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 74:sc= 0.188 USER MOD Set 2.1: A 39 TYR OH : rot 180:sc= 0.255 USER MOD Set 2.2: A 55 THR OG1 : rot 60:sc= 0.269 USER MOD Set 3.1: A 18 SER OG : rot 140:sc= 0.666 USER MOD Set 3.2: A 112 SER OG : rot 180:sc= 0.607 USER MOD Set 4.1: A 14 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 109 ASN : amide:sc= 1.19 K(o=1.2,f=0.048) USER MOD Single : A 2 SER OG : rot -35:sc= 0.129 USER MOD Single : A 3 TYR OH : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 GLN : amide:sc= -0.0471 X(o=-0.047,f=-0.044) USER MOD Single : A 12 SER OG : rot 86:sc= 0.21 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 THR OG1 : rot 180:sc= 0 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 -100:sc= -0.473 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 SER OG : rot 180:sc= 0.0718 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 SER OG : rot -74:sc= 0.572 USER MOD Single : A 36 SER OG : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= 0 X(o=0,f=-0.35) USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 54:sc= 0.0165 USER MOD Single : A 63 GLN : amide:sc= -0.023 K(o=-0.023,f=-0.86) 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 30:sc= -0.295 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0.36) USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 91 THR OG1 : rot -0:sc= 0.223 USER MOD Single : A 92 GLN : amide:sc= -0.203 X(o=-0.2,f=-0.2) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 99 ASN : amide:sc= -0.538 X(o=-0.54,f=-0.22) USER MOD Single : A 101 SER OG : rot 180:sc= 0 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 117 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 118 SER OG : rot -115:sc= 1.35 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 123 ASN : amide:sc= 0.553 K(o=0.55,f=0) USER MOD Single : A 124 TYR OH : rot 30: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= -0.0484 K(o=-0.048,f=-1) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 9.500 -15.690 -7.166 1.00 0.00 N ATOM 2 CA SER A 2 9.858 -15.393 -5.768 1.00 0.00 C ATOM 3 C SER A 2 10.607 -14.051 -5.590 1.00 0.00 C ATOM 4 O SER A 2 11.522 -13.911 -4.775 1.00 0.00 O ATOM 5 CB SER A 2 10.620 -16.579 -5.160 1.00 0.00 C ATOM 6 OG SER A 2 11.733 -16.946 -5.962 1.00 0.00 O ATOM 0 HA SER A 2 8.928 -15.258 -5.216 1.00 0.00 H new ATOM 0 HB2 SER A 2 10.962 -16.319 -4.158 1.00 0.00 H new ATOM 0 HB3 SER A 2 9.948 -17.431 -5.056 1.00 0.00 H new ATOM 0 HG SER A 2 11.512 -16.814 -6.908 1.00 0.00 H new ATOM 11 N TYR A 3 10.209 -13.050 -6.381 1.00 0.00 N ATOM 12 CA TYR A 3 10.813 -11.712 -6.518 1.00 0.00 C ATOM 13 C TYR A 3 9.781 -10.601 -6.195 1.00 0.00 C ATOM 14 O TYR A 3 8.668 -10.890 -5.759 1.00 0.00 O ATOM 15 CB TYR A 3 11.379 -11.609 -7.954 1.00 0.00 C ATOM 16 CG TYR A 3 12.843 -11.995 -8.128 1.00 0.00 C ATOM 17 CD1 TYR A 3 13.349 -13.218 -7.637 1.00 0.00 C ATOM 18 CD2 TYR A 3 13.709 -11.119 -8.820 1.00 0.00 C ATOM 19 CE1 TYR A 3 14.706 -13.547 -7.806 1.00 0.00 C ATOM 20 CE2 TYR A 3 15.062 -11.452 -9.004 1.00 0.00 C ATOM 21 CZ TYR A 3 15.572 -12.666 -8.490 1.00 0.00 C ATOM 22 OH TYR A 3 16.881 -12.995 -8.656 1.00 0.00 O ATOM 0 H TYR A 3 9.397 -13.157 -6.989 1.00 0.00 H new ATOM 0 HA TYR A 3 11.623 -11.570 -5.802 1.00 0.00 H new ATOM 0 HB2 TYR A 3 10.778 -12.243 -8.606 1.00 0.00 H new ATOM 0 HB3 TYR A 3 11.251 -10.583 -8.300 1.00 0.00 H new ATOM 0 HD1 TYR A 3 12.690 -13.906 -7.128 1.00 0.00 H new ATOM 0 HD2 TYR A 3 13.329 -10.187 -9.210 1.00 0.00 H new ATOM 0 HE1 TYR A 3 15.087 -14.477 -7.411 1.00 0.00 H new ATOM 0 HE2 TYR A 3 15.714 -10.778 -9.540 1.00 0.00 H new ATOM 0 HH TYR A 3 17.338 -12.281 -9.148 1.00 0.00 H new ATOM 31 N SER A 4 10.104 -9.322 -6.423 1.00 0.00 N ATOM 32 CA SER A 4 9.158 -8.189 -6.276 1.00 0.00 C ATOM 33 C SER A 4 7.875 -8.361 -7.112 1.00 0.00 C ATOM 34 O SER A 4 6.778 -8.019 -6.670 1.00 0.00 O ATOM 35 CB SER A 4 9.887 -6.884 -6.618 1.00 0.00 C ATOM 36 OG SER A 4 9.018 -5.768 -6.562 1.00 0.00 O ATOM 0 H SER A 4 11.037 -9.033 -6.718 1.00 0.00 H new ATOM 0 HA SER A 4 8.822 -8.160 -5.240 1.00 0.00 H new ATOM 0 HB2 SER A 4 10.714 -6.736 -5.923 1.00 0.00 H new ATOM 0 HB3 SER A 4 10.319 -6.959 -7.616 1.00 0.00 H new ATOM 0 HG SER A 4 9.516 -4.954 -6.784 1.00 0.00 H new ATOM 41 N SER A 5 7.974 -8.994 -8.287 1.00 0.00 N ATOM 42 CA SER A 5 6.810 -9.395 -9.096 1.00 0.00 C ATOM 43 C SER A 5 5.959 -10.495 -8.433 1.00 0.00 C ATOM 44 O SER A 5 4.735 -10.497 -8.555 1.00 0.00 O ATOM 45 CB SER A 5 7.289 -9.854 -10.475 1.00 0.00 C ATOM 46 OG SER A 5 6.195 -9.965 -11.367 1.00 0.00 O ATOM 0 H SER A 5 8.868 -9.245 -8.708 1.00 0.00 H new ATOM 0 HA SER A 5 6.162 -8.523 -9.188 1.00 0.00 H new ATOM 0 HB2 SER A 5 8.017 -9.144 -10.869 1.00 0.00 H new ATOM 0 HB3 SER A 5 7.795 -10.815 -10.389 1.00 0.00 H new ATOM 0 HG SER A 5 6.517 -10.258 -12.245 1.00 0.00 H new ATOM 51 N ALA A 6 6.586 -11.404 -7.673 1.00 0.00 N ATOM 52 CA ALA A 6 5.890 -12.431 -6.893 1.00 0.00 C ATOM 53 C ALA A 6 5.119 -11.807 -5.724 1.00 0.00 C ATOM 54 O ALA A 6 3.937 -12.102 -5.554 1.00 0.00 O ATOM 55 CB ALA A 6 6.894 -13.486 -6.416 1.00 0.00 C ATOM 0 H ALA A 6 7.601 -11.445 -7.583 1.00 0.00 H new ATOM 0 HA ALA A 6 5.154 -12.923 -7.529 1.00 0.00 H new ATOM 0 HB1 ALA A 6 6.373 -14.248 -5.836 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.372 -13.950 -7.279 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.652 -13.011 -5.793 1.00 0.00 H new ATOM 61 N PHE A 7 5.747 -10.883 -4.982 1.00 0.00 N ATOM 62 CA PHE A 7 5.057 -10.045 -3.992 1.00 0.00 C ATOM 63 C PHE A 7 3.816 -9.397 -4.612 1.00 0.00 C ATOM 64 O PHE A 7 2.708 -9.551 -4.096 1.00 0.00 O ATOM 65 CB PHE A 7 6.020 -8.978 -3.443 1.00 0.00 C ATOM 66 CG PHE A 7 5.393 -7.996 -2.471 1.00 0.00 C ATOM 67 CD1 PHE A 7 4.563 -6.954 -2.933 1.00 0.00 C ATOM 68 CD2 PHE A 7 5.621 -8.135 -1.092 1.00 0.00 C ATOM 69 CE1 PHE A 7 3.899 -6.121 -2.022 1.00 0.00 C ATOM 70 CE2 PHE A 7 4.995 -7.270 -0.181 1.00 0.00 C ATOM 71 CZ PHE A 7 4.113 -6.282 -0.647 1.00 0.00 C ATOM 0 H PHE A 7 6.747 -10.696 -5.052 1.00 0.00 H new ATOM 0 HA PHE A 7 4.730 -10.672 -3.163 1.00 0.00 H new ATOM 0 HB2 PHE A 7 6.851 -9.479 -2.946 1.00 0.00 H new ATOM 0 HB3 PHE A 7 6.439 -8.421 -4.281 1.00 0.00 H new ATOM 0 HD1 PHE A 7 4.438 -6.797 -3.994 1.00 0.00 H new ATOM 0 HD2 PHE A 7 6.281 -8.910 -0.731 1.00 0.00 H new ATOM 0 HE1 PHE A 7 3.224 -5.357 -2.379 1.00 0.00 H new ATOM 0 HE2 PHE A 7 5.191 -7.364 0.877 1.00 0.00 H new ATOM 0 HZ PHE A 7 3.598 -5.644 0.056 1.00 0.00 H new ATOM 80 N ALA A 8 3.999 -8.728 -5.755 1.00 0.00 N ATOM 81 CA ALA A 8 2.924 -8.072 -6.484 1.00 0.00 C ATOM 82 C ALA A 8 1.845 -9.039 -7.009 1.00 0.00 C ATOM 83 O ALA A 8 0.710 -8.614 -7.171 1.00 0.00 O ATOM 84 CB ALA A 8 3.523 -7.200 -7.594 1.00 0.00 C ATOM 0 H ALA A 8 4.911 -8.629 -6.200 1.00 0.00 H new ATOM 0 HA ALA A 8 2.388 -7.435 -5.780 1.00 0.00 H new ATOM 0 HB1 ALA A 8 2.720 -6.707 -8.142 1.00 0.00 H new ATOM 0 HB2 ALA A 8 4.177 -6.448 -7.153 1.00 0.00 H new ATOM 0 HB3 ALA A 8 4.098 -7.825 -8.277 1.00 0.00 H new ATOM 90 N GLN A 9 2.130 -10.330 -7.219 1.00 0.00 N ATOM 91 CA GLN A 9 1.122 -11.326 -7.609 1.00 0.00 C ATOM 92 C GLN A 9 0.111 -11.612 -6.486 1.00 0.00 C ATOM 93 O GLN A 9 -1.097 -11.459 -6.691 1.00 0.00 O ATOM 94 CB GLN A 9 1.802 -12.630 -8.079 1.00 0.00 C ATOM 95 CG GLN A 9 1.781 -12.786 -9.604 1.00 0.00 C ATOM 96 CD GLN A 9 0.368 -13.040 -10.132 1.00 0.00 C ATOM 97 OE1 GLN A 9 -0.186 -14.125 -10.005 1.00 0.00 O ATOM 98 NE2 GLN A 9 -0.278 -12.059 -10.728 1.00 0.00 N ATOM 0 H GLN A 9 3.069 -10.716 -7.123 1.00 0.00 H new ATOM 0 HA GLN A 9 0.558 -10.902 -8.440 1.00 0.00 H new ATOM 0 HB2 GLN A 9 2.834 -12.644 -7.730 1.00 0.00 H new ATOM 0 HB3 GLN A 9 1.300 -13.483 -7.623 1.00 0.00 H new ATOM 0 HG2 GLN A 9 2.185 -11.886 -10.067 1.00 0.00 H new ATOM 0 HG3 GLN A 9 2.431 -13.612 -9.893 1.00 0.00 H new ATOM 0 HE21 GLN A 9 0.169 -11.149 -10.842 1.00 0.00 H new ATOM 0 HE22 GLN A 9 -1.225 -12.209 -11.076 1.00 0.00 H new ATOM 105 N ALA A 10 0.581 -11.980 -5.289 1.00 0.00 N ATOM 106 CA ALA A 10 -0.309 -12.196 -4.147 1.00 0.00 C ATOM 107 C ALA A 10 -0.928 -10.882 -3.652 1.00 0.00 C ATOM 108 O ALA A 10 -2.121 -10.837 -3.345 1.00 0.00 O ATOM 109 CB ALA A 10 0.462 -12.861 -3.017 1.00 0.00 C ATOM 0 H ALA A 10 1.569 -12.134 -5.088 1.00 0.00 H new ATOM 0 HA ALA A 10 -1.123 -12.844 -4.473 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -0.203 -13.021 -2.168 1.00 0.00 H new ATOM 0 HB2 ALA A 10 0.852 -13.820 -3.358 1.00 0.00 H new ATOM 0 HB3 ALA A 10 1.290 -12.219 -2.714 1.00 0.00 H new ATOM 115 N ALA A 11 -0.141 -9.798 -3.632 1.00 0.00 N ATOM 116 CA ALA A 11 -0.642 -8.474 -3.305 1.00 0.00 C ATOM 117 C ALA A 11 -1.732 -8.016 -4.281 1.00 0.00 C ATOM 118 O ALA A 11 -2.751 -7.524 -3.814 1.00 0.00 O ATOM 119 CB ALA A 11 0.510 -7.469 -3.200 1.00 0.00 C ATOM 0 H ALA A 11 0.857 -9.823 -3.843 1.00 0.00 H new ATOM 0 HA ALA A 11 -1.118 -8.527 -2.326 1.00 0.00 H new ATOM 0 HB1 ALA A 11 0.112 -6.484 -2.954 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.200 -7.787 -2.418 1.00 0.00 H new ATOM 0 HB3 ALA A 11 1.038 -7.420 -4.152 1.00 0.00 H new ATOM 125 N SER A 12 -1.595 -8.246 -5.594 1.00 0.00 N ATOM 126 CA SER A 12 -2.660 -7.985 -6.577 1.00 0.00 C ATOM 127 C SER A 12 -3.946 -8.734 -6.244 1.00 0.00 C ATOM 128 O SER A 12 -5.004 -8.113 -6.222 1.00 0.00 O ATOM 129 CB SER A 12 -2.236 -8.339 -8.009 1.00 0.00 C ATOM 130 OG SER A 12 -1.512 -7.263 -8.584 1.00 0.00 O ATOM 0 H SER A 12 -0.741 -8.619 -6.007 1.00 0.00 H new ATOM 0 HA SER A 12 -2.846 -6.913 -6.521 1.00 0.00 H new ATOM 0 HB2 SER A 12 -1.621 -9.239 -8.002 1.00 0.00 H new ATOM 0 HB3 SER A 12 -3.116 -8.559 -8.613 1.00 0.00 H new ATOM 0 HG SER A 12 -0.566 -7.339 -8.341 1.00 0.00 H new ATOM 135 N SER A 13 -3.888 -10.033 -5.929 1.00 0.00 N ATOM 136 CA SER A 13 -5.094 -10.793 -5.560 1.00 0.00 C ATOM 137 C SER A 13 -5.730 -10.275 -4.258 1.00 0.00 C ATOM 138 O SER A 13 -6.934 -10.015 -4.213 1.00 0.00 O ATOM 139 CB SER A 13 -4.769 -12.287 -5.461 1.00 0.00 C ATOM 140 OG SER A 13 -5.974 -13.037 -5.423 1.00 0.00 O ATOM 0 H SER A 13 -3.027 -10.579 -5.921 1.00 0.00 H new ATOM 0 HA SER A 13 -5.832 -10.647 -6.349 1.00 0.00 H new ATOM 0 HB2 SER A 13 -4.164 -12.595 -6.314 1.00 0.00 H new ATOM 0 HB3 SER A 13 -4.179 -12.482 -4.565 1.00 0.00 H new ATOM 0 HG SER A 13 -5.763 -13.992 -5.361 1.00 0.00 H new ATOM 145 N SER A 14 -4.920 -10.032 -3.220 1.00 0.00 N ATOM 146 CA SER A 14 -5.361 -9.489 -1.925 1.00 0.00 C ATOM 147 C SER A 14 -5.962 -8.078 -2.038 1.00 0.00 C ATOM 148 O SER A 14 -7.079 -7.833 -1.573 1.00 0.00 O ATOM 149 CB SER A 14 -4.174 -9.496 -0.954 1.00 0.00 C ATOM 150 OG SER A 14 -4.543 -8.923 0.287 1.00 0.00 O ATOM 0 H SER A 14 -3.916 -10.211 -3.256 1.00 0.00 H new ATOM 0 HA SER A 14 -6.161 -10.127 -1.550 1.00 0.00 H new ATOM 0 HB2 SER A 14 -3.829 -10.518 -0.800 1.00 0.00 H new ATOM 0 HB3 SER A 14 -3.341 -8.940 -1.385 1.00 0.00 H new ATOM 0 HG SER A 14 -3.775 -8.937 0.895 1.00 0.00 H new ATOM 155 N LEU A 15 -5.270 -7.153 -2.713 1.00 0.00 N ATOM 156 CA LEU A 15 -5.712 -5.771 -2.905 1.00 0.00 C ATOM 157 C LEU A 15 -6.940 -5.683 -3.824 1.00 0.00 C ATOM 158 O LEU A 15 -7.834 -4.883 -3.558 1.00 0.00 O ATOM 159 CB LEU A 15 -4.522 -4.884 -3.343 1.00 0.00 C ATOM 160 CG LEU A 15 -4.215 -4.800 -4.855 1.00 0.00 C ATOM 161 CD1 LEU A 15 -5.099 -3.754 -5.552 1.00 0.00 C ATOM 162 CD2 LEU A 15 -2.743 -4.428 -5.079 1.00 0.00 C ATOM 0 H LEU A 15 -4.369 -7.350 -3.149 1.00 0.00 H new ATOM 0 HA LEU A 15 -6.057 -5.372 -1.951 1.00 0.00 H new ATOM 0 HB2 LEU A 15 -4.705 -3.873 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 15 -3.627 -5.247 -2.838 1.00 0.00 H new ATOM 0 HG LEU A 15 -4.424 -5.781 -5.283 1.00 0.00 H new ATOM 0 HD11 LEU A 15 -4.856 -3.722 -6.614 1.00 0.00 H new ATOM 0 HD12 LEU A 15 -6.148 -4.023 -5.428 1.00 0.00 H new ATOM 0 HD13 LEU A 15 -4.921 -2.774 -5.109 1.00 0.00 H new ATOM 0 HD21 LEU A 15 -2.540 -4.372 -6.149 1.00 0.00 H new ATOM 0 HD22 LEU A 15 -2.538 -3.461 -4.620 1.00 0.00 H new ATOM 0 HD23 LEU A 15 -2.103 -5.186 -4.628 1.00 0.00 H new ATOM 173 N ALA A 16 -7.033 -6.525 -4.864 1.00 0.00 N ATOM 174 CA ALA A 16 -8.212 -6.609 -5.734 1.00 0.00 C ATOM 175 C ALA A 16 -9.451 -7.149 -4.989 1.00 0.00 C ATOM 176 O ALA A 16 -10.578 -6.737 -5.272 1.00 0.00 O ATOM 177 CB ALA A 16 -7.880 -7.475 -6.956 1.00 0.00 C ATOM 0 H ALA A 16 -6.287 -7.170 -5.125 1.00 0.00 H new ATOM 0 HA ALA A 16 -8.467 -5.601 -6.062 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -8.754 -7.540 -7.604 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -7.052 -7.027 -7.506 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -7.598 -8.475 -6.627 1.00 0.00 H new ATOM 183 N THR A 17 -9.242 -8.020 -3.995 1.00 0.00 N ATOM 184 CA THR A 17 -10.258 -8.442 -3.011 1.00 0.00 C ATOM 185 C THR A 17 -10.707 -7.301 -2.080 1.00 0.00 C ATOM 186 O THR A 17 -11.823 -7.336 -1.556 1.00 0.00 O ATOM 187 CB THR A 17 -9.732 -9.677 -2.238 1.00 0.00 C ATOM 188 OG1 THR A 17 -10.288 -10.835 -2.829 1.00 0.00 O ATOM 189 CG2 THR A 17 -10.024 -9.756 -0.736 1.00 0.00 C ATOM 0 H THR A 17 -8.337 -8.466 -3.845 1.00 0.00 H new ATOM 0 HA THR A 17 -11.163 -8.724 -3.548 1.00 0.00 H new ATOM 0 HB THR A 17 -8.648 -9.591 -2.312 1.00 0.00 H new ATOM 0 HG1 THR A 17 -9.966 -11.630 -2.356 1.00 0.00 H new ATOM 0 HG21 THR A 17 -9.596 -10.673 -0.330 1.00 0.00 H new ATOM 0 HG22 THR A 17 -9.582 -8.896 -0.234 1.00 0.00 H new ATOM 0 HG23 THR A 17 -11.102 -9.756 -0.574 1.00 0.00 H new ATOM 197 N SER A 18 -9.891 -6.254 -1.908 1.00 0.00 N ATOM 198 CA SER A 18 -10.155 -5.117 -1.016 1.00 0.00 C ATOM 199 C SER A 18 -10.673 -3.897 -1.789 1.00 0.00 C ATOM 200 O SER A 18 -9.938 -2.956 -2.091 1.00 0.00 O ATOM 201 CB SER A 18 -8.909 -4.789 -0.185 1.00 0.00 C ATOM 202 OG SER A 18 -9.279 -3.974 0.914 1.00 0.00 O ATOM 0 H SER A 18 -9.002 -6.172 -2.400 1.00 0.00 H new ATOM 0 HA SER A 18 -10.949 -5.402 -0.326 1.00 0.00 H new ATOM 0 HB2 SER A 18 -8.443 -5.708 0.170 1.00 0.00 H new ATOM 0 HB3 SER A 18 -8.172 -4.275 -0.802 1.00 0.00 H new ATOM 0 HG SER A 18 -8.778 -4.250 1.709 1.00 0.00 H new ATOM 207 N SER A 19 -11.968 -3.896 -2.127 1.00 0.00 N ATOM 208 CA SER A 19 -12.623 -2.759 -2.803 1.00 0.00 C ATOM 209 C SER A 19 -12.471 -1.429 -2.039 1.00 0.00 C ATOM 210 O SER A 19 -12.412 -0.363 -2.652 1.00 0.00 O ATOM 211 CB SER A 19 -14.103 -3.078 -3.049 1.00 0.00 C ATOM 212 OG SER A 19 -14.688 -2.117 -3.913 1.00 0.00 O ATOM 0 H SER A 19 -12.594 -4.680 -1.942 1.00 0.00 H new ATOM 0 HA SER A 19 -12.115 -2.620 -3.757 1.00 0.00 H new ATOM 0 HB2 SER A 19 -14.198 -4.072 -3.486 1.00 0.00 H new ATOM 0 HB3 SER A 19 -14.639 -3.095 -2.100 1.00 0.00 H new ATOM 0 HG SER A 19 -15.631 -2.339 -4.058 1.00 0.00 H new ATOM 217 N ALA A 20 -12.305 -1.472 -0.710 1.00 0.00 N ATOM 218 CA ALA A 20 -11.970 -0.305 0.112 1.00 0.00 C ATOM 219 C ALA A 20 -10.643 0.379 -0.289 1.00 0.00 C ATOM 220 O ALA A 20 -10.563 1.606 -0.252 1.00 0.00 O ATOM 221 CB ALA A 20 -11.953 -0.734 1.584 1.00 0.00 C ATOM 0 H ALA A 20 -12.401 -2.332 -0.170 1.00 0.00 H new ATOM 0 HA ALA A 20 -12.736 0.452 -0.055 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -11.705 0.123 2.210 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -12.935 -1.115 1.863 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -11.206 -1.515 1.727 1.00 0.00 H new ATOM 227 N ILE A 21 -9.628 -0.378 -0.731 1.00 0.00 N ATOM 228 CA ILE A 21 -8.383 0.172 -1.304 1.00 0.00 C ATOM 229 C ILE A 21 -8.682 0.932 -2.609 1.00 0.00 C ATOM 230 O ILE A 21 -8.263 2.077 -2.776 1.00 0.00 O ATOM 231 CB ILE A 21 -7.333 -0.955 -1.508 1.00 0.00 C ATOM 232 CG1 ILE A 21 -6.830 -1.484 -0.147 1.00 0.00 C ATOM 233 CG2 ILE A 21 -6.142 -0.470 -2.339 1.00 0.00 C ATOM 234 CD1 ILE A 21 -5.765 -2.586 -0.241 1.00 0.00 C ATOM 0 H ILE A 21 -9.645 -1.397 -0.702 1.00 0.00 H new ATOM 0 HA ILE A 21 -7.954 0.888 -0.603 1.00 0.00 H new ATOM 0 HB ILE A 21 -7.826 -1.762 -2.050 1.00 0.00 H new ATOM 0 HG12 ILE A 21 -6.421 -0.650 0.423 1.00 0.00 H new ATOM 0 HG13 ILE A 21 -7.681 -1.867 0.416 1.00 0.00 H new ATOM 0 HG21 ILE A 21 -5.428 -1.284 -2.461 1.00 0.00 H new ATOM 0 HG22 ILE A 21 -6.491 -0.143 -3.319 1.00 0.00 H new ATOM 0 HG23 ILE A 21 -5.658 0.363 -1.829 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -5.472 -2.895 0.762 1.00 0.00 H new ATOM 0 HD12 ILE A 21 -6.173 -3.441 -0.780 1.00 0.00 H new ATOM 0 HD13 ILE A 21 -4.893 -2.205 -0.772 1.00 0.00 H new ATOM 245 N SER A 22 -9.456 0.329 -3.519 1.00 0.00 N ATOM 246 CA SER A 22 -9.878 0.975 -4.773 1.00 0.00 C ATOM 247 C SER A 22 -10.689 2.254 -4.533 1.00 0.00 C ATOM 248 O SER A 22 -10.363 3.307 -5.087 1.00 0.00 O ATOM 249 CB SER A 22 -10.655 -0.030 -5.635 1.00 0.00 C ATOM 250 OG SER A 22 -11.261 0.603 -6.750 1.00 0.00 O ATOM 0 H SER A 22 -9.809 -0.622 -3.409 1.00 0.00 H new ATOM 0 HA SER A 22 -8.981 1.286 -5.308 1.00 0.00 H new ATOM 0 HB2 SER A 22 -9.980 -0.812 -5.982 1.00 0.00 H new ATOM 0 HB3 SER A 22 -11.421 -0.515 -5.030 1.00 0.00 H new ATOM 0 HG SER A 22 -11.747 -0.063 -7.280 1.00 0.00 H new ATOM 255 N ARG A 23 -11.691 2.207 -3.642 1.00 0.00 N ATOM 256 CA ARG A 23 -12.476 3.386 -3.245 1.00 0.00 C ATOM 257 C ARG A 23 -11.622 4.466 -2.585 1.00 0.00 C ATOM 258 O ARG A 23 -11.814 5.631 -2.912 1.00 0.00 O ATOM 259 CB ARG A 23 -13.663 2.996 -2.351 1.00 0.00 C ATOM 260 CG ARG A 23 -14.772 2.247 -3.118 1.00 0.00 C ATOM 261 CD ARG A 23 -16.170 2.838 -2.868 1.00 0.00 C ATOM 262 NE ARG A 23 -16.443 4.014 -3.727 1.00 0.00 N ATOM 263 CZ ARG A 23 -17.593 4.661 -3.828 1.00 0.00 C ATOM 264 NH1 ARG A 23 -18.609 4.397 -3.054 1.00 0.00 N ATOM 265 NH2 ARG A 23 -17.755 5.592 -4.725 1.00 0.00 N ATOM 0 H ARG A 23 -11.981 1.348 -3.175 1.00 0.00 H new ATOM 0 HA ARG A 23 -12.872 3.816 -4.165 1.00 0.00 H new ATOM 0 HB2 ARG A 23 -13.306 2.368 -1.535 1.00 0.00 H new ATOM 0 HB3 ARG A 23 -14.083 3.895 -1.901 1.00 0.00 H new ATOM 0 HG2 ARG A 23 -14.554 2.278 -4.186 1.00 0.00 H new ATOM 0 HG3 ARG A 23 -14.767 1.198 -2.822 1.00 0.00 H new ATOM 0 HD2 ARG A 23 -16.924 2.073 -3.052 1.00 0.00 H new ATOM 0 HD3 ARG A 23 -16.258 3.127 -1.821 1.00 0.00 H new ATOM 0 HE ARG A 23 -15.669 4.358 -4.296 1.00 0.00 H new ATOM 0 HH11 ARG A 23 -18.532 3.671 -2.342 1.00 0.00 H new ATOM 0 HH12 ARG A 23 -19.480 4.917 -3.161 1.00 0.00 H new ATOM 0 HH21 ARG A 23 -16.991 5.829 -5.358 1.00 0.00 H new ATOM 0 HH22 ARG A 23 -18.646 6.084 -4.794 1.00 0.00 H new ATOM 276 N ALA A 24 -10.647 4.118 -1.742 1.00 0.00 N ATOM 277 CA ALA A 24 -9.697 5.082 -1.178 1.00 0.00 C ATOM 278 C ALA A 24 -8.947 5.875 -2.270 1.00 0.00 C ATOM 279 O ALA A 24 -8.883 7.104 -2.201 1.00 0.00 O ATOM 280 CB ALA A 24 -8.727 4.347 -0.246 1.00 0.00 C ATOM 0 H ALA A 24 -10.493 3.159 -1.430 1.00 0.00 H new ATOM 0 HA ALA A 24 -10.255 5.821 -0.604 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -8.018 5.059 0.176 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -9.286 3.871 0.559 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -8.186 3.587 -0.810 1.00 0.00 H new ATOM 286 N PHE A 25 -8.448 5.199 -3.311 1.00 0.00 N ATOM 287 CA PHE A 25 -7.767 5.845 -4.444 1.00 0.00 C ATOM 288 C PHE A 25 -8.697 6.607 -5.399 1.00 0.00 C ATOM 289 O PHE A 25 -8.291 7.621 -5.965 1.00 0.00 O ATOM 290 CB PHE A 25 -6.977 4.812 -5.247 1.00 0.00 C ATOM 291 CG PHE A 25 -5.953 4.020 -4.465 1.00 0.00 C ATOM 292 CD1 PHE A 25 -5.219 4.608 -3.411 1.00 0.00 C ATOM 293 CD2 PHE A 25 -5.745 2.669 -4.792 1.00 0.00 C ATOM 294 CE1 PHE A 25 -4.389 3.813 -2.608 1.00 0.00 C ATOM 295 CE2 PHE A 25 -4.876 1.892 -4.018 1.00 0.00 C ATOM 296 CZ PHE A 25 -4.263 2.445 -2.886 1.00 0.00 C ATOM 0 H PHE A 25 -8.504 4.184 -3.394 1.00 0.00 H new ATOM 0 HA PHE A 25 -7.107 6.585 -3.992 1.00 0.00 H new ATOM 0 HB2 PHE A 25 -7.681 4.114 -5.700 1.00 0.00 H new ATOM 0 HB3 PHE A 25 -6.468 5.325 -6.063 1.00 0.00 H new ATOM 0 HD1 PHE A 25 -5.297 5.669 -3.224 1.00 0.00 H new ATOM 0 HD2 PHE A 25 -6.254 2.232 -5.638 1.00 0.00 H new ATOM 0 HE1 PHE A 25 -3.850 4.252 -1.781 1.00 0.00 H new ATOM 0 HE2 PHE A 25 -4.678 0.867 -4.293 1.00 0.00 H new ATOM 0 HZ PHE A 25 -3.690 1.813 -2.224 1.00 0.00 H new ATOM 305 N ALA A 26 -9.939 6.153 -5.576 1.00 0.00 N ATOM 306 CA ALA A 26 -10.951 6.888 -6.335 1.00 0.00 C ATOM 307 C ALA A 26 -11.482 8.126 -5.579 1.00 0.00 C ATOM 308 O ALA A 26 -11.920 9.096 -6.203 1.00 0.00 O ATOM 309 CB ALA A 26 -12.082 5.920 -6.691 1.00 0.00 C ATOM 0 H ALA A 26 -10.271 5.266 -5.197 1.00 0.00 H new ATOM 0 HA ALA A 26 -10.493 7.279 -7.244 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -12.848 6.449 -7.258 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -11.685 5.102 -7.292 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -12.519 5.519 -5.777 1.00 0.00 H new ATOM 315 N SER A 27 -11.438 8.104 -4.242 1.00 0.00 N ATOM 316 CA SER A 27 -11.891 9.195 -3.375 1.00 0.00 C ATOM 317 C SER A 27 -10.964 10.416 -3.423 1.00 0.00 C ATOM 318 O SER A 27 -11.428 11.557 -3.513 1.00 0.00 O ATOM 319 CB SER A 27 -11.984 8.696 -1.934 1.00 0.00 C ATOM 320 OG SER A 27 -12.743 9.629 -1.210 1.00 0.00 O ATOM 0 H SER A 27 -11.077 7.305 -3.721 1.00 0.00 H new ATOM 0 HA SER A 27 -12.868 9.510 -3.742 1.00 0.00 H new ATOM 0 HB2 SER A 27 -12.452 7.712 -1.899 1.00 0.00 H new ATOM 0 HB3 SER A 27 -10.990 8.592 -1.500 1.00 0.00 H new ATOM 0 HG SER A 27 -12.144 10.213 -0.700 1.00 0.00 H new ATOM 325 N VAL A 28 -9.646 10.187 -3.410 1.00 0.00 N ATOM 326 CA VAL A 28 -8.633 11.236 -3.603 1.00 0.00 C ATOM 327 C VAL A 28 -8.637 11.739 -5.057 1.00 0.00 C ATOM 328 O VAL A 28 -8.689 10.958 -6.007 1.00 0.00 O ATOM 329 CB VAL A 28 -7.229 10.768 -3.157 1.00 0.00 C ATOM 330 CG1 VAL A 28 -7.208 10.498 -1.645 1.00 0.00 C ATOM 331 CG2 VAL A 28 -6.743 9.497 -3.856 1.00 0.00 C ATOM 0 H VAL A 28 -9.247 9.260 -3.264 1.00 0.00 H new ATOM 0 HA VAL A 28 -8.898 12.077 -2.962 1.00 0.00 H new ATOM 0 HB VAL A 28 -6.561 11.583 -3.434 1.00 0.00 H new ATOM 0 HG11 VAL A 28 -6.212 10.169 -1.348 1.00 0.00 H new ATOM 0 HG12 VAL A 28 -7.464 11.412 -1.109 1.00 0.00 H new ATOM 0 HG13 VAL A 28 -7.933 9.721 -1.404 1.00 0.00 H new ATOM 0 HG21 VAL A 28 -5.751 9.236 -3.488 1.00 0.00 H new ATOM 0 HG22 VAL A 28 -7.434 8.680 -3.648 1.00 0.00 H new ATOM 0 HG23 VAL A 28 -6.697 9.668 -4.932 1.00 0.00 H new ATOM 341 N SER A 29 -8.566 13.061 -5.232 1.00 0.00 N ATOM 342 CA SER A 29 -8.590 13.758 -6.537 1.00 0.00 C ATOM 343 C SER A 29 -7.331 14.612 -6.770 1.00 0.00 C ATOM 344 O SER A 29 -7.287 15.475 -7.651 1.00 0.00 O ATOM 345 CB SER A 29 -9.870 14.594 -6.651 1.00 0.00 C ATOM 346 OG SER A 29 -9.931 15.565 -5.615 1.00 0.00 O ATOM 0 H SER A 29 -8.487 13.706 -4.446 1.00 0.00 H new ATOM 0 HA SER A 29 -8.589 13.004 -7.324 1.00 0.00 H new ATOM 0 HB2 SER A 29 -9.902 15.089 -7.622 1.00 0.00 H new ATOM 0 HB3 SER A 29 -10.742 13.942 -6.597 1.00 0.00 H new ATOM 0 HG SER A 29 -10.754 16.089 -5.706 1.00 0.00 H new ATOM 351 N SER A 30 -6.288 14.346 -5.983 1.00 0.00 N ATOM 352 CA SER A 30 -4.978 14.997 -5.999 1.00 0.00 C ATOM 353 C SER A 30 -3.901 13.929 -5.810 1.00 0.00 C ATOM 354 O SER A 30 -4.054 13.027 -4.981 1.00 0.00 O ATOM 355 CB SER A 30 -4.922 16.047 -4.881 1.00 0.00 C ATOM 356 OG SER A 30 -3.587 16.355 -4.510 1.00 0.00 O ATOM 0 H SER A 30 -6.340 13.620 -5.268 1.00 0.00 H new ATOM 0 HA SER A 30 -4.808 15.503 -6.949 1.00 0.00 H new ATOM 0 HB2 SER A 30 -5.426 16.956 -5.211 1.00 0.00 H new ATOM 0 HB3 SER A 30 -5.465 15.679 -4.010 1.00 0.00 H new ATOM 0 HG SER A 30 -3.592 17.028 -3.797 1.00 0.00 H new ATOM 361 N ALA A 31 -2.804 14.029 -6.566 1.00 0.00 N ATOM 362 CA ALA A 31 -1.651 13.150 -6.393 1.00 0.00 C ATOM 363 C ALA A 31 -1.066 13.290 -4.980 1.00 0.00 C ATOM 364 O ALA A 31 -0.741 12.284 -4.363 1.00 0.00 O ATOM 365 CB ALA A 31 -0.614 13.464 -7.476 1.00 0.00 C ATOM 0 H ALA A 31 -2.693 14.718 -7.310 1.00 0.00 H new ATOM 0 HA ALA A 31 -1.961 12.111 -6.503 1.00 0.00 H new ATOM 0 HB1 ALA A 31 0.250 12.811 -7.353 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -1.054 13.301 -8.460 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -0.299 14.504 -7.387 1.00 0.00 H new ATOM 371 N SER A 32 -1.027 14.509 -4.425 1.00 0.00 N ATOM 372 CA SER A 32 -0.651 14.760 -3.025 1.00 0.00 C ATOM 373 C SER A 32 -1.607 14.098 -2.031 1.00 0.00 C ATOM 374 O SER A 32 -1.146 13.489 -1.067 1.00 0.00 O ATOM 375 CB SER A 32 -0.590 16.267 -2.734 1.00 0.00 C ATOM 376 OG SER A 32 0.758 16.712 -2.743 1.00 0.00 O ATOM 0 H SER A 32 -1.258 15.358 -4.940 1.00 0.00 H new ATOM 0 HA SER A 32 0.336 14.317 -2.893 1.00 0.00 H new ATOM 0 HB2 SER A 32 -1.166 16.813 -3.481 1.00 0.00 H new ATOM 0 HB3 SER A 32 -1.044 16.477 -1.765 1.00 0.00 H new ATOM 0 HG SER A 32 0.786 17.674 -2.558 1.00 0.00 H new ATOM 381 N ALA A 33 -2.924 14.157 -2.259 1.00 0.00 N ATOM 382 CA ALA A 33 -3.895 13.476 -1.399 1.00 0.00 C ATOM 383 C ALA A 33 -3.725 11.948 -1.440 1.00 0.00 C ATOM 384 O ALA A 33 -3.741 11.308 -0.390 1.00 0.00 O ATOM 385 CB ALA A 33 -5.315 13.896 -1.785 1.00 0.00 C ATOM 0 H ALA A 33 -3.341 14.671 -3.035 1.00 0.00 H new ATOM 0 HA ALA A 33 -3.711 13.779 -0.368 1.00 0.00 H new ATOM 0 HB1 ALA A 33 -6.033 13.386 -1.142 1.00 0.00 H new ATOM 0 HB2 ALA A 33 -5.421 14.974 -1.664 1.00 0.00 H new ATOM 0 HB3 ALA A 33 -5.504 13.627 -2.824 1.00 0.00 H new ATOM 391 N ALA A 34 -3.496 11.367 -2.622 1.00 0.00 N ATOM 392 CA ALA A 34 -3.169 9.950 -2.771 1.00 0.00 C ATOM 393 C ALA A 34 -1.857 9.590 -2.058 1.00 0.00 C ATOM 394 O ALA A 34 -1.831 8.658 -1.256 1.00 0.00 O ATOM 395 CB ALA A 34 -3.122 9.603 -4.264 1.00 0.00 C ATOM 0 H ALA A 34 -3.533 11.873 -3.507 1.00 0.00 H new ATOM 0 HA ALA A 34 -3.945 9.353 -2.293 1.00 0.00 H new ATOM 0 HB1 ALA A 34 -2.879 8.547 -4.385 1.00 0.00 H new ATOM 0 HB2 ALA A 34 -4.093 9.805 -4.715 1.00 0.00 H new ATOM 0 HB3 ALA A 34 -2.361 10.209 -4.755 1.00 0.00 H new ATOM 401 N SER A 35 -0.790 10.357 -2.294 1.00 0.00 N ATOM 402 CA SER A 35 0.513 10.200 -1.648 1.00 0.00 C ATOM 403 C SER A 35 0.398 10.244 -0.124 1.00 0.00 C ATOM 404 O SER A 35 0.919 9.351 0.531 1.00 0.00 O ATOM 405 CB SER A 35 1.481 11.283 -2.141 1.00 0.00 C ATOM 406 OG SER A 35 1.791 11.080 -3.508 1.00 0.00 O ATOM 0 H SER A 35 -0.811 11.128 -2.961 1.00 0.00 H new ATOM 0 HA SER A 35 0.903 9.219 -1.920 1.00 0.00 H new ATOM 0 HB2 SER A 35 1.035 12.268 -2.005 1.00 0.00 H new ATOM 0 HB3 SER A 35 2.395 11.262 -1.547 1.00 0.00 H new ATOM 0 HG SER A 35 2.401 10.318 -3.595 1.00 0.00 H new ATOM 411 N SER A 36 -0.330 11.207 0.450 1.00 0.00 N ATOM 412 CA SER A 36 -0.550 11.340 1.902 1.00 0.00 C ATOM 413 C SER A 36 -1.489 10.280 2.498 1.00 0.00 C ATOM 414 O SER A 36 -1.272 9.836 3.626 1.00 0.00 O ATOM 415 CB SER A 36 -1.100 12.732 2.224 1.00 0.00 C ATOM 416 OG SER A 36 -0.073 13.697 2.059 1.00 0.00 O ATOM 0 H SER A 36 -0.796 11.935 -0.091 1.00 0.00 H new ATOM 0 HA SER A 36 0.426 11.186 2.361 1.00 0.00 H new ATOM 0 HB2 SER A 36 -1.940 12.963 1.569 1.00 0.00 H new ATOM 0 HB3 SER A 36 -1.477 12.758 3.246 1.00 0.00 H new ATOM 0 HG SER A 36 -0.426 14.588 2.263 1.00 0.00 H new ATOM 421 N LEU A 37 -2.508 9.824 1.761 1.00 0.00 N ATOM 422 CA LEU A 37 -3.330 8.665 2.136 1.00 0.00 C ATOM 423 C LEU A 37 -2.448 7.417 2.222 1.00 0.00 C ATOM 424 O LEU A 37 -2.389 6.753 3.259 1.00 0.00 O ATOM 425 CB LEU A 37 -4.494 8.555 1.121 1.00 0.00 C ATOM 426 CG LEU A 37 -5.407 7.307 1.107 1.00 0.00 C ATOM 427 CD1 LEU A 37 -4.878 6.222 0.168 1.00 0.00 C ATOM 428 CD2 LEU A 37 -5.672 6.696 2.485 1.00 0.00 C ATOM 0 H LEU A 37 -2.789 10.252 0.879 1.00 0.00 H new ATOM 0 HA LEU A 37 -3.774 8.778 3.125 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -5.137 9.422 1.273 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -4.062 8.649 0.125 1.00 0.00 H new ATOM 0 HG LEU A 37 -6.361 7.684 0.738 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -5.549 5.364 0.189 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -4.823 6.615 -0.847 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -3.884 5.913 0.492 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -6.321 5.827 2.379 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -4.727 6.391 2.936 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -6.157 7.435 3.123 1.00 0.00 H new ATOM 439 N ALA A 38 -1.687 7.149 1.163 1.00 0.00 N ATOM 440 CA ALA A 38 -0.773 6.019 1.101 1.00 0.00 C ATOM 441 C ALA A 38 0.397 6.150 2.098 1.00 0.00 C ATOM 442 O ALA A 38 0.877 5.142 2.607 1.00 0.00 O ATOM 443 CB ALA A 38 -0.309 5.885 -0.343 1.00 0.00 C ATOM 0 H ALA A 38 -1.690 7.718 0.317 1.00 0.00 H new ATOM 0 HA ALA A 38 -1.286 5.107 1.407 1.00 0.00 H new ATOM 0 HB1 ALA A 38 0.380 5.045 -0.427 1.00 0.00 H new ATOM 0 HB2 ALA A 38 -1.171 5.713 -0.988 1.00 0.00 H new ATOM 0 HB3 ALA A 38 0.196 6.801 -0.649 1.00 0.00 H new ATOM 449 N TYR A 39 0.790 7.376 2.458 1.00 0.00 N ATOM 450 CA TYR A 39 1.700 7.672 3.566 1.00 0.00 C ATOM 451 C TYR A 39 1.099 7.233 4.910 1.00 0.00 C ATOM 452 O TYR A 39 1.742 6.477 5.622 1.00 0.00 O ATOM 453 CB TYR A 39 2.064 9.166 3.572 1.00 0.00 C ATOM 454 CG TYR A 39 3.241 9.564 4.440 1.00 0.00 C ATOM 455 CD1 TYR A 39 4.551 9.444 3.938 1.00 0.00 C ATOM 456 CD2 TYR A 39 3.031 10.146 5.705 1.00 0.00 C ATOM 457 CE1 TYR A 39 5.655 9.857 4.708 1.00 0.00 C ATOM 458 CE2 TYR A 39 4.128 10.600 6.459 1.00 0.00 C ATOM 459 CZ TYR A 39 5.446 10.437 5.979 1.00 0.00 C ATOM 460 OH TYR A 39 6.493 10.854 6.736 1.00 0.00 O ATOM 0 H TYR A 39 0.473 8.214 1.971 1.00 0.00 H new ATOM 0 HA TYR A 39 2.617 7.101 3.422 1.00 0.00 H new ATOM 0 HB2 TYR A 39 2.275 9.471 2.547 1.00 0.00 H new ATOM 0 HB3 TYR A 39 1.191 9.730 3.899 1.00 0.00 H new ATOM 0 HD1 TYR A 39 4.710 9.031 2.953 1.00 0.00 H new ATOM 0 HD2 TYR A 39 2.029 10.244 6.096 1.00 0.00 H new ATOM 0 HE1 TYR A 39 6.658 9.731 4.328 1.00 0.00 H new ATOM 0 HE2 TYR A 39 3.961 11.077 7.413 1.00 0.00 H new ATOM 0 HH TYR A 39 6.159 11.228 7.578 1.00 0.00 H new ATOM 469 N ASN A 40 -0.150 7.587 5.239 1.00 0.00 N ATOM 470 CA ASN A 40 -0.818 7.122 6.467 1.00 0.00 C ATOM 471 C ASN A 40 -0.974 5.587 6.517 1.00 0.00 C ATOM 472 O ASN A 40 -0.618 4.958 7.518 1.00 0.00 O ATOM 473 CB ASN A 40 -2.191 7.809 6.613 1.00 0.00 C ATOM 474 CG ASN A 40 -2.124 9.265 7.056 1.00 0.00 C ATOM 475 OD1 ASN A 40 -1.081 9.900 7.128 1.00 0.00 O ATOM 476 ND2 ASN A 40 -3.252 9.835 7.411 1.00 0.00 N ATOM 0 H ASN A 40 -0.727 8.202 4.665 1.00 0.00 H new ATOM 0 HA ASN A 40 -0.179 7.399 7.306 1.00 0.00 H new ATOM 0 HB2 ASN A 40 -2.713 7.757 5.658 1.00 0.00 H new ATOM 0 HB3 ASN A 40 -2.788 7.250 7.334 1.00 0.00 H new ATOM 0 HD21 ASN A 40 -3.254 10.799 7.743 1.00 0.00 H new ATOM 0 HD22 ASN A 40 -4.127 9.314 7.354 1.00 0.00 H new ATOM 482 N ILE A 41 -1.460 4.978 5.429 1.00 0.00 N ATOM 483 CA ILE A 41 -1.558 3.516 5.269 1.00 0.00 C ATOM 484 C ILE A 41 -0.183 2.847 5.432 1.00 0.00 C ATOM 485 O ILE A 41 -0.050 1.859 6.157 1.00 0.00 O ATOM 486 CB ILE A 41 -2.231 3.197 3.907 1.00 0.00 C ATOM 487 CG1 ILE A 41 -3.759 3.388 4.039 1.00 0.00 C ATOM 488 CG2 ILE A 41 -1.887 1.796 3.370 1.00 0.00 C ATOM 489 CD1 ILE A 41 -4.503 3.352 2.699 1.00 0.00 C ATOM 0 H ILE A 41 -1.803 5.494 4.619 1.00 0.00 H new ATOM 0 HA ILE A 41 -2.185 3.098 6.057 1.00 0.00 H new ATOM 0 HB ILE A 41 -1.833 3.894 3.170 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -4.159 2.608 4.687 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -3.956 4.342 4.528 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.390 1.638 2.416 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -0.809 1.715 3.230 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -2.218 1.041 4.084 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -5.570 3.493 2.871 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.131 4.149 2.055 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.337 2.389 2.217 1.00 0.00 H new ATOM 500 N GLY A 42 0.842 3.425 4.804 1.00 0.00 N ATOM 501 CA GLY A 42 2.223 2.959 4.808 1.00 0.00 C ATOM 502 C GLY A 42 2.935 3.129 6.143 1.00 0.00 C ATOM 503 O GLY A 42 3.667 2.233 6.537 1.00 0.00 O ATOM 0 H GLY A 42 0.722 4.274 4.252 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.240 1.905 4.532 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.779 3.498 4.041 1.00 0.00 H new ATOM 507 N LEU A 43 2.698 4.223 6.872 1.00 0.00 N ATOM 508 CA LEU A 43 3.196 4.430 8.234 1.00 0.00 C ATOM 509 C LEU A 43 2.624 3.382 9.191 1.00 0.00 C ATOM 510 O LEU A 43 3.369 2.794 9.972 1.00 0.00 O ATOM 511 CB LEU A 43 2.824 5.837 8.746 1.00 0.00 C ATOM 512 CG LEU A 43 3.649 7.028 8.221 1.00 0.00 C ATOM 513 CD1 LEU A 43 3.145 8.300 8.901 1.00 0.00 C ATOM 514 CD2 LEU A 43 5.137 6.905 8.525 1.00 0.00 C ATOM 0 H LEU A 43 2.143 5.005 6.525 1.00 0.00 H new ATOM 0 HA LEU A 43 4.281 4.333 8.203 1.00 0.00 H new ATOM 0 HB2 LEU A 43 1.778 6.018 8.500 1.00 0.00 H new ATOM 0 HB3 LEU A 43 2.899 5.830 9.833 1.00 0.00 H new ATOM 0 HG LEU A 43 3.527 7.051 7.138 1.00 0.00 H new ATOM 0 HD11 LEU A 43 3.717 9.156 8.542 1.00 0.00 H new ATOM 0 HD12 LEU A 43 2.090 8.445 8.666 1.00 0.00 H new ATOM 0 HD13 LEU A 43 3.267 8.209 9.980 1.00 0.00 H new ATOM 0 HD21 LEU A 43 5.662 7.774 8.130 1.00 0.00 H new ATOM 0 HD22 LEU A 43 5.285 6.851 9.604 1.00 0.00 H new ATOM 0 HD23 LEU A 43 5.530 6.001 8.060 1.00 0.00 H new ATOM 525 N SER A 44 1.316 3.120 9.115 1.00 0.00 N ATOM 526 CA SER A 44 0.662 2.092 9.931 1.00 0.00 C ATOM 527 C SER A 44 1.171 0.685 9.588 1.00 0.00 C ATOM 528 O SER A 44 1.580 -0.057 10.483 1.00 0.00 O ATOM 529 CB SER A 44 -0.856 2.190 9.766 1.00 0.00 C ATOM 530 OG SER A 44 -1.499 1.356 10.715 1.00 0.00 O ATOM 0 H SER A 44 0.681 3.613 8.487 1.00 0.00 H new ATOM 0 HA SER A 44 0.915 2.270 10.976 1.00 0.00 H new ATOM 0 HB2 SER A 44 -1.179 3.223 9.898 1.00 0.00 H new ATOM 0 HB3 SER A 44 -1.141 1.894 8.756 1.00 0.00 H new ATOM 0 HG SER A 44 -2.470 1.424 10.605 1.00 0.00 H new ATOM 535 N ALA A 45 1.265 0.345 8.294 1.00 0.00 N ATOM 536 CA ALA A 45 1.874 -0.904 7.834 1.00 0.00 C ATOM 537 C ALA A 45 3.337 -1.030 8.297 1.00 0.00 C ATOM 538 O ALA A 45 3.712 -2.042 8.880 1.00 0.00 O ATOM 539 CB ALA A 45 1.746 -0.999 6.308 1.00 0.00 C ATOM 0 H ALA A 45 0.918 0.934 7.537 1.00 0.00 H new ATOM 0 HA ALA A 45 1.341 -1.743 8.283 1.00 0.00 H new ATOM 0 HB1 ALA A 45 2.199 -1.928 5.962 1.00 0.00 H new ATOM 0 HB2 ALA A 45 0.692 -0.983 6.030 1.00 0.00 H new ATOM 0 HB3 ALA A 45 2.256 -0.153 5.847 1.00 0.00 H new ATOM 545 N ALA A 46 4.156 0.008 8.123 1.00 0.00 N ATOM 546 CA ALA A 46 5.555 0.041 8.543 1.00 0.00 C ATOM 547 C ALA A 46 5.742 -0.138 10.058 1.00 0.00 C ATOM 548 O ALA A 46 6.599 -0.916 10.478 1.00 0.00 O ATOM 549 CB ALA A 46 6.162 1.360 8.066 1.00 0.00 C ATOM 0 H ALA A 46 3.855 0.873 7.673 1.00 0.00 H new ATOM 0 HA ALA A 46 6.069 -0.807 8.091 1.00 0.00 H new ATOM 0 HB1 ALA A 46 7.208 1.409 8.368 1.00 0.00 H new ATOM 0 HB2 ALA A 46 6.094 1.420 6.980 1.00 0.00 H new ATOM 0 HB3 ALA A 46 5.617 2.193 8.510 1.00 0.00 H new ATOM 555 N ARG A 47 4.916 0.516 10.885 1.00 0.00 N ATOM 556 CA ARG A 47 4.886 0.303 12.344 1.00 0.00 C ATOM 557 C ARG A 47 4.494 -1.131 12.721 1.00 0.00 C ATOM 558 O ARG A 47 5.138 -1.721 13.588 1.00 0.00 O ATOM 559 CB ARG A 47 3.950 1.332 13.002 1.00 0.00 C ATOM 560 CG ARG A 47 4.632 2.703 13.139 1.00 0.00 C ATOM 561 CD ARG A 47 3.640 3.752 13.656 1.00 0.00 C ATOM 562 NE ARG A 47 4.315 5.034 13.939 1.00 0.00 N ATOM 563 CZ ARG A 47 3.763 6.113 14.466 1.00 0.00 C ATOM 564 NH1 ARG A 47 2.485 6.188 14.715 1.00 0.00 N ATOM 565 NH2 ARG A 47 4.491 7.152 14.758 1.00 0.00 N ATOM 0 H ARG A 47 4.245 1.213 10.562 1.00 0.00 H new ATOM 0 HA ARG A 47 5.898 0.449 12.723 1.00 0.00 H new ATOM 0 HB2 ARG A 47 3.042 1.433 12.407 1.00 0.00 H new ATOM 0 HB3 ARG A 47 3.648 0.974 13.986 1.00 0.00 H new ATOM 0 HG2 ARG A 47 5.478 2.627 13.822 1.00 0.00 H new ATOM 0 HG3 ARG A 47 5.029 3.015 12.173 1.00 0.00 H new ATOM 0 HD2 ARG A 47 2.854 3.908 12.917 1.00 0.00 H new ATOM 0 HD3 ARG A 47 3.158 3.385 14.562 1.00 0.00 H new ATOM 0 HE ARG A 47 5.306 5.093 13.704 1.00 0.00 H new ATOM 0 HH11 ARG A 47 1.877 5.397 14.502 1.00 0.00 H new ATOM 0 HH12 ARG A 47 2.094 7.037 15.122 1.00 0.00 H new ATOM 0 HH21 ARG A 47 5.495 7.137 14.580 1.00 0.00 