USER MOD reduce.3.24.130724 H: found=0, std=0, add=814, rem=0, adj=44 USER MOD reduce.3.24.130724 removed 815 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 108 SER OG : rot -79:sc= 1.41 USER MOD Set 1.2: A 110 SER OG : rot 93:sc= 0.105 USER MOD Set 2.1: A 60 ASN : amide:sc= -0.198 X(o=-0.52,f=-0.44) USER MOD Set 2.2: A 69 MET CE :methyl -122:sc= -0.324 (180deg=-0.742) USER MOD Set 3.1: A 49 SER OG : rot 74:sc= 1.22 USER MOD Set 3.2: A 140 TYR OH : rot 180:sc= 0 USER MOD Set 4.1: A 18 ASN : amide:sc= -1.21 K(o=-1.9,f=-3.8) USER MOD Set 4.2: A 98 SER OG : rot 72:sc= -0.687 USER MOD Single : A 22 GLN : amide:sc=-0.00923 X(o=-0.0092,f=-0.012) USER MOD Single : A 23 SER OG : rot 86:sc= 0.822 USER MOD Single : A 25 SER OG : rot -61:sc= -2.11! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -0.021 K(o=-0.021,f=-0.84) USER MOD Single : A 30 SER OG : rot 180:sc= -0.0633 USER MOD Single : A 31 SER OG : rot 40:sc= 0.937 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 MET CE :methyl -108:sc= -3.07 (180deg=-8.81!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -71:sc= 1.27 USER MOD Single : A 41 THR OG1 : rot -63:sc= 1.03 USER MOD Single : A 42 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 46 GLN : amide:sc= -0.138 X(o=-0.14,f=-0.55) USER MOD Single : A 52 THR OG1 : rot -56:sc= 1.22 USER MOD Single : A 53 SER OG : rot -179:sc= -0.251 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 ASN : amide:sc= 0.00622 X(o=0.0062,f=-0.016) USER MOD Single : A 61 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 ASN : amide:sc= -0.824 K(o=-0.82,f=-2!) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 78:sc= 0.0693 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0.0734 USER MOD Single : A 85 ASN : amide:sc= -0.0815 X(o=-0.081,f=-0.017) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 91 SER OG : rot 180:sc= 0 USER MOD Single : A 93 TYR OH : rot 15:sc= -5.46! USER MOD Single : A 95 ASN : amide:sc=-0.000259 X(o=-0.00026,f=0) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -0.0371 K(o=-0.037,f=-0.62) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0.155 USER MOD Single : A 114 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 117 SER OG : rot 180:sc= 0 USER MOD Single : A 118 SER OG : rot 180:sc= -0.0882 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 122 SER OG : rot 91:sc= 0.423 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 74:sc= 1.28 USER MOD Single : A 129 THR OG1 : rot 98:sc= 1.22 USER MOD Single : A 130 THR OG1 : rot -162:sc= 0.133 USER MOD Single : A 132 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 SER OG : rot 71:sc= 1.24 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 -15.287 -2.237 -1.551 1.00 13.42 N ATOM 2 CA GLY A 17 -13.920 -1.840 -1.270 1.00 13.24 C ATOM 3 C GLY A 17 -13.782 -0.345 -1.058 1.00 21.33 C ATOM 4 O GLY A 17 -12.856 0.110 -0.389 1.00 24.12 O ATOM 0 HA2 GLY A 17 -13.568 -2.364 -0.381 1.00 13.24 H new ATOM 0 HA3 GLY A 17 -13.279 -2.147 -2.096 1.00 13.24 H new ATOM 8 N ASN A 18 -14.706 0.420 -1.631 1.00 25.43 N ATOM 9 CA ASN A 18 -14.681 1.872 -1.502 1.00 12.40 C ATOM 10 C ASN A 18 -14.913 2.294 -0.054 1.00 42.45 C ATOM 11 O ASN A 18 -14.164 3.101 0.495 1.00 60.11 O ATOM 12 CB ASN A 18 -15.743 2.503 -2.405 1.00 14.23 C ATOM 13 CG ASN A 18 -15.707 4.018 -2.370 1.00 42.41 C ATOM 14 OD1 ASN A 18 -14.907 4.647 -3.061 1.00 71.14 O ATOM 15 ND2 ASN A 18 -16.578 4.612 -1.561 1.00 72.33 N ATOM 0 H ASN A 18 -15.480 0.059 -2.188 1.00 25.43 H new ATOM 0 HA ASN A 18 -13.696 2.222 -1.810 1.00 12.40 H new ATOM 0 HB2 ASN A 18 -15.593 2.163 -3.430 1.00 14.23 H new ATOM 0 HB3 ASN A 18 -16.730 2.159 -2.096 1.00 14.23 H new ATOM 0 HD21 ASN A 18 -16.601 5.630 -1.495 1.00 72.33 H new ATOM 0 HD22 ASN A 18 -17.224 4.050 -1.006 1.00 72.33 H new ATOM 22 N ALA A 19 -15.956 1.744 0.557 1.00 5.10 N ATOM 23 CA ALA A 19 -16.285 2.061 1.942 1.00 73.22 C ATOM 24 C ALA A 19 -15.215 1.539 2.894 1.00 64.42 C ATOM 25 O ALA A 19 -15.016 2.085 3.979 1.00 44.23 O ATOM 26 CB ALA A 19 -17.645 1.485 2.306 1.00 31.23 C ATOM 0 H ALA A 19 -16.588 1.076 0.115 1.00 5.10 H new ATOM 0 HA ALA A 19 -16.324 3.146 2.041 1.00 73.22 H new ATOM 0 HB1 ALA A 19 -17.878 1.729 3.342 1.00 31.23 H new ATOM 0 HB2 ALA A 19 -18.407 1.911 1.653 1.00 31.23 H new ATOM 0 HB3 ALA A 19 -17.626 0.402 2.184 1.00 31.23 H new ATOM 32 N PHE A 20 -14.528 0.478 2.481 1.00 14.35 N ATOM 33 CA PHE A 20 -13.478 -0.120 3.298 1.00 13.42 C ATOM 34 C PHE A 20 -12.325 0.859 3.501 1.00 70.32 C ATOM 35 O PHE A 20 -11.899 1.109 4.628 1.00 33.43 O ATOM 36 CB PHE A 20 -12.965 -1.405 2.648 1.00 44.34 C ATOM 37 CG PHE A 20 -11.479 -1.589 2.777 1.00 52.12 C ATOM 38 CD1 PHE A 20 -10.929 -2.078 3.950 1.00 43.54 C ATOM 39 CD2 PHE A 20 -10.634 -1.274 1.724 1.00 75.00 C ATOM 40 CE1 PHE A 20 -9.563 -2.248 4.072 1.00 64.00 C ATOM 41 CE2 PHE A 20 -9.268 -1.444 1.840 1.00 2.03 C ATOM 42 CZ PHE A 20 -8.731 -1.932 3.015 1.00 0.33 C ATOM 0 H PHE A 20 -14.680 0.015 1.585 1.00 14.35 H new ATOM 0 HA PHE A 20 -13.902 -0.361 4.273 1.00 13.42 H new ATOM 0 HB2 PHE A 20 -13.470 -2.259 3.101 1.00 44.34 H new ATOM 0 HB3 PHE A 20 -13.232 -1.400 1.591 1.00 44.34 H new ATOM 0 HD1 PHE A 20 -11.575 -2.329 4.779 1.00 43.54 H new ATOM 0 HD2 PHE A 20 -11.048 -0.891 0.803 1.00 75.00 H new ATOM 0 HE1 PHE A 20 -9.146 -2.628 4.993 1.00 64.00 H new ATOM 0 HE2 PHE A 20 -8.620 -1.195 1.012 1.00 2.03 H new ATOM 0 HZ PHE A 20 -7.663 -2.066 3.108 1.00 0.33 H new ATOM 52 N ALA A 21 -11.822 1.408 2.401 1.00 12.20 N ATOM 53 CA ALA A 21 -10.720 2.360 2.456 1.00 22.11 C ATOM 54 C ALA A 21 -11.175 3.696 3.030 1.00 32.40 C ATOM 55 O ALA A 21 -10.444 4.341 3.782 1.00 32.02 O ATOM 56 CB ALA A 21 -10.121 2.554 1.071 1.00 22.21 C ATOM 0 H ALA A 21 -12.161 1.210 1.460 1.00 12.20 H new ATOM 0 HA ALA A 21 -9.955 1.954 3.117 1.00 22.11 H new ATOM 0 HB1 ALA A 21 -9.299 3.268 1.127 1.00 22.21 H new ATOM 0 HB2 ALA A 21 -9.748 1.600 0.699 1.00 22.21 H new ATOM 0 HB3 ALA A 21 -10.886 2.934 0.394 1.00 22.21 H new ATOM 62 N GLN A 22 -12.388 4.107 2.670 1.00 11.22 N ATOM 63 CA GLN A 22 -12.941 5.369 3.149 1.00 23.33 C ATOM 64 C GLN A 22 -13.180 5.321 4.654 1.00 44.44 C ATOM 65 O GLN A 22 -12.899 6.284 5.368 1.00 24.44 O ATOM 66 CB GLN A 22 -14.248 5.685 2.422 1.00 55.51 C ATOM 67 CG GLN A 22 -14.460 7.170 2.172 1.00 44.10 C ATOM 68 CD GLN A 22 -15.585 7.748 3.008 1.00 4.45 C ATOM 69 OE1 GLN A 22 -16.744 7.361 2.862 1.00 52.21 O ATOM 70 NE2 GLN A 22 -15.247 8.679 3.893 1.00 3.22 N ATOM 0 H GLN A 