H new ATOM 0 HA ALA A 11 -0.613 -8.384 -2.364 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.610 -6.361 -2.981 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.698 -7.672 -2.466 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.527 -7.285 -4.195 1.00 0.00 H new ATOM 125 N SER A 12 -1.016 -7.949 -5.659 1.00 0.00 N ATOM 126 CA SER A 12 -2.066 -7.668 -6.655 1.00 0.00 C ATOM 127 C SER A 12 -3.303 -8.552 -6.463 1.00 0.00 C ATOM 128 O SER A 12 -4.415 -8.038 -6.475 1.00 0.00 O ATOM 129 CB SER A 12 -1.532 -7.819 -8.085 1.00 0.00 C ATOM 130 OG SER A 12 -2.541 -7.545 -9.044 1.00 0.00 O ATOM 0 H SER A 12 -0.112 -8.184 -6.070 1.00 0.00 H new ATOM 0 HA SER A 12 -2.369 -6.633 -6.498 1.00 0.00 H new ATOM 0 HB2 SER A 12 -0.691 -7.142 -8.235 1.00 0.00 H new ATOM 0 HB3 SER A 12 -1.155 -8.832 -8.230 1.00 0.00 H new ATOM 0 HG SER A 12 -2.172 -7.648 -9.946 1.00 0.00 H new ATOM 135 N SER A 13 -3.139 -9.854 -6.196 1.00 0.00 N ATOM 136 CA SER A 13 -4.255 -10.778 -5.946 1.00 0.00 C ATOM 137 C SER A 13 -5.129 -10.337 -4.762 1.00 0.00 C ATOM 138 O SER A 13 -6.357 -10.330 -4.870 1.00 0.00 O ATOM 139 CB SER A 13 -3.723 -12.197 -5.714 1.00 0.00 C ATOM 140 OG SER A 13 -4.772 -13.142 -5.841 1.00 0.00 O ATOM 0 H SER A 13 -2.223 -10.300 -6.147 1.00 0.00 H new ATOM 0 HA SER A 13 -4.889 -10.766 -6.833 1.00 0.00 H new ATOM 0 HB2 SER A 13 -2.935 -12.419 -6.433 1.00 0.00 H new ATOM 0 HB3 SER A 13 -3.278 -12.268 -4.721 1.00 0.00 H new ATOM 0 HG SER A 13 -4.419 -14.044 -5.692 1.00 0.00 H new ATOM 145 N SER A 14 -4.510 -9.904 -3.657 1.00 0.00 N ATOM 146 CA SER A 14 -5.207 -9.372 -2.478 1.00 0.00 C ATOM 147 C SER A 14 -5.728 -7.939 -2.697 1.00 0.00 C ATOM 148 O SER A 14 -6.902 -7.666 -2.485 1.00 0.00 O ATOM 149 CB SER A 14 -4.259 -9.442 -1.277 1.00 0.00 C ATOM 150 OG SER A 14 -4.917 -9.056 -0.082 1.00 0.00 O ATOM 0 H SER A 14 -3.495 -9.913 -3.555 1.00 0.00 H new ATOM 0 HA SER A 14 -6.090 -9.983 -2.290 1.00 0.00 H new ATOM 0 HB2 SER A 14 -3.875 -10.457 -1.172 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.401 -8.792 -1.449 1.00 0.00 H new ATOM 0 HG SER A 14 -4.290 -9.111 0.669 1.00 0.00 H new ATOM 155 N LEU A 15 -4.903 -7.023 -3.213 1.00 0.00 N ATOM 156 CA LEU A 15 -5.245 -5.627 -3.518 1.00 0.00 C ATOM 157 C LEU A 15 -6.411 -5.518 -4.530 1.00 0.00 C ATOM 158 O LEU A 15 -7.282 -4.663 -4.369 1.00 0.00 O ATOM 159 CB LEU A 15 -3.976 -4.888 -4.011 1.00 0.00 C ATOM 160 CG LEU A 15 -2.839 -4.745 -2.966 1.00 0.00 C ATOM 161 CD1 LEU A 15 -1.496 -4.343 -3.580 1.00 0.00 C ATOM 162 CD2 LEU A 15 -3.157 -3.705 -1.900 1.00 0.00 C ATOM 0 H LEU A 15 -3.933 -7.243 -3.441 1.00 0.00 H new ATOM 0 HA LEU A 15 -5.601 -5.147 -2.606 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -3.583 -5.417 -4.880 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -4.264 -3.892 -4.347 1.00 0.00 H new ATOM 0 HG LEU A 15 -2.764 -5.741 -2.529 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -0.746 -4.261 -2.793 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -1.185 -5.099 -4.301 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -1.599 -3.382 -4.084 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.329 -3.644 -1.193 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -3.304 -2.733 -2.372 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -4.066 -3.992 -1.371 1.00 0.00 H new ATOM 173 N ALA A 16 -6.493 -6.416 -5.519 1.00 0.00 N ATOM 174 CA ALA A 16 -7.605 -6.532 -6.473 1.00 0.00 C ATOM 175 C ALA A 16 -8.913 -7.083 -5.860 1.00 0.00 C ATOM 176 O ALA A 16 -9.983 -6.904 -6.447 1.00 0.00 O ATOM 177 CB ALA A 16 -7.163 -7.413 -7.652 1.00 0.00 C ATOM 0 H ALA A 16 -5.761 -7.107 -5.684 1.00 0.00 H new ATOM 0 HA ALA A 16 -7.841 -5.521 -6.804 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -7.982 -7.505 -8.365 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -6.303 -6.958 -8.144 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -6.890 -8.402 -7.285 1.00 0.00 H new ATOM 183 N THR A 17 -8.855 -7.713 -4.680 1.00 0.00 N ATOM 184 CA THR A 17 -10.026 -8.175 -3.901 1.00 0.00 C ATOM 185 C THR A 17 -10.272 -7.315 -2.648 1.00 0.00 C ATOM 186 O THR A 17 -11.245 -7.533 -1.922 1.00 0.00 O ATOM 187 CB THR A 17 -9.924 -9.675 -3.547 1.00 0.00 C ATOM 188 OG1 THR A 17 -8.783 -9.962 -2.772 1.00 0.00 O ATOM 189 CG2 THR A 17 -9.871 -10.566 -4.792 1.00 0.00 C ATOM 0 H THR A 17 -7.969 -7.925 -4.222 1.00 0.00 H new ATOM 0 HA THR A 17 -10.896 -8.050 -4.546 1.00 0.00 H new ATOM 0 HB THR A 17 -10.827 -9.891 -2.976 1.00 0.00 H new ATOM 0 HG1 THR A 17 -8.229 -9.157 -2.696 1.00 0.00 H new ATOM 0 HG21 THR A 17 -9.800 -11.611 -4.489 1.00 0.00 H new ATOM 0 HG22 THR A 17 -10.776 -10.420 -5.382 1.00 0.00 H new ATOM 0 HG23 THR A 17 -9.000 -10.302 -5.392 1.00 0.00 H new ATOM 197 N SER A 18 -9.449 -6.283 -2.427 1.00 0.00 N ATOM 198 CA SER A 18 -9.573 -5.278 -1.364 1.00 0.00 C ATOM 199 C SER A 18 -10.430 -4.098 -1.824 1.00 0.00 C ATOM 200 O SER A 18 -9.919 -3.008 -2.094 1.00 0.00 O ATOM 201 CB SER A 18 -8.194 -4.780 -0.905 1.00 0.00 C ATOM 202 OG SER A 18 -7.497 -5.797 -0.213 1.00 0.00 O ATOM 0 H SER A 18 -8.634 -6.117 -3.017 1.00 0.00 H new ATOM 0 HA SER A 18 -10.065 -5.757 -0.517 1.00 0.00 H new ATOM 0 HB2 SER A 18 -7.613 -4.458 -1.769 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.313 -3.910 -0.259 1.00 0.00 H new ATOM 0 HG SER A 18 -7.246 -6.507 -0.840 1.00 0.00 H new ATOM 207 N SER A 19 -11.749 -4.289 -1.901 1.00 0.00 N ATOM 208 CA SER A 19 -12.701 -3.222 -2.254 1.00 0.00 C ATOM 209 C SER A 19 -12.556 -1.966 -1.384 1.00 0.00 C ATOM 210 O SER A 19 -12.771 -0.866 -1.883 1.00 0.00 O ATOM 211 CB SER A 19 -14.147 -3.721 -2.185 1.00 0.00 C ATOM 212 OG SER A 19 -14.316 -4.874 -2.996 1.00 0.00 O ATOM 0 H SER A 19 -12.193 -5.189 -1.720 1.00 0.00 H new ATOM 0 HA SER A 19 -12.456 -2.943 -3.279 1.00 0.00 H new ATOM 0 HB2 SER A 19 -14.408 -3.954 -1.153 1.00 0.00 H new ATOM 0 HB3 SER A 19 -14.825 -2.934 -2.516 1.00 0.00 H new ATOM 0 HG SER A 19 -15.245 -5.181 -2.939 1.00 0.00 H new ATOM 217 N ALA A 20 -12.124 -2.092 -0.123 1.00 0.00 N ATOM 218 CA ALA A 20 -11.786 -0.952 0.738 1.00 0.00 C ATOM 219 C ALA A 20 -10.654 -0.077 0.166 1.00 0.00 C ATOM 220 O ALA A 20 -10.758 1.149 0.180 1.00 0.00 O ATOM 221 CB ALA A 20 -11.400 -1.482 2.123 1.00 0.00 C ATOM 0 H ALA A 20 -11.998 -2.996 0.332 1.00 0.00 H new ATOM 0 HA ALA A 20 -12.664 -0.309 0.801 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -11.146 -0.646 2.775 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.239 -2.032 2.549 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -10.540 -2.145 2.032 1.00 0.00 H new ATOM 227 N ILE A 21 -9.596 -0.692 -0.376 1.00 0.00 N ATOM 228 CA ILE A 21 -8.490 0.009 -1.045 1.00 0.00 C ATOM 229 C ILE A 21 -8.975 0.606 -2.368 1.00 0.00 C ATOM 230 O ILE A 21 -8.740 1.787 -2.625 1.00 0.00 O ATOM 231 CB ILE A 21 -7.285 -0.940 -1.256 1.00 0.00 C ATOM 232 CG1 ILE A 21 -6.719 -1.366 0.115 1.00 0.00 C ATOM 233 CG2 ILE A 21 -6.185 -0.263 -2.088 1.00 0.00 C ATOM 234 CD1 ILE A 21 -5.532 -2.319 0.016 1.00 0.00 C ATOM 0 H ILE A 21 -9.481 -1.705 -0.363 1.00 0.00 H new ATOM 0 HA ILE A 21 -8.151 0.826 -0.408 1.00 0.00 H new ATOM 0 HB ILE A 21 -7.629 -1.818 -1.802 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -6.415 -0.476 0.666 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -7.510 -1.843 0.693 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.352 -0.953 -2.220 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -6.585 0.014 -3.064 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.837 0.632 -1.572 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -5.187 -2.575 1.018 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -5.836 -3.226 -0.506 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -4.724 -1.837 -0.534 1.00 0.00 H new ATOM 245 N SER A 22 -9.702 -0.165 -3.184 1.00 0.00 N ATOM 246 CA SER A 22 -10.245 0.330 -4.455 1.00 0.00 C ATOM 247 C SER A 22 -11.196 1.515 -4.270 1.00 0.00 C ATOM 248 O SER A 22 -11.094 2.496 -5.006 1.00 0.00 O ATOM 249 CB SER A 22 -10.934 -0.786 -5.249 1.00 0.00 C ATOM 250 OG SER A 22 -10.020 -1.838 -5.511 1.00 0.00 O ATOM 0 H SER A 22 -9.929 -1.139 -2.986 1.00 0.00 H new ATOM 0 HA SER A 22 -9.389 0.685 -5.028 1.00 0.00 H new ATOM 0 HB2 SER A 22 -11.787 -1.167 -4.688 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.321 -0.389 -6.187 1.00 0.00 H new ATOM 0 HG SER A 22 -10.472 -2.545 -6.017 1.00 0.00 H new ATOM 255 N ARG A 23 -12.066 1.483 -3.251 1.00 0.00 N ATOM 256 CA ARG A 23 -12.933 2.610 -2.874 1.00 0.00 C ATOM 257 C ARG A 23 -12.165 3.777 -2.267 1.00 0.00 C ATOM 258 O ARG A 23 -12.478 4.908 -2.621 1.00 0.00 O ATOM 259 CB ARG A 23 -14.045 2.158 -1.914 1.00 0.00 C ATOM 260 CG ARG A 23 -15.148 1.349 -2.628 1.00 0.00 C ATOM 261 CD ARG A 23 -16.569 1.808 -2.248 1.00 0.00 C ATOM 262 NE ARG A 23 -17.226 2.585 -3.323 1.00 0.00 N ATOM 263 CZ ARG A 23 -16.990 3.825 -3.718 1.00 0.00 C ATOM 264 NH1 ARG A 23 -16.080 4.581 -3.171 1.00 0.00 N ATOM 265 NH2 ARG A 23 -17.676 4.339 -4.697 1.00 0.00 N ATOM 0 H ARG A 23 -12.190 0.663 -2.657 1.00 0.00 H new ATOM 0 HA ARG A 23 -13.381 2.966 -3.802 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -13.610 1.551 -1.119 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.490 3.033 -1.440 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -15.018 1.440 -3.706 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -15.035 0.293 -2.382 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -17.178 0.935 -2.013 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.520 2.415 -1.344 1.00 0.00 H new ATOM 0 HE ARG A 23 -17.964 2.096 -3.830 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -15.513 4.222 -2.403 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -15.935 5.532 -3.511 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -18.397 3.786 -5.161 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -17.493 5.295 -5.001 1.00 0.00 H new ATOM 276 N ALA A 24 -11.161 3.555 -1.417 1.00 0.00 N ATOM 277 CA ALA A 24 -10.313 4.637 -0.906 1.00 0.00 C ATOM 278 C ALA A 24 -9.590 5.374 -2.051 1.00 0.00 C ATOM 279 O ALA A 24 -9.605 6.605 -2.103 1.00 0.00 O ATOM 280 CB ALA A 24 -9.332 4.072 0.130 1.00 0.00 C ATOM 0 H ALA A 24 -10.913 2.630 -1.065 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.940 5.380 -0.414 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -8.701 4.876 0.510 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.890 3.627 0.954 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -8.707 3.311 -0.338 1.00 0.00 H new ATOM 286 N PHE A 25 -9.036 4.635 -3.018 1.00 0.00 N ATOM 287 CA PHE A 25 -8.382 5.199 -4.201 1.00 0.00 C ATOM 288 C PHE A 25 -9.337 5.808 -5.242 1.00 0.00 C ATOM 289 O PHE A 25 -8.958 6.767 -5.910 1.00 0.00 O ATOM 290 CB PHE A 25 -7.498 4.134 -4.857 1.00 0.00 C ATOM 291 CG PHE A 25 -6.194 3.818 -4.137 1.00 0.00 C ATOM 292 CD1 PHE A 25 -5.393 4.838 -3.578 1.00 0.00 C ATOM 293 CD2 PHE A 25 -5.730 2.489 -4.109 1.00 0.00 C ATOM 294 CE1 PHE A 25 -4.195 4.520 -2.917 1.00 0.00 C ATOM 295 CE2 PHE A 25 -4.512 2.174 -3.478 1.00 0.00 C ATOM 296 CZ PHE A 25 -3.769 3.185 -2.848 1.00 0.00 C ATOM 0 H PHE A 25 -9.030 3.615 -3.000 1.00 0.00 H new ATOM 0 HA PHE A 25 -7.784 6.035 -3.838 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -8.075 3.213 -4.944 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -7.262 4.459 -5.870 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.704 5.869 -3.659 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -6.312 1.707 -4.574 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -3.603 5.301 -2.463 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -4.150 1.157 -3.478 1.00 0.00 H new ATOM 0 HZ PHE A 25 -2.867 2.934 -2.309 1.00 0.00 H new ATOM 305 N ALA A 26 -10.565 5.302 -5.385 1.00 0.00 N ATOM 306 CA ALA A 26 -11.588 5.914 -6.241 1.00 0.00 C ATOM 307 C ALA A 26 -12.277 7.132 -5.583 1.00 0.00 C ATOM 308 O ALA A 26 -12.759 8.026 -6.282 1.00 0.00 O ATOM 309 CB ALA A 26 -12.608 4.836 -6.631 1.00 0.00 C ATOM 0 H ALA A 26 -10.879 4.456 -4.910 1.00 0.00 H new ATOM 0 HA ALA A 26 -11.100 6.306 -7.133 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -13.376 5.275 -7.268 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -12.103 4.035 -7.171 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -13.071 4.431 -5.731 1.00 0.00 H new ATOM 315 N SER A 27 -12.316 7.183 -4.245 1.00 0.00 N ATOM 316 CA SER A 27 -12.818 8.313 -3.449 1.00 0.00 C ATOM 317 C SER A 27 -11.944 9.563 -3.617 1.00 0.00 C ATOM 318 O SER A 27 -12.465 10.669 -3.789 1.00 0.00 O ATOM 319 CB SER A 27 -12.869 7.910 -1.970 1.00 0.00 C ATOM 320 OG SER A 27 -13.349 8.964 -1.161 1.00 0.00 O ATOM 0 H SER A 27 -11.987 6.411 -3.665 1.00 0.00 H new ATOM 0 HA SER A 27 -13.818 8.560 -3.806 1.00 0.00 H new ATOM 0 HB2 SER A 27 -13.512 7.038 -1.852 1.00 0.00 H new ATOM 0 HB3 SER A 27 -11.873 7.619 -1.637 1.00 0.00 H new ATOM 0 HG SER A 27 -13.020 8.849 -0.245 1.00 0.00 H new ATOM 325 N VAL A 28 -10.615 9.397 -3.621 1.00 0.00 N ATOM 326 CA VAL A 28 -9.669 10.487 -3.915 1.00 0.00 C ATOM 327 C VAL A 28 -9.616 10.800 -5.419 1.00 0.00 C ATOM 328 O VAL A 28 -9.598 9.901 -6.262 1.00 0.00 O ATOM 329 CB VAL A 28 -8.261 10.209 -3.345 1.00 0.00 C ATOM 330 CG1 VAL A 28 -8.307 10.118 -1.814 1.00 0.00 C ATOM 331 CG2 VAL A 28 -7.594 8.940 -3.875 1.00 0.00 C ATOM 0 H VAL A 28 -10.163 8.505 -3.421 1.00 0.00 H new ATOM 0 HA VAL A 28 -10.046 11.375 -3.407 1.00 0.00 H new ATOM 0 HB VAL A 28 -7.659 11.054 -3.681 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -7.306 9.922 -1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -8.674 11.059 -1.404 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -8.974 9.308 -1.518 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -6.610 8.828 -3.419 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -8.209 8.075 -3.627 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -7.486 9.011 -4.957 1.00 0.00 H new ATOM 341 N SER A 29 -9.539 12.093 -5.750 1.00 0.00 N ATOM 342 CA SER A 29 -9.476 12.620 -7.132 1.00 0.00 C ATOM 343 C SER A 29 -8.276 13.559 -7.344 1.00 0.00 C ATOM 344 O SER A 29 -8.242 14.343 -8.294 1.00 0.00 O ATOM 345 CB SER A 29 -10.795 13.316 -7.506 1.00 0.00 C ATOM 346 OG SER A 29 -11.871 12.391 -7.528 1.00 0.00 O ATOM 0 H SER A 29 -9.518 12.831 -5.047 1.00 0.00 H new ATOM 0 HA SER A 29 -9.331 11.769 -7.797 1.00 0.00 H new ATOM 0 HB2 SER A 29 -11.008 14.109 -6.789 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.697 13.788 -8.484 1.00 0.00 H new ATOM 0 HG SER A 29 -12.699 12.858 -7.767 1.00 0.00 H new ATOM 351 N SER A 30 -7.274 13.474 -6.461 1.00 0.00 N ATOM 352 CA SER A 30 -6.025 14.242 -6.512 1.00 0.00 C ATOM 353 C SER A 30 -4.837 13.336 -6.198 1.00 0.00 C ATOM 354 O SER A 30 -4.899 12.520 -5.274 1.00 0.00 O ATOM 355 CB SER A 30 -6.091 15.393 -5.505 1.00 0.00 C ATOM 356 OG SER A 30 -4.886 16.140 -5.542 1.00 0.00 O ATOM 0 H SER A 30 -7.313 12.844 -5.660 1.00 0.00 H new ATOM 0 HA SER A 30 -5.895 14.649 -7.515 1.00 0.00 H new ATOM 0 HB2 SER A 30 -6.937 16.040 -5.735 1.00 0.00 H new ATOM 0 HB3 SER A 30 -6.254 15.000 -4.501 1.00 0.00 H new ATOM 0 HG SER A 30 -4.937 16.875 -4.896 1.00 0.00 H new ATOM 361 N ALA A 31 -3.744 13.472 -6.954 1.00 0.00 N ATOM 362 CA ALA A 31 -2.506 12.730 -6.714 1.00 0.00 C ATOM 363 C ALA A 31 -1.941 12.990 -5.308 1.00 0.00 C ATOM 364 O ALA A 31 -1.413 12.071 -4.684 1.00 0.00 O ATOM 365 CB ALA A 31 -1.491 13.104 -7.800 1.00 0.00 C ATOM 0 H ALA A 31 -3.694 14.103 -7.753 1.00 0.00 H new ATOM 0 HA ALA A 31 -2.719 11.662 -6.763 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -0.562 12.558 -7.634 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.894 12.845 -8.779 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -1.294 14.175 -7.760 1.00 0.00 H new ATOM 371 N SER A 32 -2.110 14.209 -4.781 1.00 0.00 N ATOM 372 CA SER A 32 -1.736 14.557 -3.405 1.00 0.00 C ATOM 373 C SER A 32 -2.630 13.864 -2.370 1.00 0.00 C ATOM 374 O SER A 32 -2.127 13.348 -1.376 1.00 0.00 O ATOM 375 CB SER A 32 -1.793 16.076 -3.212 1.00 0.00 C ATOM 376 OG SER A 32 -1.088 16.442 -2.036 1.00 0.00 O ATOM 0 H SER A 32 -2.513 14.988 -5.302 1.00 0.00 H new ATOM 0 HA SER A 32 -0.717 14.205 -3.246 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.359 16.577 -4.077 1.00 0.00 H new ATOM 0 HB3 SER A 32 -2.830 16.403 -3.141 1.00 0.00 H new ATOM 0 HG SER A 32 -1.128 17.414 -1.920 1.00 0.00 H new ATOM 381 N ALA A 33 -3.942 13.762 -2.618 1.00 0.00 N ATOM 382 CA ALA A 33 -4.861 13.032 -1.740 1.00 0.00 C ATOM 383 C ALA A 33 -4.547 11.526 -1.707 1.00 0.00 C ATOM 384 O ALA A 33 -4.458 10.943 -0.627 1.00 0.00 O ATOM 385 CB ALA A 33 -6.304 13.303 -2.180 1.00 0.00 C ATOM 0 H ALA A 33 -4.394 14.182 -3.430 1.00 0.00 H new ATOM 0 HA ALA A 33 -4.731 13.391 -0.719 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.991 12.762 -1.529 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -6.509 14.372 -2.116 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -6.440 12.969 -3.209 1.00 0.00 H new ATOM 391 N ALA A 34 -4.307 10.902 -2.867 1.00 0.00 N ATOM 392 CA ALA A 34 -3.870 9.508 -2.946 1.00 0.00 C ATOM 393 C ALA A 34 -2.494 9.294 -2.286 1.00 0.00 C ATOM 394 O ALA A 34 -2.328 8.346 -1.523 1.00 0.00 O ATOM 395 CB ALA A 34 -3.880 9.067 -4.416 1.00 0.00 C ATOM 0 H ALA A 34 -4.411 11.352 -3.776 1.00 0.00 H new ATOM 0 HA ALA A 34 -4.565 8.885 -2.383 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -3.556 8.029 -4.487 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.889 9.160 -4.817 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -3.202 9.699 -4.990 1.00 0.00 H new ATOM 401 N SER A 35 -1.531 10.191 -2.521 1.00 0.00 N ATOM 402 CA SER A 35 -0.210 10.206 -1.874 1.00 0.00 C ATOM 403 C SER A 35 -0.323 10.275 -0.344 1.00 0.00 C ATOM 404 O SER A 35 0.237 9.424 0.346 1.00 0.00 O ATOM 405 CB SER A 35 0.597 11.380 -2.444 1.00 0.00 C ATOM 406 OG SER A 35 1.751 11.676 -1.686 1.00 0.00 O ATOM 0 H SER A 35 -1.651 10.953 -3.189 1.00 0.00 H new ATOM 0 HA SER A 35 0.310 9.273 -2.090 1.00 0.00 H new ATOM 0 HB2 SER A 35 0.891 11.148 -3.468 1.00 0.00 H new ATOM 0 HB3 SER A 35 -0.039 12.264 -2.487 1.00 0.00 H new ATOM 0 HG SER A 35 2.226 12.429 -2.095 1.00 0.00 H new ATOM 411 N SER A 36 -1.117 11.206 0.196 1.00 0.00 N ATOM 412 CA SER A 36 -1.390 11.334 1.635 1.00 0.00 C ATOM 413 C SER A 36 -2.108 10.119 2.223 1.00 0.00 C ATOM 414 O SER A 36 -1.757 9.692 3.323 1.00 0.00 O ATOM 415 CB SER A 36 -2.226 12.589 1.916 1.00 0.00 C ATOM 416 OG SER A 36 -1.456 13.758 1.688 1.00 0.00 O ATOM 0 H SER A 36 -1.599 11.908 -0.366 1.00 0.00 H new ATOM 0 HA SER A 36 -0.416 11.409 2.118 1.00 0.00 H new ATOM 0 HB2 SER A 36 -3.108 12.597 1.276 1.00 0.00 H new ATOM 0 HB3 SER A 36 -2.580 12.574 2.947 1.00 0.00 H new ATOM 0 HG SER A 36 -1.440 13.957 0.729 1.00 0.00 H new ATOM 421 N LEU A 37 -3.076 9.518 1.513 1.00 0.00 N ATOM 422 CA LEU A 37 -3.708 8.270 1.954 1.00 0.00 C ATOM 423 C LEU A 37 -2.687 7.124 1.950 1.00 0.00 C ATOM 424 O LEU A 37 -2.517 6.471 2.969 1.00 0.00 O ATOM 425 CB LEU A 37 -5.032 8.003 1.187 1.00 0.00 C ATOM 426 CG LEU A 37 -5.146 6.799 0.223 1.00 0.00 C ATOM 427 CD1 LEU A 37 -5.273 5.453 0.942 1.00 0.00 C ATOM 428 CD2 LEU A 37 -6.410 6.948 -0.624 1.00 0.00 C ATOM 0 H LEU A 37 -3.437 9.879 0.630 1.00 0.00 H new ATOM 0 HA LEU A 37 -4.026 8.358 2.993 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.820 7.896 1.932 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -5.258 8.900 0.611 1.00 0.00 H new ATOM 0 HG LEU A 37 -4.230 6.802 -0.368 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.349 4.653 0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.395 5.290 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -6.166 5.457 1.567 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.494 6.101 -1.305 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -7.283 6.977 0.028 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.355 7.872 -1.200 1.00 0.00 H new ATOM 439 N ALA A 38 -1.940 6.908 0.868 1.00 0.00 N ATOM 440 CA ALA A 38 -0.952 5.833 0.774 1.00 0.00 C ATOM 441 C ALA A 38 0.200 5.984 1.784 1.00 0.00 C ATOM 442 O ALA A 38 0.691 4.984 2.307 1.00 0.00 O ATOM 443 CB ALA A 38 -0.443 5.782 -0.665 1.00 0.00 C ATOM 0 H ALA A 38 -2.004 7.479 0.025 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.431 4.890 1.036 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.296 4.987 -0.761 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -1.277 5.586 -1.339 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.015 6.737 -0.923 1.00 0.00 H new ATOM 449 N TYR A 39 0.574 7.221 2.121 1.00 0.00 N ATOM 450 CA TYR A 39 1.430 7.552 3.259 1.00 0.00 C ATOM 451 C TYR A 39 0.776 7.119 4.584 1.00 0.00 C ATOM 452 O TYR A 39 1.328 6.289 5.299 1.00 0.00 O ATOM 453 CB TYR A 39 1.725 9.063 3.220 1.00 0.00 C ATOM 454 CG TYR A 39 2.729 9.570 4.237 1.00 0.00 C ATOM 455 CD1 TYR A 39 2.303 9.929 5.530 1.00 0.00 C ATOM 456 CD2 TYR A 39 4.085 9.715 3.884 1.00 0.00 C ATOM 457 CE1 TYR A 39 3.234 10.400 6.476 1.00 0.00 C ATOM 458 CE2 TYR A 39 5.026 10.156 4.835 1.00 0.00 C ATOM 459 CZ TYR A 39 4.603 10.489 6.139 1.00 0.00 C ATOM 460 OH TYR A 39 5.514 10.900 7.062 1.00 0.00 O ATOM 0 H TYR A 39 0.280 8.043 1.593 1.00 0.00 H new ATOM 0 HA TYR A 39 2.372 7.007 3.194 1.00 0.00 H new ATOM 0 HB2 TYR A 39 2.087 9.317 2.224 1.00 0.00 H new ATOM 0 HB3 TYR A 39 0.788 9.600 3.365 1.00 0.00 H new ATOM 0 HD1 TYR A 39 1.260 9.843 5.797 1.00 0.00 H new ATOM 0 HD2 TYR A 39 4.405 9.487 2.878 1.00 0.00 H new ATOM 0 HE1 TYR A 39 2.901 10.694 7.460 1.00 0.00 H new ATOM 0 HE2 TYR A 39 6.069 10.239 4.566 1.00 0.00 H new ATOM 0 HH TYR A 39 6.408 10.901 6.661 1.00 0.00 H new ATOM 469 N ASN A 40 -0.433 7.607 4.891 1.00 0.00 N ATOM 470 CA ASN A 40 -1.170 7.314 6.130 1.00 0.00 C ATOM 471 C ASN A 40 -1.463 5.812 6.345 1.00 0.00 C ATOM 472 O ASN A 40 -1.298 5.295 7.451 1.00 0.00 O ATOM 473 CB ASN A 40 -2.460 8.151 6.108 1.00 0.00 C ATOM 474 CG ASN A 40 -3.271 7.999 7.384 1.00 0.00 C ATOM 475 OD1 ASN A 40 -4.163 7.171 7.488 1.00 0.00 O ATOM 476 ND2 ASN A 40 -2.990 8.795 8.392 1.00 0.00 N ATOM 0 H ASN A 40 -0.941 8.234 4.267 1.00 0.00 H new ATOM 0 HA ASN A 40 -0.545 7.585 6.981 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -2.206 9.201 5.965 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -3.070 7.852 5.255 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.517 8.722 9.262 