H new ATOM 0 HH22 ARG A 47 4.057 7.981 15.164 1.00 0.00 H new ATOM 576 N SER A 48 3.510 -1.723 12.041 1.00 0.00 N ATOM 577 CA SER A 48 3.110 -3.131 12.221 1.00 0.00 C ATOM 578 C SER A 48 4.190 -4.141 11.792 1.00 0.00 C ATOM 579 O SER A 48 4.383 -5.159 12.459 1.00 0.00 O ATOM 580 CB SER A 48 1.814 -3.417 11.451 1.00 0.00 C ATOM 581 OG SER A 48 0.719 -2.794 12.102 1.00 0.00 O ATOM 0 H SER A 48 2.956 -1.235 11.337 1.00 0.00 H new ATOM 0 HA SER A 48 2.958 -3.264 13.292 1.00 0.00 H new ATOM 0 HB2 SER A 48 1.899 -3.048 10.429 1.00 0.00 H new ATOM 0 HB3 SER A 48 1.647 -4.492 11.389 1.00 0.00 H new ATOM 0 HG SER A 48 -0.105 -2.979 11.605 1.00 0.00 H new ATOM 586 N LEU A 49 4.923 -3.856 10.709 1.00 0.00 N ATOM 587 CA LEU A 49 6.041 -4.666 10.198 1.00 0.00 C ATOM 588 C LEU A 49 7.363 -4.447 10.972 1.00 0.00 C ATOM 589 O LEU A 49 8.295 -5.242 10.830 1.00 0.00 O ATOM 590 CB LEU A 49 6.241 -4.340 8.706 1.00 0.00 C ATOM 591 CG LEU A 49 5.055 -4.695 7.788 1.00 0.00 C ATOM 592 CD1 LEU A 49 5.223 -3.976 6.450 1.00 0.00 C ATOM 593 CD2 LEU A 49 4.914 -6.199 7.545 1.00 0.00 C ATOM 0 H LEU A 49 4.750 -3.026 10.142 1.00 0.00 H new ATOM 0 HA LEU A 49 5.780 -5.715 10.339 1.00 0.00 H new ATOM 0 HB2 LEU A 49 6.448 -3.274 8.609 1.00 0.00 H new ATOM 0 HB3 LEU A 49 7.125 -4.870 8.351 1.00 0.00 H new ATOM 0 HG LEU A 49 4.146 -4.369 8.294 1.00 0.00 H new ATOM 0 HD11 LEU A 49 4.387 -4.224 5.796 1.00 0.00 H new ATOM 0 HD12 LEU A 49 5.247 -2.899 6.616 1.00 0.00 H new ATOM 0 HD13 LEU A 49 6.155 -4.292 5.982 1.00 0.00 H new ATOM 0 HD21 LEU A 49 4.061 -6.384 6.892 1.00 0.00 H new ATOM 0 HD22 LEU A 49 5.821 -6.578 7.074 1.00 0.00 H new ATOM 0 HD23 LEU A 49 4.759 -6.708 8.496 1.00 0.00 H new ATOM 604 N GLY A 50 7.454 -3.389 11.788 1.00 0.00 N ATOM 605 CA GLY A 50 8.623 -3.053 12.613 1.00 0.00 C ATOM 606 C GLY A 50 9.761 -2.348 11.857 1.00 0.00 C ATOM 607 O GLY A 50 10.933 -2.523 12.201 1.00 0.00 O ATOM 0 H GLY A 50 6.691 -2.721 11.896 1.00 0.00 H new ATOM 0 HA2 GLY A 50 8.300 -2.413 13.434 1.00 0.00 H new ATOM 0 HA3 GLY A 50 9.013 -3.969 13.057 1.00 0.00 H new ATOM 611 N ILE A 51 9.436 -1.587 10.807 1.00 0.00 N ATOM 612 CA ILE A 51 10.388 -0.869 9.943 1.00 0.00 C ATOM 613 C ILE A 51 11.118 0.236 10.730 1.00 0.00 C ATOM 614 O ILE A 51 10.487 1.070 11.381 1.00 0.00 O ATOM 615 CB ILE A 51 9.638 -0.276 8.727 1.00 0.00 C ATOM 616 CG1 ILE A 51 8.834 -1.332 7.931 1.00 0.00 C ATOM 617 CG2 ILE A 51 10.560 0.493 7.762 1.00 0.00 C ATOM 618 CD1 ILE A 51 9.641 -2.409 7.196 1.00 0.00 C ATOM 0 H ILE A 51 8.467 -1.447 10.522 1.00 0.00 H new ATOM 0 HA ILE A 51 11.141 -1.571 9.586 1.00 0.00 H new ATOM 0 HB ILE A 51 8.935 0.430 9.169 1.00 0.00 H new ATOM 0 HG12 ILE A 51 8.153 -1.830 8.621 1.00 0.00 H new ATOM 0 HG13 ILE A 51 8.220 -0.809 7.198 1.00 0.00 H new ATOM 0 HG21 ILE A 51 9.972 0.883 6.931 1.00 0.00 H new ATOM 0 HG22 ILE A 51 11.033 1.320 8.292 1.00 0.00 H new ATOM 0 HG23 ILE A 51 11.328 -0.179 7.379 1.00 0.00 H new ATOM 0 HD11 ILE A 51 8.960 -3.085 6.679 1.00 0.00 H new ATOM 0 HD12 ILE A 51 10.303 -1.936 6.471 1.00 0.00 H new ATOM 0 HD13 ILE A 51 10.235 -2.973 7.915 1.00 0.00 H new ATOM 629 N ALA A 52 12.449 0.281 10.626 1.00 0.00 N ATOM 630 CA ALA A 52 13.332 1.219 11.342 1.00 0.00 C ATOM 631 C ALA A 52 13.341 2.671 10.788 1.00 0.00 C ATOM 632 O ALA A 52 14.245 3.453 11.095 1.00 0.00 O ATOM 633 CB ALA A 52 14.736 0.598 11.337 1.00 0.00 C ATOM 0 H ALA A 52 12.965 -0.357 10.020 1.00 0.00 H new ATOM 0 HA ALA A 52 12.948 1.347 12.354 1.00 0.00 H new ATOM 0 HB1 ALA A 52 15.428 1.259 11.858 1.00 0.00 H new ATOM 0 HB2 ALA A 52 14.708 -0.368 11.841 1.00 0.00 H new ATOM 0 HB3 ALA A 52 15.070 0.461 10.308 1.00 0.00 H new ATOM 639 N SER A 53 12.360 3.012 9.949 1.00 0.00 N ATOM 640 CA SER A 53 12.183 4.271 9.209 1.00 0.00 C ATOM 641 C SER A 53 10.824 4.229 8.493 1.00 0.00 C ATOM 642 O SER A 53 10.729 4.191 7.264 1.00 0.00 O ATOM 643 CB SER A 53 13.350 4.526 8.232 1.00 0.00 C ATOM 644 OG SER A 53 14.234 5.512 8.743 1.00 0.00 O ATOM 0 H SER A 53 11.601 2.360 9.750 1.00 0.00 H new ATOM 0 HA SER A 53 12.192 5.110 9.905 1.00 0.00 H new ATOM 0 HB2 SER A 53 13.895 3.598 8.060 1.00 0.00 H new ATOM 0 HB3 SER A 53 12.958 4.849 7.267 1.00 0.00 H new ATOM 0 HG SER A 53 14.523 5.257 9.644 1.00 0.00 H new ATOM 649 N ASP A 54 9.742 4.171 9.275 1.00 0.00 N ATOM 650 CA ASP A 54 8.367 4.272 8.768 1.00 0.00 C ATOM 651 C ASP A 54 8.176 5.469 7.821 1.00 0.00 C ATOM 652 O ASP A 54 7.641 5.297 6.729 1.00 0.00 O ATOM 653 CB ASP A 54 7.347 4.253 9.929 1.00 0.00 C ATOM 654 CG ASP A 54 7.451 5.387 10.977 1.00 0.00 C ATOM 655 OD1 ASP A 54 8.438 6.170 10.961 1.00 0.00 O ATOM 656 OD2 ASP A 54 6.554 5.478 11.842 1.00 0.00 O ATOM 0 H ASP A 54 9.794 4.052 10.287 1.00 0.00 H new ATOM 0 HA ASP A 54 8.175 3.389 8.159 1.00 0.00 H new ATOM 0 HB2 ASP A 54 6.345 4.280 9.500 1.00 0.00 H new ATOM 0 HB3 ASP A 54 7.445 3.301 10.450 1.00 0.00 H new ATOM 660 N THR A 55 8.707 6.641 8.175 1.00 0.00 N ATOM 661 CA THR A 55 8.766 7.845 7.325 1.00 0.00 C ATOM 662 C THR A 55 9.418 7.606 5.954 1.00 0.00 C ATOM 663 O THR A 55 8.915 8.108 4.947 1.00 0.00 O ATOM 664 CB THR A 55 9.454 8.997 8.083 1.00 0.00 C ATOM 665 OG1 THR A 55 9.460 10.169 7.298 1.00 0.00 O ATOM 666 CG2 THR A 55 10.907 8.718 8.490 1.00 0.00 C ATOM 0 H THR A 55 9.125 6.789 9.094 1.00 0.00 H new ATOM 0 HA THR A 55 7.735 8.123 7.107 1.00 0.00 H new ATOM 0 HB THR A 55 8.867 9.112 8.994 1.00 0.00 H new ATOM 0 HG1 THR A 55 8.538 10.428 7.090 1.00 0.00 H new ATOM 0 HG21 THR A 55 11.310 9.583 9.017 1.00 0.00 H new ATOM 0 HG22 THR A 55 10.941 7.846 9.144 1.00 0.00 H new ATOM 0 HG23 THR A 55 11.504 8.526 7.598 1.00 0.00 H new ATOM 674 N ALA A 56 10.486 6.797 5.869 1.00 0.00 N ATOM 675 CA ALA A 56 11.165 6.510 4.604 1.00 0.00 C ATOM 676 C ALA A 56 10.413 5.474 3.756 1.00 0.00 C ATOM 677 O ALA A 56 10.285 5.686 2.551 1.00 0.00 O ATOM 678 CB ALA A 56 12.603 6.050 4.858 1.00 0.00 C ATOM 0 H ALA A 56 10.899 6.327 6.675 1.00 0.00 H new ATOM 0 HA ALA A 56 11.182 7.439 4.034 1.00 0.00 H new ATOM 0 HB1 ALA A 56 13.092 5.841 3.906 1.00 0.00 H new ATOM 0 HB2 ALA A 56 13.149 6.835 5.382 1.00 0.00 H new ATOM 0 HB3 ALA A 56 12.594 5.146 5.467 1.00 0.00 H new ATOM 684 N LEU A 57 9.871 4.400 4.356 1.00 0.00 N ATOM 685 CA LEU A 57 8.984 3.474 3.634 1.00 0.00 C ATOM 686 C LEU A 57 7.762 4.229 3.117 1.00 0.00 C ATOM 687 O LEU A 57 7.518 4.241 1.914 1.00 0.00 O ATOM 688 CB LEU A 57 8.584 2.262 4.504 1.00 0.00 C ATOM 689 CG LEU A 57 7.580 1.306 3.807 1.00 0.00 C ATOM 690 CD1 LEU A 57 7.632 -0.091 4.416 1.00 0.00 C ATOM 691 CD2 LEU A 57 6.116 1.757 3.929 1.00 0.00 C ATOM 0 H LEU A 57 10.031 4.153 5.333 1.00 0.00 H new ATOM 0 HA LEU A 57 9.529 3.069 2.781 1.00 0.00 H new ATOM 0 HB2 LEU A 57 9.481 1.703 4.770 1.00 0.00 H new ATOM 0 HB3 LEU A 57 8.145 2.622 5.435 1.00 0.00 H new ATOM 0 HG LEU A 57 7.886 1.313 2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 57 6.917 -0.737 3.906 1.00 0.00 H new ATOM 0 HD12 LEU A 57 8.636 -0.500 4.303 1.00 0.00 H new ATOM 0 HD13 LEU A 57 7.380 -0.036 5.475 1.00 0.00 H new ATOM 0 HD21 LEU A 57 5.471 1.042 3.419 1.00 0.00 H new ATOM 0 HD22 LEU A 57 5.838 1.810 4.982 1.00 0.00 H new ATOM 0 HD23 LEU A 57 5.999 2.740 3.473 1.00 0.00 H new ATOM 702 N ALA A 58 7.023 4.888 4.010 1.00 0.00 N ATOM 703 CA ALA A 58 5.800 5.600 3.682 1.00 0.00 C ATOM 704 C ALA A 58 6.050 6.705 2.651 1.00 0.00 C ATOM 705 O ALA A 58 5.249 6.857 1.734 1.00 0.00 O ATOM 706 CB ALA A 58 5.191 6.142 4.976 1.00 0.00 C ATOM 0 H ALA A 58 7.267 4.939 4.999 1.00 0.00 H new ATOM 0 HA ALA A 58 5.091 4.916 3.216 1.00 0.00 H new ATOM 0 HB1 ALA A 58 4.271 6.680 4.748 1.00 0.00 H new ATOM 0 HB2 ALA A 58 4.969 5.314 5.649 1.00 0.00 H new ATOM 0 HB3 ALA A 58 5.898 6.819 5.455 1.00 0.00 H new ATOM 712 N GLY A 59 7.175 7.422 2.739 1.00 0.00 N ATOM 713 CA GLY A 59 7.589 8.440 1.771 1.00 0.00 C ATOM 714 C GLY A 59 7.963 7.863 0.402 1.00 0.00 C ATOM 715 O GLY A 59 7.517 8.382 -0.619 1.00 0.00 O ATOM 0 H GLY A 59 7.839 7.307 3.505 1.00 0.00 H new ATOM 0 HA2 GLY A 59 6.781 9.160 1.645 1.00 0.00 H new ATOM 0 HA3 GLY A 59 8.443 8.986 2.172 1.00 0.00 H new ATOM 719 N ALA A 60 8.713 6.759 0.353 1.00 0.00 N ATOM 720 CA ALA A 60 9.039 6.056 -0.892 1.00 0.00 C ATOM 721 C ALA A 60 7.785 5.482 -1.585 1.00 0.00 C ATOM 722 O ALA A 60 7.631 5.593 -2.804 1.00 0.00 O ATOM 723 CB ALA A 60 10.058 4.954 -0.570 1.00 0.00 C ATOM 0 H ALA A 60 9.115 6.324 1.183 1.00 0.00 H new ATOM 0 HA ALA A 60 9.470 6.764 -1.600 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.315 4.418 -1.484 1.00 0.00 H new ATOM 0 HB2 ALA A 60 10.957 5.402 -0.147 1.00 0.00 H new ATOM 0 HB3 ALA A 60 9.627 4.259 0.150 1.00 0.00 H new ATOM 729 N LEU A 61 6.855 4.919 -0.808 1.00 0.00 N ATOM 730 CA LEU A 61 5.547 4.448 -1.277 1.00 0.00 C ATOM 731 C LEU A 61 4.650 5.618 -1.727 1.00 0.00 C ATOM 732 O LEU A 61 4.034 5.544 -2.789 1.00 0.00 O ATOM 733 CB LEU A 61 4.953 3.510 -0.197 1.00 0.00 C ATOM 734 CG LEU A 61 3.538 3.776 0.348 1.00 0.00 C ATOM 735 CD1 LEU A 61 2.481 3.498 -0.708 1.00 0.00 C ATOM 736 CD2 LEU A 61 3.262 2.809 1.496 1.00 0.00 C ATOM 0 H LEU A 61 6.994 4.774 0.192 1.00 0.00 H new ATOM 0 HA LEU A 61 5.640 3.853 -2.186 1.00 0.00 H new ATOM 0 HB2 LEU A 61 4.961 2.499 -0.604 1.00 0.00 H new ATOM 0 HB3 LEU A 61 5.636 3.517 0.652 1.00 0.00 H new ATOM 0 HG LEU A 61 3.493 4.819 0.661 1.00 0.00 H new ATOM 0 HD11 LEU A 61 1.492 3.695 -0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 61 2.649 4.144 -1.570 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.543 2.455 -1.019 1.00 0.00 H new ATOM 0 HD21 LEU A 61 2.262 2.988 1.890 1.00 0.00 H new ATOM 0 HD22 LEU A 61 3.330 1.784 1.132 1.00 0.00 H new ATOM 0 HD23 LEU A 61 3.997 2.963 2.286 1.00 0.00 H new ATOM 747 N ALA A 62 4.635 6.731 -0.992 1.00 0.00 N ATOM 748 CA ALA A 62 3.940 7.958 -1.375 1.00 0.00 C ATOM 749 C ALA A 62 4.459 8.502 -2.721 1.00 0.00 C ATOM 750 O ALA A 62 3.667 8.786 -3.614 1.00 0.00 O ATOM 751 CB ALA A 62 4.093 8.978 -0.240 1.00 0.00 C ATOM 0 H ALA A 62 5.116 6.805 -0.096 1.00 0.00 H new ATOM 0 HA ALA A 62 2.880 7.751 -1.525 1.00 0.00 H new ATOM 0 HB1 ALA A 62 3.580 9.901 -0.509 1.00 0.00 H new ATOM 0 HB2 ALA A 62 3.658 8.574 0.674 1.00 0.00 H new ATOM 0 HB3 ALA A 62 5.151 9.185 -0.077 1.00 0.00 H new ATOM 757 N GLN A 63 5.781 8.555 -2.919 1.00 0.00 N ATOM 758 CA GLN A 63 6.406 8.916 -4.202 1.00 0.00 C ATOM 759 C GLN A 63 5.993 7.974 -5.348 1.00 0.00 C ATOM 760 O GLN A 63 5.778 8.439 -6.470 1.00 0.00 O ATOM 761 CB GLN A 63 7.938 8.916 -4.052 1.00 0.00 C ATOM 762 CG GLN A 63 8.475 10.021 -3.119 1.00 0.00 C ATOM 763 CD GLN A 63 9.015 11.274 -3.815 1.00 0.00 C ATOM 764 OE1 GLN A 63 8.983 11.451 -5.027 1.00 0.00 O ATOM 765 NE2 GLN A 63 9.554 12.205 -3.056 1.00 0.00 N ATOM 0 H GLN A 63 6.458 8.346 -2.185 1.00 0.00 H new ATOM 0 HA GLN A 63 6.054 9.914 -4.464 1.00 0.00 H new ATOM 0 HB2 GLN A 63 8.256 7.946 -3.670 1.00 0.00 H new ATOM 0 HB3 GLN A 63 8.390 9.035 -5.037 1.00 0.00 H new ATOM 0 HG2 GLN A 63 7.675 10.320 -2.442 1.00 0.00 H new ATOM 0 HG3 GLN A 63 9.270 9.598 -2.505 1.00 0.00 H new ATOM 0 HE21 GLN A 63 9.592 12.080 -2.044 1.00 0.00 H new ATOM 0 HE22 GLN A 63 9.934 13.052 -3.480 1.00 0.00 H new ATOM 772 N ALA A 64 5.831 6.673 -5.080 1.00 0.00 N ATOM 773 CA ALA A 64 5.319 5.709 -6.055 1.00 0.00 C ATOM 774 C ALA A 64 3.858 6.009 -6.442 1.00 0.00 C ATOM 775 O ALA A 64 3.540 6.116 -7.628 1.00 0.00 O ATOM 776 CB ALA A 64 5.495 4.290 -5.498 1.00 0.00 C ATOM 0 H ALA A 64 6.053 6.259 -4.175 1.00 0.00 H new ATOM 0 HA ALA A 64 5.893 5.794 -6.978 1.00 0.00 H new ATOM 0 HB1 ALA A 64 5.116 3.566 -6.219 1.00 0.00 H new ATOM 0 HB2 ALA A 64 6.553 4.100 -5.315 1.00 0.00 H new ATOM 0 HB3 ALA A 64 4.942 4.195 -4.563 1.00 0.00 H new ATOM 782 N VAL A 65 2.979 6.218 -5.456 1.00 0.00 N ATOM 783 CA VAL A 65 1.571 6.619 -5.650 1.00 0.00 C ATOM 784 C VAL A 65 1.443 7.925 -6.443 1.00 0.00 C ATOM 785 O VAL A 65 0.710 7.981 -7.433 1.00 0.00 O ATOM 786 CB VAL A 65 0.882 6.700 -4.274 1.00 0.00 