22 -13.006 3.585 2.049 1.00 11.22 H new ATOM 0 HA GLN A 22 -12.218 6.157 2.940 1.00 23.33 H new ATOM 0 HB2 GLN A 22 -14.260 5.159 1.468 1.00 55.51 H new ATOM 0 HB3 GLN A 22 -15.083 5.301 3.008 1.00 55.51 H new ATOM 0 HG2 GLN A 22 -13.537 7.707 2.391 1.00 44.10 H new ATOM 0 HG3 GLN A 22 -14.678 7.329 1.116 1.00 44.10 H new ATOM 0 HE21 GLN A 22 -14.273 8.970 3.980 1.00 3.22 H new ATOM 0 HE22 GLN A 22 -15.961 9.103 4.485 1.00 3.22 H new ATOM 79 N SER A 23 -13.702 4.196 5.130 1.00 61.51 N ATOM 80 CA SER A 23 -13.984 4.024 6.551 1.00 34.32 C ATOM 81 C SER A 23 -12.699 4.083 7.370 1.00 34.44 C ATOM 82 O SER A 23 -12.638 4.752 8.403 1.00 62.21 O ATOM 83 CB SER A 23 -14.699 2.693 6.794 1.00 61.34 C ATOM 84 OG SER A 23 -16.055 2.762 6.395 1.00 33.42 O ATOM 0 H SER A 23 -13.939 3.389 4.553 1.00 61.51 H new ATOM 0 HA SER A 23 -14.634 4.839 6.869 1.00 34.32 H new ATOM 0 HB2 SER A 23 -14.194 1.900 6.242 1.00 61.34 H new ATOM 0 HB3 SER A 23 -14.641 2.433 7.851 1.00 61.34 H new ATOM 0 HG SER A 23 -16.126 2.553 5.440 1.00 33.42 H new ATOM 90 N LEU A 24 -11.675 3.377 6.904 1.00 52.41 N ATOM 91 CA LEU A 24 -10.390 3.348 7.594 1.00 40.34 C ATOM 92 C LEU A 24 -9.675 4.690 7.470 1.00 4.53 C ATOM 93 O LEU A 24 -9.201 5.245 8.462 1.00 43.44 O ATOM 94 CB LEU A 24 -9.509 2.234 7.024 1.00 22.03 C ATOM 95 CG LEU A 24 -8.092 2.142 7.593 1.00 74.00 C ATOM 96 CD1 LEU A 24 -7.157 3.085 6.851 1.00 32.12 C ATOM 97 CD2 LEU A 24 -8.094 2.452 9.083 1.00 75.03 C ATOM 0 H LEU A 24 -11.709 2.817 6.052 1.00 52.41 H new ATOM 0 HA LEU A 24 -10.576 3.152 8.650 1.00 40.34 H new ATOM 0 HB2 LEU A 24 -10.009 1.280 7.192 1.00 22.03 H new ATOM 0 HB3 LEU A 24 -9.438 2.371 5.945 1.00 22.03 H new ATOM 0 HG LEU A 24 -7.731 1.123 7.455 1.00 74.00 H new ATOM 0 HD11 LEU A 24 -6.154 3.006 7.269 1.00 32.12 H new ATOM 0 HD12 LEU A 24 -7.132 2.816 5.795 1.00 32.12 H new ATOM 0 HD13 LEU A 24 -7.514 4.109 6.956 1.00 32.12 H new ATOM 0 HD21 LEU A 24 -7.078 2.382 9.471 1.00 75.03 H new ATOM 0 HD22 LEU A 24 -8.475 3.460 9.244 1.00 75.03 H new ATOM 0 HD23 LEU A 24 -8.731 1.736 9.603 1.00 75.03 H new ATOM 109 N SER A 25 -9.603 5.206 6.247 1.00 33.12 N ATOM 110 CA SER A 25 -8.945 6.483 5.995 1.00 34.21 C ATOM 111 C SER A 25 -9.638 7.611 6.751 1.00 14.30 C ATOM 112 O SER A 25 -8.990 8.533 7.245 1.00 23.15 O ATOM 113 CB SER A 25 -8.938 6.789 4.496 1.00 64.54 C ATOM 114 OG SER A 25 -10.258 6.908 3.992 1.00 43.32 O ATOM 0 H SER A 25 -9.992 4.760 5.416 1.00 33.12 H new ATOM 0 HA SER A 25 -7.917 6.410 6.350 1.00 34.21 H new ATOM 0 HB2 SER A 25 -8.391 7.714 4.313 1.00 64.54 H new ATOM 0 HB3 SER A 25 -8.412 5.997 3.963 1.00 64.54 H new ATOM 0 HG SER A 25 -10.734 6.060 4.117 1.00 43.32 H new ATOM 120 N SER A 26 -10.962 7.531 6.837 1.00 74.42 N ATOM 121 CA SER A 26 -11.746 8.546 7.530 1.00 10.53 C ATOM 122 C SER A 26 -11.278 8.704 8.973 1.00 63.12 C ATOM 123 O SER A 26 -11.024 9.813 9.438 1.00 54.33 O ATOM 124 CB SER A 26 -13.232 8.184 7.501 1.00 74.45 C ATOM 125 OG SER A 26 -13.944 8.866 8.517 1.00 2.22 O ATOM 0 H SER A 26 -11.514 6.773 6.435 1.00 74.42 H new ATOM 0 HA SER A 26 -11.601 9.495 7.013 1.00 10.53 H new ATOM 0 HB2 SER A 26 -13.652 8.436 6.527 1.00 74.45 H new ATOM 0 HB3 SER A 26 -13.350 7.108 7.630 1.00 74.45 H new ATOM 0 HG SER A 26 -14.891 8.618 8.475 1.00 2.22 H new ATOM 131 N ASN A 27 -11.164 7.582 9.678 1.00 74.23 N ATOM 132 CA ASN A 27 -10.727 7.593 11.069 1.00 54.01 C ATOM 133 C ASN A 27 -9.229 7.867 11.166 1.00 31.30 C ATOM 134 O ASN A 27 -8.768 8.527 12.097 1.00 61.40 O ATOM 135 CB ASN A 27 -11.059 6.259 11.740 1.00 62.40 C ATOM 136 CG ASN A 27 -10.974 6.335 13.252 1.00 65.13 C ATOM 137 OD1 ASN A 27 -9.897 6.537 13.815 1.00 14.31 O ATOM 138 ND2 ASN A 27 -12.110 6.173 13.918 1.00 51.03 N ATOM 0 H ASN A 27 -11.368 6.654 9.308 1.00 74.23 H new ATOM 0 HA ASN A 27 -11.258 8.393 11.585 1.00 54.01 H new ATOM 0 HB2 ASN A 27 -12.063 5.950 11.450 1.00 62.40 H new ATOM 0 HB3 ASN A 27 -10.373 5.493 11.378 1.00 62.40 H new ATOM 0 HD21 ASN A 27 -12.114 6.214 14.937 1.00 51.03 H new ATOM 0 HD22 ASN A 27 -12.979 6.008 13.411 1.00 51.03 H new ATOM 145 N LEU A 28 -8.477 7.355 10.198 1.00 1.41 N ATOM 146 CA LEU A 28 -7.031 7.545 10.173 1.00 44.01 C ATOM 147 C LEU A 28 -6.677 9.017 9.987 1.00 21.42 C ATOM 148 O LEU A 28 -5.772 9.537 10.639 1.00 4.11 O ATOM 149 CB LEU A 28 -6.407 6.712 9.052 1.00 52.25 C ATOM 150 CG LEU A 28 -5.002 6.170 9.319 1.00 15.53 C ATOM 151 CD1 LEU A 28 -4.383 5.638 8.037 1.00 71.12 C ATOM 152 CD2 LEU A 28 -4.123 7.249 9.933 1.00 41.15 C ATOM 0 H LEU A 28 -8.844 6.806 9.421 1.00 1.41 H new ATOM 0 HA LEU A 28 -6.629 7.213 11.130 1.00 44.01 H new ATOM 0 HB2 LEU A 28 -7.066 5.869 8.843 1.00 52.25 H new ATOM 0 HB3 LEU A 28 -6.374 7.322 8.149 1.00 52.25 H new ATOM 0 HG LEU A 28 -5.079 5.346 10.028 1.00 15.53 H new ATOM 0 HD11 LEU A 28 -3.384 5.257 8.246 1.00 71.12 H new ATOM 0 HD12 LEU A 28 -5.003 4.834 7.640 1.00 71.12 H new ATOM 0 HD13 LEU A 28 -4.318 6.442 7.303 1.00 71.12 H new ATOM 0 HD21 LEU A 28 -3.127 6.846 10.116 1.00 41.15 H new ATOM 0 HD22 LEU A 28 -4.052 8.094 9.248 1.00 41.15 H new ATOM 0 HD23 LEU A 28 -4.559 7.581 10.875 1.00 41.15 H new ATOM 164 N LEU A 29 -7.400 9.686 9.093 1.00 22.45 N ATOM 165 CA LEU A 29 -7.165 11.098 8.823 1.00 64.30 C ATOM 166 C LEU A 29 -7.666 11.964 9.975 1.00 72.35 C ATOM 167 O LEU A 29 -7.051 12.975 10.317 1.00 22.11 O ATOM 168 CB LEU A 29 -7.855 11.511 7.521 1.00 34.30 C ATOM 169 CG LEU A 29 -7.405 12.840 6.913 1.00 22.40 C ATOM 170 CD1 LEU A 29 -7.784 12.909 5.443 1.00 42.14 C ATOM 171 CD2 LEU A 29 -8.007 14.008 7.679 1.00 13.45 C ATOM 0 H LEU A 29 -8.153 9.271 8.544 1.00 22.45 H new ATOM 0 HA LEU A 29 -6.090 11.249 8.721 1.00 64.30 H new ATOM 0 HB2 LEU A 29 -7.695 10.725 6.783 1.00 34.30 H new ATOM 0 HB3 LEU A 29 -8.928 11.563 7.703 1.00 34.30 H new ATOM 0 HG LEU A 29 -6.320 12.904 6.989 1.00 22.40 H new ATOM 0 HD11 LEU A 29 -7.456 13.862 5.027 1.00 42.14 H new ATOM 0 HD12 LEU A 29 -7.303 12.093 4.904 1.00 42.14 H new ATOM 0 HD13 LEU A 29 -8.866 12.822 5.342 1.00 42.14 H new ATOM 0 HD21 LEU A 29 -7.676 14.945 7.232 1.00 13.45 H new ATOM 0 HD22 LEU A 29 -9.095 13.950 7.636 1.00 13.45 H new ATOM 0 HD23 LEU A 29 -7.683 13.967 8.719 1.00 13.45 H new ATOM 183 N SER A 30 -8.785 11.562 10.567 1.00 52.42 N ATOM 184 CA SER A 30 -9.370 12.302 11.678 1.00 72.03 C ATOM 185 C SER A 30 -8.764 11.857 13.006 1.00 44.01 C ATOM 186 O SER A 30 -9.222 12.259 14.075 1.00 1.04 O ATOM 187 CB SER A 30 -10.887 12.106 11.706 1.00 24.23 C ATOM 188 OG SER A 30 -11.277 11.298 12.803 1.00 4.24 O ATOM 0 H SER A 30 -9.305 10.727 10.296 1.00 52.42 H new ATOM 0 HA SER A 30 -9.150 13.360 11.534 1.00 72.03 H new ATOM 0 HB2 SER A 30 -11.381 13.076 11.771 1.00 24.23 H new ATOM 0 HB3 SER A 30 -11.214 11.643 10.775 1.00 24.23 H new ATOM 0 HG SER A 30 -12.251 11.189 12.799 1.00 4.24 H new ATOM 194 N SER A 31 -7.730 11.024 12.928 1.00 55.25 N ATOM 195 CA SER A 31 -7.063 10.520 14.123 1.00 54.53 C ATOM 196 C SER A 31 -6.584 11.672 15.003 1.00 62.32 C ATOM 197 O SER A 31 -6.167 12.716 14.505 1.00 61.03 O ATOM 198 CB SER A 31 -5.879 9.632 13.735 1.00 3.31 C ATOM 199 OG SER A 31 -6.299 8.304 13.483 1.00 34.23 O ATOM 0 H SER A 31 -7.337 10.684 12.050 1.00 55.25 H new ATOM 0 HA SER A 31 -7.782 9.927 14.689 1.00 54.53 H new ATOM 0 HB2 SER A 31 -5.392 10.037 12.848 1.00 3.31 H new ATOM 0 HB3 SER A 31 -5.139 9.637 14.535 1.00 3.31 H new ATOM 0 HG SER A 31 -7.154 8.317 13.004 1.00 34.23 H new ATOM 205 N GLY A 32 -6.648 11.469 16.315 1.00 1.53 N ATOM 206 CA GLY A 32 -6.219 12.498 17.246 1.00 64.25 C ATOM 207 C GLY A 32 -4.778 12.915 17.023 1.00 11.32 C ATOM 208 O GLY A 32 -4.361 13.987 17.460 1.00 53.15 O ATOM 0 H GLY A 32 -6.989 10.612 16.750 1.00 1.53 H new ATOM 0 HA2 GLY A 32 -6.866 13.369 17.144 1.00 64.25 H new ATOM 0 HA3 GLY A 32 -6.335 12.132 18.266 1.00 64.25 H new ATOM 212 N ASP A 33 -4.015 12.065 16.345 1.00 30.41 N ATOM 213 CA ASP A 33 -2.612 12.350 16.065 1.00 13.44 C ATOM 214 C ASP A 33 -2.430 12.825 14.629 1.00 65.51 C ATOM 215 O ASP A 33 -1.621 13.713 14.354 1.00 24.34 O ATOM 216 CB ASP A 33 -1.757 11.107 16.318 1.00 24.03 C ATOM 217 CG ASP A 33 -2.357 9.858 15.704 1.00 72.23 C ATOM 218 OD1 ASP A 33 -3.257 9.261 16.329 1.00 11.13 O ATOM 219 OD2 ASP A 33 -1.925 9.476 14.595 1.00 15.43 O ATOM 0 H ASP A 33 -4.345 11.172 15.979 1.00 30.41 H new ATOM 0 HA ASP A 33 -2.288 13.147 16.735 1.00 13.44 H new ATOM 0 HB2 ASP A 33 -0.759 11.266 15.909 1.00 24.03 H new ATOM 0 HB3 ASP A 33 -1.642 10.961 17.392 1.00 24.03 H new ATOM 224 N PHE A 34 -3.186 12.229 13.712 1.00 15.04 N ATOM 225 CA PHE A 34 -3.106 12.590 12.302 1.00 21.42 C ATOM 226 C PHE A 34 -3.661 13.993 12.067 1.00 21.35 C ATOM 227 O PHE A 34 -3.097 14.775 11.302 1.00 1.23 O ATOM 228 CB PHE A 34 -3.874 11.577 11.450 1.00 71.32 C ATOM 229 CG PHE A 34 -3.383 11.492 10.033 1.00 35.34 C ATOM 230 CD1 PHE A 34 -3.466 12.587 9.189 1.00 31.14 C ATOM 231 CD2 PHE A 34 -2.839 10.314 9.545 1.00 41.10 C ATOM 232 CE1 PHE A 34 -3.016 12.513 7.886 1.00 74.33 C ATOM 233 CE2 PHE A 34 -2.387 10.233 8.242 1.00 40.54 C ATOM 234 CZ PHE A 34 -2.475 11.334 7.410 1.00 34.14 C ATOM 0 H PHE A 34 -3.861 11.494 13.921 1.00 15.04 H new ATOM 0 HA PHE A 34 -2.056 12.579 12.009 1.00 21.42 H new ATOM 0 HB2 PHE A 34 -3.797 10.593 11.912 1.00 71.32 H new ATOM 0 HB3 PHE A 34 -4.930 11.845 11.445 1.00 71.32 H new ATOM 0 HD1 PHE A 34 -3.888 13.511 9.555 1.00 31.14 H new ATOM 0 HD2 PHE A 34 -2.768 9.451 10.190 1.00 41.10 H new ATOM 0 HE1 PHE A 34 -3.087 13.375 7.240 1.00 74.33 H new ATOM 0 HE2 PHE A 34 -1.965 9.310 7.873 1.00 40.54 H new ATOM 0 HZ PHE A 34 -2.122 11.273 6.391 1.00 34.14 H new ATOM 244 N VAL A 35 -4.769 14.303 12.731 1.00 33.33 N ATOM 245 CA VAL A 35 -5.401 15.610 12.596 1.00 14.11 C ATOM 246 C VAL A 35 -4.414 16.730 12.902 1.00 0.23 C ATOM 247 O VAL A 35 -4.446 17.788 12.271 1.00 24.45 O ATOM 248 CB VAL A 35 -6.619 15.743 13.530 1.00 50.31 C ATOM 249 CG1 VAL A 35 -7.705 14.755 13.135 1.00 30.14 C ATOM 250 CG2 VAL A 35 -6.203 15.544 14.979 1.00 33.24 C ATOM 0 H VAL A 35 -5.248 13.667 13.368 1.00 33.33 H new ATOM 0 HA VAL A 35 -5.735 15.696 11.562 1.00 14.11 H new ATOM 0 HB VAL A 35 -7.025 16.749 13.429 1.00 50.31 H new ATOM 0 HG11 VAL A 35 -8.557 14.864 13.806 1.00 30.14 H new ATOM 0 HG12 VAL A 35 -8.022 14.953 12.111 1.00 30.14 H new ATOM 0 HG13 VAL A 35 -7.316 13.739 13.205 1.00 30.14 H new ATOM 0 HG21 VAL A 35 -7.076 15.641 15.625 1.00 33.24 H new ATOM 0 HG22 VAL A 35 -5.771 14.551 15.100 1.00 33.24 H new ATOM 0 HG23 VAL A 35 -5.464 16.297 15.252 1.00 33.24 H new ATOM 260 N GLN A 36 -3.539 16.493 13.873 1.00 33.20 N ATOM 261 CA GLN A 36 -2.542 17.483 14.261 1.00 3.15 C ATOM 262 C GLN A 36 -1.545 17.723 13.135 1.00 41.12 C ATOM 263 O GLN A 36 -1.029 18.831 12.974 1.00 22.24 O ATOM 264 CB GLN A 36 -1.806 17.028 15.523 1.00 25.02 C ATOM 265 CG GLN A 36 -1.696 18.108 16.588 1.00 31.52 C ATOM 266 CD GLN A 36 -1.273 17.558 17.936 1.00 42.41 C ATOM 267 OE1 GLN A 36 -0.101 17.632 18.309 1.00 74.01 O ATOM 268 NE2 GLN A 36 -2.225 17.001 18.674 1.00 13.33 N ATOM 0 H GLN A 36 -3.500 15.624 14.406 1.00 33.20 H new ATOM 0 HA GLN A 36 -3.059 18.420 14.468 1.00 3.15 H new ATOM 0 HB2 GLN A 36 -2.323 16.166 15.944 1.00 25.02 H new ATOM 0 HB3 GLN A 36 -0.804 16.696 15.249 1.00 25.02 H new ATOM 0 HG2 GLN A 36 -0.976 18.860 16.265 1.00 31.52 H new ATOM 0 HG3 GLN A 36 -2.658 18.611 16.691 1.00 31.52 H new ATOM 0 HE21 GLN A 36 -3.183 16.961 18.326 1.00 13.33 H new ATOM 0 HE22 GLN A 36 -1.999 16.613 19.590 1.00 13.33 H new ATOM 277 N MET A 37 -1.275 16.681 12.356 1.00 61.21 N ATOM 278 CA MET A 37 -0.339 16.780 11.242 1.00 21.34 C ATOM 279 C MET A 37 -0.915 17.640 10.123 1.00 71.30 C ATOM 280 O MET A 37 -0.298 18.617 9.700 1.00 52.45 O ATOM 281 CB MET A 37 0.000 15.387 10.709 1.00 63.53 C ATOM 282 CG MET A 37 1.424 15.265 10.190 1.00 2.01 C ATOM 283 SD MET A 37 1.518 14.403 8.609 1.00 35.15 S ATOM 284 CE MET A 37 2.070 15.725 7.535 1.00 3.40 C ATOM 0 H MET A 37 -1.691 15.758 12.476 1.00 61.21 H new ATOM 0 HA MET A 37 0.573 17.253 11.606 1.00 21.34 H new ATOM 0 HB2 MET A 37 -0.153 14.656 11.503 1.00 63.53 H new ATOM 0 HB3 MET A 37 -0.693 15.135 9.907 1.00 63.53 H new ATOM 0 HG2 MET A 37 1.853 16.261 10.082 1.00 2.01 H new ATOM 0 HG3 MET A 37 2.030 14.735 10.925 1.00 2.01 H new ATOM 0 HE1 MET A 37 1.251 16.032 6.885 1.00 3.40 H new ATOM 0 HE2 MET A 37 2.392 16.574 8.139 1.00 3.40 H new ATOM 0 HE3 MET A 37 2.904 15.375 6.927 1.00 3.40 H new ATOM 294 N ILE A 38 -2.100 17.269 9.647 1.00 44.22 N ATOM 295 CA ILE A 38 -2.758 18.007 8.577 1.00 33.13 C ATOM 296 C ILE A 38 -3.076 19.434 9.010 1.00 51.32 C ATOM 297 O ILE A 38 -3.114 20.350 8.188 1.00 54.03 O ATOM 298 CB ILE A 38 -4.060 17.314 8.133 1.00 4.24 C ATOM 299 CG1 ILE A 38 -3.805 15.832 7.855 1.00 60.35 C ATOM 300 CG2 ILE A 38 -4.630 18.001 6.900 1.00 32.33 C ATOM 301 CD1 ILE A 38 -5.024 15.093 7.348 1.00 51.42 C ATOM 0 H ILE A 38 -2.623 16.462 9.986 1.00 44.22 H new ATOM 0 HA ILE A 38 -2.065 18.031 7.736 1.00 33.13 H new ATOM 0 HB ILE A 38 -4.790 17.392 8.939 1.00 4.24 H new ATOM 0 HG12 ILE A 38 -3.004 15.741 7.121 1.00 60.35 H new ATOM 0 HG13 ILE A 38 -3.455 15.354 8.770 1.00 60.35 H new ATOM 0 HG21 ILE A 38 -5.550 17.501 6.597 1.00 32.33 H new ATOM 0 HG22 ILE A 38 -4.844 19.045 7.131 1.00 32.33 H new ATOM 0 HG23 ILE A 38 -3.905 17.950 6.087 1.00 32.33 H new ATOM 0 HD11 ILE A 38 -4.769 14.048 7.172 1.00 51.42 H new ATOM 0 HD12 ILE A 38 -5.820 15.153 8.090 1.00 51.42 H new ATOM 0 HD13 ILE A 38 -5.362 15.545 6.416 1.00 51.42 H new ATOM 313 N SER A 39 -3.305 19.617 10.307 1.00 72.14 N ATOM 314 CA SER A 39 -3.622 20.933 10.849 1.00 73.21 C ATOM 315 C SER A 39 -2.365 21.787 10.973 1.00 50.43 C ATOM 316 O SER A 39 -2.431 23.016 10.947 1.00 1.40 O ATOM 317 CB SER A 39 -4.295 20.795 12.216 1.00 61.25 C ATOM 318 OG SER A 39 -4.853 22.028 12.636 1.00 13.24 O ATOM 0 H SER A 39 -3.277 18.870 11.001 1.00 72.14 H new ATOM 0 HA SER A 39 -4.309 21.426 10.161 1.00 73.21 H new ATOM 0 HB2 SER A 39 -5.077 20.037 12.165 1.00 61.25 H new ATOM 0 HB3 SER A 39 -3.566 20.453 12.951 1.00 61.25 H new ATOM 0 HG SER A 39 -5.278 21.913 13.511 1.00 13.24 H new ATOM 324 N SER A 40 -1.219 21.128 11.104 1.00 23.14 N ATOM 325 CA SER A 40 0.055 21.825 11.236 1.00 13.12 C ATOM 326 C SER A 40 0.461 22.468 9.913 1.00 33.33 C ATOM 327 O SER A 40 1.171 23.473 9.888 1.00 23.12 O ATOM 328 CB SER A 40 1.145 20.859 11.703 1.00 54.14 C ATOM 329 OG SER A 40 1.637 20.084 10.622 1.00 52.34 O ATOM 0 H SER A 40 -1.146 20.111 11.122 1.00 23.14 H new ATOM 0 HA SER A 40 -0.065 22.611 11.981 1.00 13.12 H new ATOM 0 HB2 SER A 40 1.963 21.420 12.155 1.00 54.14 H new ATOM 0 HB3 SER A 40 0.746 20.201 12.475 1.00 54.14 H new ATOM 0 HG SER A 40 0.956 19.434 10.349 1.00 52.34 H new ATOM 335 N THR A 41 0.004 21.880 8.811 1.00 25.53 N ATOM 336 CA THR A 41 0.319 22.392 7.484 1.00 61.40 C ATOM 337 C THR A 41 0.005 23.880 7.380 1.00 63.32 C ATOM 338 O THR A 41 -1.157 24.274 7.288 1.00 3.25 O ATOM 339 CB THR A 41 -0.459 21.635 6.390 1.00 41.45 C ATOM 340 OG1 THR A 41 -1.861 21.896 6.519 1.00 0.20 O ATOM 341 CG2 THR A 41 -0.205 20.139 6.481 1.00 50.40 C ATOM 0 H THR A 41 -0.586 21.048 8.812 1.00 25.53 H new ATOM 0 HA THR A 41 1.387 22.238 7.331 1.00 61.40 H new ATOM 0 HB THR A 41 -0.112 21.986 5.418 1.00 41.45 H new ATOM 0 HG1 THR A 41 -2.179 21.557 7.382 1.00 0.20 H new ATOM 0 HG21 THR A 41 -0.765 19.627 5.699 1.00 50.40 H new ATOM 0 HG22 THR A 41 0.859 19.942 6.354 1.00 50.40 H new ATOM 0 HG23 THR A 41 -0.527 19.774 7.456 1.00 50.40 H new ATOM 349 N THR A 42 1.050 24.702 7.392 1.00 55.42 N ATOM 350 CA THR A 42 0.885 26.147 7.300 1.00 64.04 C ATOM 351 C THR A 42 0.017 26.527 6.105 1.00 20.34 C ATOM 352 O THR A 42 -0.677 27.544 6.128 1.00 71.13 O ATOM 353 CB THR A 42 2.245 26.861 7.178 1.00 33.00 C ATOM 354 OG1 THR A 42 2.916 26.437 5.985 1.00 30.23 O ATOM 355 CG2 THR A 42 3.119 26.571 8.388 1.00 12.12 C ATOM 0 H THR A 42 2.019 24.392 7.464 1.00 55.42 H new ATOM 0 HA THR A 42 0.395 26.468 8.219 1.00 64.04 H new ATOM 0 HB THR A 42 2.064 27.935 7.130 1.00 33.00 H new ATOM 0 HG1 THR A 42 3.779 26.897 5.914 1.00 30.23 H new ATOM 0 HG21 THR A 42 4.074 27.086 8.279 1.00 12.12 H new ATOM 0 HG22 THR A 42 2.619 26.922 9.291 1.00 12.12 H new ATOM 0 HG23 THR A 42 3.292 25.497 8.463 1.00 12.12 H new ATOM 363 N SER A 43 0.059 25.702 5.065 1.00 75.41 N ATOM 364 CA SER A 43 -0.724 25.953 3.859 1.00 60.32 C ATOM 365 C SER A 43 -1.302 24.654 3.307 1.00 71.11 C ATOM 366 O SER A 43 -0.660 23.603 3.353 1.00 3.53 O ATOM 367 CB SER A 43 0.142 26.632 2.795 1.00 71.30 C ATOM 368 OG SER A 43 -0.654 27.381 1.892 1.00 23.23 O ATOM 0 H SER A 43 0.626 24.855 5.032 1.00 75.41 H new ATOM 0 HA SER A 43 -1.549 26.615 4.122 1.00 60.32 H new ATOM 0 HB2 SER A 43 0.867 27.288 3.276 1.00 71.30 H new ATOM 0 HB3 SER A 43 0.708 25.879 2.247 1.00 71.30 H new ATOM 0 HG SER A 43 -0.078 27.806 1.223 1.00 23.23 H new ATOM 374 N THR A 44 -2.522 24.732 2.782 1.00 62.51 N ATOM 375 CA THR A 44 -3.189 23.563 2.221 1.00 3.43 C ATOM 376 C THR A 44 -2.322 22.889 1.164 1.00 70.21 C ATOM 377 O THR A 44 -2.403 21.678 0.961 1.00 1.24 O ATOM 378 CB THR A 44 -4.544 23.938 1.594 1.00 55.44 C ATOM 379 OG1 THR A 44 -5.280 22.753 1.270 1.00 73.22 O ATOM 380 CG2 THR A 44 -4.347 24.777 0.339 1.00 31.25 C ATOM 0 H THR A 44 -3.068 25.592 2.734 1.00 62.51 H new ATOM 0 HA THR A 44 -3.357 22.869 3.045 1.00 3.43 H new ATOM 0 HB THR A 44 -5.104 24.526 2.321 1.00 55.44 H new ATOM 0 HG1 THR A 44 -6.141 23.001 0.873 1.00 73.22 H new ATOM 0 HG21 THR A 44 -5.318 25.030 -0.086 1.00 31.25 H new ATOM 0 HG22 THR A 44 -3.813 25.693 0.594 1.00 31.25 H new ATOM 0 HG23 THR A 44 -3.768 24.210 -0.390 1.00 31.25 H new ATOM 388 N ASP A 45 -1.492 23.681 0.494 1.00 43.22 N ATOM 389 CA ASP A 45 -0.607 23.160 -0.541 1.00 34.51 C ATOM 390 C ASP A 45 0.252 22.021 0.000 1.00 13.44 C ATOM 391 O ASP A 45 0.411 20.989 -0.650 1.00 23.24 O ATOM 392 CB ASP A 45 0.287 24.275 -1.088 1.00 31.03 C ATOM 393 CG ASP A 45 -0.388 25.070 -2.188 1.00 41.22 C ATOM 394 OD1 ASP A 45 -1.100 24.458 -3.012 1.00 24.13 O ATOM 395 OD2 ASP A 45 -0.203 26.304 -2.227 1.00 61.30 O ATOM 0 H ASP A 45 -1.414 24.686 0.649 1.00 43.22 H new ATOM 0 HA ASP A 45 -1.225 22.771 -1.350 1.00 34.51 H new ATOM 0 HB2 ASP A 45 0.564 24.947 -0.275 1.00 31.03 H new ATOM 0 HB3 ASP A 45 1.211 23.841 -1.471 1.00 31.03 H new ATOM 400 N GLN A 46 0.804 22.219 1.193 1.00 52.13 N ATOM 401 CA GLN A 46 1.649 21.209 1.821 1.00 55.44 C ATOM 402 C GLN A 46 0.867 19.923 2.066 1.00 24.15 C ATOM 403 O GLN A 46 1.448 18.842 2.161 1.00 11.03 O ATOM 404 CB GLN A 46 2.216 21.737 3.139 1.00 33.55 C ATOM 405 CG GLN A 46 3.735 21.795 3.169 1.00 73.42 C ATOM 406 CD GLN A 46 4.306 22.683 2.081 1.00 60.01 C ATOM 407 OE1 GLN A 46 3.690 23.674 1.687 1.00 61.13 O ATOM 408 NE2 GLN A 46 5.488 22.334 1.592 1.00 62.12 N ATOM 0 H GLN A 46 0.682 23.069 1.744 1.00 52.13 H new ATOM 0 HA GLN A 46 2.474 20.987 1.144 1.00 55.44 H new ATOM 0 HB2 GLN A 46 1.819 22.736 3.321 1.00 33.55 H new ATOM 0 HB3 GLN A 46 1.869 21.102 3.954 1.00 33.55 H new ATOM 0 HG2 GLN A 46 4.062 22.163 4.142 1.00 73.42 H new ATOM 0 HG3 GLN A 46 4.136 20.787 3.058 1.00 73.42 H new ATOM 0 HE21 GLN A 46 5.963 21.505 1.948 1.00 62.12 H new ATOM 0 HE22 GLN A 46 5.923 22.895 0.859 1.00 62.12 H new ATOM 417 N ALA A 47 -0.452 20.048 2.170 1.00 43.21 N ATOM 418 CA ALA A 47 -1.313 18.896 2.405 1.00 2.03 C ATOM 419 C ALA A 47 -1.253 17.919 1.235 1.00 41.40 C ATOM 420 O ALA A 47 -1.385 16.710 1.416 1.00 33.55 O ATOM 421 CB ALA A 47 -2.746 19.348 