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -2.245 9.486 8.304 1.00 0.00 H new ATOM 482 N ILE A 41 -1.844 5.095 5.287 1.00 0.00 N ATOM 483 CA ILE A 41 -2.025 3.637 5.267 1.00 0.00 C ATOM 484 C ILE A 41 -0.669 2.923 5.386 1.00 0.00 C ATOM 485 O ILE A 41 -0.538 1.943 6.124 1.00 0.00 O ATOM 486 CB ILE A 41 -2.804 3.246 3.987 1.00 0.00 C ATOM 487 CG1 ILE A 41 -4.220 3.869 3.941 1.00 0.00 C ATOM 488 CG2 ILE A 41 -2.950 1.730 3.796 1.00 0.00 C ATOM 489 CD1 ILE A 41 -5.080 3.696 5.191 1.00 0.00 C ATOM 0 H ILE A 41 -2.043 5.527 4.385 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.612 3.315 6.127 1.00 0.00 H new ATOM 0 HB ILE A 41 -2.194 3.646 3.178 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -4.117 4.936 3.742 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -4.756 3.437 3.096 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -3.506 1.531 2.880 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.962 1.275 3.727 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.486 1.306 4.645 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.047 4.175 5.036 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.228 2.634 5.387 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.580 4.156 6.043 1.00 0.00 H new ATOM 500 N GLY A 42 0.359 3.473 4.736 1.00 0.00 N ATOM 501 CA GLY A 42 1.761 3.093 4.873 1.00 0.00 C ATOM 502 C GLY A 42 2.300 3.165 6.303 1.00 0.00 C ATOM 503 O GLY A 42 3.071 2.286 6.669 1.00 0.00 O ATOM 0 H GLY A 42 0.227 4.232 4.068 1.00 0.00 H new ATOM 0 HA2 GLY A 42 1.887 2.076 4.501 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.364 3.742 4.238 1.00 0.00 H new ATOM 507 N LEU A 43 1.880 4.127 7.141 1.00 0.00 N ATOM 508 CA LEU A 43 2.258 4.165 8.567 1.00 0.00 C ATOM 509 C LEU A 43 1.802 2.899 9.304 1.00 0.00 C ATOM 510 O LEU A 43 2.601 2.273 9.998 1.00 0.00 O ATOM 511 CB LEU A 43 1.684 5.400 9.304 1.00 0.00 C ATOM 512 CG LEU A 43 2.509 6.698 9.318 1.00 0.00 C ATOM 513 CD1 LEU A 43 3.963 6.481 9.727 1.00 0.00 C ATOM 514 CD2 LEU A 43 2.510 7.405 7.976 1.00 0.00 C ATOM 0 H LEU A 43 1.274 4.895 6.854 1.00 0.00 H new ATOM 0 HA LEU A 43 3.346 4.228 8.579 1.00 0.00 H new ATOM 0 HB2 LEU A 43 0.715 5.629 8.861 1.00 0.00 H new ATOM 0 HB3 LEU A 43 1.502 5.112 10.339 1.00 0.00 H new ATOM 0 HG LEU A 43 2.012 7.318 10.064 1.00 0.00 H new ATOM 0 HD11 LEU A 43 4.490 7.435 9.717 1.00 0.00 H new ATOM 0 HD12 LEU A 43 3.999 6.057 10.731 1.00 0.00 H new ATOM 0 HD13 LEU A 43 4.440 5.796 9.026 1.00 0.00 H new ATOM 0 HD21 LEU A 43 3.107 8.314 8.044 1.00 0.00 H new ATOM 0 HD22 LEU A 43 2.936 6.747 7.218 1.00 0.00 H new ATOM 0 HD23 LEU A 43 1.488 7.662 7.700 1.00 0.00 H new ATOM 525 N SER A 44 0.542 2.494 9.148 1.00 0.00 N ATOM 526 CA SER A 44 0.022 1.282 9.794 1.00 0.00 C ATOM 527 C SER A 44 0.649 0.014 9.221 1.00 0.00 C ATOM 528 O SER A 44 1.016 -0.873 9.987 1.00 0.00 O ATOM 529 CB SER A 44 -1.484 1.182 9.618 1.00 0.00 C ATOM 530 OG SER A 44 -2.144 2.298 10.189 1.00 0.00 O ATOM 0 H SER A 44 -0.144 2.989 8.577 1.00 0.00 H new ATOM 0 HA SER A 44 0.279 1.363 10.850 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.725 1.118 8.557 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.847 0.265 10.083 1.00 0.00 H new ATOM 0 HG SER A 44 -3.111 2.208 10.059 1.00 0.00 H new ATOM 535 N ALA A 45 0.837 -0.070 7.897 1.00 0.00 N ATOM 536 CA ALA A 45 1.564 -1.180 7.280 1.00 0.00 C ATOM 537 C ALA A 45 3.003 -1.279 7.823 1.00 0.00 C ATOM 538 O ALA A 45 3.450 -2.354 8.218 1.00 0.00 O ATOM 539 CB ALA A 45 1.529 -1.018 5.758 1.00 0.00 C ATOM 0 H ALA A 45 0.492 0.623 7.233 1.00 0.00 H new ATOM 0 HA ALA A 45 1.077 -2.120 7.539 1.00 0.00 H new ATOM 0 HB1 ALA A 45 2.069 -1.842 5.292 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.494 -1.022 5.415 1.00 0.00 H new ATOM 0 HB3 ALA A 45 1.999 -0.074 5.482 1.00 0.00 H new ATOM 545 N ALA A 46 3.699 -0.146 7.929 1.00 0.00 N ATOM 546 CA ALA A 46 5.033 -0.043 8.507 1.00 0.00 C ATOM 547 C ALA A 46 5.076 -0.433 9.998 1.00 0.00 C ATOM 548 O ALA A 46 5.993 -1.144 10.405 1.00 0.00 O ATOM 549 CB ALA A 46 5.550 1.379 8.259 1.00 0.00 C ATOM 0 H ALA A 46 3.336 0.750 7.604 1.00 0.00 H new ATOM 0 HA ALA A 46 5.690 -0.764 8.019 1.00 0.00 H new ATOM 0 HB1 ALA A 46 6.549 1.482 8.683 1.00 0.00 H new ATOM 0 HB2 ALA A 46 5.589 1.570 7.187 1.00 0.00 H new ATOM 0 HB3 ALA A 46 4.880 2.097 8.731 1.00 0.00 H new ATOM 555 N ARG A 47 4.079 -0.052 10.810 1.00 0.00 N ATOM 556 CA ARG A 47 3.938 -0.508 12.211 1.00 0.00 C ATOM 557 C ARG A 47 3.687 -2.016 12.312 1.00 0.00 C ATOM 558 O ARG A 47 4.365 -2.691 13.087 1.00 0.00 O ATOM 559 CB ARG A 47 2.818 0.272 12.921 1.00 0.00 C ATOM 560 CG ARG A 47 3.237 1.707 13.275 1.00 0.00 C ATOM 561 CD ARG A 47 2.073 2.443 13.948 1.00 0.00 C ATOM 562 NE ARG A 47 2.240 3.908 13.880 1.00 0.00 N ATOM 563 CZ ARG A 47 1.299 4.810 14.100 1.00 0.00 C ATOM 564 NH1 ARG A 47 0.112 4.484 14.531 1.00 0.00 N ATOM 565 NH2 ARG A 47 1.532 6.073 13.882 1.00 0.00 N ATOM 0 H ARG A 47 3.340 0.586 10.516 1.00 0.00 H new ATOM 0 HA ARG A 47 4.886 -0.307 12.710 1.00 0.00 H new ATOM 0 HB2 ARG A 47 1.937 0.301 12.280 1.00 0.00 H new ATOM 0 HB3 ARG A 47 2.533 -0.255 13.831 1.00 0.00 H new ATOM 0 HG2 ARG A 47 4.100 1.689 13.941 1.00 0.00 H new ATOM 0 HG3 ARG A 47 3.541 2.239 12.373 1.00 0.00 H new ATOM 0 HD2 ARG A 47 1.137 2.161 13.466 1.00 0.00 H new ATOM 0 HD3 ARG A 47 2.001 2.133 14.991 1.00 0.00 H new ATOM 0 HE ARG A 47 3.168 4.257 13.641 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -0.115 3.506 14.709 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -0.589 5.207 14.690 1.00 0.00 H new ATOM 0 HH21 ARG A 47 2.445 6.371 13.539 1.00 0.00 H new ATOM 0 HH22 ARG A 47 0.801 6.764 14.054 1.00 0.00 H new ATOM 576 N SER A 48 2.785 -2.563 11.494 1.00 0.00 N ATOM 577 CA SER A 48 2.502 -4.009 11.405 1.00 0.00 C ATOM 578 C SER A 48 3.707 -4.846 10.945 1.00 0.00 C ATOM 579 O SER A 48 3.790 -6.034 11.264 1.00 0.00 O ATOM 580 CB SER A 48 1.324 -4.263 10.457 1.00 0.00 C ATOM 581 OG SER A 48 0.129 -3.733 11.010 1.00 0.00 O ATOM 0 H SER A 48 2.215 -2.006 10.858 1.00 0.00 H new ATOM 0 HA SER A 48 2.257 -4.328 12.418 1.00 0.00 H new ATOM 0 HB2 SER A 48 1.521 -3.803 9.489 1.00 0.00 H new ATOM 0 HB3 SER A 48 1.210 -5.333 10.284 1.00 0.00 H new ATOM 0 HG SER A 48 0.102 -2.764 10.863 1.00 0.00 H new ATOM 586 N LEU A 49 4.661 -4.226 10.241 1.00 0.00 N ATOM 587 CA LEU A 49 5.912 -4.831 9.764 1.00 0.00 C ATOM 588 C LEU A 49 7.147 -4.387 10.587 1.00 0.00 C ATOM 589 O LEU A 49 8.276 -4.743 10.249 1.00 0.00 O ATOM 590 CB LEU A 49 6.056 -4.513 8.260 1.00 0.00 C ATOM 591 CG LEU A 49 4.937 -5.103 7.374 1.00 0.00 C ATOM 592 CD1 LEU A 49 5.037 -4.536 5.961 1.00 0.00 C ATOM 593 CD2 LEU A 49 5.002 -6.628 7.272 1.00 0.00 C ATOM 0 H LEU A 49 4.579 -3.244 9.976 1.00 0.00 H new ATOM 0 HA LEU A 49 5.865 -5.911 9.905 1.00 0.00 H new ATOM 0 HB2 LEU A 49 6.074 -3.431 8.130 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.017 -4.892 7.911 1.00 0.00 H new ATOM 0 HG LEU A 49 3.995 -4.828 7.848 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.244 -4.957 5.343 1.00 0.00 H new ATOM 0 HD12 LEU A 49 4.932 -3.452 5.996 1.00 0.00 H new ATOM 0 HD13 LEU A 49 6.006 -4.793 5.533 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.191 -6.985 6.637 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.958 -6.923 6.840 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.903 -7.064 8.266 1.00 0.00 H new ATOM 604 N GLY A 50 6.943 -3.632 11.677 1.00 0.00 N ATOM 605 CA GLY A 50 7.979 -3.163 12.609 1.00 0.00 C ATOM 606 C GLY A 50 9.112 -2.334 11.983 1.00 0.00 C ATOM 607 O GLY A 50 10.257 -2.419 12.433 1.00 0.00 O ATOM 0 H GLY A 50 6.010 -3.318 11.944 1.00 0.00 H new ATOM 0 HA2 GLY A 50 7.501 -2.564 13.384 1.00 0.00 H new ATOM 0 HA3 GLY A 50 8.418 -4.030 13.102 1.00 0.00 H new ATOM 611 N ILE A 51 8.820 -1.565 10.928 1.00 0.00 N ATOM 612 CA ILE A 51 9.798 -0.769 10.167 1.00 0.00 C ATOM 613 C ILE A 51 10.458 0.305 11.054 1.00 0.00 C ATOM 614 O ILE A 51 9.776 1.099 11.707 1.00 0.00 O ATOM 615 CB ILE A 51 9.114 -0.127 8.941 1.00 0.00 C ATOM 616 CG1 ILE A 51 8.419 -1.143 8.004 1.00 0.00 C ATOM 617 CG2 ILE A 51 10.090 0.733 8.123 1.00 0.00 C ATOM 618 CD1 ILE A 51 9.330 -2.146 7.286 1.00 0.00 C ATOM 0 H ILE A 51 7.870 -1.475 10.567 1.00 0.00 H new ATOM 0 HA ILE A 51 10.588 -1.435 9.820 1.00 0.00 H new ATOM 0 HB ILE A 51 8.336 0.507 9.366 1.00 0.00 H new ATOM 0 HG12 ILE A 51 7.689 -1.703 8.589 1.00 0.00 H new ATOM 0 HG13 ILE A 51 7.863 -0.586 7.250 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.567 1.165 7.270 1.00 0.00 H new ATOM 0 HG22 ILE A 51 10.484 1.532 8.750 1.00 0.00 H new ATOM 0 HG23 ILE A 51 10.912 0.112 7.768 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.726 -2.803 6.660 1.00 0.00 H new ATOM 0 HD12 ILE A 51 10.044 -1.608 6.663 1.00 0.00 H new ATOM 0 HD13 ILE A 51 9.868 -2.741 8.024 1.00 0.00 H new ATOM 629 N ALA A 52 11.791 0.374 11.028 1.00 0.00 N ATOM 630 CA ALA A 52 12.624 1.280 11.835 1.00 0.00 C ATOM 631 C ALA A 52 12.696 2.746 11.322 1.00 0.00 C ATOM 632 O ALA A 52 13.572 3.508 11.739 1.00 0.00 O ATOM 633 CB ALA A 52 14.010 0.625 11.940 1.00 0.00 C ATOM 0 H ALA A 52 12.347 -0.225 10.418 1.00 0.00 H new ATOM 0 HA ALA A 52 12.162 1.400 12.815 1.00 0.00 H new ATOM 0 HB1 ALA A 52 14.669 1.260 12.532 1.00 0.00 H new ATOM 0 HB2 ALA A 52 13.917 -0.349 12.421 1.00 0.00 H new ATOM 0 HB3 ALA A 52 14.429 0.498 10.942 1.00 0.00 H new ATOM 639 N SER A 53 11.792 3.123 10.409 1.00 0.00 N ATOM 640 CA SER A 53 11.653 4.424 9.725 1.00 0.00 C ATOM 641 C SER A 53 10.331 4.440 8.943 1.00 0.00 C ATOM 642 O SER A 53 10.304 4.494 7.713 1.00 0.00 O ATOM 643 CB SER A 53 12.847 4.725 8.793 1.00 0.00 C ATOM 644 OG SER A 53 13.851 5.464 9.470 1.00 0.00 O ATOM 0 H SER A 53 11.073 2.470 10.099 1.00 0.00 H new ATOM 0 HA SER A 53 11.645 5.210 10.480 1.00 0.00 H new ATOM 0 HB2 SER A 53 13.267 3.790 8.422 1.00 0.00 H new ATOM 0 HB3 SER A 53 12.502 5.286 7.925 1.00 0.00 H new ATOM 0 HG SER A 53 14.036 5.046 10.337 1.00 0.00 H new ATOM 649 N ASP A 54 9.202 4.332 9.652 1.00 0.00 N ATOM 650 CA ASP A 54 7.862 4.397 9.044 1.00 0.00 C ATOM 651 C ASP A 54 7.640 5.654 8.173 1.00 0.00 C ATOM 652 O ASP A 54 6.973 5.567 7.146 1.00 0.00 O ATOM 653 CB ASP A 54 6.769 4.192 10.110 1.00 0.00 C ATOM 654 CG ASP A 54 6.772 5.178 11.299 1.00 0.00 C ATOM 655 OD1 ASP A 54 7.255 6.329 11.168 1.00 0.00 O ATOM 656 OD2 ASP A 54 6.288 4.791 12.386 1.00 0.00 O ATOM 0 H ASP A 54 9.188 4.197 10.663 1.00 0.00 H new ATOM 0 HA ASP A 54 7.788 3.569 8.339 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.798 4.253 9.619 1.00 0.00 H new ATOM 0 HB3 ASP A 54 6.863 3.181 10.505 1.00 0.00 H new ATOM 660 N THR A 55 8.290 6.777 8.499 1.00 0.00 N ATOM 661 CA THR A 55 8.359 8.006 7.686 1.00 0.00 C ATOM 662 C THR A 55 8.979 7.790 6.297 1.00 0.00 C ATOM 663 O THR A 55 8.457 8.292 5.299 1.00 0.00 O ATOM 664 CB THR A 55 9.112 9.104 8.465 1.00 0.00 C ATOM 665 OG1 THR A 55 9.074 10.330 7.767 1.00 0.00 O ATOM 666 CG2 THR A 55 10.588 8.794 8.752 1.00 0.00 C ATOM 0 H THR A 55 8.806 6.862 9.374 1.00 0.00 H new ATOM 0 HA THR A 55 7.333 8.324 7.501 1.00 0.00 H new ATOM 0 HB THR A 55 8.588 9.157 9.419 1.00 0.00 H new ATOM 0 HG1 THR A 55 9.556 11.013 8.279 