C ATOM 787 CG1 VAL A 65 -0.425 7.484 -4.250 1.00 0.00 C ATOM 788 CG2 VAL A 65 0.565 5.275 -3.830 1.00 0.00 C ATOM 0 H VAL A 65 3.229 6.112 -4.473 1.00 0.00 H new ATOM 0 HA VAL A 65 1.067 5.865 -6.254 1.00 0.00 H new ATOM 0 HB VAL A 65 1.574 7.228 -3.618 1.00 0.00 H new ATOM 0 HG11 VAL A 65 -0.831 7.483 -3.239 1.00 0.00 H new ATOM 0 HG12 VAL A 65 -0.239 8.511 -4.565 1.00 0.00 H new ATOM 0 HG13 VAL A 65 -1.140 7.020 -4.929 1.00 0.00 H new ATOM 0 HG21 VAL A 65 0.075 5.298 -2.856 1.00 0.00 H new ATOM 0 HG22 VAL A 65 -0.097 4.806 -4.558 1.00 0.00 H new ATOM 0 HG23 VAL A 65 1.490 4.702 -3.758 1.00 0.00 H new ATOM 798 N GLY A 66 2.229 8.944 -6.089 1.00 0.00 N ATOM 799 CA GLY A 66 2.361 10.192 -6.848 1.00 0.00 C ATOM 800 C GLY A 66 2.957 10.030 -8.257 1.00 0.00 C ATOM 801 O GLY A 66 2.855 10.947 -9.074 1.00 0.00 O ATOM 0 H GLY A 66 2.805 8.925 -5.247 1.00 0.00 H new ATOM 0 HA2 GLY A 66 1.377 10.653 -6.936 1.00 0.00 H new ATOM 0 HA3 GLY A 66 2.987 10.881 -6.281 1.00 0.00 H new ATOM 805 N GLY A 67 3.547 8.869 -8.567 1.00 0.00 N ATOM 806 CA GLY A 67 4.113 8.521 -9.872 1.00 0.00 C ATOM 807 C GLY A 67 3.058 8.330 -10.969 1.00 0.00 C ATOM 808 O GLY A 67 3.287 8.723 -12.115 1.00 0.00 O ATOM 0 H GLY A 67 3.646 8.117 -7.886 1.00 0.00 H new ATOM 0 HA2 GLY A 67 4.806 9.305 -10.179 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.693 7.603 -9.774 1.00 0.00 H new ATOM 812 N VAL A 68 1.888 7.773 -10.625 1.00 0.00 N ATOM 813 CA VAL A 68 0.734 7.662 -11.542 1.00 0.00 C ATOM 814 C VAL A 68 0.016 9.010 -11.690 1.00 0.00 C ATOM 815 O VAL A 68 -0.239 9.460 -12.810 1.00 0.00 O ATOM 816 CB VAL A 68 -0.254 6.582 -11.052 1.00 0.00 C ATOM 817 CG1 VAL A 68 -1.512 6.500 -11.924 1.00 0.00 C ATOM 818 CG2 VAL A 68 0.400 5.198 -11.078 1.00 0.00 C ATOM 0 H VAL A 68 1.710 7.384 -9.699 1.00 0.00 H new ATOM 0 HA VAL A 68 1.114 7.367 -12.520 1.00 0.00 H new ATOM 0 HB VAL A 68 -0.531 6.871 -10.038 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -2.174 5.725 -11.536 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -2.029 7.460 -11.908 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -1.230 6.257 -12.948 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -0.314 4.452 -10.729 1.00 0.00 H new ATOM 0 HG22 VAL A 68 0.706 4.959 -12.097 1.00 0.00 H new ATOM 0 HG23 VAL A 68 1.274 5.196 -10.427 1.00 0.00 H new ATOM 828 N GLY A 69 -0.285 9.665 -10.563 1.00 0.00 N ATOM 829 CA GLY A 69 -1.016 10.937 -10.505 1.00 0.00 C ATOM 830 C GLY A 69 -2.545 10.782 -10.423 1.00 0.00 C ATOM 831 O GLY A 69 -3.092 9.701 -10.654 1.00 0.00 O ATOM 0 H GLY A 69 -0.020 9.316 -9.642 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -0.672 11.502 -9.638 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -0.768 11.526 -11.388 1.00 0.00 H new ATOM 835 N ALA A 70 -3.235 11.878 -10.085 1.00 0.00 N ATOM 836 CA ALA A 70 -4.695 11.926 -9.928 1.00 0.00 C ATOM 837 C ALA A 70 -5.470 11.561 -11.209 1.00 0.00 C ATOM 838 O ALA A 70 -5.039 11.865 -12.326 1.00 0.00 O ATOM 839 CB ALA A 70 -5.086 13.319 -9.428 1.00 0.00 C ATOM 0 H ALA A 70 -2.785 12.776 -9.909 1.00 0.00 H new ATOM 0 HA ALA A 70 -4.975 11.164 -9.201 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -6.168 13.371 -9.306 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -4.603 13.510 -8.470 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -4.766 14.069 -10.152 1.00 0.00 H new ATOM 845 N GLY A 71 -6.654 10.960 -11.036 1.00 0.00 N ATOM 846 CA GLY A 71 -7.549 10.592 -12.139 1.00 0.00 C ATOM 847 C GLY A 71 -7.054 9.379 -12.935 1.00 0.00 C ATOM 848 O GLY A 71 -6.875 9.460 -14.154 1.00 0.00 O ATOM 0 H GLY A 71 -7.021 10.713 -10.117 1.00 0.00 H new ATOM 0 HA2 GLY A 71 -8.540 10.377 -11.739 1.00 0.00 H new ATOM 0 HA3 GLY A 71 -7.655 11.443 -12.812 1.00 0.00 H new ATOM 852 N ALA A 72 -6.805 8.266 -12.240 1.00 0.00 N ATOM 853 CA ALA A 72 -6.271 7.019 -12.796 1.00 0.00 C ATOM 854 C ALA A 72 -6.957 5.773 -12.199 1.00 0.00 C ATOM 855 O ALA A 72 -7.737 5.870 -11.246 1.00 0.00 O ATOM 856 CB ALA A 72 -4.759 6.999 -12.540 1.00 0.00 C ATOM 0 H ALA A 72 -6.976 8.206 -11.236 1.00 0.00 H new ATOM 0 HA ALA A 72 -6.474 6.985 -13.866 1.00 0.00 H new ATOM 0 HB1 ALA A 72 -4.334 6.080 -12.944 1.00 0.00 H new ATOM 0 HB2 ALA A 72 -4.296 7.858 -13.026 1.00 0.00 H new ATOM 0 HB3 ALA A 72 -4.571 7.045 -11.467 1.00 0.00 H new ATOM 862 N SER A 73 -6.666 4.595 -12.762 1.00 0.00 N ATOM 863 CA SER A 73 -7.206 3.313 -12.284 1.00 0.00 C ATOM 864 C SER A 73 -6.747 2.991 -10.856 1.00 0.00 C ATOM 865 O SER A 73 -5.608 3.277 -10.475 1.00 0.00 O ATOM 866 CB SER A 73 -6.791 2.182 -13.232 1.00 0.00 C ATOM 867 OG SER A 73 -7.491 0.996 -12.897 1.00 0.00 O ATOM 0 H SER A 73 -6.046 4.502 -13.567 1.00 0.00 H new ATOM 0 HA SER A 73 -8.292 3.401 -12.269 1.00 0.00 H new ATOM 0 HB2 SER A 73 -7.004 2.463 -14.263 1.00 0.00 H new ATOM 0 HB3 SER A 73 -5.716 2.013 -13.163 1.00 0.00 H new ATOM 0 HG SER A 73 -7.225 0.276 -13.506 1.00 0.00 H new ATOM 872 N ALA A 74 -7.602 2.327 -10.075 1.00 0.00 N ATOM 873 CA ALA A 74 -7.226 1.799 -8.765 1.00 0.00 C ATOM 874 C ALA A 74 -6.071 0.794 -8.861 1.00 0.00 C ATOM 875 O ALA A 74 -5.150 0.850 -8.047 1.00 0.00 O ATOM 876 CB ALA A 74 -8.448 1.143 -8.130 1.00 0.00 C ATOM 0 H ALA A 74 -8.571 2.141 -10.333 1.00 0.00 H new ATOM 0 HA ALA A 74 -6.877 2.625 -8.146 1.00 0.00 H new ATOM 0 HB1 ALA A 74 -8.180 0.745 -7.151 1.00 0.00 H new ATOM 0 HB2 ALA A 74 -9.240 1.883 -8.016 1.00 0.00 H new ATOM 0 HB3 ALA A 74 -8.798 0.332 -8.768 1.00 0.00 H new ATOM 882 N SER A 75 -6.073 -0.071 -9.884 1.00 0.00 N ATOM 883 CA SER A 75 -4.942 -0.960 -10.165 1.00 0.00 C ATOM 884 C SER A 75 -3.660 -0.196 -10.487 1.00 0.00 C ATOM 885 O SER A 75 -2.607 -0.666 -10.091 1.00 0.00 O ATOM 886 CB SER A 75 -5.234 -1.944 -11.303 1.00 0.00 C ATOM 887 OG SER A 75 -5.917 -3.081 -10.798 1.00 0.00 O ATOM 0 H SER A 75 -6.852 -0.173 -10.534 1.00 0.00 H new ATOM 0 HA SER A 75 -4.794 -1.522 -9.243 1.00 0.00 H new ATOM 0 HB2 SER A 75 -5.837 -1.458 -12.069 1.00 0.00 H new ATOM 0 HB3 SER A 75 -4.302 -2.251 -11.778 1.00 0.00 H new ATOM 0 HG SER A 75 -6.102 -3.704 -11.531 1.00 0.00 H new ATOM 892 N ALA A 76 -3.694 0.980 -11.126 1.00 0.00 N ATOM 893 CA ALA A 76 -2.478 1.767 -11.374 1.00 0.00 C ATOM 894 C ALA A 76 -1.850 2.285 -10.065 1.00 0.00 C ATOM 895 O ALA A 76 -0.661 2.066 -9.813 1.00 0.00 O ATOM 896 CB ALA A 76 -2.799 2.910 -12.345 1.00 0.00 C ATOM 0 H ALA A 76 -4.549 1.408 -11.481 1.00 0.00 H new ATOM 0 HA ALA A 76 -1.730 1.119 -11.831 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -1.898 3.494 -12.530 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -3.163 2.497 -13.286 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -3.565 3.552 -11.911 1.00 0.00 H new ATOM 902 N TYR A 77 -2.655 2.901 -9.192 1.00 0.00 N ATOM 903 CA TYR A 77 -2.216 3.317 -7.855 1.00 0.00 C ATOM 904 C TYR A 77 -1.719 2.136 -7.016 1.00 0.00 C ATOM 905 O TYR A 77 -0.637 2.185 -6.431 1.00 0.00 O ATOM 906 CB TYR A 77 -3.373 4.015 -7.130 1.00 0.00 C ATOM 907 CG TYR A 77 -3.534 5.485 -7.452 1.00 0.00 C ATOM 908 CD1 TYR A 77 -2.472 6.366 -7.171 1.00 0.00 C ATOM 909 CD2 TYR A 77 -4.765 5.994 -7.913 1.00 0.00 C ATOM 910 CE1 TYR A 77 -2.659 7.754 -7.261 1.00 0.00 C ATOM 911 CE2 TYR A 77 -4.965 7.384 -7.984 1.00 0.00 C ATOM 912 CZ TYR A 77 -3.921 8.268 -7.626 1.00 0.00 C ATOM 913 OH TYR A 77 -4.137 9.607 -7.595 1.00 0.00 O ATOM 0 H TYR A 77 -3.630 3.125 -9.393 1.00 0.00 H new ATOM 0 HA TYR A 77 -1.380 4.005 -7.981 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -4.301 3.500 -7.378 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -3.226 3.908 -6.055 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -1.508 5.971 -6.885 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -5.553 5.318 -8.211 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -1.840 8.426 -7.052 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -5.916 7.777 -8.312 1.00 0.00 H new ATOM 0 HH TYR A 77 -3.297 10.078 -7.777 1.00 0.00 H new ATOM 922 N ALA A 78 -2.485 1.047 -6.996 1.00 0.00 N ATOM 923 CA ALA A 78 -2.137 -0.157 -6.266 1.00 0.00 C ATOM 924 C ALA A 78 -0.943 -0.924 -6.862 1.00 0.00 C ATOM 925 O ALA A 78 -0.215 -1.568 -6.115 1.00 0.00 O ATOM 926 CB ALA A 78 -3.367 -1.046 -6.202 1.00 0.00 C ATOM 0 H ALA A 78 -3.373 0.981 -7.493 1.00 0.00 H new ATOM 0 HA ALA A 78 -1.815 0.141 -5.268 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.128 -1.959 -5.656 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.172 -0.518 -5.691 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -3.685 -1.300 -7.213 1.00 0.00 H new ATOM 932 N ASN A 79 -0.691 -0.829 -8.174 1.00 0.00 N ATOM 933 CA ASN A 79 0.530 -1.317 -8.819 1.00 0.00 C ATOM 934 C ASN A 79 1.734 -0.568 -8.264 1.00 0.00 C ATOM 935 O ASN A 79 2.703 -1.209 -7.878 1.00 0.00 O ATOM 936 CB ASN A 79 0.485 -1.151 -10.356 1.00 0.00 C ATOM 937 CG ASN A 79 0.125 -2.431 -11.094 1.00 0.00 C ATOM 938 OD1 ASN A 79 -0.981 -2.644 -11.567 1.00 0.00 O ATOM 939 ND2 ASN A 79 1.075 -3.326 -11.250 1.00 0.00 N ATOM 0 H ASN A 79 -1.346 -0.401 -8.829 1.00 0.00 H new ATOM 0 HA ASN A 79 0.612 -2.382 -8.603 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -0.241 -0.379 -10.609 1.00 0.00 H new ATOM 0 HB3 ASN A 79 1.457 -0.801 -10.704 1.00 0.00 H new ATOM 0 HD21 ASN A 79 0.885 -4.188 -11.762 1.00 0.00 H new ATOM 0 HD22 ASN A 79 2.002 -3.159 -10.859 1.00 0.00 H new ATOM 945 N ALA A 80 1.675 0.764 -8.180 1.00 0.00 N ATOM 946 CA ALA A 80 2.753 1.555 -7.598 1.00 0.00 C ATOM 947 C ALA A 80 3.001 1.199 -6.121 1.00 0.00 C ATOM 948 O ALA A 80 4.150 1.103 -5.702 1.00 0.00 O ATOM 949 CB ALA A 80 2.437 3.038 -7.785 1.00 0.00 C ATOM 0 H ALA A 80 0.884 1.317 -8.511 1.00 0.00 H new ATOM 0 HA ALA A 80 3.683 1.322 -8.117 1.00 0.00 H new ATOM 0 HB1 ALA A 80 3.238 3.638 -7.353 1.00 0.00 H new ATOM 0 HB2 ALA A 80 2.351 3.260 -8.849 1.00 0.00 H new ATOM 0 HB3 ALA A 80 1.497 3.275 -7.287 1.00 0.00 H new ATOM 955 N ILE A 81 1.945 0.928 -5.347 1.00 0.00 N ATOM 956 CA ILE A 81 2.042 0.471 -3.951 1.00 0.00 C ATOM 957 C ILE A 81 2.619 -0.943 -3.851 1.00 0.00 C ATOM 958 O ILE A 81 3.547 -1.162 -3.079 1.00 0.00 O ATOM 959 CB ILE A 81 0.661 0.558 -3.269 1.00 0.00 C ATOM 960 CG1 ILE A 81 0.281 2.042 -3.143 1.00 0.00 C ATOM 961 CG2 ILE A 81 0.661 -0.112 -1.882 1.00 0.00 C ATOM 962 CD1 ILE A 81 -1.188 2.291 -2.854 1.00 0.00 C ATOM 0 H ILE A 81 0.983 1.020 -5.675 1.00 0.00 H new ATOM 0 HA ILE A 81 2.734 1.131 -3.428 1.00 0.00 H new ATOM 0 HB ILE A 81 -0.069 0.024 -3.878 1.00 0.00 H new ATOM 0 HG12 ILE A 81 0.876 2.491 -2.348 1.00 0.00 H new ATOM 0 HG13 ILE A 81 0.548 2.553 -4.068 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -0.331 -0.028 -1.437 1.00 0.00 H new ATOM 0 HG22 ILE A 81 0.924 -1.165 -1.986 1.00 0.00 H new ATOM 0 HG23 ILE A 81 1.390 0.382 -1.239 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -1.368 3.364 -2.781 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -1.793 1.876 -3.660 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -1.460 1.813 -1.913 1.00 0.00 H new ATOM 973 N ALA A 82 2.114 -1.901 -4.631 1.00 0.00 N ATOM 974 CA ALA A 82 2.594 -3.281 -4.642 1.00 0.00 C ATOM 975 C ALA A 82 4.043 -3.385 -5.151 1.00 0.00 C ATOM 976 O ALA A 82 4.837 -4.145 -4.598 1.00 0.00 O ATOM 977 CB ALA A 82 1.630 -4.129 -5.482 1.00 0.00 C ATOM 0 H ALA A 82 1.347 -1.735 -5.283 1.00 0.00 H new ATOM 0 HA ALA A 82 2.612 -3.661 -3.621 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.975 -5.163 -5.500 1.00 0.00 H new ATOM 0 HB2 ALA A 82 0.633 -4.087 -5.044 1.00 0.00 H new ATOM 0 HB3 ALA A 82 1.596 -3.740 -6.500 1.00 0.00 H new ATOM 983 N ARG A 83 4.416 -2.574 -6.151 1.00 0.00 N ATOM 984 CA ARG A 83 5.799 -2.394 -6.615 1.00 0.00 C ATOM 985 C ARG A 83 6.678 -1.697 -5.584 1.00 0.00 C ATOM 986 O ARG A 83 7.813 -2.120 -5.423 1.00 0.00 O ATOM 987 CB ARG A 83 5.841 -1.594 -7.929 1.00 0.00 C ATOM 988 CG ARG A 83 5.428 -2.394 -9.174 1.00 0.00 C ATOM 989 CD ARG A 83 6.436 -3.507 -9.500 1.00 0.00 C ATOM 990 NE ARG A 83 