2.647 1.00 62.45 C ATOM 0 H ALA A 47 -0.948 20.936 2.095 1.00 43.21 H new ATOM 0 HA ALA A 47 -0.953 18.379 3.295 1.00 2.03 H new ATOM 0 HB1 ALA A 47 -3.378 18.477 2.821 1.00 62.45 H new ATOM 0 HB2 ALA A 47 -2.779 20.001 3.519 1.00 62.45 H new ATOM 0 HB3 ALA A 47 -3.109 19.891 1.774 1.00 62.45 H new ATOM 427 N VAL A 48 -1.053 18.454 0.035 1.00 63.40 N ATOM 428 CA VAL A 48 -0.975 17.629 -1.165 1.00 54.12 C ATOM 429 C VAL A 48 0.206 16.667 -1.097 1.00 52.53 C ATOM 430 O VAL A 48 0.125 15.535 -1.572 1.00 21.25 O ATOM 431 CB VAL A 48 -0.846 18.495 -2.434 1.00 73.50 C ATOM 432 CG1 VAL A 48 -0.952 17.632 -3.683 1.00 35.15 C ATOM 433 CG2 VAL A 48 -1.902 19.590 -2.441 1.00 61.35 C ATOM 0 H VAL A 48 -0.942 19.454 -0.132 1.00 63.40 H new ATOM 0 HA VAL A 48 -1.902 17.057 -1.216 1.00 54.12 H new ATOM 0 HB VAL A 48 0.136 18.969 -2.431 1.00 73.50 H new ATOM 0 HG11 VAL A 48 -0.859 18.261 -4.569 1.00 35.15 H new ATOM 0 HG12 VAL A 48 -0.155 16.888 -3.680 1.00 35.15 H new ATOM 0 HG13 VAL A 48 -1.918 17.128 -3.696 1.00 35.15 H new ATOM 0 HG21 VAL A 48 -1.796 20.192 -3.344 1.00 61.35 H new ATOM 0 HG22 VAL A 48 -2.894 19.139 -2.420 1.00 61.35 H new ATOM 0 HG23 VAL A 48 -1.773 20.225 -1.565 1.00 61.35 H new ATOM 443 N SER A 49 1.302 17.127 -0.502 1.00 1.24 N ATOM 444 CA SER A 49 2.501 16.309 -0.374 1.00 22.21 C ATOM 445 C SER A 49 2.264 15.140 0.578 1.00 35.11 C ATOM 446 O SER A 49 2.562 13.990 0.255 1.00 62.04 O ATOM 447 CB SER A 49 3.673 17.157 0.127 1.00 13.34 C ATOM 448 OG SER A 49 3.312 18.526 0.207 1.00 30.43 O ATOM 0 H SER A 49 1.384 18.061 -0.101 1.00 1.24 H new ATOM 0 HA SER A 49 2.744 15.910 -1.359 1.00 22.21 H new ATOM 0 HB2 SER A 49 3.990 16.803 1.108 1.00 13.34 H new ATOM 0 HB3 SER A 49 4.524 17.040 -0.544 1.00 13.34 H new ATOM 0 HG SER A 49 2.725 18.665 0.979 1.00 30.43 H new ATOM 454 N VAL A 50 1.721 15.443 1.754 1.00 0.51 N ATOM 455 CA VAL A 50 1.441 14.420 2.753 1.00 15.40 C ATOM 456 C VAL A 50 0.326 13.490 2.289 1.00 20.42 C ATOM 457 O VAL A 50 0.366 12.284 2.536 1.00 51.00 O ATOM 458 CB VAL A 50 1.041 15.047 4.102 1.00 42.02 C ATOM 459 CG1 VAL A 50 -0.156 15.968 3.931 1.00 73.54 C ATOM 460 CG2 VAL A 50 0.748 13.962 5.127 1.00 11.34 C ATOM 0 H VAL A 50 1.467 16.389 2.037 1.00 0.51 H new ATOM 0 HA VAL A 50 2.359 13.847 2.884 1.00 15.40 H new ATOM 0 HB VAL A 50 1.877 15.644 4.467 1.00 42.02 H new ATOM 0 HG11 VAL A 50 -0.423 16.401 4.895 1.00 73.54 H new ATOM 0 HG12 VAL A 50 0.096 16.766 3.232 1.00 73.54 H new ATOM 0 HG13 VAL A 50 -1.001 15.399 3.543 1.00 73.54 H new ATOM 0 HG21 VAL A 50 0.467 14.423 6.074 1.00 11.34 H new ATOM 0 HG22 VAL A 50 -0.070 13.336 4.771 1.00 11.34 H new ATOM 0 HG23 VAL A 50 1.637 13.348 5.272 1.00 11.34 H new ATOM 470 N ALA A 51 -0.668 14.057 1.614 1.00 35.51 N ATOM 471 CA ALA A 51 -1.794 13.278 1.112 1.00 24.55 C ATOM 472 C ALA A 51 -1.314 12.104 0.266 1.00 73.51 C ATOM 473 O ALA A 51 -1.879 11.010 0.324 1.00 4.12 O ATOM 474 CB ALA A 51 -2.731 14.164 0.305 1.00 75.12 C ATOM 0 H ALA A 51 -0.717 15.053 1.402 1.00 35.51 H new ATOM 0 HA ALA A 51 -2.338 12.878 1.968 1.00 24.55 H new ATOM 0 HB1 ALA A 51 -3.567 13.569 -0.063 1.00 75.12 H new ATOM 0 HB2 ALA A 51 -3.108 14.967 0.939 1.00 75.12 H new ATOM 0 HB3 ALA A 51 -2.190 14.592 -0.539 1.00 75.12 H new ATOM 480 N THR A 52 -0.269 12.336 -0.524 1.00 25.45 N ATOM 481 CA THR A 52 0.286 11.297 -1.383 1.00 15.13 C ATOM 482 C THR A 52 1.062 10.268 -0.572 1.00 42.44 C ATOM 483 O THR A 52 1.160 9.103 -0.958 1.00 1.24 O ATOM 484 CB THR A 52 1.214 11.895 -2.458 1.00 52.11 C ATOM 485 OG1 THR A 52 2.397 12.421 -1.845 1.00 32.43 O ATOM 486 CG2 THR A 52 0.507 12.996 -3.233 1.00 34.21 C ATOM 0 H THR A 52 0.210 13.235 -0.586 1.00 25.45 H new ATOM 0 HA THR A 52 -0.556 10.807 -1.872 1.00 15.13 H new ATOM 0 HB THR A 52 1.486 11.101 -3.153 1.00 52.11 H new ATOM 0 HG1 THR A 52 2.147 13.076 -1.160 1.00 32.43 H new ATOM 0 HG21 THR A 52 1.182 13.402 -3.986 1.00 34.21 H new ATOM 0 HG22 THR A 52 -0.377 12.587 -3.722 1.00 34.21 H new ATOM 0 HG23 THR A 52 0.208 13.789 -2.548 1.00 34.21 H new ATOM 494 N SER A 53 1.615 10.705 0.556 1.00 60.32 N ATOM 495 CA SER A 53 2.386 9.820 1.422 1.00 52.15 C ATOM 496 C SER A 53 1.526 8.666 1.925 1.00 34.23 C ATOM 497 O SER A 53 1.934 7.505 1.880 1.00 62.22 O ATOM 498 CB SER A 53 2.957 10.601 2.606 1.00 14.44 C ATOM 499 OG SER A 53 3.493 11.845 2.188 1.00 33.10 O ATOM 0 H SER A 53 1.543 11.666 0.891 1.00 60.32 H new ATOM 0 HA SER A 53 3.209 9.408 0.838 1.00 52.15 H new ATOM 0 HB2 SER A 53 2.174 10.769 3.346 1.00 14.44 H new ATOM 0 HB3 SER A 53 3.734 10.012 3.093 1.00 14.44 H new ATOM 0 HG SER A 53 3.864 12.318 2.962 1.00 33.10 H new ATOM 505 N VAL A 54 0.330 8.993 2.406 1.00 41.43 N ATOM 506 CA VAL A 54 -0.591 7.985 2.918 1.00 75.35 C ATOM 507 C VAL A 54 -1.142 7.120 1.790 1.00 42.43 C ATOM 508 O VAL A 54 -1.375 5.925 1.966 1.00 43.14 O ATOM 509 CB VAL A 54 -1.766 8.631 3.676 1.00 63.13 C ATOM 510 CG1 VAL A 54 -1.277 9.285 4.960 1.00 75.22 C ATOM 511 CG2 VAL A 54 -2.479 9.642 2.791 1.00 40.20 C ATOM 0 H VAL A 54 -0.024 9.949 2.452 1.00 41.43 H new ATOM 0 HA VAL A 54 -0.024 7.360 3.607 1.00 75.35 H new ATOM 0 HB VAL A 54 -2.478 7.850 3.942 1.00 63.13 H new ATOM 0 HG11 VAL A 54 -2.120 9.736 5.483 1.00 75.22 H new ATOM 0 HG12 VAL A 54 -0.815 8.532 5.599 1.00 75.22 H new ATOM 0 HG13 VAL A 54 -0.545 10.056 4.720 1.00 75.22 H new ATOM 0 HG21 VAL A 54 -3.306 10.089 3.342 1.00 40.20 H new ATOM 0 HG22 VAL A 54 -1.779 10.422 2.493 1.00 40.20 H new ATOM 0 HG23 VAL A 54 -2.864 9.141 1.903 1.00 40.20 H new ATOM 521 N ALA A 55 -1.348 7.734 0.628 1.00 33.32 N ATOM 522 CA ALA A 55 -1.870 7.020 -0.531 1.00 4.34 C ATOM 523 C ALA A 55 -0.891 5.948 -1.002 1.00 42.31 C ATOM 524 O ALA A 55 -1.299 4.877 -1.446 1.00 71.12 O ATOM 525 CB ALA A 55 -2.172 7.995 -1.659 1.00 51.14 C ATOM 0 H ALA A 55 -1.161 8.723 0.465 1.00 33.32 H new ATOM 0 HA ALA A 55 -2.795 6.525 -0.236 1.00 4.34 H new ATOM 0 HB1 ALA A 55 -2.561 7.448 -2.518 1.00 51.14 H new ATOM 0 HB2 ALA A 55 -2.914 8.720 -1.324 1.00 51.14 H new ATOM 0 HB3 ALA A 55 -1.258 8.516 -1.944 1.00 51.14 H new ATOM 531 N GLN A 56 0.399 6.249 -0.902 1.00 25.13 N ATOM 532 CA GLN A 56 1.435 5.310 -1.319 1.00 51.23 C ATOM 533 C GLN A 56 1.504 4.118 -0.370 1.00 64.24 C ATOM 534 O GLN A 56 1.687 2.980 -0.800 1.00 12.00 O ATOM 535 CB GLN A 56 2.794 6.012 -1.377 1.00 34.53 C ATOM 536 CG GLN A 56 3.879 5.180 -2.042 1.00 41.20 C ATOM 537 CD GLN A 56 5.269 5.740 -1.808 1.00 31.54 C ATOM 538 OE1 GLN A 56 5.958 5.347 -0.867 1.00 21.34 O ATOM 539 