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.033 9.622 9.303 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.660 7.883 9.346 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.120 8.656 7.811 1.00 0.00 H new ATOM 674 N ALA A 56 10.052 6.995 6.194 1.00 0.00 N ATOM 675 CA ALA A 56 10.722 6.701 4.926 1.00 0.00 C ATOM 676 C ALA A 56 9.929 5.689 4.088 1.00 0.00 C ATOM 677 O ALA A 56 9.820 5.854 2.872 1.00 0.00 O ATOM 678 CB ALA A 56 12.137 6.182 5.209 1.00 0.00 C ATOM 0 H ALA A 56 10.481 6.535 6.997 1.00 0.00 H new ATOM 0 HA ALA A 56 10.782 7.621 4.344 1.00 0.00 H new ATOM 0 HB1 ALA A 56 12.639 5.962 4.267 1.00 0.00 H new ATOM 0 HB2 ALA A 56 12.701 6.940 5.752 1.00 0.00 H new ATOM 0 HB3 ALA A 56 12.078 5.274 5.809 1.00 0.00 H new ATOM 684 N LEU A 57 9.333 4.674 4.728 1.00 0.00 N ATOM 685 CA LEU A 57 8.472 3.699 4.051 1.00 0.00 C ATOM 686 C LEU A 57 7.207 4.371 3.506 1.00 0.00 C ATOM 687 O LEU A 57 6.920 4.277 2.316 1.00 0.00 O ATOM 688 CB LEU A 57 8.119 2.542 5.011 1.00 0.00 C ATOM 689 CG LEU A 57 8.337 1.128 4.439 1.00 0.00 C ATOM 690 CD1 LEU A 57 7.561 0.871 3.146 1.00 0.00 C ATOM 691 CD2 LEU A 57 9.815 0.839 4.186 1.00 0.00 C ATOM 0 H LEU A 57 9.435 4.507 5.729 1.00 0.00 H new ATOM 0 HA LEU A 57 9.017 3.286 3.202 1.00 0.00 H new ATOM 0 HB2 LEU A 57 8.717 2.647 5.917 1.00 0.00 H new ATOM 0 HB3 LEU A 57 7.074 2.641 5.305 1.00 0.00 H new ATOM 0 HG LEU A 57 7.954 0.455 5.207 1.00 0.00 H new ATOM 0 HD11 LEU A 57 7.760 -0.143 2.798 1.00 0.00 H new ATOM 0 HD12 LEU A 57 6.494 0.988 3.333 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.876 1.585 2.385 1.00 0.00 H new ATOM 0 HD21 LEU A 57 9.925 -0.168 3.783 1.00 0.00 H new ATOM 0 HD22 LEU A 57 10.210 1.561 3.471 1.00 0.00 H new ATOM 0 HD23 LEU A 57 10.367 0.917 5.123 1.00 0.00 H new ATOM 702 N ALA A 58 6.492 5.113 4.354 1.00 0.00 N ATOM 703 CA ALA A 58 5.329 5.897 3.963 1.00 0.00 C ATOM 704 C ALA A 58 5.671 6.947 2.893 1.00 0.00 C ATOM 705 O ALA A 58 4.900 7.126 1.956 1.00 0.00 O ATOM 706 CB ALA A 58 4.738 6.533 5.219 1.00 0.00 C ATOM 0 H ALA A 58 6.712 5.184 5.347 1.00 0.00 H new ATOM 0 HA ALA A 58 4.589 5.243 3.502 1.00 0.00 H new ATOM 0 HB1 ALA A 58 3.864 7.126 4.950 1.00 0.00 H new ATOM 0 HB2 ALA A 58 4.444 5.751 5.919 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.483 7.177 5.686 1.00 0.00 H new ATOM 712 N GLY A 59 6.844 7.587 2.973 1.00 0.00 N ATOM 713 CA GLY A 59 7.353 8.505 1.949 1.00 0.00 C ATOM 714 C GLY A 59 7.600 7.828 0.595 1.00 0.00 C ATOM 715 O GLY A 59 7.136 8.319 -0.432 1.00 0.00 O ATOM 0 H GLY A 59 7.477 7.479 3.766 1.00 0.00 H new ATOM 0 HA2 GLY A 59 6.641 9.320 1.815 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.284 8.950 2.300 1.00 0.00 H new ATOM 719 N ALA A 60 8.257 6.666 0.574 1.00 0.00 N ATOM 720 CA ALA A 60 8.448 5.878 -0.647 1.00 0.00 C ATOM 721 C ALA A 60 7.112 5.376 -1.238 1.00 0.00 C ATOM 722 O ALA A 60 6.913 5.425 -2.452 1.00 0.00 O ATOM 723 CB ALA A 60 9.409 4.725 -0.335 1.00 0.00 C ATOM 0 H ALA A 60 8.672 6.244 1.404 1.00 0.00 H new ATOM 0 HA ALA A 60 8.882 6.514 -1.418 1.00 0.00 H new ATOM 0 HB1 ALA A 60 9.563 4.127 -1.233 1.00 0.00 H new ATOM 0 HB2 ALA A 60 10.364 5.128 0.001 1.00 0.00 H new ATOM 0 HB3 ALA A 60 8.984 4.099 0.449 1.00 0.00 H new ATOM 729 N LEU A 61 6.163 4.963 -0.390 1.00 0.00 N ATOM 730 CA LEU A 61 4.789 4.608 -0.776 1.00 0.00 C ATOM 731 C LEU A 61 3.999 5.808 -1.335 1.00 0.00 C ATOM 732 O LEU A 61 3.255 5.666 -2.307 1.00 0.00 O ATOM 733 CB LEU A 61 4.073 4.009 0.451 1.00 0.00 C ATOM 734 CG LEU A 61 4.566 2.606 0.858 1.00 0.00 C ATOM 735 CD1 LEU A 61 3.958 2.213 2.205 1.00 0.00 C ATOM 736 CD2 LEU A 61 4.151 1.561 -0.171 1.00 0.00 C ATOM 0 H LEU A 61 6.332 4.863 0.611 1.00 0.00 H new ATOM 0 HA LEU A 61 4.838 3.876 -1.582 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.202 4.685 1.297 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.004 3.958 0.243 1.00 0.00 H new ATOM 0 HG LEU A 61 5.654 2.642 0.922 1.00 0.00 H new ATOM 0 HD11 LEU A 61 4.310 1.221 2.487 1.00 0.00 H new ATOM 0 HD12 LEU A 61 4.259 2.935 2.964 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.871 2.203 2.125 1.00 0.00 H new ATOM 0 HD21 LEU A 61 4.511 0.581 0.140 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.064 1.540 -0.250 1.00 0.00 H new ATOM 0 HD23 LEU A 61 4.580 1.814 -1.140 1.00 0.00 H new ATOM 747 N ALA A 62 4.196 7.001 -0.772 1.00 0.00 N ATOM 748 CA ALA A 62 3.636 8.253 -1.275 1.00 0.00 C ATOM 749 C ALA A 62 4.182 8.600 -2.670 1.00 0.00 C ATOM 750 O ALA A 62 3.408 8.923 -3.571 1.00 0.00 O ATOM 751 CB ALA A 62 3.943 9.360 -0.262 1.00 0.00 C ATOM 0 H ALA A 62 4.763 7.125 0.067 1.00 0.00 H new ATOM 0 HA ALA A 62 2.557 8.148 -1.388 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.533 10.304 -0.620 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.493 9.109 0.699 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.022 9.455 -0.143 1.00 0.00 H new ATOM 757 N GLN A 63 5.499 8.464 -2.880 1.00 0.00 N ATOM 758 CA GLN A 63 6.137 8.632 -4.192 1.00 0.00 C ATOM 759 C GLN A 63 5.673 7.583 -5.215 1.00 0.00 C ATOM 760 O GLN A 63 5.525 7.908 -6.392 1.00 0.00 O ATOM 761 CB GLN A 63 7.669 8.588 -4.057 1.00 0.00 C ATOM 762 CG GLN A 63 8.229 9.822 -3.333 1.00 0.00 C ATOM 763 CD GLN A 63 9.757 9.820 -3.315 1.00 0.00 C ATOM 764 OE1 GLN A 63 10.406 8.936 -2.770 1.00 0.00 O ATOM 765 NE2 GLN A 63 10.397 10.804 -3.916 1.00 0.00 N ATOM 0 H GLN A 63 6.157 8.232 -2.136 1.00 0.00 H new ATOM 0 HA GLN A 63 5.830 9.609 -4.565 1.00 0.00 H new ATOM 0 HB2 GLN A 63 7.957 7.689 -3.513 1.00 0.00 H new ATOM 0 HB3 GLN A 63 8.116 8.518 -5.048 1.00 0.00 H new ATOM 0 HG2 GLN A 63 7.872 10.726 -3.825 1.00 0.00 H new ATOM 0 HG3 GLN A 63 7.853 9.846 -2.310 1.00 0.00 H new ATOM 0 HE21 GLN A 63 9.872 11.549 -4.375 1.00 0.00 H new ATOM 0 HE22 GLN A 63 11.417 10.821 -3.922 1.00 0.00 H new ATOM 772 N ALA A 64 5.396 6.348 -4.784 1.00 0.00 N ATOM 773 CA ALA A 64 4.852 5.297 -5.642 1.00 0.00 C ATOM 774 C ALA A 64 3.482 5.685 -6.223 1.00 0.00 C ATOM 775 O ALA A 64 3.287 5.694 -7.441 1.00 0.00 O ATOM 776 CB ALA A 64 4.764 4.006 -4.822 1.00 0.00 C ATOM 0 H ALA A 64 5.546 6.050 -3.820 1.00 0.00 H new ATOM 0 HA ALA A 64 5.513 5.149 -6.496 1.00 0.00 H new ATOM 0 HB1 ALA A 64 4.360 3.207 -5.444 1.00 0.00 H new ATOM 0 HB2 ALA A 64 5.759 3.727 -4.474 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.111 4.164 -3.964 1.00 0.00 H new ATOM 782 N VAL A 65 2.545 6.068 -5.351 1.00 0.00 N ATOM 783 CA VAL A 65 1.199 6.520 -5.739 1.00 0.00 C ATOM 784 C VAL A 65 1.225 7.845 -6.500 1.00 0.00 C ATOM 785 O VAL A 65 0.584 7.958 -7.544 1.00 0.00 O ATOM 786 CB VAL A 65 0.302 6.587 -4.493 1.00 0.00 C ATOM 787 CG1 VAL A 65 -0.977 7.398 -4.690 1.00 0.00 C ATOM 788 CG2 VAL A 65 -0.094 5.156 -4.134 1.00 0.00 C ATOM 0 H VAL A 65 2.698 6.074 -4.343 1.00 0.00 H new ATOM 0 HA VAL A 65 0.780 5.792 -6.434 1.00 0.00 H new ATOM 0 HB VAL A 65 0.872 7.086 -3.710 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -1.555 7.397 -3.766 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.720 8.423 -4.956 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.570 6.953 -5.489 1.00 0.00 H new ATOM 0 HG21 VAL A 65 -0.733 5.166 -3.251 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.634 4.708 -4.968 1.00 0.00 H new ATOM 0 HG23 VAL A 65 0.802 4.572 -3.926 1.00 0.00 H new ATOM 798 N GLY A 66 2.013 8.819 -6.040 1.00 0.00 N ATOM 799 CA GLY A 66 2.232 10.096 -6.726 1.00 0.00 C ATOM 800 C GLY A 66 2.864 9.945 -8.119 1.00 0.00 C ATOM 801 O GLY A 66 2.647 10.791 -8.988 1.00 0.00 O ATOM 0 H GLY A 66 2.527 8.741 -5.163 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.278 10.615 -6.823 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.876 10.724 -6.110 1.00 0.00 H new ATOM 805 N GLY A 67 3.597 8.851 -8.355 1.00 0.00 N ATOM 806 CA GLY A 67 4.182 8.485 -9.648 1.00 0.00 C ATOM 807 C GLY A 67 3.139 8.246 -10.749 1.00 0.00 C ATOM 808 O GLY A 67 3.326 8.703 -11.879 1.00 0.00 O ATOM 0 H GLY A 67 3.806 8.172 -7.623 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.860 9.276 -9.967 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.781 7.583 -9.524 1.00 0.00 H new ATOM 812 N VAL A 68 2.023 7.578 -10.422 1.00 0.00 N ATOM 813 CA VAL A 68 0.877 7.400 -11.339 1.00 0.00 C ATOM 814 C VAL A 68 -0.100 8.583 -11.240 1.00 0.00 C ATOM 815 O VAL A 68 -0.490 9.152 -12.263 1.00 0.00 O ATOM 816 CB VAL A 68 0.136 6.073 -11.061 1.00 0.00 C ATOM 817 CG1 VAL A 68 -0.995 5.839 -12.070 1.00 0.00 C ATOM 818 CG2 VAL A 68 1.067 4.854 -11.149 1.00 0.00 C ATOM 0 H VAL A 68 1.885 7.142 -9.510 1.00 0.00 H new ATOM 0 HA VAL A 68 1.276 7.364 -12.353 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.257 6.172 -10.049 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -1.495 4.897 -11.845 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -1.714 6.655 -12.006 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -0.581 5.798 -13.078 1.00 0.00 H new ATOM 0 HG21 VAL A 68 0.498 3.947 -10.946 1.00 0.00 H new ATOM 0 HG22 VAL A 68 1.497 4.796 -12.149 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.867 4.953 -10.415 1.00 0.00 H new ATOM 828 N GLY A 69 -0.463 8.982 -10.016 1.00 0.00 N ATOM 829 CA GLY A 69 -1.420 10.054 -9.711 1.00 0.00 C ATOM 830 C GLY A 69 -2.894 9.698 -9.969 1.00 0.00 C ATOM 831 O GLY A 69 -3.216 8.721 -10.650 1.00 0.00 O ATOM 0 H GLY A 69 -0.082 8.549 -9.175 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -1.307 10.335 -8.664 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -1.163 10.931 -10.306 1.00 0.00 H new ATOM 835 N ALA A 70 -3.813 10.492 -9.405 1.00 0.00 N ATOM 836 CA ALA A 70 -5.258 10.250 -9.483 1.00 0.00 C ATOM 837 C ALA A 70 -5.798 10.209 -10.932 1.00 0.00 C ATOM 838 O ALA A 70 -5.511 11.097 -11.741 1.00 0.00 O ATOM 839 CB ALA A 70 -5.989 11.295 -8.642 1.00 0.00 C ATOM 0 H ALA A 70 -3.571 11.330 -8.876 1.00 0.00 H new ATOM 0 HA ALA A 70 -5.448 9.255 -9.080 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -7.063 11.119 -8.697 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -5.662 11.221 -7.605 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -5.764 12.291 -9.023 1.00 0.00 H new ATOM 845 N GLY A 71 -6.597 9.183 -11.244 1.00 0.00 N ATOM 846 CA GLY A 71 -7.272 8.971 -12.532 1.00 0.00 C ATOM 847 C GLY A 71 -7.201 7.521 -13.032 1.00 0.00 C ATOM 848 O GLY A 71 -8.189 6.995 -13.551 1.00 0.00 O ATOM 0 H GLY A 71 -6.801 8.441 -10.574 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.318 9.263 -12.437 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -6.825 9.626 -13.279 1.00 0.00 H new ATOM 852 N ALA A 72 -6.052 6.861 -12.850 1.00 0.00 N ATOM 853 CA ALA A 72 -5.865 5.430 -13.111 1.00 0.00 C ATOM 854 C ALA A 72 -6.703 4.528 -12.171 1.00 0.00 C ATOM 855 O ALA A 72 -7.291 4.985 -11.184 1.00 0.00 O ATOM 856 CB ALA A 72 -4.366 5.114 -13.010 1.00 0.00 C ATOM 0 H ALA A 72 -5.206 7.318 -12.509 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.228 5.209 -14.115 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -4.204 4.053 -13.201 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -3.820 5.703 -13.747 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.009 5.361 -12.010 1.00 0.00 H new ATOM 862 N SER A 73 -6.759 3.226 -12.469 1.00 0.00 N ATOM 863 CA SER A 73 -7.394 2.229 -11.598 1.00 0.00 C ATOM 864 C SER A 73 -6.622 2.018 -10.289 1.00 0.00 C ATOM 865 O SER A 73 -5.410 2.240 -10.209 1.00 0.00 O ATOM 866 CB SER A 73 -7.539 0.895 -12.342 1.00 0.00 C ATOM 867 OG SER A 73 -6.275 0.400 -12.758 1.00 0.00 O ATOM 0 H SER A 73 -6.365 2.832 -13.323 1.00 0.00 H new ATOM 0 HA SER A 73 -8.379 2.613 -11.334 1.00 0.00 H new ATOM 0 HB2 SER A 73 -8.023 0.165 -11.694 1.00 0.00 H new ATOM 0 HB3 SER A 73 -8.184 1.028 -13.210 1.00 0.00 H new ATOM 0 HG SER A 73 -6.396 -0.451 -13.228 1.00 0.00 H new ATOM 872 N ALA A 74 -7.309 1.501 -9.266 1.00 0.00 N ATOM 873 CA ALA A 74 -6.673 1.055 -8.026 1.00 0.00 C ATOM 874 C ALA A 74 -5.599 -0.019 -8.263 1.00 0.00 C ATOM 875 O ALA A 74 -4.613 -0.055 -7.533 1.00 0.00 O ATOM 876 CB ALA A 74 -7.758 0.550 -7.078 1.00 0.00 C ATOM 0 H ALA A 74 -8.322 1.381 -9.276 1.00 0.00 H new ATOM 0 HA ALA A 74 -6.151 1.902 -7.581 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -7.300 0.213 -6.148 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -8.460 1.356 -6.866 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.289 -0.281 -7.543 1.00 0.00 H new ATOM 882 N SER A 75 -5.744 -0.846 -9.308 1.00 0.00 N ATOM 883 CA SER A 75 -4.719 -1.805 -9.735 1.00 0.00 C ATOM 884 C SER A 75 -3.397 -1.126 -10.111 1.00 0.00 C ATOM 885 O SER A 75 -2.344 -1.633 -9.739 1.00 0.00 O ATOM 886 CB SER A 75 -5.228 -2.660 -10.899 1.00 0.00 C ATOM 887 OG SER A 75 -4.305 -3.697 -11.191 1.00 0.00 O ATOM 0 H SER A 75 -6.585 -0.867 -9.885 1.00 0.00 H new ATOM 0 HA SER A 75 -4.517 -2.450 -8.880 1.00 0.00 H new ATOM 0 HB2 SER A 75 -6.198 -3.088 -10.647 1.00 0.00 H new ATOM 0 HB3 SER A 75 -5.374 -2.036 -11.780 1.00 0.00 H new ATOM 0 HG SER A 75 -4.644 -4.236 -11.936 1.00 0.00 H new ATOM 892 N ALA A 76 -3.409 0.046 -10.763 1.00 0.00 N ATOM 893 CA ALA A 76 -2.186 0.794 -11.081 1.00 0.00 C ATOM 894 C ALA A 76 -1.453 1.286 -9.818 1.00 0.00 C ATOM 895 O ALA A 76 -0.231 1.147 -9.713 1.00 0.00 O ATOM 896 CB ALA A 76 -2.540 1.966 -12.003 1.00 0.00 C ATOM 0 H ALA A 76 -4.264 0.500 -11.083 1.00 0.00 H new ATOM 0 HA ALA A 76 -1.497 0.121 -11.590 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.636 2.526 -12.243 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -2.985 1.584 -12.922 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.251 2.622 -11.501 1.00 0.00 H new ATOM 902 N TYR A 77 -2.191 1.807 -8.831 1.00 0.00 N ATOM 903 CA TYR A 77 -1.635 2.239 -7.541 1.00 0.00 C ATOM 904 C TYR A 77 -1.150 1.057 -6.714 1.00 0.00 C ATOM 905 O TYR A 77 -0.053 1.104 -6.175 1.00 0.00 O ATOM 906 CB TYR A 77 -2.688 3.009 -6.740 1.00 0.00 C ATOM 907 CG TYR A 77 -3.376 4.120 -7.497 1.00 0.00 C ATOM 908 CD1 TYR A 77 -2.685 4.882 -8.456 1.00 0.00 C ATOM 909 CD2 TYR A 77 -4.741 4.353 -7.264 1.00 0.00 C ATOM 910 CE1 TYR A 77 -3.372 5.846 -9.204 1.00 0.00 C ATOM 911 CE2 TYR A 77 -5.432 5.337 -7.993 1.00 0.00 C ATOM 912 CZ TYR A 77 -4.744 6.072 -8.976 1.00 0.00 C ATOM 913 OH TYR A 77 -5.389 7.007 -9.707 1.00 0.00 O ATOM 0 H TYR A 77 -3.199 1.942 -8.905 1.00 0.00 H new ATOM 0 HA TYR A 77 -0.784 2.885 -7.756 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -3.443 2.305 -6.390 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -2.213 3.432 -5.855 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -1.628 4.724 -8.615 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.264 3.772 -6.519 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -2.849 6.417 -9.957 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -6.478 5.526 -7.801 1.00 0.00 H new ATOM 0 HH TYR A 77 -4.736 7.620 -10.104 1.00 0.00 H new ATOM 922 N ALA A 78 -1.930 -0.023 -6.666 1.00 0.00 N ATOM 923 CA ALA A 78 -1.548 -1.297 -6.079 1.00 0.00 C ATOM 924 C ALA A 78 -0.273 -1.862 -6.720 1.00 0.00 C ATOM 925 O ALA A 78 0.592 -2.347 -6.002 1.00 0.00 O ATOM 926 CB ALA A 78 -2.730 -2.257 -6.236 1.00 0.00 C ATOM 0 H ALA A 78 -2.875 -0.030 -7.049 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.315 -1.161 -5.023 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -2.473 -3.224 -5.804 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -3.600 -1.850 -5.722 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -2.959 -2.382 -7.294 1.00 0.00 H new ATOM 932 N ASN A 79 -0.107 -1.744 -8.043 1.00 0.00 N ATOM 933 CA ASN A 79 1.119 -2.126 -8.741 1.00 0.00 C ATOM 934 C ASN A 79 2.298 -1.248 -8.313 1.00 0.00 C ATOM 935 O ASN A 79 3.349 -1.778 -7.971 1.00 0.00 O ATOM 936 CB ASN A 79 0.924 -2.044 -10.273 1.00 0.00 C ATOM 937 CG ASN A 79 1.278 -3.321 -11.017 1.00 0.00 C ATOM 938 OD1 ASN A 79 2.001 -4.186 -10.548 1.00 0.00 O ATOM 939 ND2 ASN A 79 0.834 -3.439 -12.247 1.00 0.00 N ATOM 0 H ASN A 79 -0.830 -1.377 -8.662 1.00 0.00 H new ATOM 0 HA ASN A 79 1.345 -3.157 -8.470 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.115 -1.792 -10.482 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.535 -1.229 -10.662 1.00 0.00 H new ATOM 0 HD21 ASN A 79 1.093 -4.251 -12.807 1.00 0.00 H new ATOM 0 HD22 ASN A 79 0.230 -2.719 -12.642 1.00 0.00 H new ATOM 945 N ALA A 80 2.141 0.080 -8.314 1.00 0.00 N ATOM 946 CA ALA A 80 3.201 0.999 -7.906 1.00 0.00 C ATOM 947 C ALA A 80 3.586 0.807 -6.429 1.00 0.00 C ATOM 948 O ALA A 80 4.769 0.720 -6.120 1.00 0.00 O ATOM 949 CB ALA A 80 2.766 2.436 -8.210 1.00 0.00 C ATOM 0 H ALA A 80 1.278 0.544 -8.597 1.00 0.00 H new ATOM 0 HA ALA A 80 4.102 0.780 -8.479 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.553 3.126 -7.907 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.582 2.542 -9.279 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.853 2.664 -7.660 1.00 0.00 H new ATOM 955 N ILE A 81 2.612 0.664 -5.526 1.00 0.00 N ATOM 956 CA ILE A 81 2.804 0.336 -4.104 1.00 0.00 C ATOM 957 C ILE A 81 3.505 -1.008 -3.945 1.00 0.00 C ATOM 958 O ILE A 81 4.537 -1.074 -3.288 1.00 0.00 O ATOM 959 CB ILE A 81 1.445 0.346 -3.365 1.00 0.00 C ATOM 960 CG1 ILE A 81 1.021 1.809 -3.133 1.00 0.00 C ATOM 961 CG2 ILE A 81 1.483 -0.428 -2.032 1.00 0.00 C ATOM 962 CD1 ILE A 81 -0.452 1.958 -2.743 1.00 0.00 C ATOM 0 H ILE A 81 1.628 0.777 -5.771 1.00 0.00 H new ATOM 0 HA ILE A 81 3.444 1.096 -3.656 1.00 0.00 H new ATOM 0 HB ILE A 81 0.714 -0.167 -3.990 1.00 0.00 H new ATOM 0 HG12 ILE A 81 1.643 2.240 -2.348 1.00 0.00 H new ATOM 0 HG13 ILE A 81 1.209 2.383 -4.040 1.00 0.00 H new ATOM 0 HG21 ILE A 81 0.502 -0.386 -1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 81 1.750 -1.467 -2.222 1.00 0.00 H new ATOM 0 HG23 ILE A 81 2.224 0.022 -1.371 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -0.684 3.013 -2.595 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -1.081 1.556 -3.537 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -0.641 1.411 -1.819 1.00 0.00 H new ATOM 973 N ALA A 82 2.988 -2.075 -4.555 1.00 0.00 N ATOM 974 CA ALA A 82 3.563 -3.408 -4.427 1.00 0.00 C ATOM 975 C ALA A 82 4.930 -3.539 -5.120 1.00 0.00 C ATOM 976 O ALA A 82 5.722 -4.379 -4.708 1.00 0.00 O ATOM 977 CB ALA A 82 2.567 -4.447 -4.939 1.00 0.00 C ATOM 0 H ALA A 82 2.160 -2.036 -5.150 1.00 0.00 H new ATOM 0 HA ALA A 82 3.754 -3.589 -3.369 1.00 0.00 H new ATOM 0 HB1 ALA A 82 2.999 -5.443 -4.843 1.00 0.00 H new ATOM 0 HB2 ALA A 82 1.649 -4.391 -4.353 1.00 0.00 H new ATOM 0 HB3 ALA A 82 2.341 -4.249 -5.987 1.00 0.00 H new ATOM 983 N ARG A 83 5.249 -2.691 -6.109 1.00 0.00 N ATOM 984 CA ARG A 83 6.603 -2.538 -6.670 1.00 0.00 C ATOM 985 C ARG A 83 7.509 -1.639 -5.832 1.00 0.00 C ATOM 986 O ARG A 83 8.698 -1.913 -5.768 1.00 0.00 O ATOM 987 CB ARG A 83 6.546 -2.001 -8.111 1.00 0.00 C ATOM 988 CG ARG A 83 6.147 -3.090 -9.120 1.00 0.00 C ATOM 989 CD ARG A 83 6.283 -2.594 -10.569 1.00 0.00 C ATOM 990 NE ARG A 83 4.994 -2.207 -11.178 1.00 0.00 N ATOM 991 CZ ARG A 83 4.834 -1.776 -12.421 1.00 0.00 C ATOM 992 NH1 ARG A 83 5.845 -1.540 -13.208 1.00 0.00 N ATOM 993 NH2 ARG A 83 3.650 -1.576 -12.922 1.00 0.00 N ATOM 0 H ARG A 83 4.562 -2.080 -6.551 1.00 0.00 H new ATOM 0 HA ARG A 83 7.038 -3.538 -6.662 1.00 0.00 H new ATOM 0 HB2 ARG A 83 5.831 -1.180 -8.163 1.00 0.00 H new ATOM 0 HB3 ARG A 83 7.519 -1.594 -8.384 1.00 0.00 H new ATOM 0 HG2 ARG A 83 6.775 -3.969 -8.975 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.118 -3.399 -8.935 1.00 0.00 H new ATOM 0 HD2 ARG A 83 6.958 -1.739 -10.591 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.741 -3.378 -11.172 1.00 0.00 H new ATOM 0 HE ARG A 83 4.160 -2.277 -10.595 1.00 0.00 H new ATOM 0 HH11 ARG A 83 6.797 -1.686 -12.873 1.00 0.00 H new ATOM 0 HH12 ARG A 83 5.684 -1.209 -14.159 1.00 0.00 H new ATOM 0 HH21 ARG A 83 2.820 -1.751 -12.355 1.00 0.00 H new ATOM 0 HH22 ARG A 83 3.552 -1.244 -13.881 1.00 0.00 H new ATOM 1004 N ALA A 84 7.012 -0.596 -5.174 1.00 0.00 N ATOM 1005 CA ALA A 84 7.825 0.251 -4.297 1.00 0.00 C ATOM 1006 C ALA A 84 8.154 -0.474 -2.987 1.00 0.00 C ATOM 1007 O ALA A 84 9.323 -0.631 -2.645 1.00 0.00 O ATOM 1008 CB ALA A 84 7.088 1.567 -4.046 1.00 0.00 C ATOM 0 H ALA A 84 6.034 -0.311 -5.231 1.00 0.00 H new ATOM 0 HA ALA A 84 8.776 0.471 -4.783 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.688 2.202 -3.394 1.00 0.00 H new ATOM 0 HB2 ALA A 84 6.921 2.077 -4.995 1.00 0.00 H new ATOM 0 HB3 ALA A 84 6.129 1.362 -3.570 1.00 0.00 H new ATOM 1014 N ALA A 85 7.132 -1.004 -2.310 1.00 0.00 N ATOM 1015 CA ALA A 85 7.282 -1.923 -1.193 1.00 0.00 C ATOM 1016 C ALA A 85 8.039 -3.192 -1.611 1.00 0.00 C ATOM 1017 O ALA A 85 8.962 -3.595 -0.918 1.00 0.00 O ATOM 1018 CB ALA A 85 5.896 -2.268 -0.642 1.00 0.00 C ATOM 0 H ALA A 85 6.158 -0.798 -2.533 1.00 0.00 H new ATOM 0 HA ALA A 85 7.873 -1.442 -0.413 1.00 0.00 H new ATOM 0 HB1 ALA A 85 5.999 -2.957 0.196 1.00 0.00 H new ATOM 0 HB2 ALA A 85 5.402 -1.357 -0.304 1.00 0.00 H new ATOM 0 HB3 ALA A 85 5.299 -2.736 -1.425 1.00 0.00 H new ATOM 1024 N GLY A 86 7.717 -3.793 -2.761 1.00 0.00 N ATOM 1025 CA GLY A 86 8.399 -4.989 -3.264 1.00 0.00 C ATOM 1026 C GLY A 86 9.884 -4.762 -3.536 1.00 0.00 C ATOM 1027 O GLY A 86 10.702 -5.519 -3.026 1.00 0.00 O ATOM 0 H GLY A 86 6.971 -3.461 -3.372 1.00 0.00 H new ATOM 0 HA2 GLY A 86 8.288 -5.795 -2.539 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.913 -5.317 -4.183 1.00 0.00 H new ATOM 1031 N GLN A 87 10.260 -3.693 -4.246 1.00 0.00 N ATOM 1032 CA GLN A 87 11.668 -3.327 -4.449 1.00 0.00 C ATOM 1033 C GLN A 87 12.365 -2.997 -3.122 1.00 0.00 C ATOM 1034 O GLN A 87 13.465 -3.489 -2.889 1.00 0.00 O ATOM 1035 CB GLN A 87 11.814 -2.144 -5.423 1.00 0.00 C ATOM 1036 CG GLN A 87 11.580 -2.539 -6.891 1.00 0.00 C ATOM 1037 CD GLN A 87 11.823 -1.367 -7.839 1.00 0.00 C ATOM 1038 OE1 GLN A 87 12.805 -1.312 -8.569 1.00 0.00 O ATOM 1039 NE2 GLN A 87 10.954 -0.377 -7.862 1.00 0.00 N ATOM 0 H GLN A 87 9.600 -3.058 -4.695 1.00 0.00 H new ATOM 0 HA GLN A 87 12.154 -4.198 -4.888 1.00 0.00 H new ATOM 0 HB2 GLN A 87 11.106 -1.363 -5.146 1.00 0.00 H new ATOM 0 HB3 GLN A 87 12.813 -1.719 -5.322 1.00 0.00 H new ATOM 0 HG2 GLN A 87 12.242 -3.364 -7.155 1.00 0.00 H new ATOM 0 HG3 GLN A 87 10.558 -2.899 -7.012 1.00 0.00 H new ATOM 0 HE21 GLN A 87 10.131 -0.407 -7.260 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.104 0.419 -8.481 1.00 0.00 H new ATOM 1046 N PHE A 88 11.739 -2.216 -2.233 1.00 0.00 N ATOM 1047 CA PHE A 88 12.336 -1.849 -0.943 1.00 0.00 C ATOM 1048 C PHE A 88 12.534 -3.074 -0.034 1.00 0.00 C ATOM 1049 O PHE A 88 13.623 -3.300 0.482 1.00 0.00 O ATOM 1050 CB PHE A 88 11.476 -0.764 -0.272 1.00 0.00 C ATOM 1051 CG PHE A 88 12.171 -0.024 0.857 1.00 0.00 C ATOM 1052 CD1 PHE A 88 12.234 -0.582 2.148 1.00 0.00 C ATOM 1053 CD2 PHE A 88 12.751 1.238 0.617 1.00 0.00 C ATOM 1054 CE1 PHE A 88 12.876 0.113 3.188 1.00 0.00 C ATOM 1055 CE2 PHE A 88 13.385 1.938 1.659 1.00 0.00 C ATOM 1056 CZ PHE A 88 13.448 1.376 2.947 1.00 0.00 C ATOM 0 H PHE A 88 10.810 -1.823 -2.386 1.00 0.00 H new ATOM 0 HA PHE A 88 13.332 -1.443 -1.120 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.168 -0.042 -1.028 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.568 -1.225 0.117 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.788 -1.547 2.340 1.00 0.00 H new ATOM 0 HD2 PHE A 88 12.708 1.670 -0.372 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.930 -0.324 4.174 1.00 0.00 H new ATOM 0 HE2 PHE A 88 13.823 2.907 1.470 1.00 0.00 H new ATOM 0 HZ PHE A 88 13.934 1.912 3.749 1.00 0.00 H new ATOM 1065 N LEU A 89 11.516 -3.920 0.133 1.00 0.00 N ATOM 1066 CA LEU A 89 11.611 -5.151 0.923 1.00 0.00 C ATOM 1067 C LEU A 89 12.514 -6.210 0.260 1.00 0.00 C ATOM 1068 O LEU A 89 13.141 -6.994 0.976 1.00 0.00 O ATOM 1069 CB LEU A 89 10.199 -5.683 1.239 1.00 0.00 C ATOM 1070 CG LEU A 89 9.315 -4.749 2.101 1.00 0.00 C ATOM 1071 CD1 LEU A 89 8.045 -5.491 2.513 1.00 0.00 C ATOM 1072 CD2 LEU A 89 9.988 -4.227 3.372 1.00 0.00 C ATOM 0 H LEU A 89 10.595 -3.770 -0.279 1.00 0.00 H new ATOM 0 HA LEU A 89 12.099 -4.913 1.868 1.00 0.00 H new ATOM 0 HB2 LEU A 89 9.683 -5.877 0.298 1.00 0.00 H new ATOM 0 HB3 LEU A 89 10.296 -6.639 1.753 1.00 0.00 H new ATOM 0 HG LEU A 89 9.107 -3.883 1.472 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.421 -4.835 3.120 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.495 -5.793 1.622 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.312 -6.375 3.091 1.00 0.00 H new ATOM 0 HD21 LEU A 89 9.295 -3.582 3.912 1.00 0.00 H new ATOM 0 HD22 LEU A 89 10.270 -5.068 4.006 1.00 0.00 H new ATOM 0 HD23 LEU A 89 10.879 -3.659 3.105 1.00 0.00 H new ATOM 1083 N ALA A 90 12.658 -6.213 -1.071 1.00 0.00 N ATOM 1084 CA ALA A 90 13.664 -7.011 -1.778 1.00 0.00 C ATOM 1085 C ALA A 90 15.098 -6.530 -1.488 1.00 0.00 C ATOM 1086 O ALA A 90 15.954 -7.351 -1.151 1.00 0.00 O ATOM 1087 CB ALA A 90 13.379 -6.999 -3.288 1.00 0.00 C ATOM 0 H ALA A 90 12.073 -5.655 -1.693 1.00 0.00 H new ATOM 0 HA ALA A 90 13.594 -8.034 -1.409 1.00 0.00 H new ATOM 0 HB1 ALA A 90 14.132 -7.594 -3.805 1.00 0.00 H new ATOM 0 HB2 ALA A 90 12.391 -7.420 -3.475 1.00 0.00 H new ATOM 0 HB3 ALA A 90 13.412 -5.974 -3.656 1.00 0.00 H new ATOM 1093 N THR A 91 15.378 -5.221 -1.558 1.00 0.00 N ATOM 1094 CA THR A 91 16.712 -4.668 -1.245 1.00 0.00 C ATOM 1095 C THR A 91 17.062 -4.767 0.244 1.00 0.00 C ATOM 1096 O THR A 91 18.231 -4.977 0.578 1.00 0.00 O ATOM 1097 CB THR A 91 16.894 -3.215 -1.723 1.00 0.00 C ATOM 1098 OG1 THR A 91 15.913 -2.359 -1.187 1.00 0.00 O ATOM 1099 CG2 THR A 91 16.857 -3.100 -3.249 1.00 0.00 C ATOM 0 H THR A 91 14.694 -4.516 -1.831 1.00 0.00 H new ATOM 0 HA THR A 91 17.405 -5.296 -1.805 1.00 0.00 H new ATOM 0 HB THR A 91 17.877 -2.910 -1.365 1.00 0.00 H new ATOM 0 HG1 THR A 91 15.271 -2.884 -0.664 1.00 0.00 H new ATOM 0 HG21 THR A 91 16.989 -2.058 -3.539 1.00 0.00 H new ATOM 0 HG22 THR A 91 17.659 -3.701 -3.679 1.00 0.00 H new ATOM 0 HG23 THR A 91 15.896 -3.460 -3.618 1.00 0.00 H new ATOM 1107 N GLN A 92 16.073 -4.708 1.145 1.00 0.00 N ATOM 1108 CA GLN A 92 16.244 -5.029 2.572 1.00 0.00 C ATOM 1109 C GLN A 92 16.362 -6.541 2.867 1.00 0.00 C ATOM 1110 O GLN A 92 16.655 -6.918 4.005 1.00 0.00 O ATOM 1111 CB GLN A 92 15.100 -4.416 3.409 1.00 0.00 C ATOM 1112 CG GLN A 92 15.047 -2.876 3.431 1.00 0.00 C ATOM 1113 CD GLN A 92 16.412 -2.220 3.620 1.00 0.00 C ATOM 1114 OE1 GLN A 92 17.020 -2.268 4.682 1.00 0.00 O ATOM 1115 NE2 GLN A 92 16.956 -1.601 2.591 1.00 0.00 N ATOM 0 H GLN A 92 15.121 -4.433 0.903 1.00 0.00 H new ATOM 0 HA GLN A 92 17.197 -4.585 2.860 1.00 0.00 H new ATOM 0 HB2 GLN A 92 14.151 -4.790 3.024 1.00 0.00 H new ATOM 0 HB3 GLN A 92 15.191 -4.774 4.435 1.00 0.00 H new ATOM 0 HG2 GLN A 92 14.610 -2.523 2.497 1.00 0.00 H new ATOM 0 HG3 GLN A 92 14.385 -2.555 4.235 1.00 0.00 H new ATOM 0 HE21 GLN A 92 16.458 -1.555 1.702 1.00 0.00 H new ATOM 0 HE22 GLN A 92 17.875 -1.168 2.684 1.00 0.00 H new ATOM 1122 N GLY A 93 16.130 -7.421 1.884 1.00 0.00 N ATOM 1123 CA GLY A 93 16.101 -8.880 2.071 1.00 0.00 C ATOM 1124 C GLY A 93 15.008 -9.375 3.035 1.00 0.00 C ATOM 1125 O GLY A 93 15.120 -10.470 3.590 1.00 0.00 O ATOM 0 H GLY A 93 15.954 -7.136 0.921 1.00 0.00 H new ATOM 0 HA2 GLY A 93 15.956 -9.356 1.101 1.00 0.00 H new ATOM 0 HA3 GLY A 93 17.072 -9.206 2.444 1.00 0.00 H new ATOM 1129 N VAL A 94 13.959 -8.571 3.256 1.00 0.00 N ATOM 1130 CA VAL A 94 12.754 -8.952 4.019 1.00 0.00 C ATOM 1131 C VAL A 94 11.990 -10.070 3.307 1.00 0.00 C ATOM 1132 O VAL A 94 11.466 -10.971 3.964 1.00 0.00 O ATOM 1133 CB VAL A 94 11.864 -7.710 4.251 1.00 0.00 C ATOM 1134 CG1 VAL A 94 10.394 -8.030 4.556 1.00 0.00 C ATOM 1135 CG2 VAL A 94 12.431 -6.888 5.413 1.00 0.00 C ATOM 0 H VAL A 94 13.920 -7.615 2.903 1.00 0.00 H new ATOM 0 HA VAL A 94 13.057 -9.339 4.992 1.00 0.00 H new ATOM 0 HB VAL A 94 11.878 -7.157 3.312 1.00 0.00 H new ATOM 0 HG11 VAL A 94 9.843 -7.101 4.705 1.00 0.00 H new ATOM 0 HG12 VAL A 94 9.960 -8.579 3.720 1.00 0.00 H new ATOM 0 HG13 VAL A 94 10.334 -8.637 5.460 1.00 0.00 H new ATOM 0 HG21 VAL A 94 11.805 -6.011 5.578 1.00 0.00 H new ATOM 0 HG22 VAL A 94 12.447 -7.498 6.316 1.00 0.00 H new ATOM 0 HG23 VAL A 94 13.445 -6.569 5.172 1.00 0.00 H new ATOM 1145 N LEU A 95 11.985 -10.050 1.970 1.00 0.00 N ATOM 1146 CA LEU A 95 11.439 -11.113 1.126 1.00 0.00 C ATOM 1147 C LEU A 95 12.556 -11.943 0.470 1.00 0.00 C ATOM 1148 O LEU A 95 13.662 -11.451 0.235 1.00 0.00 O ATOM 1149 CB LEU A 95 10.395 -10.518 0.159 1.00 0.00 C ATOM 1150 CG LEU A 95 10.905 -9.507 -0.889 1.00 0.00 C ATOM 1151 CD1 LEU A 95 11.531 -10.182 -2.110 1.00 0.00 C ATOM 1152 CD2 LEU A 95 9.735 -8.684 -1.418 1.00 0.00 C ATOM 0 H LEU A 95 12.371 -9.273 1.433 1.00 0.00 H new ATOM 0 HA LEU A 95 10.901 -11.842 1.732 1.00 0.00 H new ATOM 0 HB2 LEU A 95 9.916 -11.342 -0.370 1.00 0.00 H new ATOM 0 HB3 LEU A 95 9.623 -10.029 0.753 1.00 0.00 H new ATOM 0 HG LEU A 95 11.655 -8.900 -0.381 1.00 0.00 H new ATOM 0 HD11 LEU A 95 11.871 -9.421 -2.812 1.00 0.00 H new ATOM 0 HD12 LEU A 95 12.379 -10.790 -1.795 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.790 -10.817 -2.595 1.00 0.00 H new ATOM 0 HD21 LEU A 95 10.097 -7.970 -2.158 1.00 0.00 H new ATOM 0 HD22 LEU A 95 9.004 -9.347 -1.881 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.267 -8.146 -0.594 1.00 0.00 H new ATOM 1163 N ASN A 96 12.260 -13.216 0.195 1.00 0.00 N ATOM 1164 CA ASN A 96 13.186 -14.223 -0.345 1.00 0.00 C ATOM 1165 C ASN A 96 12.380 -15.239 -1.168 1.00 0.00 C ATOM 1166 O ASN A 96 11.224 -15.491 -0.831 1.00 0.00 O ATOM 1167 CB ASN A 96 13.894 -14.986 0.803 1.00 0.00 C ATOM 1168 CG ASN A 96 14.330 -14.142 1.991 1.00 0.00 C ATOM 1169 OD1 ASN A 96 15.429 -13.606 2.039 1.00 0.00 O ATOM 1170 ND2 ASN A 96 13.493 -14.030 3.002 1.00 0.00 N ATOM 0 H ASN A 96 11.325 -13.593 0.349 1.00 0.00 H new ATOM 0 HA ASN A 96 13.934 -13.720 -0.958 1.00 0.00 H new ATOM 0 HB2 ASN A 96 13.223 -15.766 1.163 1.00 0.00 H new ATOM 0 HB3 ASN A 96 14.773 -15.485 0.394 1.00 0.00 H new ATOM 0 HD21 ASN A 96 13.760 -13.495 3.828 1.00 0.00 H new ATOM 0 HD22 ASN A 96 12.578 -14.478 2.958 1.00 0.00 H new ATOM 1176 N ALA A 97 12.974 -15.896 -2.171 1.00 0.00 N ATOM 1177 CA ALA A 97 12.293 -16.884 -3.031 1.00 0.00 C ATOM 1178 C ALA A 97 11.560 -18.028 -2.281 1.00 0.00 C ATOM 1179 O ALA A 97 10.645 -18.642 -2.833 1.00 0.00 O ATOM 1180 CB ALA A 97 13.321 -17.443 -4.021 1.00 0.00 C ATOM 0 H ALA A 97 13.955 -15.758 -2.415 1.00 0.00 H new ATOM 0 HA ALA A 97 11.488 -16.356 -3.543 1.00 0.00 H new ATOM 0 HB1 ALA A 97 12.841 -18.177 -4.669 1.00 0.00 H new ATOM 0 HB2 ALA A 97 13.721 -16.631 -4.627 1.00 0.00 H new ATOM 0 HB3 ALA A 97 14.133 -17.920 -3.472 1.00 0.00 H new ATOM 1186 N VAL A 98 11.915 -18.266 -1.011 1.00 0.00 N ATOM 1187 CA VAL A 98 11.199 -19.105 -0.025 1.00 0.00 C ATOM 1188 C VAL A 98 9.683 -18.849 -0.022 1.00 0.00 C ATOM 1189 O VAL A 98 8.893 -19.794 -0.060 1.00 0.00 O ATOM 1190 CB VAL A 98 11.767 -18.834 1.389 1.00 0.00 C ATOM 1191 CG1 VAL A 98 11.111 -19.695 2.474 1.00 0.00 C ATOM 1192 CG2 VAL A 98 13.281 -19.083 1.466 1.00 0.00 C ATOM 0 H VAL A 98 12.761 -17.855 -0.615 1.00 0.00 H new ATOM 0 HA VAL A 98 11.354 -20.146 -0.310 1.00 0.00 H new ATOM 0 HB VAL A 98 11.544 -17.783 1.571 1.00 0.00 H new ATOM 0 HG11 VAL A 98 11.552 -19.458 3.442 1.00 0.00 H new ATOM 0 HG12 VAL A 98 10.041 -19.491 2.503 1.00 0.00 H new ATOM 0 HG13 VAL A 98 11.273 -20.749 2.249 1.00 0.00 H new ATOM 0 HG21 VAL A 98 13.632 -18.879 2.478 1.00 0.00 H new ATOM 0 HG22 VAL A 98 13.492 -20.121 1.211 1.00 0.00 H new ATOM 0 HG23 VAL A 98 13.794 -18.425 0.764 1.00 0.00 H new ATOM 1202 N ASN A 99 9.279 -17.573 0.022 1.00 0.00 N ATOM 1203 CA ASN A 99 7.880 -17.126 0.107 1.00 0.00 C ATOM 1204 C ASN A 99 7.686 -15.651 -0.315 1.00 0.00 C ATOM 1205 O ASN A 99 6.805 -14.973 0.208 1.00 0.00 O ATOM 1206 CB ASN A 99 7.301 -17.447 1.513 1.00 0.00 C ATOM 1207 CG ASN A 99 8.164 -17.072 2.711 1.00 0.00 C ATOM 1208 OD1 ASN A 99 8.315 -17.839 3.651 1.00 0.00 O ATOM 1209 ND2 ASN A 99 8.758 -15.901 2.747 1.00 0.00 N ATOM 0 H ASN A 99 9.939 -16.796 -0.001 1.00 0.00 H new ATOM 0 HA ASN A 99 7.303 -17.691 -0.625 1.00 0.00 H new ATOM 0 HB2 ASN A 99 6.343 -16.937 1.611 1.00 0.00 H new ATOM 0 HB3 ASN A 99 7.099 -18.517 1.561 1.00 0.00 H new ATOM 0 HD21 ASN A 99 9.333 -15.645 3.550 1.00 0.00 H new ATOM 0 HD22 ASN A 99 8.644 -15.247 1.972 1.00 0.00 H new ATOM 1215 N ALA A 100 8.516 -15.116 -1.219 1.00 0.00 N ATOM 1216 CA ALA A 100 8.446 -13.724 -1.685 1.00 0.00 C ATOM 1217 C ALA A 100 7.059 -13.349 -2.220 1.00 0.00 C ATOM 1218 O ALA A 100 6.543 -12.282 -1.895 1.00 0.00 O ATOM 1219 CB ALA A 100 9.516 -13.490 -2.759 1.00 0.00 C ATOM 0 H ALA A 100 9.269 -15.648 -1.656 1.00 0.00 H new ATOM 0 HA ALA A 100 8.633 -13.079 -0.827 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.465 -12.458 -3.105 1.00 0.00 H new ATOM 0 HB2 ALA A 100 10.503 -13.683 -2.338 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.342 -14.163 -3.599 1.00 0.00 H new ATOM 1225 N SER A 101 6.425 -14.252 -2.973 1.00 0.00 N ATOM 1226 CA SER A 101 5.011 -14.145 -3.329 1.00 0.00 C ATOM 1227 C SER A 101 4.121 -14.107 -2.092 1.00 0.00 C ATOM 1228 O SER A 101 3.462 -13.101 -1.865 1.00 0.00 O ATOM 1229 CB SER A 101 4.595 -15.265 -4.289 1.00 0.00 C ATOM 1230 OG SER A 101 5.136 -16.509 -3.870 1.00 0.00 O ATOM 0 H SER A 101 6.882 -15.081 -3.354 1.00 0.00 H new ATOM 0 HA SER A 101 4.875 -13.197 -3.850 1.00 0.00 H new ATOM 0 HB2 SER A 101 3.508 -15.331 -4.330 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.939 -15.034 -5.297 1.00 0.00 H new ATOM 0 HG SER A 101 4.859 -17.213 -4.493 