6.498 -3.768 -10.951 1.00 0.00 N ATOM 991 CZ ARG A 83 7.150 -4.747 -11.553 1.00 0.00 C ATOM 992 NH1 ARG A 83 7.756 -5.691 -10.888 1.00 0.00 N ATOM 993 NH2 ARG A 83 7.214 -4.789 -12.853 1.00 0.00 N ATOM 0 H ARG A 83 3.746 -2.010 -6.674 1.00 0.00 H new ATOM 0 HA ARG A 83 6.194 -3.397 -6.778 1.00 0.00 H new ATOM 0 HB2 ARG A 83 5.185 -0.729 -7.834 1.00 0.00 H new ATOM 0 HB3 ARG A 83 6.852 -1.213 -8.076 1.00 0.00 H new ATOM 0 HG2 ARG A 83 4.443 -2.832 -9.014 1.00 0.00 H new ATOM 0 HG3 ARG A 83 5.343 -1.720 -10.027 1.00 0.00 H new ATOM 0 HD2 ARG A 83 7.424 -3.223 -9.137 1.00 0.00 H new ATOM 0 HD3 ARG A 83 6.154 -4.420 -8.976 1.00 0.00 H new ATOM 0 HE ARG A 83 5.983 -3.125 -11.553 1.00 0.00 H new ATOM 0 HH11 ARG A 83 7.736 -5.690 -9.868 1.00 0.00 H new ATOM 0 HH12 ARG A 83 8.249 -6.431 -11.388 1.00 0.00 H new ATOM 0 HH21 ARG A 83 6.760 -4.065 -13.410 1.00 0.00 H new ATOM 0 HH22 ARG A 83 7.718 -5.546 -13.315 1.00 0.00 H new ATOM 1004 N ALA A 84 6.200 -0.677 -4.870 1.00 0.00 N ATOM 1005 CA ALA A 84 6.987 -0.015 -3.828 1.00 0.00 C ATOM 1006 C ALA A 84 7.193 -0.918 -2.604 1.00 0.00 C ATOM 1007 O ALA A 84 8.322 -1.097 -2.159 1.00 0.00 O ATOM 1008 CB ALA A 84 6.327 1.308 -3.433 1.00 0.00 C ATOM 0 H ALA A 84 5.265 -0.289 -4.996 1.00 0.00 H new ATOM 0 HA ALA A 84 7.976 0.194 -4.235 1.00 0.00 H new ATOM 0 HB1 ALA A 84 6.920 1.793 -2.657 1.00 0.00 H new ATOM 0 HB2 ALA A 84 6.267 1.959 -4.305 1.00 0.00 H new ATOM 0 HB3 ALA A 84 5.323 1.115 -3.055 1.00 0.00 H new ATOM 1014 N ALA A 85 6.138 -1.553 -2.092 1.00 0.00 N ATOM 1015 CA ALA A 85 6.238 -2.544 -1.026 1.00 0.00 C ATOM 1016 C ALA A 85 7.122 -3.741 -1.447 1.00 0.00 C ATOM 1017 O ALA A 85 8.003 -4.154 -0.691 1.00 0.00 O ATOM 1018 CB ALA A 85 4.815 -2.946 -0.627 1.00 0.00 C ATOM 0 H ALA A 85 5.183 -1.391 -2.410 1.00 0.00 H new ATOM 0 HA ALA A 85 6.739 -2.124 -0.154 1.00 0.00 H new ATOM 0 HB1 ALA A 85 4.857 -3.688 0.170 1.00 0.00 H new ATOM 0 HB2 ALA A 85 4.273 -2.067 -0.277 1.00 0.00 H new ATOM 0 HB3 ALA A 85 4.301 -3.369 -1.490 1.00 0.00 H new ATOM 1024 N GLY A 86 6.979 -4.219 -2.689 1.00 0.00 N ATOM 1025 CA GLY A 86 7.837 -5.243 -3.286 1.00 0.00 C ATOM 1026 C GLY A 86 9.306 -4.818 -3.410 1.00 0.00 C ATOM 1027 O GLY A 86 10.179 -5.520 -2.908 1.00 0.00 O ATOM 0 H GLY A 86 6.245 -3.895 -3.319 1.00 0.00 H new ATOM 0 HA2 GLY A 86 7.779 -6.150 -2.684 1.00 0.00 H new ATOM 0 HA3 GLY A 86 7.455 -5.493 -4.276 1.00 0.00 H new ATOM 1031 N GLN A 87 9.609 -3.655 -4.003 1.00 0.00 N ATOM 1032 CA GLN A 87 10.985 -3.152 -4.142 1.00 0.00 C ATOM 1033 C GLN A 87 11.644 -2.916 -2.775 1.00 0.00 C ATOM 1034 O GLN A 87 12.831 -3.194 -2.616 1.00 0.00 O ATOM 1035 CB GLN A 87 11.071 -1.901 -5.055 1.00 0.00 C ATOM 1036 CG GLN A 87 10.928 -0.545 -4.334 1.00 0.00 C ATOM 1037 CD GLN A 87 10.853 0.662 -5.270 1.00 0.00 C ATOM 1038 OE1 GLN A 87 10.023 0.751 -6.165 1.00 0.00 O ATOM 1039 NE2 GLN A 87 11.693 1.660 -5.076 1.00 0.00 N ATOM 0 H GLN A 87 8.905 -3.034 -4.402 1.00 0.00 H new ATOM 0 HA GLN A 87 11.555 -3.934 -4.643 1.00 0.00 H new ATOM 0 HB2 GLN A 87 12.028 -1.917 -5.576 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.293 -1.973 -5.815 1.00 0.00 H new ATOM 0 HG2 GLN A 87 10.029 -0.568 -3.717 1.00 0.00 H new ATOM 0 HG3 GLN A 87 11.774 -0.415 -3.660 1.00 0.00 H new ATOM 0 HE21 GLN A 87 12.391 1.602 -4.334 1.00 0.00 H new ATOM 0 HE22 GLN A 87 11.645 2.490 -5.667 1.00 0.00 H new ATOM 1046 N PHE A 88 10.880 -2.451 -1.779 1.00 0.00 N ATOM 1047 CA PHE A 88 11.370 -2.253 -0.416 1.00 0.00 C ATOM 1048 C PHE A 88 11.764 -3.593 0.218 1.00 0.00 C ATOM 1049 O PHE A 88 12.869 -3.739 0.732 1.00 0.00 O ATOM 1050 CB PHE A 88 10.311 -1.510 0.418 1.00 0.00 C ATOM 1051 CG PHE A 88 10.882 -0.617 1.498 1.00 0.00 C ATOM 1052 CD1 PHE A 88 11.284 0.692 1.165 1.00 0.00 C ATOM 1053 CD2 PHE A 88 10.991 -1.065 2.826 1.00 0.00 C ATOM 1054 CE1 PHE A 88 11.794 1.550 2.153 1.00 0.00 C ATOM 1055 CE2 PHE A 88 11.503 -0.205 3.815 1.00 0.00 C ATOM 1056 CZ PHE A 88 11.905 1.099 3.479 1.00 0.00 C ATOM 0 H PHE A 88 9.899 -2.201 -1.900 1.00 0.00 H new ATOM 0 HA PHE A 88 12.268 -1.636 -0.443 1.00 0.00 H new ATOM 0 HB2 PHE A 88 9.698 -0.905 -0.250 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.650 -2.243 0.881 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.199 1.037 0.145 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.683 -2.067 3.086 1.00 0.00 H new ATOM 0 HE1 PHE A 88 12.100 2.553 1.894 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.587 -0.548 4.836 1.00 0.00 H new ATOM 0 HZ PHE A 88 12.300 1.755 4.241 1.00 0.00 H new ATOM 1065 N LEU A 89 10.915 -4.619 0.111 1.00 0.00 N ATOM 1066 CA LEU A 89 11.264 -5.965 0.572 1.00 0.00 C ATOM 1067 C LEU A 89 12.347 -6.653 -0.284 1.00 0.00 C ATOM 1068 O LEU A 89 13.056 -7.519 0.232 1.00 0.00 O ATOM 1069 CB LEU A 89 9.993 -6.815 0.692 1.00 0.00 C ATOM 1070 CG LEU A 89 8.972 -6.342 1.750 1.00 0.00 C ATOM 1071 CD1 LEU A 89 7.977 -7.480 1.946 1.00 0.00 C ATOM 1072 CD2 LEU A 89 9.574 -5.980 3.109 1.00 0.00 C ATOM 0 H LEU A 89 9.981 -4.543 -0.291 1.00 0.00 H new ATOM 0 HA LEU A 89 11.718 -5.864 1.558 1.00 0.00 H new ATOM 0 HB2 LEU A 89 9.499 -6.837 -0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 89 10.283 -7.839 0.925 1.00 0.00 H new ATOM 0 HG LEU A 89 8.520 -5.423 1.376 1.00 0.00 H new ATOM 0 HD11 LEU A 89 7.234 -7.189 2.688 1.00 0.00 H new ATOM 0 HD12 LEU A 89 7.480 -7.696 1.000 1.00 0.00 H new ATOM 0 HD13 LEU A 89 8.505 -8.370 2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 89 8.781 -5.660 3.785 1.00 0.00 H new ATOM 0 HD22 LEU A 89 10.078 -6.851 3.528 1.00 0.00 H new ATOM 0 HD23 LEU A 89 10.293 -5.170 2.984 1.00 0.00 H new ATOM 1083 N ALA A 90 12.534 -6.260 -1.548 1.00 0.00 N ATOM 1084 CA ALA A 90 13.641 -6.721 -2.389 1.00 0.00 C ATOM 1085 C ALA A 90 14.988 -6.159 -1.899 1.00 0.00 C ATOM 1086 O ALA A 90 15.941 -6.920 -1.715 1.00 0.00 O ATOM 1087 CB ALA A 90 13.390 -6.330 -3.855 1.00 0.00 C ATOM 0 H ALA A 90 11.912 -5.604 -2.021 1.00 0.00 H new ATOM 0 HA ALA A 90 13.692 -7.807 -2.318 1.00 0.00 H new ATOM 0 HB1 ALA A 90 14.219 -6.678 -4.471 1.00 0.00 H new ATOM 0 HB2 ALA A 90 12.464 -6.789 -4.200 1.00 0.00 H new ATOM 0 HB3 ALA A 90 13.309 -5.246 -3.934 1.00 0.00 H new ATOM 1093 N THR A 91 15.069 -4.849 -1.628 1.00 0.00 N ATOM 1094 CA THR A 91 16.287 -4.196 -1.106 1.00 0.00 C ATOM 1095 C THR A 91 16.601 -4.585 0.344 1.00 0.00 C ATOM 1096 O THR A 91 17.776 -4.686 0.705 1.00 0.00 O ATOM 1097 CB THR A 91 16.237 -2.662 -1.234 1.00 0.00 C ATOM 1098 OG1 THR A 91 15.110 -2.126 -0.578 1.00 0.00 O ATOM 1099 CG2 THR A 91 16.199 -2.216 -2.697 1.00 0.00 C ATOM 0 H THR A 91 14.289 -4.205 -1.764 1.00 0.00 H new ATOM 0 HA THR A 91 17.095 -4.568 -1.736 1.00 0.00 H new ATOM 0 HB THR A 91 17.147 -2.289 -0.765 1.00 0.00 H new ATOM 0 HG1 THR A 91 14.587 -2.853 -0.180 1.00 0.00 H new ATOM 0 HG21 THR A 91 16.164 -1.128 -2.745 1.00 0.00 H new ATOM 0 HG22 THR A 91 17.092 -2.573 -3.210 1.00 0.00 H new ATOM 0 HG23 THR A 91 15.314 -2.629 -3.180 1.00 0.00 H new ATOM 1107 N GLN A 92 15.584 -4.897 1.160 1.00 0.00 N ATOM 1108 CA GLN A 92 15.757 -5.507 2.489 1.00 0.00 C ATOM 1109 C GLN A 92 16.091 -7.016 2.458 1.00 0.00 C ATOM 1110 O GLN A 92 16.361 -7.599 3.511 1.00 0.00 O ATOM 1111 CB GLN A 92 14.512 -5.251 3.369 1.00 0.00 C ATOM 1112 CG GLN A 92 14.250 -3.772 3.712 1.00 0.00 C ATOM 1113 CD GLN A 92 15.494 -3.026 4.187 1.00 0.00 C ATOM 1114 OE1 GLN A 92 16.088 -3.329 5.214 1.00 0.00 O ATOM 1115 NE2 GLN A 92 15.946 -2.033 3.448 1.00 0.00 N ATOM 0 H GLN A 92 14.608 -4.732 0.915 1.00 0.00 H new ATOM 0 HA GLN A 92 16.628 -5.018 2.925 1.00 0.00 H new ATOM 0 HB2 GLN A 92 13.636 -5.650 2.858 1.00 0.00 H new ATOM 0 HB3 GLN A 92 14.621 -5.810 4.298 1.00 0.00 H new ATOM 0 HG2 GLN A 92 13.849 -3.269 2.832 1.00 0.00 H new ATOM 0 HG3 GLN A 92 13.485 -3.717 4.487 1.00 0.00 H new ATOM 0 HE21 GLN A 92 15.459 -1.772 2.591 1.00 0.00 H new ATOM 0 HE22 GLN A 92 16.783 -1.525 3.733 1.00 0.00 H new ATOM 1122 N GLY A 93 16.080 -7.671 1.288 1.00 0.00 N ATOM 1123 CA GLY A 93 16.320 -9.116 1.153 1.00 0.00 C ATOM 1124 C GLY A 93 15.282 -9.999 1.867 1.00 0.00 C ATOM 1125 O GLY A 93 15.586 -11.131 2.248 1.00 0.00 O ATOM 0 H GLY A 93 15.902 -7.207 0.397 1.00 0.00 H new ATOM 0 HA2 GLY A 93 16.332 -9.373 0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 93 17.309 -9.347 1.548 1.00 0.00 H new ATOM 1129 N VAL A 94 14.067 -9.483 2.074 1.00 0.00 N ATOM 1130 CA VAL A 94 12.916 -10.212 2.644 1.00 0.00 C ATOM 1131 C VAL A 94 12.244 -11.108 1.596 1.00 0.00 C ATOM 1132 O VAL A 94 11.673 -12.142 1.941 1.00 0.00 O ATOM 1133 CB VAL A 94 11.917 -9.204 3.254 1.00 0.00 C ATOM 1134 CG1 VAL A 94 10.531 -9.789 3.558 1.00 0.00 C ATOM 1135 CG2 VAL A 94 12.481 -8.639 4.563 1.00 0.00 C ATOM 0 H VAL A 94 13.844 -8.515 1.844 1.00 0.00 H new ATOM 0 HA VAL A 94 13.274 -10.871 3.435 1.00 0.00 H new ATOM 0 HB VAL A 94 11.788 -8.434 2.493 1.00 0.00 H new ATOM 0 HG11 VAL A 94 9.894 -9.013 3.983 1.00 0.00 H new ATOM 0 HG12 VAL A 94 10.083 -10.162 2.637 1.00 0.00 H new ATOM 0 HG13 VAL A 94 10.630 -10.608 4.270 1.00 0.00 H new ATOM 0 HG21 VAL A 94 11.772 -7.929 4.988 1.00 0.00 H new ATOM 0 HG22 VAL A 94 12.647 -9.453 5.269 1.00 0.00 H new ATOM 0 HG23 VAL A 94 13.426 -8.133 4.364 1.00 0.00 H new ATOM 1145 N LEU A 95 12.330 -10.753 0.311 1.00 0.00 N ATOM 1146 CA LEU A 95 11.826 -11.577 -0.790 1.00 0.00 C ATOM 1147 C LEU A 95 12.794 -12.732 -1.097 1.00 0.00 C ATOM 1148 O LEU A 95 13.899 -12.519 -1.602 1.00 0.00 O ATOM 1149 CB LEU A 95 11.555 -10.689 -2.013 1.00 0.00 C ATOM 1150 CG LEU A 95 10.444 -9.656 -1.750 1.00 0.00 C ATOM 1151 CD1 LEU A 95 10.353 -8.706 -2.927 1.00 0.00 C ATOM 1152 CD2 LEU A 95 9.054 -10.263 -1.599 1.00 0.00 C ATOM 0 H LEU A 95 12.755 -9.878 0.004 1.00 0.00 H new ATOM 0 HA LEU A 95 10.882 -12.039 -0.501 1.00 0.00 H new ATOM 0 HB2 LEU A 95 12.472 -10.170 -2.293 1.00 0.00 H new ATOM 0 HB3 LEU A 95 11.273 -11.316 -2.859 1.00 0.00 H new ATOM 0 HG LEU A 95 10.720 -9.169 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 95 9.567 -7.973 -2.743 1.00 0.00 H new ATOM 0 HD12 LEU A 95 11.306 -8.192 -3.054 1.00 0.00 H new ATOM 0 HD13 LEU A 95 10.121 -9.268 -3.831 1.00 0.00 H new ATOM 0 HD21 LEU A 95 8.329 -9.470 -1.416 1.00 0.00 H new ATOM 0 HD22 LEU A 95 8.788 -10.795 -2.513 1.00 0.00 H new ATOM 0 HD23 LEU A 95 9.050 -10.959 -0.760 1.00 0.00 H new ATOM 1163 N ASN A 96 12.355 -13.955 -0.781 1.00 0.00 N ATOM 1164 CA ASN A 96 13.108 -15.202 -0.943 1.00 0.00 C ATOM 1165 C ASN A 96 12.243 -16.294 -1.599 1.00 0.00 C ATOM 1166 O ASN A 96 11.009 -16.252 -1.533 1.00 0.00 O ATOM 1167 CB ASN A 96 13.568 -15.708 0.442 1.00 0.00 C ATOM 1168 CG ASN A 96 14.198 -14.665 1.351 1.00 0.00 C ATOM 1169 OD1 ASN A 96 15.270 -14.142 1.091 1.00 0.00 O ATOM 1170 ND2 ASN A 96 13.567 -14.366 2.464 1.00 0.00 N ATOM 0 H ASN A 96 11.426 -14.109 -0.389 1.00 0.00 H new ATOM 0 HA ASN A 96 13.966 -14.997 -1.584 1.00 0.00 H new ATOM 0 HB2 ASN A 96 12.708 -16.138 0.955 1.00 0.00 H new ATOM 0 HB3 ASN A 96 14.286 -16.514 0.293 1.00 0.00 H new ATOM 0 HD21 ASN A 96 13.973 -13.694 3.115 1.00 0.00 H new ATOM 0 HD22 ASN A 96 12.672 -14.806 2.677 1.00 0.00 H new ATOM 1176 N ALA A 97 12.884 -17.356 -2.099 1.00 0.00 N ATOM 1177 CA ALA A 97 12.228 -18.594 -2.547 1.00 0.00 C ATOM 1178 C ALA A 97 11.384 -19.310 -1.464 1.00 0.00 C ATOM 1179 O ALA A 97 10.564 -20.170 -1.790 1.00 0.00 O ATOM 1180 CB ALA A 97 13.302 -19.520 -3.130 1.00 0.00 C ATOM 0 H ALA A 97 13.898 -17.381 -2.207 1.00 0.00 H new ATOM 0 HA ALA A 97 11.496 -18.320 -3.307 1.00 0.00 H new ATOM 0 HB1 ALA A 97 12.838 -20.446 -3.469 1.00 0.00 H new ATOM 0 HB2 ALA A 97 13.789 -19.028 -3.972 1.00 0.00 H new ATOM 0 HB3 ALA A 97 14.043 -19.745 -2.363 1.00 0.00 H new ATOM 1186 N VAL A 98 11.551 -18.932 -0.188 1.00 0.00 N ATOM 1187 CA VAL A 98 10.736 -19.374 0.959 1.00 0.00 C ATOM 1188 C VAL A 98 9.237 -19.167 0.695 1.00 0.00 C ATOM 1189 O VAL A 98 8.460 -20.104 0.872 1.00 0.00 O ATOM 1190 CB VAL A 98 11.157 -18.628 2.249 1.00 