NE2 GLN A 56 5.688 6.661 -2.668 1.00 11.44 N ATOM 0 H GLN A 56 0.752 7.133 -0.537 1.00 25.13 H new ATOM 0 HA GLN A 56 1.180 4.944 -2.313 1.00 51.23 H new ATOM 0 HB2 GLN A 56 2.686 6.952 -1.918 1.00 34.53 H new ATOM 0 HB3 GLN A 56 3.109 6.262 -0.364 1.00 34.53 H new ATOM 0 HG2 GLN A 56 3.834 4.160 -1.662 1.00 41.20 H new ATOM 0 HG3 GLN A 56 3.687 5.129 -3.114 1.00 41.20 H new ATOM 0 HE21 GLN A 56 5.083 6.957 -3.434 1.00 11.44 H new ATOM 0 HE22 GLN A 56 6.615 7.073 -2.563 1.00 11.44 H new ATOM 548 N ASN A 57 1.361 4.389 0.923 1.00 33.31 N ATOM 549 CA ASN A 57 1.408 3.337 1.933 1.00 52.22 C ATOM 550 C ASN A 57 0.265 2.346 1.740 1.00 22.55 C ATOM 551 O ASN A 57 0.475 1.132 1.740 1.00 40.30 O ATOM 552 CB ASN A 57 1.339 3.946 3.336 1.00 74.22 C ATOM 553 CG ASN A 57 1.664 2.937 4.420 1.00 51.44 C ATOM 554 OD1 ASN A 57 2.741 2.341 4.426 1.00 61.32 O ATOM 555 ND2 ASN A 57 0.731 2.741 5.344 1.00 62.21 N ATOM 0 H ASN A 57 1.212 5.326 1.296 1.00 33.31 H new ATOM 0 HA ASN A 57 2.351 2.802 1.822 1.00 52.22 H new ATOM 0 HB2 ASN A 57 2.035 4.782 3.401 1.00 74.22 H new ATOM 0 HB3 ASN A 57 0.340 4.349 3.506 1.00 74.22 H new ATOM 0 HD21 ASN A 57 0.893 2.074 6.098 1.00 62.21 H new ATOM 0 HD22 ASN A 57 -0.147 3.258 5.299 1.00 62.21 H new ATOM 562 N VAL A 58 -0.945 2.870 1.577 1.00 60.24 N ATOM 563 CA VAL A 58 -2.121 2.031 1.380 1.00 12.50 C ATOM 564 C VAL A 58 -2.046 1.280 0.057 1.00 33.53 C ATOM 565 O VAL A 58 -2.472 0.129 -0.042 1.00 54.13 O ATOM 566 CB VAL A 58 -3.417 2.864 1.412 1.00 43.53 C ATOM 567 CG1 VAL A 58 -3.376 3.955 0.352 1.00 51.31 C ATOM 568 CG2 VAL A 58 -4.631 1.968 1.221 1.00 11.21 C ATOM 0 H VAL A 58 -1.137 3.872 1.577 1.00 60.24 H new ATOM 0 HA VAL A 58 -2.138 1.314 2.201 1.00 12.50 H new ATOM 0 HB VAL A 58 -3.498 3.342 2.388 1.00 43.53 H new ATOM 0 HG11 VAL A 58 -4.299 4.533 0.389 1.00 51.31 H new ATOM 0 HG12 VAL A 58 -2.528 4.613 0.540 1.00 51.31 H new ATOM 0 HG13 VAL A 58 -3.272 3.501 -0.633 1.00 51.31 H new ATOM 0 HG21 VAL A 58 -5.537 2.573 1.246 1.00 11.21 H new ATOM 0 HG22 VAL A 58 -4.561 1.460 0.259 1.00 11.21 H new ATOM 0 HG23 VAL A 58 -4.666 1.228 2.020 1.00 11.21 H new ATOM 578 N GLY A 59 -1.499 1.937 -0.962 1.00 14.02 N ATOM 579 CA GLY A 59 -1.377 1.315 -2.268 1.00 12.40 C ATOM 580 C GLY A 59 -0.361 0.190 -2.281 1.00 21.34 C ATOM 581 O GLY A 59 -0.607 -0.871 -2.853 1.00 54.21 O ATOM 0 H GLY A 59 -1.138 2.889 -0.906 1.00 14.02 H new ATOM 0 HA2 GLY A 59 -2.348 0.927 -2.574 1.00 12.40 H new ATOM 0 HA3 GLY A 59 -1.089 2.069 -3.001 1.00 12.40 H new ATOM 585 N ASN A 60 0.785 0.423 -1.650 1.00 50.54 N ATOM 586 CA ASN A 60 1.843 -0.579 -1.594 1.00 24.30 C ATOM 587 C ASN A 60 1.407 -1.787 -0.770 1.00 2.35 C ATOM 588 O ASN A 60 1.704 -2.928 -1.118 1.00 31.13 O ATOM 589 CB ASN A 60 3.117 0.025 -0.998 1.00 1.43 C ATOM 590 CG ASN A 60 4.256 0.074 -1.997 1.00 44.23 C ATOM 591 OD1 ASN A 60 4.903 1.107 -2.167 1.00 45.12 O ATOM 592 ND2 ASN A 60 4.507 -1.047 -2.664 1.00 14.41 N ATOM 0 H ASN A 60 1.005 1.296 -1.171 1.00 50.54 H new ATOM 0 HA ASN A 60 2.048 -0.910 -2.612 1.00 24.30 H new ATOM 0 HB2 ASN A 60 2.906 1.033 -0.642 1.00 1.43 H new ATOM 0 HB3 ASN A 60 3.423 -0.561 -0.131 1.00 1.43 H new ATOM 0 HD21 ASN A 60 5.262 -1.075 -3.349 1.00 14.41 H new ATOM 0 HD22 ASN A 60 3.945 -1.880 -2.491 1.00 14.41 H new ATOM 599 N GLN A 61 0.700 -1.524 0.324 1.00 12.51 N ATOM 600 CA GLN A 61 0.221 -2.589 1.198 1.00 25.32 C ATOM 601 C GLN A 61 -0.719 -3.528 0.449 1.00 10.40 C ATOM 602 O GLN A 61 -0.796 -4.719 0.753 1.00 52.14 O ATOM 603 CB GLN A 61 -0.491 -1.997 2.416 1.00 40.01 C ATOM 604 CG GLN A 61 -0.103 -2.660 3.729 1.00 54.03 C ATOM 605 CD GLN A 61 -0.607 -4.085 3.834 1.00 33.24 C ATOM 606 OE1 GLN A 61 -1.806 -4.323 3.986 1.00 31.42 O ATOM 607 NE2 GLN A 61 0.308 -5.044 3.754 1.00 24.22 N ATOM 0 H GLN A 61 0.446 -0.584 0.626 1.00 12.51 H new ATOM 0 HA GLN A 61 1.084 -3.163 1.535 1.00 25.32 H new ATOM 0 HB2 GLN A 61 -0.266 -0.932 2.476 1.00 40.01 H new ATOM 0 HB3 GLN A 61 -1.568 -2.088 2.277 1.00 40.01 H new ATOM 0 HG2 GLN A 61 0.983 -2.654 3.828 1.00 54.03 H new ATOM 0 HG3 GLN A 61 -0.501 -2.076 4.558 1.00 54.03 H new ATOM 0 HE21 GLN A 61 1.291 -4.802 3.628 1.00 24.22 H new ATOM 0 HE22 GLN A 61 0.028 -6.023 3.819 1.00 24.22 H new ATOM 616 N LEU A 62 -1.434 -2.981 -0.529 1.00 34.04 N ATOM 617 CA LEU A 62 -2.372 -3.769 -1.321 1.00 22.40 C ATOM 618 C LEU A 62 -1.676 -4.391 -2.528 1.00 72.41 C ATOM 619 O LEU A 62 -2.123 -5.405 -3.062 1.00 53.31 O ATOM 620 CB LEU A 62 -3.538 -2.896 -1.785 1.00 43.14 C ATOM 621 CG LEU A 62 -4.729 -2.804 -0.831 1.00 72.54 C ATOM 622 CD1 LEU A 62 -5.231 -1.372 -0.739 1.00 14.50 C ATOM 623 CD2 LEU A 62 -5.846 -3.734 -1.281 1.00 72.41 C ATOM 0 H LEU A 62 -1.382 -1.997 -0.792 1.00 34.04 H new ATOM 0 HA LEU A 62 -2.756 -4.572 -0.692 1.00 22.40 H new ATOM 0 HB2 LEU A 62 -3.163 -1.888 -1.964 1.00 43.14 H new ATOM 0 HB3 LEU A 62 -3.893 -3.278 -2.742 1.00 43.14 H new ATOM 0 HG LEU A 62 -4.400 -3.116 0.160 1.00 72.54 H new ATOM 0 HD11 LEU A 62 -6.079 -1.327 -0.055 1.00 14.50 H new ATOM 0 HD12 LEU A 62 -4.432 -0.729 -0.369 1.00 14.50 H new ATOM 0 HD13 LEU A 62 -5.543 -1.032 -1.726 1.00 14.50 H new ATOM 0 HD21 LEU A 62 -6.685 -3.655 -0.590 1.00 72.41 H new ATOM 0 HD22 LEU A 62 -6.172 -3.453 -2.282 1.00 72.41 H new ATOM 0 HD23 LEU A 62 -5.481 -4.761 -1.293 1.00 72.41 H new ATOM 635 N GLY A 63 -0.575 -3.777 -2.952 1.00 22.43 N ATOM 636 CA GLY A 63 0.167 -4.285 -4.091 1.00 12.24 C ATOM 637 C GLY A 63 0.057 -3.384 -5.303 1.00 55.13 C ATOM 638 O GLY A 63 0.774 -2.387 -5.414 1.00 14.23 O ATOM 0 H GLY A 63 -0.184 -2.937 -2.527 1.00 22.43 H new ATOM 0 HA2 GLY A 63 1.216 -4.394 -3.817 1.00 12.24 H new ATOM 0 HA3 GLY A 63 -0.201 -5.279 -4.346 1.00 12.24 H new ATOM 642 N LEU A 64 -0.842 -3.731 -6.219 1.00 1.11 N ATOM 643 CA LEU A 64 -1.043 -2.945 -7.432 1.00 24.13 C ATOM 644 C LEU A 64 0.219 -2.938 -8.291 1.00 5.45 C ATOM 645 O LEU A 64 1.275 -3.404 -7.864 1.00 23.24 O ATOM 646 CB LEU A 64 -1.439 -1.511 -7.075 1.00 21.52 C ATOM 647 CG LEU A 64 -2.414 -1.356 -5.908 1.00 75.42 C ATOM 648 CD1 LEU A 64 -2.682 0.115 -5.630 1.00 20.22 C ATOM 649 CD2 LEU A 64 -3.716 -2.090 -6.200 1.00 71.24 C ATOM 0 H LEU A 64 -1.443 -4.552 -6.144 1.00 1.11 H new ATOM 0 HA LEU A 64 -1.848 -3.405 -8.005 1.00 24.13 H new ATOM 0 HB2 LEU A 64 -0.533 -0.952 -6.842 1.00 21.52 H new ATOM 0 HB3 LEU A 64 -1.882 -1.047 -7.956 1.00 21.52 H new ATOM 0 HG LEU A 64 -1.962 -1.797 -5.020 1.00 75.42 H new ATOM 0 HD11 LEU A 64 -3.378 0.207 -4.796 1.00 20.22 H new ATOM 0 HD12 