1.00 0.00 H new ATOM 1235 N SER A 102 4.137 -15.132 -1.238 1.00 0.00 N ATOM 1236 CA SER A 102 3.264 -15.205 -0.052 1.00 0.00 C ATOM 1237 C SER A 102 3.363 -13.983 0.887 1.00 0.00 C ATOM 1238 O SER A 102 2.348 -13.509 1.404 1.00 0.00 O ATOM 1239 CB SER A 102 3.535 -16.507 0.710 1.00 0.00 C ATOM 1240 OG SER A 102 2.313 -17.118 1.085 1.00 0.00 O ATOM 0 H SER A 102 4.753 -15.938 -1.344 1.00 0.00 H new ATOM 0 HA SER A 102 2.239 -15.194 -0.422 1.00 0.00 H new ATOM 0 HB2 SER A 102 4.114 -17.188 0.086 1.00 0.00 H new ATOM 0 HB3 SER A 102 4.134 -16.300 1.597 1.00 0.00 H new ATOM 0 HG SER A 102 2.498 -17.950 1.569 1.00 0.00 H new ATOM 1245 N LEU A 103 4.559 -13.400 1.049 1.00 0.00 N ATOM 1246 CA LEU A 103 4.788 -12.148 1.791 1.00 0.00 C ATOM 1247 C LEU A 103 4.152 -10.909 1.139 1.00 0.00 C ATOM 1248 O LEU A 103 3.798 -9.961 1.840 1.00 0.00 O ATOM 1249 CB LEU A 103 6.297 -11.908 1.953 1.00 0.00 C ATOM 1250 CG LEU A 103 7.000 -12.873 2.920 1.00 0.00 C ATOM 1251 CD1 LEU A 103 8.490 -12.541 2.919 1.00 0.00 C ATOM 1252 CD2 LEU A 103 6.475 -12.777 4.353 1.00 0.00 C ATOM 0 H LEU A 103 5.416 -13.794 0.659 1.00 0.00 H new ATOM 0 HA LEU A 103 4.302 -12.280 2.758 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.771 -11.986 0.974 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.453 -10.887 2.302 1.00 0.00 H new ATOM 0 HG LEU A 103 6.804 -13.889 2.577 1.00 0.00 H new ATOM 0 HD11 LEU A 103 9.013 -13.213 3.599 1.00 0.00 H new ATOM 0 HD12 LEU A 103 8.889 -12.661 1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 103 8.633 -11.511 3.245 1.00 0.00 H new ATOM 0 HD21 LEU A 103 7.012 -13.484 4.985 1.00 0.00 H new ATOM 0 HD22 LEU A 103 6.627 -11.765 4.729 1.00 0.00 H new ATOM 0 HD23 LEU A 103 5.411 -13.014 4.367 1.00 0.00 H new ATOM 1263 N GLY A 104 3.945 -10.925 -0.177 1.00 0.00 N ATOM 1264 CA GLY A 104 3.129 -9.939 -0.883 1.00 0.00 C ATOM 1265 C GLY A 104 1.702 -9.887 -0.347 1.00 0.00 C ATOM 1266 O GLY A 104 1.175 -8.807 -0.095 1.00 0.00 O ATOM 0 H GLY A 104 4.345 -11.634 -0.791 1.00 0.00 H new ATOM 0 HA2 GLY A 104 3.588 -8.955 -0.788 1.00 0.00 H new ATOM 0 HA3 GLY A 104 3.108 -10.180 -1.946 1.00 0.00 H new ATOM 1270 N SER A 105 1.103 -11.052 -0.076 1.00 0.00 N ATOM 1271 CA SER A 105 -0.195 -11.146 0.605 1.00 0.00 C ATOM 1272 C SER A 105 -0.135 -10.668 2.062 1.00 0.00 C ATOM 1273 O SER A 105 -1.096 -10.073 2.543 1.00 0.00 O ATOM 1274 CB SER A 105 -0.747 -12.578 0.551 1.00 0.00 C ATOM 1275 OG SER A 105 -2.069 -12.558 0.036 1.00 0.00 O ATOM 0 H SER A 105 1.504 -11.957 -0.322 1.00 0.00 H new ATOM 0 HA SER A 105 -0.869 -10.480 0.066 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.110 -13.201 -0.077 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.741 -13.019 1.548 1.00 0.00 H new ATOM 0 HG SER A 105 -2.420 -13.472 0.000 1.00 0.00 H new ATOM 1280 N ALA A 106 0.988 -10.867 2.767 1.00 0.00 N ATOM 1281 CA ALA A 106 1.172 -10.376 4.137 1.00 0.00 C ATOM 1282 C ALA A 106 1.212 -8.833 4.213 1.00 0.00 C ATOM 1283 O ALA A 106 0.488 -8.241 5.016 1.00 0.00 O ATOM 1284 CB ALA A 106 2.432 -11.014 4.744 1.00 0.00 C ATOM 0 H ALA A 106 1.794 -11.374 2.401 1.00 0.00 H new ATOM 0 HA ALA A 106 0.305 -10.675 4.727 1.00 0.00 H new ATOM 0 HB1 ALA A 106 2.570 -10.650 5.762 1.00 0.00 H new ATOM 0 HB2 ALA A 106 2.320 -12.098 4.758 1.00 0.00 H new ATOM 0 HB3 ALA A 106 3.301 -10.747 4.142 1.00 0.00 H new ATOM 1290 N LEU A 107 1.989 -8.161 3.351 1.00 0.00 N ATOM 1291 CA LEU A 107 1.976 -6.694 3.240 1.00 0.00 C ATOM 1292 C LEU A 107 0.653 -6.169 2.663 1.00 0.00 C ATOM 1293 O LEU A 107 0.139 -5.165 3.151 1.00 0.00 O ATOM 1294 CB LEU A 107 3.195 -6.214 2.429 1.00 0.00 C ATOM 1295 CG LEU A 107 3.135 -4.715 2.033 1.00 0.00 C ATOM 1296 CD1 LEU A 107 4.447 -3.972 2.269 1.00 0.00 C ATOM 1297 CD2 LEU A 107 2.756 -4.570 0.555 1.00 0.00 C ATOM 0 H LEU A 107 2.642 -8.616 2.713 1.00 0.00 H new ATOM 0 HA LEU A 107 2.051 -6.276 4.244 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.099 -6.390 3.012 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.277 -6.816 1.524 1.00 0.00 H new ATOM 0 HG LEU A 107 2.378 -4.268 2.678 1.00 0.00 H new ATOM 0 HD11 LEU A 107 4.334 -2.930 1.971 1.00 0.00 H new ATOM 0 HD12 LEU A 107 4.707 -4.020 3.326 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.238 -4.434 1.679 1.00 0.00 H new ATOM 0 HD21 LEU A 107 2.718 -3.513 0.291 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.501 -5.071 -0.063 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.779 -5.022 0.384 1.00 0.00 H new ATOM 1308 N ALA A 108 0.060 -6.836 1.672 1.00 0.00 N ATOM 1309 CA ALA A 108 -1.248 -6.432 1.161 1.00 0.00 C ATOM 1310 C ALA A 108 -2.341 -6.551 2.230 1.00 0.00 C ATOM 1311 O ALA A 108 -3.177 -5.659 2.324 1.00 0.00 O ATOM 1312 CB ALA A 108 -1.586 -7.228 -0.091 1.00 0.00 C ATOM 0 H ALA A 108 0.462 -7.652 1.211 1.00 0.00 H new ATOM 0 HA ALA A 108 -1.200 -5.377 0.892 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.563 -6.920 -0.465 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.830 -7.043 -0.855 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -1.608 -8.291 0.149 1.00 0.00 H new ATOM 1318 N ASN A 109 -2.302 -7.570 3.096 1.00 0.00 N ATOM 1319 CA ASN A 109 -3.137 -7.633 4.294 1.00 0.00 C ATOM 1320 C ASN A 109 -2.809 -6.514 5.303 1.00 0.00 C ATOM 1321 O ASN A 109 -3.728 -5.996 5.924 1.00 0.00 O ATOM 1322 CB ASN A 109 -3.037 -9.031 4.929 1.00 0.00 C ATOM 1323 CG ASN A 109 -3.821 -9.120 6.230 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -3.259 -9.217 7.311 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -5.133 -9.061 6.174 1.00 0.00 N ATOM 0 H ASN A 109 -1.687 -8.376 2.982 1.00 0.00 H new ATOM 0 HA ASN A 109 -4.171 -7.463 3.993 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -3.412 -9.776 4.227 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -1.990 -9.270 5.119 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -5.682 -9.096 7.033 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -5.602 -8.980 5.272 1.00 0.00 H new ATOM 1331 N ALA A 110 -1.551 -6.083 5.448 1.00 0.00 N ATOM 1332 CA ALA A 110 -1.185 -4.962 6.323 1.00 0.00 C ATOM 1333 C ALA A 110 -1.742 -3.608 5.822 1.00 0.00 C ATOM 1334 O ALA A 110 -2.362 -2.864 6.585 1.00 0.00 O ATOM 1335 CB ALA A 110 0.343 -4.931 6.477 1.00 0.00 C ATOM 0 H ALA A 110 -0.757 -6.501 4.962 1.00 0.00 H new ATOM 0 HA ALA A 110 -1.644 -5.119 7.299 1.00 0.00 H new ATOM 0 HB1 ALA A 110 0.627 -4.102 7.125 1.00 0.00 H new ATOM 0 HB2 ALA A 110 0.683 -5.868 6.917 1.00 0.00 H new ATOM 0 HB3 ALA A 110 0.805 -4.801 5.498 1.00 0.00 H new ATOM 1341 N LEU A 111 -1.577 -3.309 4.526 1.00 0.00 N ATOM 1342 CA LEU A 111 -2.172 -2.140 3.865 1.00 0.00 C ATOM 1343 C LEU A 111 -3.710 -2.237 3.827 1.00 0.00 C ATOM 1344 O LEU A 111 -4.386 -1.242 4.073 1.00 0.00 O ATOM 1345 CB LEU A 111 -1.594 -2.010 2.441 1.00 0.00 C ATOM 1346 CG LEU A 111 -0.099 -1.626 2.376 1.00 0.00 C ATOM 1347 CD1 LEU A 111 0.461 -2.039 1.020 1.00 0.00 C ATOM 1348 CD2 LEU A 111 0.152 -0.120 2.520 1.00 0.00 C ATOM 0 H LEU A 111 -1.016 -3.883 3.897 1.00 0.00 H new ATOM 0 HA LEU A 111 -1.921 -1.248 4.439 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.733 -2.958 1.921 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.170 -1.261 1.898 1.00 0.00 H new ATOM 0 HG LEU A 111 0.384 -2.137 3.209 1.00 0.00 H new ATOM 0 HD11 LEU A 111 1.516 -1.772 0.965 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.353 -3.116 0.894 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.085 -1.525 0.229 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.223 0.077 2.465 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -0.357 0.412 1.716 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -0.231 0.222 3.481 1.00 0.00 H new ATOM 1359 N SER A 112 -4.277 -3.422 3.577 1.00 0.00 N ATOM 1360 CA SER A 112 -5.730 -3.664 3.545 1.00 0.00 C ATOM 1361 C SER A 112 -6.389 -3.572 4.919 1.00 0.00 C ATOM 1362 O SER A 112 -7.416 -2.913 5.037 1.00 0.00 O ATOM 1363 CB SER A 112 -6.040 -5.021 2.907 1.00 0.00 C ATOM 1364 OG SER A 112 -7.438 -5.228 2.808 1.00 0.00 O ATOM 0 H SER A 112 -3.729 -4.261 3.386 1.00 0.00 H new ATOM 0 HA SER A 112 -6.155 -2.866 2.936 1.00 0.00 H new ATOM 0 HB2 SER A 112 -5.590 -5.072 1.915 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.592 -5.817 3.502 1.00 0.00 H new ATOM 0 HG SER A 112 -7.674 -5.431 1.879 1.00 0.00 H new ATOM 1369 N ASP A 113 -5.795 -4.131 5.979 1.00 0.00 N ATOM 1370 CA ASP A 113 -6.279 -3.968 7.358 1.00 0.00 C ATOM 1371 C ASP A 113 -6.373 -2.481 7.725 1.00 0.00 C ATOM 1372 O ASP A 113 -7.385 -2.025 8.262 1.00 0.00 O ATOM 1373 CB ASP A 113 -5.344 -4.675 8.361 1.00 0.00 C ATOM 1374 CG ASP A 113 -5.619 -6.176 8.581 1.00 0.00 C ATOM 1375 OD1 ASP A 113 -6.533 -6.765 7.953 1.00 0.00 O ATOM 1376 OD2 ASP A 113 -4.946 -6.768 9.460 1.00 0.00 O ATOM 0 H ASP A 113 -4.960 -4.713 5.906 1.00 0.00 H new ATOM 0 HA ASP A 113 -7.269 -4.421 7.413 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.316 -4.558 8.017 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.418 -4.165 9.322 1.00 0.00 H new ATOM 1380 N SER A 114 -5.335 -1.713 7.378 1.00 0.00 N ATOM 1381 CA SER A 114 -5.311 -0.269 7.584 1.00 0.00 C ATOM 1382 C SER A 114 -6.333 0.475 6.718 1.00 0.00 C ATOM 1383 O SER A 114 -7.091 1.284 7.244 1.00 0.00 O ATOM 1384 CB SER A 114 -3.905 0.249 7.322 1.00 0.00 C ATOM 1385 OG SER A 114 -3.881 1.636 7.591 1.00 0.00 O ATOM 0 H SER A 114 -4.488 -2.080 6.945 1.00 0.00 H new ATOM 0 HA SER A 114 -5.595 -0.076 8.619 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.186 -0.272 7.954 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.618 0.059 6.288 1.00 0.00 H new ATOM 0 HG SER A 114 -4.278 1.805 8.471 1.00 0.00 H new ATOM 1390 N ALA A 115 -6.424 0.196 5.415 1.00 0.00 N ATOM 1391 CA ALA A 115 -7.366 0.862 4.509 1.00 0.00 C ATOM 1392 C ALA A 115 -8.842 0.518 4.800 1.00 0.00 C ATOM 1393 O ALA A 115 -9.712 1.386 4.714 1.00 0.00 O ATOM 1394 CB ALA A 115 -6.973 0.511 3.074 1.00 0.00 C ATOM 0 H ALA A 115 -5.842 -0.504 4.955 1.00 0.00 H new ATOM 0 HA ALA A 115 -7.298 1.938 4.666 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.660 0.995 2.380 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.958 0.856 2.880 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -7.021 -0.569 2.938 1.00 0.00 H new ATOM 1400 N ALA A 116 -9.129 -0.718 5.217 1.00 0.00 N ATOM 1401 CA ALA A 116 -10.435 -1.142 5.720 1.00 0.00 C ATOM 1402 C ALA A 116 -10.812 -0.400 7.015 1.00 0.00 C ATOM 1403 O ALA A 116 -11.931 0.099 7.145 1.00 0.00 O ATOM 1404 CB ALA A 116 -10.406 -2.661 5.925 1.00 0.00 C ATOM 0 H ALA A 116 -8.440 -1.470 5.213 1.00 0.00 H new ATOM 0 HA ALA A 116 -11.205 -0.889 4.991 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -11.373 -2.996 6.300 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -10.195 -3.152 4.975 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.629 -2.916 6.645 1.00 0.00 H new ATOM 1410 N ASN A 117 -9.868 -0.255 7.951 1.00 0.00 N ATOM 1411 CA ASN A 117 -10.039 0.584 9.139 1.00 0.00 C ATOM 1412 C ASN A 117 -10.154 2.086 8.792 1.00 0.00 C ATOM 1413 O ASN A 117 -10.930 2.805 9.413 1.00 0.00 O ATOM 1414 CB ASN A 117 -8.882 0.285 10.107 1.00 0.00 C ATOM 1415 CG ASN A 117 -9.003 