0.00 C ATOM 1191 CG1 VAL A 98 10.412 -19.135 3.490 1.00 0.00 C ATOM 1192 CG2 VAL A 98 12.655 -18.782 2.553 1.00 0.00 C ATOM 0 H VAL A 98 12.288 -18.283 0.087 1.00 0.00 H new ATOM 0 HA VAL A 98 10.912 -20.441 1.095 1.00 0.00 H new ATOM 0 HB VAL A 98 10.909 -17.585 2.050 1.00 0.00 H new ATOM 0 HG11 VAL A 98 10.744 -18.579 4.366 1.00 0.00 H new ATOM 0 HG12 VAL A 98 9.340 -18.992 3.355 1.00 0.00 H new ATOM 0 HG13 VAL A 98 10.621 -20.195 3.632 1.00 0.00 H new ATOM 0 HG21 VAL A 98 12.898 -18.240 3.467 1.00 0.00 H new ATOM 0 HG22 VAL A 98 12.893 -19.838 2.682 1.00 0.00 H new ATOM 0 HG23 VAL A 98 13.238 -18.377 1.725 1.00 0.00 H new ATOM 1202 N ASN A 99 8.852 -17.956 0.251 1.00 0.00 N ATOM 1203 CA ASN A 99 7.466 -17.493 0.027 1.00 0.00 C ATOM 1204 C ASN A 99 7.363 -15.987 -0.325 1.00 0.00 C ATOM 1205 O ASN A 99 6.544 -15.283 0.256 1.00 0.00 O ATOM 1206 CB ASN A 99 6.513 -17.882 1.198 1.00 0.00 C ATOM 1207 CG ASN A 99 7.014 -17.621 2.613 1.00 0.00 C ATOM 1208 OD1 ASN A 99 6.807 -18.418 3.517 1.00 0.00 O ATOM 1209 ND2 ASN A 99 7.662 -16.509 2.873 1.00 0.00 N ATOM 0 H ASN A 99 9.536 -17.233 0.026 1.00 0.00 H new ATOM 0 HA ASN A 99 7.125 -18.029 -0.859 1.00 0.00 H new ATOM 0 HB2 ASN A 99 5.576 -17.342 1.066 1.00 0.00 H new ATOM 0 HB3 ASN A 99 6.284 -18.944 1.110 1.00 0.00 H new ATOM 0 HD21 ASN A 99 7.987 -16.318 3.821 1.00 0.00 H new ATOM 0 HD22 ASN A 99 7.841 -15.837 2.127 1.00 0.00 H new ATOM 1215 N ALA A 100 8.182 -15.434 -1.223 1.00 0.00 N ATOM 1216 CA ALA A 100 8.076 -14.016 -1.616 1.00 0.00 C ATOM 1217 C ALA A 100 6.693 -13.603 -2.169 1.00 0.00 C ATOM 1218 O ALA A 100 6.254 -12.480 -1.922 1.00 0.00 O ATOM 1219 CB ALA A 100 9.170 -13.722 -2.633 1.00 0.00 C ATOM 0 H ALA A 100 8.929 -15.943 -1.696 1.00 0.00 H new ATOM 0 HA ALA A 100 8.200 -13.420 -0.712 1.00 0.00 H new ATOM 0 HB1 ALA A 100 9.111 -12.677 -2.939 1.00 0.00 H new ATOM 0 HB2 ALA A 100 10.145 -13.915 -2.185 1.00 0.00 H new ATOM 0 HB3 ALA A 100 9.038 -14.363 -3.505 1.00 0.00 H new ATOM 1225 N SER A 101 5.984 -14.499 -2.872 1.00 0.00 N ATOM 1226 CA SER A 101 4.563 -14.303 -3.210 1.00 0.00 C ATOM 1227 C SER A 101 3.684 -14.378 -1.959 1.00 0.00 C ATOM 1228 O SER A 101 3.068 -13.383 -1.585 1.00 0.00 O ATOM 1229 CB SER A 101 4.113 -15.284 -4.309 1.00 0.00 C ATOM 1230 OG SER A 101 2.704 -15.326 -4.441 1.00 0.00 O ATOM 0 H SER A 101 6.374 -15.374 -3.221 1.00 0.00 H new ATOM 0 HA SER A 101 4.443 -13.299 -3.618 1.00 0.00 H new ATOM 0 HB2 SER A 101 4.557 -14.991 -5.260 1.00 0.00 H new ATOM 0 HB3 SER A 101 4.485 -16.282 -4.078 1.00 0.00 H new ATOM 0 HG SER A 101 2.460 -15.958 -5.149 1.00 0.00 H new ATOM 1235 N SER A 102 3.677 -15.502 -1.239 1.00 0.00 N ATOM 1236 CA SER A 102 2.786 -15.696 -0.081 1.00 0.00 C ATOM 1237 C SER A 102 2.975 -14.664 1.053 1.00 0.00 C ATOM 1238 O SER A 102 1.984 -14.219 1.638 1.00 0.00 O ATOM 1239 CB SER A 102 2.906 -17.138 0.433 1.00 0.00 C ATOM 1240 OG SER A 102 1.783 -17.900 0.026 1.00 0.00 O ATOM 0 H SER A 102 4.281 -16.300 -1.436 1.00 0.00 H new ATOM 0 HA SER A 102 1.771 -15.520 -0.438 1.00 0.00 H new ATOM 0 HB2 SER A 102 3.820 -17.593 0.051 1.00 0.00 H new ATOM 0 HB3 SER A 102 2.980 -17.139 1.520 1.00 0.00 H new ATOM 0 HG SER A 102 1.872 -18.818 0.358 1.00 0.00 H new ATOM 1245 N LEU A 103 4.207 -14.196 1.321 1.00 0.00 N ATOM 1246 CA LEU A 103 4.478 -13.078 2.245 1.00 0.00 C ATOM 1247 C LEU A 103 3.989 -11.727 1.701 1.00 0.00 C ATOM 1248 O LEU A 103 3.614 -10.846 2.473 1.00 0.00 O ATOM 1249 CB LEU A 103 5.973 -13.032 2.641 1.00 0.00 C ATOM 1250 CG LEU A 103 6.951 -12.322 1.673 1.00 0.00 C ATOM 1251 CD1 LEU A 103 7.021 -10.799 1.836 1.00 0.00 C ATOM 1252 CD2 LEU A 103 8.380 -12.810 1.923 1.00 0.00 C ATOM 0 H LEU A 103 5.050 -14.586 0.899 1.00 0.00 H new ATOM 0 HA LEU A 103 3.899 -13.267 3.149 1.00 0.00 H new ATOM 0 HB2 LEU A 103 6.048 -12.543 3.612 1.00 0.00 H new ATOM 0 HB3 LEU A 103 6.317 -14.058 2.773 1.00 0.00 H new ATOM 0 HG LEU A 103 6.566 -12.561 0.682 1.00 0.00 H new ATOM 0 HD11 LEU A 103 7.730 -10.388 1.117 1.00 0.00 H new ATOM 0 HD12 LEU A 103 6.035 -10.368 1.659 1.00 0.00 H new ATOM 0 HD13 LEU A 103 7.347 -10.556 2.847 1.00 0.00 H new ATOM 0 HD21 LEU A 103 9.062 -12.306 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 103 8.666 -12.586 2.951 1.00 0.00 H new ATOM 0 HD23 LEU A 103 8.431 -13.886 1.759 1.00 0.00 H new ATOM 1263 N GLY A 104 3.950 -11.560 0.376 1.00 0.00 N ATOM 1264 CA GLY A 104 3.361 -10.391 -0.273 1.00 0.00 C ATOM 1265 C GLY A 104 1.875 -10.244 0.031 1.00 0.00 C ATOM 1266 O GLY A 104 1.404 -9.132 0.263 1.00 0.00 O ATOM 0 H GLY A 104 4.331 -12.241 -0.281 1.00 0.00 H new ATOM 0 HA2 GLY A 104 3.886 -9.494 0.055 1.00 0.00 H new ATOM 0 HA3 GLY A 104 3.503 -10.468 -1.351 1.00 0.00 H new ATOM 1270 N SER A 105 1.157 -11.365 0.154 1.00 0.00 N ATOM 1271 CA SER A 105 -0.206 -11.375 0.693 1.00 0.00 C ATOM 1272 C SER A 105 -0.267 -10.877 2.141 1.00 0.00 C ATOM 1273 O SER A 105 -1.178 -10.127 2.481 1.00 0.00 O ATOM 1274 CB SER A 105 -0.833 -12.773 0.603 1.00 0.00 C ATOM 1275 OG SER A 105 -2.135 -12.657 0.057 1.00 0.00 O ATOM 0 H SER A 105 1.502 -12.286 -0.116 1.00 0.00 H new ATOM 0 HA SER A 105 -0.780 -10.685 0.075 1.00 0.00 H new ATOM 0 HB2 SER A 105 -0.219 -13.422 -0.021 1.00 0.00 H new ATOM 0 HB3 SER A 105 -0.878 -13.230 1.591 1.00 0.00 H new ATOM 0 HG SER A 105 -2.544 -13.546 -0.006 1.00 0.00 H new ATOM 1280 N ALA A 106 0.699 -11.228 3.001 1.00 0.00 N ATOM 1281 CA ALA A 106 0.736 -10.763 4.394 1.00 0.00 C ATOM 1282 C ALA A 106 0.900 -9.231 4.507 1.00 0.00 C ATOM 1283 O ALA A 106 0.172 -8.591 5.270 1.00 0.00 O ATOM 1284 CB ALA A 106 1.831 -11.516 5.164 1.00 0.00 C ATOM 0 H ALA A 106 1.475 -11.841 2.751 1.00 0.00 H new ATOM 0 HA ALA A 106 -0.229 -10.988 4.848 1.00 0.00 H new ATOM 0 HB1 ALA A 106 1.855 -11.168 6.197 1.00 0.00 H new ATOM 0 HB2 ALA A 106 1.619 -12.585 5.146 1.00 0.00 H new ATOM 0 HB3 ALA A 106 2.798 -11.330 4.696 1.00 0.00 H new ATOM 1290 N LEU A 107 1.791 -8.622 3.710 1.00 0.00 N ATOM 1291 CA LEU A 107 1.927 -7.158 3.650 1.00 0.00 C ATOM 1292 C LEU A 107 0.713 -6.502 2.969 1.00 0.00 C ATOM 1293 O LEU A 107 0.192 -5.509 3.466 1.00 0.00 O ATOM 1294 CB LEU A 107 3.255 -6.784 2.970 1.00 0.00 C ATOM 1295 CG LEU A 107 3.772 -5.376 3.343 1.00 0.00 C ATOM 1296 CD1 LEU A 107 5.245 -5.195 2.987 1.00 0.00 C ATOM 1297 CD2 LEU A 107 3.005 -4.207 2.726 1.00 0.00 C ATOM 0 H LEU A 107 2.431 -9.124 3.095 1.00 0.00 H new ATOM 0 HA LEU A 107 1.949 -6.766 4.667 1.00 0.00 H new ATOM 0 HB2 LEU A 107 4.011 -7.522 3.240 1.00 0.00 H new ATOM 0 HB3 LEU A 107 3.127 -6.839 1.889 1.00 0.00 H new ATOM 0 HG LEU A 107 3.614 -5.342 4.421 1.00 0.00 H new ATOM 0 HD11 LEU A 107 5.566 -4.192 3.266 1.00 0.00 H new ATOM 0 HD12 LEU A 107 5.843 -5.930 3.526 1.00 0.00 H new ATOM 0 HD13 LEU A 107 5.380 -5.334 1.914 1.00 0.00 H new ATOM 0 HD21 LEU A 107 3.450 -3.267 3.052 1.00 0.00 H new ATOM 0 HD22 LEU A 107 3.053 -4.273 1.639 1.00 0.00 H new ATOM 0 HD23 LEU A 107 1.964 -4.246 3.046 1.00 0.00 H new ATOM 1308 N ALA A 108 0.181 -7.084 1.894 1.00 0.00 N ATOM 1309 CA ALA A 108 -1.048 -6.597 1.267 1.00 0.00 C ATOM 1310 C ALA A 108 -2.257 -6.624 2.220 1.00 0.00 C ATOM 1311 O ALA A 108 -3.061 -5.694 2.214 1.00 0.00 O ATOM 1312 CB ALA A 108 -1.308 -7.421 0.014 1.00 0.00 C ATOM 0 H ALA A 108 0.586 -7.900 1.436 1.00 0.00 H new ATOM 0 HA ALA A 108 -0.911 -5.548 1.003 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -2.221 -7.072 -0.468 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -0.470 -7.311 -0.674 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -1.419 -8.471 0.285 1.00 0.00 H new ATOM 1318 N ASN A 109 -2.352 -7.632 3.095 1.00 0.00 N ATOM 1319 CA ASN A 109 -3.318 -7.663 4.193 1.00 0.00 C ATOM 1320 C ASN A 109 -3.034 -6.592 5.263 1.00 0.00 C ATOM 1321 O ASN A 109 -3.987 -6.051 5.814 1.00 0.00 O ATOM 1322 CB ASN A 109 -3.393 -9.074 4.806 1.00 0.00 C ATOM 1323 CG ASN A 109 -4.347 -9.975 4.036 1.00 0.00 C ATOM 1324 OD1 ASN A 109 -5.525 -10.083 4.349 1.00 0.00 O ATOM 1325 ND2 ASN A 109 -3.886 -10.639 3.005 1.00 0.00 N ATOM 0 H ASN A 109 -1.753 -8.457 3.058 1.00 0.00 H new ATOM 0 HA ASN A 109 -4.294 -7.418 3.774 1.00 0.00 H new ATOM 0 HB2 ASN A 109 -2.399 -9.520 4.814 1.00 0.00 H new ATOM 0 HB3 ASN A 109 -3.719 -9.003 5.844 1.00 0.00 H new ATOM 0 HD21 ASN A 109 -4.508 -11.242 2.467 1.00 0.00 H new ATOM 0 HD22 ASN A 109 -2.905 -10.552 2.740 1.00 0.00 H new ATOM 1331 N ALA A 110 -1.774 -6.214 5.519 1.00 0.00 N ATOM 1332 CA ALA A 110 -1.440 -5.070 6.377 1.00 0.00 C ATOM 1333 C ALA A 110 -1.903 -3.730 5.767 1.00 0.00 C ATOM 1334 O ALA A 110 -2.500 -2.908 6.460 1.00 0.00 O ATOM 1335 CB ALA A 110 0.068 -5.059 6.678 1.00 0.00 C ATOM 0 H ALA A 110 -0.958 -6.693 5.137 1.00 0.00 H new ATOM 0 HA ALA A 110 -1.983 -5.185 7.315 1.00 0.00 H new ATOM 0 HB1 ALA A 110 0.306 -4.207 7.315 1.00 0.00 H new ATOM 0 HB2 ALA A 110 0.344 -5.982 7.188 1.00 0.00 H new ATOM 0 HB3 ALA A 110 0.625 -4.981 5.744 1.00 0.00 H new ATOM 1341 N LEU A 111 -1.695 -3.522 4.459 1.00 0.00 N ATOM 1342 CA LEU A 111 -2.200 -2.344 3.738 1.00 0.00 C ATOM 1343 C LEU A 111 -3.734 -2.341 3.657 1.00 0.00 C ATOM 1344 O LEU A 111 -4.346 -1.294 3.846 1.00 0.00 O ATOM 1345 CB LEU A 111 -1.598 -2.276 2.324 1.00 0.00 C ATOM 1346 CG LEU A 111 -0.066 -2.150 2.291 1.00 0.00 C ATOM 1347 CD1 LEU A 111 0.427 -2.376 0.866 1.00 0.00 C ATOM 1348 CD2 LEU A 111 0.447 -0.786 2.751 1.00 0.00 C ATOM 0 H LEU A 111 -1.170 -4.168 3.869 1.00 0.00 H new ATOM 0 HA LEU A 111 -1.892 -1.463 4.300 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.889 -3.172 1.775 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.032 -1.425 1.798 1.00 0.00 H new ATOM 0 HG LEU A 111 0.316 -2.900 2.984 1.00 0.00 H new ATOM 0 HD11 LEU A 111 1.513 -2.287 0.838 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.136 -3.372 0.534 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.015 -1.630 0.206 1.00 0.00 H new ATOM 0 HD21 LEU A 111 1.536 -0.771 2.701 1.00 0.00 H new ATOM 0 HD22 LEU A 111 0.043 -0.008 2.103 1.00 0.00 H new ATOM 0 HD23 LEU A 111 0.128 -0.605 3.778 1.00 0.00 H new ATOM 1359 N SER A 112 -4.357 -3.501 3.430 1.00 0.00 N ATOM 1360 CA SER A 112 -5.814 -3.688 3.472 1.00 0.00 C ATOM 1361 C SER A 112 -6.392 -3.411 4.860 1.00 0.00 C ATOM 1362 O SER A 112 -7.390 -2.698 4.965 1.00 0.00 O ATOM 1363 CB SER A 112 -6.181 -5.104 3.022 1.00 0.00 C ATOM 1364 OG SER A 112 -7.588 -5.226 2.905 1.00 0.00 O ATOM 0 H SER A 112 -3.852 -4.358 3.206 1.00 0.00 H new ATOM 0 HA SER A 112 -6.252 -2.964 2.785 1.00 0.00 H new ATOM 0 HB2 SER A 112 -5.708 -5.324 2.065 1.00 0.00 H new ATOM 0 HB3 SER A 112 -5.803 -5.832 3.740 1.00 0.00 H new ATOM 0 HG SER A 112 -7.815 -6.134 2.615 1.00 0.00 H new ATOM 1369 N ASP A 113 -5.739 -3.876 5.933 1.00 0.00 N ATOM 1370 CA ASP A 113 -6.086 -3.514 7.309 1.00 0.00 C ATOM 1371 C ASP A 113 -6.050 -1.996 7.488 1.00 0.00 C ATOM 1372 O ASP A 113 -7.055 -1.430 7.905 1.00 0.00 O ATOM 1373 CB ASP A 113 -5.161 -4.189 8.343 1.00 0.00 C ATOM 1374 CG ASP A 113 -5.628 -5.585 8.796 1.00 0.00 C ATOM 1375 OD1 ASP A 113 -6.853 -5.806 8.961 1.00 0.00 O ATOM 1376 OD2 ASP A 113 -4.765 -6.450 9.081 1.00 0.00 O ATOM 0 H ASP A 113 -4.950 -4.519 5.868 1.00 0.00 H new ATOM 0 HA ASP A 113 -7.098 -3.877 7.488 1.00 0.00 H new ATOM 0 HB2 ASP A 113 -4.161 -4.274 7.918 1.00 0.00 H new ATOM 0 HB3 ASP A 113 -5.082 -3.544 9.218 1.00 0.00 H new ATOM 1380 N SER A 114 -4.958 -1.318 7.120 1.00 0.00 N ATOM 1381 CA SER A 114 -4.848 0.142 7.235 1.00 0.00 C ATOM 1382 C SER A 114 -5.864 0.903 6.371 1.00 0.00 C ATOM 1383 O SER A 114 -6.409 1.906 6.825 1.00 0.00 O ATOM 1384 CB SER A 114 -3.444 0.614 6.858 1.00 0.00 C ATOM 1385 OG SER A 114 -2.456 -0.013 7.650 1.00 0.00 O ATOM 0 H SER A 114 -4.126 -1.764 6.734 1.00 0.00 H new ATOM 0 HA SER A 114 -5.062 0.365 8.280 1.00 0.00 H new ATOM 0 HB2 SER A 114 -3.258 0.400 5.806 1.00 0.00 H new ATOM 0 HB3 SER A 114 -3.378 1.695 6.980 1.00 0.00 H new ATOM 0 HG SER A 114 -2.354 -0.946 7.367 1.00 0.00 H new ATOM 1390 