LEU A 64 -1.746 0.614 -5.378 1.00 20.22 H new ATOM 0 HD13 LEU A 64 -3.114 0.580 -6.516 1.00 20.22 H new ATOM 0 HD21 LEU A 64 -4.398 -1.969 -5.359 1.00 71.24 H new ATOM 0 HD22 LEU A 64 -4.172 -1.677 -7.100 1.00 71.24 H new ATOM 0 HD23 LEU A 64 -3.510 -3.150 -6.351 1.00 71.24 H new ATOM 661 N ASP A 65 0.100 -2.405 -9.502 1.00 21.41 N ATOM 662 CA ASP A 65 1.231 -2.334 -10.420 1.00 13.25 C ATOM 663 C ASP A 65 1.978 -1.013 -10.260 1.00 31.22 C ATOM 664 O ASP A 65 1.461 -0.063 -9.671 1.00 22.31 O ATOM 665 CB ASP A 65 0.754 -2.493 -11.863 1.00 71.10 C ATOM 666 CG ASP A 65 1.893 -2.783 -12.821 1.00 14.23 C ATOM 667 OD1 ASP A 65 2.226 -3.973 -13.002 1.00 33.50 O ATOM 668 OD2 ASP A 65 2.450 -1.821 -13.389 1.00 34.33 O ATOM 0 H ASP A 65 -0.768 -2.016 -9.871 1.00 21.41 H new ATOM 0 HA ASP A 65 1.914 -3.149 -10.180 1.00 13.25 H new ATOM 0 HB2 ASP A 65 0.025 -3.302 -11.915 1.00 71.10 H new ATOM 0 HB3 ASP A 65 0.243 -1.583 -12.176 1.00 71.10 H new ATOM 673 N ALA A 66 3.197 -0.961 -10.786 1.00 34.51 N ATOM 674 CA ALA A 66 4.016 0.242 -10.702 1.00 34.14 C ATOM 675 C ALA A 66 3.323 1.423 -11.375 1.00 3.14 C ATOM 676 O ALA A 66 3.261 2.518 -10.818 1.00 21.33 O ATOM 677 CB ALA A 66 5.379 -0.002 -11.332 1.00 4.31 C ATOM 0 H ALA A 66 3.640 -1.739 -11.275 1.00 34.51 H new ATOM 0 HA ALA A 66 4.155 0.486 -9.649 1.00 34.14 H new ATOM 0 HB1 ALA A 66 5.980 0.905 -11.262 1.00 4.31 H new ATOM 0 HB2 ALA A 66 5.883 -0.813 -10.806 1.00 4.31 H new ATOM 0 HB3 ALA A 66 5.252 -0.273 -12.380 1.00 4.31 H new ATOM 683 N ASN A 67 2.806 1.193 -12.578 1.00 70.53 N ATOM 684 CA ASN A 67 2.121 2.240 -13.327 1.00 32.35 C ATOM 685 C ASN A 67 0.799 2.610 -12.660 1.00 23.33 C ATOM 686 O ASN A 67 0.425 3.781 -12.608 1.00 32.31 O ATOM 687 CB ASN A 67 1.867 1.784 -14.766 1.00 72.31 C ATOM 688 CG ASN A 67 1.387 2.915 -15.655 1.00 71.13 C ATOM 689 OD1 ASN A 67 0.583 3.748 -15.237 1.00 43.43 O ATOM 690 ND2 ASN A 67 1.880 2.946 -16.888 1.00 33.01 N ATOM 0 H ASN A 67 2.848 0.292 -13.054 1.00 70.53 H new ATOM 0 HA ASN A 67 2.762 3.122 -13.339 1.00 32.35 H new ATOM 0 HB2 ASN A 67 2.785 1.366 -15.179 1.00 72.31 H new ATOM 0 HB3 ASN A 67 1.125 0.986 -14.766 1.00 72.31 H new ATOM 0 HD21 ASN A 67 1.594 3.683 -17.533 1.00 33.01 H new ATOM 0 HD22 ASN A 67 2.544 2.233 -17.190 1.00 33.01 H new ATOM 697 N ALA A 68 0.098 1.603 -12.149 1.00 54.11 N ATOM 698 CA ALA A 68 -1.180 1.822 -11.483 1.00 24.32 C ATOM 699 C ALA A 68 -1.000 2.635 -10.204 1.00 61.33 C ATOM 700 O ALA A 68 -1.805 3.515 -9.899 1.00 21.33 O ATOM 701 CB ALA A 68 -1.850 0.491 -11.174 1.00 63.01 C ATOM 0 H ALA A 68 0.394 0.627 -12.184 1.00 54.11 H new ATOM 0 HA ALA A 68 -1.820 2.390 -12.158 1.00 24.32 H new ATOM 0 HB1 ALA A 68 -2.803 0.670 -10.677 1.00 63.01 H new ATOM 0 HB2 ALA A 68 -2.022 -0.054 -12.102 1.00 63.01 H new ATOM 0 HB3 ALA A 68 -1.206 -0.098 -10.521 1.00 63.01 H new ATOM 707 N MET A 69 0.061 2.334 -9.462 1.00 41.43 N ATOM 708 CA MET A 69 0.345 3.038 -8.217 1.00 63.23 C ATOM 709 C MET A 69 0.523 4.533 -8.467 1.00 21.14 C ATOM 710 O MET A 69 -0.036 5.361 -7.749 1.00 55.45 O ATOM 711 CB MET A 69 1.603 2.467 -7.559 1.00 75.43 C ATOM 712 CG MET A 69 1.403 1.079 -6.971 1.00 10.22 C ATOM 713 SD MET A 69 1.766 1.015 -5.207 1.00 21.45 S ATOM 714 CE MET A 69 3.463 1.585 -5.188 1.00 61.30 C ATOM 0 H MET A 69 0.737 1.609 -9.701 1.00 41.43 H new ATOM 0 HA MET A 69 -0.503 2.897 -7.547 1.00 63.23 H new ATOM 0 HB2 MET A 69 2.404 2.428 -8.297 1.00 75.43 H new ATOM 0 HB3 MET A 69 1.930 3.144 -6.770 1.00 75.43 H new ATOM 0 HG2 MET A 69 0.373 0.763 -7.138 1.00 10.22 H new ATOM 0 HG3 MET A 69 2.043 0.370 -7.496 1.00 10.22 H new ATOM 0 HE1 MET A 69 4.097 0.826 -4.729 1.00 61.30 H new ATOM 0 HE2 MET A 69 3.797 1.768 -6.209 1.00 61.30 H new ATOM 0 HE3 MET A 69 3.530 2.509 -4.614 1.00 61.30 H new ATOM 724 N ASN A 70 1.305 4.869 -9.487 1.00 1.42 N ATOM 725 CA ASN A 70 1.558 6.266 -9.829 1.00 34.15 C ATOM 726 C ASN A 70 0.259 6.978 -10.196 1.00 2.12 C ATOM 727 O ASN A 70 0.053 8.138 -9.839 1.00 22.42 O ATOM 728 CB ASN A 70 2.548 6.356 -10.990 1.00 61.32 C ATOM 729 CG ASN A 70 3.013 7.777 -11.244 1.00 23.33 C ATOM 730 OD1 ASN A 70 3.886 8.291 -10.543 1.00 70.34 O ATOM 731 ND2 ASN A 70 2.430 8.420 -12.249 1.00 11.15 N ATOM 0 H ASN A 70 1.775 4.195 -10.091 1.00 1.42 H new ATOM 0 HA ASN A 70 1.987 6.758 -8.956 1.00 34.15 H new ATOM 0 HB2 ASN A 70 3.412 5.726 -10.777 1.00 61.32 H new ATOM 0 HB3 ASN A 70 2.082 5.962 -11.893 1.00 61.32 H new ATOM 0 HD21 ASN A 70 2.701 9.379 -12.467 1.00 11.15 H new ATOM 0 HD22 ASN A 70 1.711 7.955 -12.803 1.00 11.15 H new ATOM 738 N SER A 71 -0.614 6.275 -10.911 1.00 13.45 N ATOM 739 CA SER A 71 -1.891 6.840 -11.329 1.00 24.25 C ATOM 740 C SER A 71 -2.814 7.041 -10.131 1.00 13.13 C ATOM 741 O SER A 71 -3.551 8.026 -10.059 1.00 34.05 O ATOM 742 CB SER A 71 -2.563 5.930 -12.358 1.00 32.04 C ATOM 743 OG SER A 71 -1.812 5.875 -13.558 1.00 54.31 O ATOM 0 H SER A 71 -0.460 5.313 -11.213 1.00 13.45 H new ATOM 0 HA SER A 71 -1.699 7.811 -11.785 1.00 24.25 H new ATOM 0 HB2 SER A 71 -2.670 4.927 -11.946 1.00 32.04 H new ATOM 0 HB3 SER A 71 -3.568 6.296 -12.570 1.00 32.04 H new ATOM 0 HG SER A 71 -1.049 5.272 -13.439 1.00 54.31 H new ATOM 749 N LEU A 72 -2.769 6.103 -9.193 1.00 31.24 N ATOM 750 CA LEU A 72 -3.601 6.174 -7.997 1.00 13.25 C ATOM 751 C LEU A 72 -3.169 7.332 -7.101 1.00 62.53 C ATOM 752 O LEU A 72 -4.000 8.109 -6.630 1.00 11.32 O ATOM 753 CB LEU A 72 -3.527 4.859 -7.220 1.00 23.30 C ATOM 754 CG LEU A 72 -4.781 4.471 -6.435 1.00 22.31 C ATOM 755 CD1 LEU A 72 -4.526 3.220 -5.607 1.00 42.53 C ATOM 756 CD2 LEU A 72 -5.230 5.620 -5.545 1.00 13.32 C ATOM 0 H LEU A 72 -2.164 5.283 -9.237 1.00 31.24 H new ATOM 0 HA LEU A 72 -4.631 6.345 -8.311 1.00 13.25 H new ATOM 0 HB2 LEU A 72 -3.300 4.057 -7.923 1.00 23.30 H new ATOM 0 HB3 LEU A 72 -2.691 4.918 -6.524 1.00 23.30 H new ATOM 0 HG LEU A 72 -5.579 4.255 -7.145 1.00 22.31 H new ATOM 0 HD11 LEU A 72 -5.429 2.959 -5.055 1.00 42.53 H new ATOM 0 HD12 LEU A 72 -4.253 2.396 -6.267 1.00 42.53 H new ATOM 0 HD13 LEU A 72 -3.713 3.408 -4.905 1.00 42.53 H new ATOM 0 HD21 LEU A 72 -6.123 5.326 -4.994 1.00 13.32 H new ATOM 0 HD22 LEU A 72 -4.435 5.867 -4.842 1.00 13.32 H new ATOM 0 HD23 LEU A 72 -5.454 6.491 -6.161 1.00 13.32 H new ATOM 768 N LEU A 73 -1.865 7.442 -6.874 1.00 14.40 N ATOM 769 CA LEU A 73 -1.322 8.507 -6.038 1.00 41.41 C ATOM 770 C LEU A 73 -1.494 9.868 -6.707 1.00 31.32 C ATOM 771 O LEU A 73 -1.529 10.899 -6.039 1.00 31.54 O ATOM 772 CB LEU A 73 0.158 8.251 -5.750 