1.048 11.415 1.00 0.00 C ATOM 1416 OD1 ASN A 117 -10.020 1.017 12.092 1.00 0.00 O ATOM 1417 ND2 ASN A 117 -7.966 1.746 11.822 1.00 0.00 N ATOM 0 H ASN A 117 -8.961 -0.719 7.904 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.985 0.341 9.623 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.855 -0.784 10.316 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -7.937 0.540 9.628 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -8.011 2.261 12.702 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -7.116 1.773 11.258 1.00 0.00 H new ATOM 1423 N SER A 118 -9.466 2.567 7.753 1.00 0.00 N ATOM 1424 CA SER A 118 -9.584 3.944 7.253 1.00 0.00 C ATOM 1425 C SER A 118 -11.002 4.248 6.766 1.00 0.00 C ATOM 1426 O SER A 118 -11.565 5.294 7.101 1.00 0.00 O ATOM 1427 CB SER A 118 -8.570 4.189 6.136 1.00 0.00 C ATOM 1428 OG SER A 118 -8.412 5.578 5.912 1.00 0.00 O ATOM 0 H SER A 118 -8.800 2.003 7.225 1.00 0.00 H new ATOM 0 HA SER A 118 -9.370 4.619 8.081 1.00 0.00 H new ATOM 0 HB2 SER A 118 -7.611 3.745 6.403 1.00 0.00 H new ATOM 0 HB3 SER A 118 -8.903 3.702 5.220 1.00 0.00 H new ATOM 0 HG SER A 118 -7.759 5.722 5.196 1.00 0.00 H new ATOM 1433 N ALA A 119 -11.634 3.291 6.074 1.00 0.00 N ATOM 1434 CA ALA A 119 -13.052 3.349 5.719 1.00 0.00 C ATOM 1435 C ALA A 119 -14.010 3.393 6.935 1.00 0.00 C ATOM 1436 O ALA A 119 -15.138 3.872 6.806 1.00 0.00 O ATOM 1437 CB ALA A 119 -13.379 2.210 4.744 1.00 0.00 C ATOM 0 H ALA A 119 -11.167 2.447 5.743 1.00 0.00 H new ATOM 0 HA ALA A 119 -13.226 4.303 5.222 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -14.435 2.251 4.478 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -12.774 2.316 3.844 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -13.161 1.252 5.217 1.00 0.00 H new ATOM 1443 N VAL A 120 -13.567 2.962 8.127 1.00 0.00 N ATOM 1444 CA VAL A 120 -14.313 3.097 9.395 1.00 0.00 C ATOM 1445 C VAL A 120 -14.217 4.509 9.990 1.00 0.00 C ATOM 1446 O VAL A 120 -15.177 4.985 10.598 1.00 0.00 O ATOM 1447 CB VAL A 120 -13.877 2.009 10.413 1.00 0.00 C ATOM 1448 CG1 VAL A 120 -13.204 2.500 11.708 1.00 0.00 C ATOM 1449 CG2 VAL A 120 -15.095 1.177 10.824 1.00 0.00 C ATOM 0 H VAL A 120 -12.664 2.501 8.242 1.00 0.00 H new ATOM 0 HA VAL A 120 -15.367 2.939 9.165 1.00 0.00 H new ATOM 0 HB VAL A 120 -13.117 1.443 9.874 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -12.949 1.644 12.332 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -12.297 3.052 11.460 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -13.889 3.152 12.249 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -14.789 0.413 11.539 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -15.841 1.826 11.283 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -15.523 0.699 9.943 1.00 0.00 H new ATOM 1459 N SER A 121 -13.090 5.201 9.793 1.00 0.00 N ATOM 1460 CA SER A 121 -12.839 6.553 10.322 1.00 0.00 C ATOM 1461 C SER A 121 -13.681 7.661 9.668 1.00 0.00 C ATOM 1462 O SER A 121 -13.628 8.801 10.128 1.00 0.00 O ATOM 1463 CB SER A 121 -11.350 6.906 10.185 1.00 0.00 C ATOM 1464 OG SER A 121 -10.553 6.063 11.002 1.00 0.00 O ATOM 0 H SER A 121 -12.309 4.833 9.251 1.00 0.00 H new ATOM 0 HA SER A 121 -13.140 6.514 11.369 1.00 0.00 H new ATOM 0 HB2 SER A 121 -11.043 6.806 9.144 1.00 0.00 H new ATOM 0 HB3 SER A 121 -11.192 7.947 10.466 1.00 0.00 H new ATOM 0 HG SER A 121 -9.609 6.304 10.898 1.00 0.00 H new ATOM 1469 N GLY A 122 -14.423 7.372 8.588 1.00 0.00 N ATOM 1470 CA GLY A 122 -15.333 8.301 7.890 1.00 0.00 C ATOM 1471 C GLY A 122 -14.627 9.341 7.007 1.00 0.00 C ATOM 1472 O GLY A 122 -15.062 9.610 5.886 1.00 0.00 O ATOM 0 H GLY A 122 -14.407 6.448 8.157 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -16.018 7.722 7.271 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -15.938 8.823 8.632 1.00 0.00 H new ATOM 1476 N ASN A 123 -13.453 9.823 7.426 1.00 0.00 N ATOM 1477 CA ASN A 123 -12.559 10.673 6.631 1.00 0.00 C ATOM 1478 C ASN A 123 -12.145 10.072 5.262 1.00 0.00 C ATOM 1479 O ASN A 123 -11.665 10.801 4.396 1.00 0.00 O ATOM 1480 CB ASN A 123 -11.344 11.072 7.497 1.00 0.00 C ATOM 1481 CG ASN A 123 -10.140 10.147 7.364 1.00 0.00 C ATOM 1482 OD1 ASN A 123 -9.040 10.566 7.038 1.00 0.00 O ATOM 1483 ND2 ASN A 123 -10.300 8.862 7.590 1.00 0.00 N ATOM 0 H ASN A 123 -13.086 9.627 8.357 1.00 0.00 H new ATOM 0 HA ASN A 123 -13.119 11.566 6.354 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -11.040 12.084 7.229 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.652 11.098 8.542 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -9.510 8.225 7.493 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -11.215 8.502 7.863 1.00 0.00 H new ATOM 1489 N TYR A 124 -12.351 8.764 5.046 1.00 0.00 N ATOM 1490 CA TYR A 124 -12.118 8.070 3.771 1.00 0.00 C ATOM 1491 C TYR A 124 -12.913 8.674 2.600 1.00 0.00 C ATOM 1492 O TYR A 124 -12.456 8.627 1.456 1.00 0.00 O ATOM 1493 CB TYR A 124 -12.414 6.566 3.938 1.00 0.00 C ATOM 1494 CG TYR A 124 -13.666 6.034 3.249 1.00 0.00 C ATOM 1495 CD1 TYR A 124 -13.623 5.722 1.876 1.00 0.00 C ATOM 1496 CD2 TYR A 124 -14.863 5.846 3.970 1.00 0.00 C ATOM 1497 CE1 TYR A 124 -14.776 5.254 1.217 1.00 0.00 C ATOM 1498 CE2 TYR A 124 -16.008 5.340 3.323 1.00 0.00 C ATOM 1499 CZ TYR A 124 -15.972 5.060 1.938 1.00 0.00 C ATOM 1500 OH TYR A 124 -17.082 4.610 1.291 1.00 0.00 O ATOM 0 H TYR A 124 -12.695 8.141 5.777 1.00 0.00 H new ATOM 0 HA TYR A 124 -11.068 8.204 3.511 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -11.556 6.007 3.564 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -12.495 6.351 5.004 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -12.701 5.842 1.326 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -14.902 6.091 5.021 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -14.744 5.043 0.158 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -16.913 5.166 3.886 1.00 0.00 H new ATOM 0 HH TYR A 124 -17.822 4.528 1.929 1.00 0.00 H new ATOM 1509 N LEU A 125 -14.076 9.277 2.878 1.00 0.00 N ATOM 1510 CA LEU A 125 -14.933 9.994 1.923 1.00 0.00 C ATOM 1511 C LEU A 125 -14.338 11.368 1.512 1.00 0.00 C ATOM 1512 O LEU A 125 -15.045 12.377 1.437 1.00 0.00 O ATOM 1513 CB LEU A 125 -16.358 10.080 2.515 1.00 0.00 C ATOM 1514 CG LEU A 125 -17.063 8.702 2.597 1.00 0.00 C ATOM 1515 CD1 LEU A 125 -17.479 8.344 4.025 1.00 0.00 C ATOM 1516 CD2 LEU A 125 -18.327 8.668 1.735 1.00 0.00 C ATOM 0 H LEU A 125 -14.464 9.279 3.821 1.00 0.00 H new ATOM 0 HA LEU A 125 -14.987 9.441 0.985 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -16.305 10.515 3.513 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -16.959 10.754 1.905 1.00 0.00 H new ATOM 0 HG LEU A 125 -16.330 7.981 2.235 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -17.968 7.370 4.028 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -16.596 8.309 4.663 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -18.170 9.098 4.403 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -18.796 7.687 1.816 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -19.023 9.433 2.079 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -18.063 8.859 0.695 1.00 0.00 H new ATOM 1527 N GLY A 126 -13.020 11.426 1.284 1.00 0.00 N ATOM 1528 CA GLY A 126 -12.280 12.613 0.844 1.00 0.00 C ATOM 1529 C GLY A 126 -12.192 13.730 1.893 1.00 0.00 C ATOM 1530 O GLY A 126 -12.245 14.906 1.531 1.00 0.00 O ATOM 0 H GLY A 126 -12.416 10.613 1.406 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -11.270 12.314 0.564 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -12.755 13.010 -0.053 1.00 0.00 H new ATOM 1534 N VAL A 127 -12.087 13.370 3.181 1.00 0.00 N ATOM 1535 CA VAL A 127 -12.150 14.270 4.352 1.00 0.00 C ATOM 1536 C VAL A 127 -13.382 15.187 4.286 1.00 0.00 C ATOM 1537 O VAL A 127 -13.300 16.397 4.059 1.00 0.00 O ATOM 1538 CB VAL A 127 -10.808 14.999 4.608 1.00 0.00 C ATOM 1539 CG1 VAL A 127 -10.825 15.815 5.910 1.00 0.00 C ATOM 1540 CG2 VAL A 127 -9.653 13.993 4.750 1.00 0.00 C ATOM 0 H VAL A 127 -11.949 12.396 3.452 1.00 0.00 H new ATOM 0 HA VAL A 127 -12.294 13.660 5.244 1.00 0.00 H new ATOM 0 HB VAL A 127 -10.667 15.657 3.750 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -9.861 16.307 6.044 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -11.612 16.567 5.858 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -11.013 15.151 6.753 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -8.722 14.531 4.929 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -9.853 13.325 5.588 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -9.564 13.409 3.834 1.00 0.00 H new ATOM 1550 N SER A 128 -14.558 14.570 4.440 1.00 0.00 N ATOM 1551 CA SER A 128 -15.874 15.219 4.386 1.00 0.00 C ATOM 1552 C SER A 128 -16.880 14.523 5.315 1.00 0.00 C ATOM 1553 O SER A 128 -16.660 13.376 5.708 1.00 0.00 O ATOM 1554 CB SER A 128 -16.385 15.195 2.939 1.00 0.00 C ATOM 1555 OG SER A 128 -17.298 16.262 2.732 1.00 0.00 O ATOM 0 H SER A 128 -14.623 13.567 4.612 1.00 0.00 H new ATOM 0 HA SER A 128 -15.770 16.249 4.727 1.00 0.00 H new ATOM 0 HB2 SER A 128 -15.548 15.282 2.247 1.00 0.00 H new ATOM 0 HB3 SER A 128 -16.872 14.242 2.732 1.00 0.00 H new ATOM 0 HG SER A 128 -17.619 16.243 1.806 1.00 0.00 H new ATOM 1560 N GLN A 129 -17.985 15.204 5.644 1.00 0.00 N ATOM 1561 CA GLN A 129 -19.055 14.812 6.587 1.00 0.00 C ATOM 1562 C GLN A 129 -18.590 14.531 8.034 1.00 0.00 C ATOM 1563 O GLN A 129 -18.942 15.284 8.947 1.00 0.00 O ATOM 1564 CB GLN A 129 -19.853 13.632 5.993 1.00 0.00 C ATOM 1565 CG GLN A 129 -21.069 13.210 6.838 1.00 0.00 C ATOM 1566 CD GLN A 129 -21.614 11.844 6.418 1.00 0.00 C ATOM 1567 OE1 GLN A 129 -21.710 10.913 7.208 1.00 0.00 O ATOM 1568 NE2 GLN A 129 -21.988 11.656 5.168 1.00 0.00 N ATOM 0 H GLN A 129 -18.175 16.116 5.228 1.00 0.00 H new ATOM 0 HA GLN A 129 -19.703 15.682 6.697 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -20.194 13.904 4.994 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -19.187 12.776 5.881 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -20.786 13.179 7.890 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -21.855 13.959 6.741 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -21.916 12.418 4.494 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -22.349 10.748 4.875 1.00 0.00 H new ATOM 1575 N ASN A 130 -17.828 13.453 8.249 1.00 0.00 N ATOM 1576 CA ASN A 130 -17.437 12.890 9.549 1.00 0.00 C ATOM 1577 C ASN A 130 -15.931 12.553 9.584 1.00 0.00 C ATOM 1578 O ASN A 130 -15.130 13.507 9.743 1.00 0.00 O ATOM 1579 CB ASN A 130 -18.375 11.702 9.905 1.00 0.00 C ATOM 1580 CG ASN A 130 -18.436 10.526 8.922 1.00 0.00 C ATOM 1581 OD1 ASN A 130 -18.165 10.616 7.731 1.00 0.00 O ATOM 1582 ND2 ASN A 130 -18.854 9.370 9.394 1.00 0.00 N ATOM 0 H ASN A 130 -17.443 12.916 7.472 1.00 0.00 H new ATOM 0 HA ASN A 130 -17.569 13.634 10.335 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -18.070 11.312 10.876 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -19.385 12.095 10.022 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -18.947 8.568 8.770 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -19.084 9.276 10.383 1.00 0.00 H new TER 1588 ASN A 130