N ALA A 115 -6.149 0.441 5.148 1.00 0.00 N ATOM 1391 CA ALA A 115 -7.095 1.070 4.223 1.00 0.00 C ATOM 1392 C ALA A 115 -8.559 0.897 4.663 1.00 0.00 C ATOM 1393 O ALA A 115 -9.316 1.867 4.687 1.00 0.00 O ATOM 1394 CB ALA A 115 -6.886 0.468 2.829 1.00 0.00 C ATOM 0 H ALA A 115 -5.717 -0.401 4.766 1.00 0.00 H new ATOM 0 HA ALA A 115 -6.900 2.142 4.214 1.00 0.00 H new ATOM 0 HB1 ALA A 115 -7.583 0.925 2.127 1.00 0.00 H new ATOM 0 HB2 ALA A 115 -5.864 0.657 2.501 1.00 0.00 H new ATOM 0 HB3 ALA A 115 -7.062 -0.607 2.867 1.00 0.00 H new ATOM 1400 N ALA A 116 -8.952 -0.313 5.070 1.00 0.00 N ATOM 1401 CA ALA A 116 -10.267 -0.590 5.643 1.00 0.00 C ATOM 1402 C ALA A 116 -10.447 0.104 7.010 1.00 0.00 C ATOM 1403 O ALA A 116 -11.499 0.683 7.279 1.00 0.00 O ATOM 1404 CB ALA A 116 -10.443 -2.109 5.744 1.00 0.00 C ATOM 0 H ALA A 116 -8.355 -1.138 5.009 1.00 0.00 H new ATOM 0 HA ALA A 116 -11.042 -0.182 4.995 1.00 0.00 H new ATOM 0 HB1 ALA A 116 -11.421 -2.334 6.170 1.00 0.00 H new ATOM 0 HB2 ALA A 116 -10.370 -2.551 4.750 1.00 0.00 H new ATOM 0 HB3 ALA A 116 -9.664 -2.524 6.384 1.00 0.00 H new ATOM 1410 N ASN A 117 -9.398 0.133 7.845 1.00 0.00 N ATOM 1411 CA ASN A 117 -9.330 0.944 9.064 1.00 0.00 C ATOM 1412 C ASN A 117 -9.400 2.451 8.778 1.00 0.00 C ATOM 1413 O ASN A 117 -9.887 3.194 9.618 1.00 0.00 O ATOM 1414 CB ASN A 117 -8.046 0.599 9.839 1.00 0.00 C ATOM 1415 CG ASN A 117 -7.840 1.454 11.080 1.00 0.00 C ATOM 1416 OD1 ASN A 117 -8.399 1.206 12.139 1.00 0.00 O ATOM 1417 ND2 ASN A 117 -7.026 2.485 10.990 1.00 0.00 N ATOM 0 H ASN A 117 -8.556 -0.420 7.686 1.00 0.00 H new ATOM 0 HA ASN A 117 -10.204 0.704 9.670 1.00 0.00 H new ATOM 0 HB2 ASN A 117 -8.078 -0.451 10.131 1.00 0.00 H new ATOM 0 HB3 ASN A 117 -7.188 0.719 9.178 1.00 0.00 H new ATOM 0 HD21 ASN A 117 -6.861 3.077 11.804 1.00 0.00 H new ATOM 0 HD22 ASN A 117 -6.560 2.691 10.106 1.00 0.00 H new ATOM 1423 N SER A 118 -8.965 2.936 7.614 1.00 0.00 N ATOM 1424 CA SER A 118 -9.054 4.363 7.272 1.00 0.00 C ATOM 1425 C SER A 118 -10.512 4.870 7.298 1.00 0.00 C ATOM 1426 O SER A 118 -10.781 5.999 7.716 1.00 0.00 O ATOM 1427 CB SER A 118 -8.369 4.623 5.927 1.00 0.00 C ATOM 1428 OG SER A 118 -7.811 5.923 5.907 1.00 0.00 O ATOM 0 H SER A 118 -8.544 2.360 6.885 1.00 0.00 H new ATOM 0 HA SER A 118 -8.525 4.936 8.034 1.00 0.00 H new ATOM 0 HB2 SER A 118 -7.588 3.881 5.759 1.00 0.00 H new ATOM 0 HB3 SER A 118 -9.090 4.516 5.117 1.00 0.00 H new ATOM 0 HG SER A 118 -8.274 6.467 5.236 1.00 0.00 H new ATOM 1433 N ALA A 119 -11.483 3.992 6.992 1.00 0.00 N ATOM 1434 CA ALA A 119 -12.920 4.240 7.156 1.00 0.00 C ATOM 1435 C ALA A 119 -13.388 4.475 8.614 1.00 0.00 C ATOM 1436 O ALA A 119 -14.490 4.989 8.812 1.00 0.00 O ATOM 1437 CB ALA A 119 -13.699 3.095 6.491 1.00 0.00 C ATOM 0 H ALA A 119 -11.281 3.066 6.614 1.00 0.00 H new ATOM 0 HA ALA A 119 -13.132 5.189 6.663 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -14.769 3.268 6.606 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -13.450 3.053 5.431 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -13.431 2.150 6.964 1.00 0.00 H new ATOM 1443 N VAL A 120 -12.571 4.170 9.636 1.00 0.00 N ATOM 1444 CA VAL A 120 -12.830 4.515 11.055 1.00 0.00 C ATOM 1445 C VAL A 120 -12.962 6.026 11.245 1.00 0.00 C ATOM 1446 O VAL A 120 -13.893 6.484 11.909 1.00 0.00 O ATOM 1447 CB VAL A 120 -11.721 3.973 11.987 1.00 0.00 C ATOM 1448 CG1 VAL A 120 -11.768 4.521 13.421 1.00 0.00 C ATOM 1449 CG2 VAL A 120 -11.802 2.443 12.075 1.00 0.00 C ATOM 0 H VAL A 120 -11.694 3.667 9.503 1.00 0.00 H new ATOM 0 HA VAL A 120 -13.773 4.040 11.324 1.00 0.00 H new ATOM 0 HB VAL A 120 -10.789 4.311 11.534 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -10.955 4.087 14.003 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -11.661 5.606 13.400 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -12.722 4.260 13.879 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -11.016 2.074 12.734 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -12.775 2.152 12.472 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -11.673 2.014 11.081 1.00 0.00 H new ATOM 1459 N SER A 121 -12.062 6.808 10.638 1.00 0.00 N ATOM 1460 CA SER A 121 -12.112 8.277 10.687 1.00 0.00 C ATOM 1461 C SER A 121 -13.331 8.856 9.960 1.00 0.00 C ATOM 1462 O SER A 121 -13.777 9.953 10.300 1.00 0.00 O ATOM 1463 CB SER A 121 -10.838 8.884 10.087 1.00 0.00 C ATOM 1464 OG SER A 121 -9.699 8.471 10.829 1.00 0.00 O ATOM 0 H SER A 121 -11.278 6.442 10.098 1.00 0.00 H new ATOM 0 HA SER A 121 -12.194 8.541 11.741 1.00 0.00 H new ATOM 0 HB2 SER A 121 -10.735 8.575 9.047 1.00 0.00 H new ATOM 0 HB3 SER A 121 -10.908 9.972 10.091 1.00 0.00 H new ATOM 0 HG SER A 121 -8.892 8.864 10.435 1.00 0.00 H new ATOM 1469 N GLY A 122 -13.875 8.130 8.973 1.00 0.00 N ATOM 1470 CA GLY A 122 -15.033 8.540 8.168 1.00 0.00 C ATOM 1471 C GLY A 122 -14.891 9.951 7.588 1.00 0.00 C ATOM 1472 O GLY A 122 -15.794 10.773 7.714 1.00 0.00 O ATOM 0 H GLY A 122 -13.511 7.216 8.706 1.00 0.00 H new ATOM 0 HA2 GLY A 122 -15.171 7.830 7.352 1.00 0.00 H new ATOM 0 HA3 GLY A 122 -15.931 8.495 8.784 1.00 0.00 H new ATOM 1476 N ASN A 123 -13.714 10.281 7.047 1.00 0.00 N ATOM 1477 CA ASN A 123 -13.377 11.635 6.582 1.00 0.00 C ATOM 1478 C ASN A 123 -12.323 11.639 5.463 1.00 0.00 C ATOM 1479 O ASN A 123 -12.433 12.420 4.517 1.00 0.00 O ATOM 1480 CB ASN A 123 -12.899 12.470 7.791 1.00 0.00 C ATOM 1481 CG ASN A 123 -13.820 13.642 8.089 1.00 0.00 C ATOM 1482 OD1 ASN A 123 -13.478 14.800 7.893 1.00 0.00 O ATOM 1483 ND2 ASN A 123 -15.015 13.380 8.566 1.00 0.00 N ATOM 0 H ASN A 123 -12.958 9.609 6.917 1.00 0.00 H new ATOM 0 HA ASN A 123 -14.274 12.077 6.148 1.00 0.00 H new ATOM 0 HB2 ASN A 123 -12.837 11.828 8.670 1.00 0.00 H new ATOM 0 HB3 ASN A 123 -11.893 12.843 7.596 1.00 0.00 H new ATOM 0 HD21 ASN A 123 -15.660 14.143 8.774 1.00 0.00 H new ATOM 0 HD22 ASN A 123 -15.299 12.414 8.729 1.00 0.00 H new ATOM 1489 N TYR A 124 -11.342 10.726 5.524 1.00 0.00 N ATOM 1490 CA TYR A 124 -10.348 10.516 4.460 1.00 0.00 C ATOM 1491 C TYR A 124 -10.987 10.185 3.091 1.00 0.00 C ATOM 1492 O TYR A 124 -10.458 10.581 2.050 1.00 0.00 O ATOM 1493 CB TYR A 124 -9.360 9.414 4.887 1.00 0.00 C ATOM 1494 CG TYR A 124 -9.743 8.026 4.406 1.00 0.00 C ATOM 1495 CD1 TYR A 124 -10.879 7.370 4.924 1.00 0.00 C ATOM 1496 CD2 TYR A 124 -9.020 7.440 3.351 1.00 0.00 C ATOM 1497 CE1 TYR A 124 -11.309 6.155 4.360 1.00 0.00 C ATOM 1498 CE2 TYR A 124 -9.422 6.205 2.822 1.00 0.00 C ATOM 1499 CZ TYR A 124 -10.582 5.564 3.305 1.00 0.00 C ATOM 1500 OH TYR A 124 -10.983 4.384 2.767 1.00 0.00 O ATOM 0 H TYR A 124 -11.215 10.105 6.323 1.00 0.00 H new ATOM 0 HA TYR A 124 -9.813 11.456 4.322 1.00 0.00 H new ATOM 0 HB2 TYR A 124 -8.369 9.660 4.505 1.00 0.00 H new ATOM 0 HB3 TYR A 124 -9.289 9.404 5.975 1.00 0.00 H new ATOM 0 HD1 TYR A 124 -11.419 7.801 5.754 1.00 0.00 H new ATOM 0 HD2 TYR A 124 -8.153 7.942 2.948 1.00 0.00 H new ATOM 0 HE1 TYR A 124 -12.199 5.673 4.736 1.00 0.00 H new ATOM 0 HE2 TYR A 124 -8.840 5.742 2.040 1.00 0.00 H new ATOM 0 HH TYR A 124 -11.957 4.306 2.839 1.00 0.00 H new ATOM 1509 N LEU A 125 -12.156 9.518 3.095 1.00 0.00 N ATOM 1510 CA LEU A 125 -12.958 9.179 1.913 1.00 0.00 C ATOM 1511 C LEU A 125 -13.837 10.354 1.409 1.00 0.00 C ATOM 1512 O LEU A 125 -14.905 10.153 0.824 1.00 0.00 O ATOM 1513 CB LEU A 125 -13.739 7.857 2.123 1.00 0.00 C ATOM 1514 CG LEU A 125 -14.988 7.907 3.032 1.00 0.00 C ATOM 1515 CD1 LEU A 125 -16.014 6.858 2.595 1.00 0.00 C ATOM 1516 CD2 LEU A 125 -14.679 7.653 4.507 1.00 0.00 C ATOM 0 H LEU A 125 -12.582 9.188 3.961 1.00 0.00 H new ATOM 0 HA LEU A 125 -12.261 8.999 1.094 1.00 0.00 H new ATOM 0 HB2 LEU A 125 -14.049 7.489 1.145 1.00 0.00 H new ATOM 0 HB3 LEU A 125 -13.050 7.121 2.537 1.00 0.00 H new ATOM 0 HG LEU A 125 -15.378 8.920 2.927 1.00 0.00 H new ATOM 0 HD11 LEU A 125 -16.886 6.909 3.247 1.00 0.00 H new ATOM 0 HD12 LEU A 125 -16.318 7.053 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 125 -15.569 5.865 2.660 1.00 0.00 H new ATOM 0 HD21 LEU A 125 -15.601 7.703 5.086 1.00 0.00 H new ATOM 0 HD22 LEU A 125 -14.233 6.665 4.620 1.00 0.00 H new ATOM 0 HD23 LEU A 125 -13.982 8.409 4.868 1.00 0.00 H new ATOM 1527 N GLY A 126 -13.422 11.591 1.685 1.00 0.00 N ATOM 1528 CA GLY A 126 -14.131 12.831 1.364 1.00 0.00 C ATOM 1529 C GLY A 126 -15.079 13.275 2.486 1.00 0.00 C ATOM 1530 O GLY A 126 -15.032 14.432 2.910 1.00 0.00 O ATOM 0 H GLY A 126 -12.538 11.764 2.163 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -13.405 13.621 1.172 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -14.701 12.692 0.445 1.00 0.00 H new ATOM 1534 N VAL A 127 -15.915 12.356 2.992 1.00 0.00 N ATOM 1535 CA VAL A 127 -16.896 12.588 4.074 1.00 0.00 C ATOM 1536 C VAL A 127 -17.400 11.264 4.681 1.00 0.00 C ATOM 1537 O VAL A 127 -17.236 10.201 4.085 1.00 0.00 O ATOM 1538 CB VAL A 127 -18.071 13.442 3.532 1.00 0.00 C ATOM 1539 CG1 VAL A 127 -19.067 12.644 2.679 1.00 0.00 C ATOM 1540 CG2 VAL A 127 -18.817 14.190 4.642 1.00 0.00 C ATOM 0 H VAL A 127 -15.931 11.395 2.650 1.00 0.00 H new ATOM 0 HA VAL A 127 -16.402 13.133 4.879 1.00 0.00 H new ATOM 0 HB VAL A 127 -17.596 14.175 2.880 1.00 0.00 H new ATOM 0 HG11 VAL A 127 -19.862 13.305 2.334 1.00 0.00 H new ATOM 0 HG12 VAL A 127 -18.550 12.218 1.819 1.00 0.00 H new ATOM 0 HG13 VAL A 127 -19.497 11.841 3.278 1.00 0.00 H new ATOM 0 HG21 VAL A 127 -19.629 14.772 4.206 1.00 0.00 H new ATOM 0 HG22 VAL A 127 -19.226 13.472 5.353 1.00 0.00 H new ATOM 0 HG23 VAL A 127 -18.127 14.859 5.157 1.00 0.00 H new ATOM 1550 N SER A 128 -18.038 11.309 5.854 1.00 0.00 N ATOM 1551 CA SER A 128 -18.627 10.137 6.529 1.00 0.00 C ATOM 1552 C SER A 128 -19.790 9.534 5.724 1.00 0.00 C ATOM 1553 O SER A 128 -20.854 10.151 5.609 1.00 0.00 O ATOM 1554 CB SER A 128 -19.094 10.517 7.948 1.00 0.00 C ATOM 1555 OG SER A 128 -18.551 9.623 8.907 1.00 0.00 O ATOM 0 H SER A 128 -18.165 12.176 6.376 1.00 0.00 H new ATOM 0 HA SER A 128 -17.851 9.375 6.600 1.00 0.00 H new ATOM 0 HB2 SER A 128 -18.786 11.537 8.178 1.00 0.00 H new ATOM 0 HB3 SER A 128 -20.183 10.495 7.997 1.00 0.00 H new ATOM 0 HG SER A 128 -18.856 9.879 9.802 1.00 0.00 H new ATOM 1560 N GLN A 129 -19.594 8.337 5.153 1.00 0.00 N ATOM 1561 CA GLN A 129 -20.619 7.603 4.393 1.00 0.00 C ATOM 1562 C GLN A 129 -20.338 6.079 4.329 1.00 0.00 C ATOM 1563 O GLN A 129 -20.165 5.508 3.249 1.00 0.00 O ATOM 1564 CB GLN A 129 -20.806 8.223 2.989 1.00 0.00 C ATOM 1565 CG GLN A 129 -22.167 7.824 2.384 1.00 0.00 C ATOM 1566 CD GLN A 129 -22.086 7.514 0.889 1.00 0.00 C ATOM 1567 OE1 GLN A 129 -21.862 6.387 0.465 1.00 0.00 O ATOM 1568 NE2 GLN A 129 -22.283 8.487 0.023 1.00 0.00 N ATOM 0 H GLN A 129 -18.704 7.842 5.207 1.00 0.00 H new ATOM 0 HA GLN A 129 -21.561 7.706 4.932 1.00 0.00 H new ATOM 0 HB2 GLN A 129 -20.738 9.309 3.055 1.00 0.00 H new ATOM 0 HB3 GLN A 129 -20.001 7.893 2.332 1.00 0.00 H new ATOM 0 HG2 GLN A 129 -22.551 6.950 2.911 1.00 0.00 H new ATOM 0 HG3 GLN A 129 -22.881 8.632 2.544 1.00 0.00 H new ATOM 0 HE21 GLN A 129 -22.471 9.433 0.353 1.00 0.00 H new ATOM 0 HE22 GLN A 129 -22.247 8.294 -0.978 1.00 0.00 H new ATOM 1575 N ASN A 130 -20.255 5.415 5.489 1.00 0.00 N ATOM 1576 CA ASN A 130 -20.149 3.946 5.633 1.00 0.00 C ATOM 1577 C ASN A 130 -20.636 3.454 7.014 1.00 0.00 C ATOM 1578 O ASN A 130 -20.689 4.262 7.969 1.00 0.00 O ATOM 1579 CB ASN A 130 -18.691 3.484 5.339 1.00 0.00 C ATOM 1580 CG ASN A 130 -18.466 2.876 3.954 1.00 0.00 C ATOM 1581 OD1 ASN A 130 -19.352 2.334 3.302 1.00 0.00 O ATOM 1582 ND2 ASN A 130 -17.244 2.897 3.470 1.00 0.00 N ATOM 0 H ASN A 130 -20.259 5.897 6.388 1.00 0.00 H new ATOM 0 HA ASN A 130 -20.813 3.490 4.898 1.00 0.00 H new ATOM 0 HB2 ASN A 130 -18.026 4.340 5.455 1.00 0.00 H new ATOM 0 HB3 ASN A 130 -18.401 2.751 6.091 1.00 0.00 H new ATOM 0 HD21 ASN A 130 -17.046 2.467 2.566 1.00 0.00 H new ATOM 0 HD22 ASN A 130 -16.494 3.343 3.998 1.00 0.00 H new TER 1588 ASN A 130