1.00 64.43 C ATOM 773 CG LEU A 73 0.464 7.380 -4.532 1.00 44.02 C ATOM 774 CD1 LEU A 73 -0.314 6.076 -4.598 1.00 2.42 C ATOM 775 CD2 LEU A 73 1.959 7.107 -4.432 1.00 12.53 C ATOM 0 H LEU A 73 -1.164 6.807 -7.257 1.00 14.40 H new ATOM 0 HA LEU A 73 -1.873 8.514 -5.098 1.00 41.41 H new ATOM 0 HB2 LEU A 73 0.602 7.782 -6.628 1.00 64.43 H new ATOM 0 HB3 LEU A 73 0.653 9.213 -5.617 1.00 64.43 H new ATOM 0 HG LEU A 73 0.153 7.920 -3.637 1.00 44.02 H new ATOM 0 HD11 LEU A 73 -0.083 5.470 -3.722 1.00 2.42 H new ATOM 0 HD12 LEU A 73 -1.382 6.290 -4.619 1.00 2.42 H new ATOM 0 HD13 LEU A 73 -0.035 5.531 -5.500 1.00 2.42 H new ATOM 0 HD21 LEU A 73 2.158 6.485 -3.559 1.00 12.53 H new ATOM 0 HD22 LEU A 73 2.295 6.589 -5.330 1.00 12.53 H new ATOM 0 HD23 LEU A 73 2.496 8.051 -4.335 1.00 12.53 H new ATOM 787 N GLY A 74 -1.602 9.859 -8.033 1.00 11.42 N ATOM 788 CA GLY A 74 -1.772 11.097 -8.770 1.00 12.01 C ATOM 789 C GLY A 74 -3.196 11.615 -8.716 1.00 65.41 C ATOM 790 O GLY A 74 -3.445 12.791 -8.975 1.00 74.01 O ATOM 0 H GLY A 74 -1.575 9.017 -8.608 1.00 11.42 H new ATOM 0 HA2 GLY A 74 -1.099 11.852 -8.365 1.00 12.01 H new ATOM 0 HA3 GLY A 74 -1.486 10.939 -9.810 1.00 12.01 H new ATOM 794 N ALA A 75 -4.131 10.733 -8.379 1.00 4.14 N ATOM 795 CA ALA A 75 -5.538 11.107 -8.290 1.00 20.30 C ATOM 796 C ALA A 75 -5.791 12.006 -7.085 1.00 10.23 C ATOM 797 O ALA A 75 -6.399 13.069 -7.208 1.00 52.40 O ATOM 798 CB ALA A 75 -6.411 9.864 -8.218 1.00 30.31 C ATOM 0 H ALA A 75 -3.940 9.755 -8.163 1.00 4.14 H new ATOM 0 HA ALA A 75 -5.798 11.667 -9.188 1.00 20.30 H new ATOM 0 HB1 ALA A 75 -7.458 10.158 -8.152 1.00 30.31 H new ATOM 0 HB2 ALA A 75 -6.259 9.261 -9.113 1.00 30.31 H new ATOM 0 HB3 ALA A 75 -6.142 9.281 -7.337 1.00 30.31 H new ATOM 804 N VAL A 76 -5.322 11.572 -5.919 1.00 71.51 N ATOM 805 CA VAL A 76 -5.499 12.338 -4.690 1.00 63.42 C ATOM 806 C VAL A 76 -4.699 13.634 -4.732 1.00 12.41 C ATOM 807 O VAL A 76 -5.148 14.670 -4.241 1.00 72.41 O ATOM 808 CB VAL A 76 -5.070 11.523 -3.455 1.00 13.34 C ATOM 809 CG1 VAL A 76 -3.620 11.084 -3.581 1.00 40.13 C ATOM 810 CG2 VAL A 76 -5.283 12.332 -2.184 1.00 55.32 C ATOM 0 H VAL A 76 -4.817 10.694 -5.799 1.00 71.51 H new ATOM 0 HA VAL A 76 -6.561 12.572 -4.612 1.00 63.42 H new ATOM 0 HB VAL A 76 -5.690 10.629 -3.398 1.00 13.34 H new ATOM 0 HG11 VAL A 76 -3.336 10.510 -2.699 1.00 40.13 H new ATOM 0 HG12 VAL A 76 -3.503 10.465 -4.470 1.00 40.13 H new ATOM 0 HG13 VAL A 76 -2.980 11.962 -3.664 1.00 40.13 H new ATOM 0 HG21 VAL A 76 -4.975 11.742 -1.321 1.00 55.32 H new ATOM 0 HG22 VAL A 76 -4.689 13.245 -2.230 1.00 55.32 H new ATOM 0 HG23 VAL A 76 -6.338 12.590 -2.089 1.00 55.32 H new ATOM 820 N SER A 77 -3.509 13.572 -5.323 1.00 13.13 N ATOM 821 CA SER A 77 -2.644 14.741 -5.426 1.00 54.23 C ATOM 822 C SER A 77 -3.362 15.887 -6.134 1.00 24.05 C ATOM 823 O SER A 77 -3.203 17.051 -5.770 1.00 11.53 O ATOM 824 CB SER A 77 -1.360 14.387 -6.177 1.00 21.44 C ATOM 825 OG SER A 77 -0.667 15.554 -6.582 1.00 43.50 O ATOM 0 H SER A 77 -3.123 12.724 -5.738 1.00 13.13 H new ATOM 0 HA SER A 77 -2.388 15.064 -4.417 1.00 54.23 H new ATOM 0 HB2 SER A 77 -0.717 13.782 -5.538 1.00 21.44 H new ATOM 0 HB3 SER A 77 -1.601 13.782 -7.051 1.00 21.44 H new ATOM 0 HG SER A 77 0.151 15.300 -7.059 1.00 43.50 H new ATOM 831 N GLY A 78 -4.151 15.546 -7.147 1.00 70.42 N ATOM 832 CA GLY A 78 -4.880 16.556 -7.891 1.00 72.44 C ATOM 833 C GLY A 78 -6.292 16.752 -7.372 1.00 11.45 C ATOM 834 O GLY A 78 -6.894 17.807 -7.573 1.00 45.33 O ATOM 0 H GLY A 78 -4.299 14.588 -7.466 1.00 70.42 H new ATOM 0 HA2 GLY A 78 -4.342 17.502 -7.837 1.00 72.44 H new ATOM 0 HA3 GLY A 78 -4.919 16.271 -8.942 1.00 72.44 H new ATOM 838 N TYR A 79 -6.821 15.734 -6.704 1.00 20.14 N ATOM 839 CA TYR A 79 -8.171 15.796 -6.157 1.00 53.53 C ATOM 840 C TYR A 79 -8.234 16.750 -4.968 1.00 24.52 C ATOM 841 O TYR A 79 -9.272 17.350 -4.692 1.00 50.31 O ATOM 842 CB TYR A 79 -8.639 14.403 -5.734 1.00 64.41 C ATOM 843 CG TYR A 79 -9.438 13.684 -6.797 1.00 43.12 C ATOM 844 CD1 TYR A 79 -9.097 13.788 -8.141 1.00 12.15 C ATOM 845 CD2 TYR A 79 -10.533 12.897 -6.458 1.00 61.34 C ATOM 846 CE1 TYR A 79 -9.825 13.133 -9.115 1.00 14.12 C ATOM 847 CE2 TYR A 79 -11.265 12.237 -7.426 1.00 70.04 C ATOM 848 CZ TYR A 79 -10.908 12.359 -8.753 1.00 73.13 C ATOM 849 OH TYR A 79 -11.634 11.704 -9.721 1.00 23.31 O ATOM 0 H TYR A 79 -6.335 14.855 -6.528 1.00 20.14 H new ATOM 0 HA TYR A 79 -8.834 16.172 -6.937 1.00 53.53 H new ATOM 0 HB2 TYR A 79 -7.769 13.800 -5.475 1.00 64.41 H new ATOM 0 HB3 TYR A 79 -9.246 14.491 -4.833 1.00 64.41 H new ATOM 0 HD1 TYR A 79 -8.248 14.391 -8.428 1.00 12.15 H new ATOM 0 HD2 TYR A 79 -10.816 12.800 -5.420 1.00 61.34 H new ATOM 0 HE1 TYR A 79 -9.548 13.226 -10.155 1.00 14.12 H new ATOM 0 HE2 TYR A 79 -12.112 11.629 -7.145 1.00 70.04 H new ATOM 0 HH TYR A 79 -12.363 11.202 -9.300 1.00 23.31 H new ATOM 859 N VAL A 80 -7.113 16.883 -4.267 1.00 5.55 N ATOM 860 CA VAL A 80 -7.038 17.762 -3.105 1.00 44.43 C ATOM 861 C VAL A 80 -7.378 19.200 -3.484 1.00 32.25 C ATOM 862 O VAL A 80 -8.007 19.924 -2.711 1.00 22.43 O ATOM 863 CB VAL A 80 -5.636 17.731 -2.467 1.00 72.10 C ATOM 864 CG1 VAL A 80 -5.336 16.349 -1.905 1.00 55.10 C ATOM 865 CG2 VAL A 80 -4.579 18.143 -3.480 1.00 55.13 C ATOM 0 H VAL A 80 -6.244 16.394 -4.483 1.00 5.55 H new ATOM 0 HA VAL A 80 -7.767 17.395 -2.382 1.00 44.43 H new ATOM 0 HB VAL A 80 -5.615 18.445 -1.644 1.00 72.10 H new ATOM 0 HG11 VAL A 80 -4.342 16.346 -1.458 1.00 55.10 H new ATOM 0 HG12 VAL A 80 -6.076 16.097 -1.145 1.00 55.10 H new ATOM 0 HG13 VAL A 80 -5.375 15.613 -2.708 1.00 55.10 H new ATOM 0 HG21 VAL A 80 -3.595 18.115 -3.011 1.00 55.13 H new ATOM 0 HG22 VAL A 80 -4.598 17.455 -4.325 1.00 55.13 H new ATOM 0 HG23 VAL A 80 -4.785 19.154 -3.830 1.00 55.13 H new ATOM 875 N SER A 81 -6.961 19.607 -4.678 1.00 73.02 N ATOM 876 CA SER A 81 -7.220 20.960 -5.158 1.00 34.35 C ATOM 877 C SER A 81 -8.716 21.265 -5.144 1.00 63.30 C ATOM 878 O SER A 81 -9.137 22.346 -4.734 1.00 4.13 O ATOM 879 CB SER A 81 -6.665 21.136 -6.573 1.00 75.25 C ATOM 880 OG SER A 81 -5.978 22.368 -6.701 1.00 42.33 O ATOM 0 H SER A 81 -6.442 19.020 -5.331 1.00 73.02 H new ATOM 0 HA SER A 81 -6.718 21.659 -4.489 1.00 34.35 H new ATOM 0 HB2 SER A 81 -5.989 20.313 -6.807 1.00 75.25 H new ATOM 0 HB3 SER A 81 -7.481 21.094 -7.295 1.00 75.25 H new ATOM 0 HG SER A 81 -5.631 22.456 -7.613 1.00 42.33 H new ATOM 886 N THR A 82 -9.513 20.302 -5.597 1.00 52.22 N ATOM 887 CA THR A 82 -10.960 20.465 -5.638 1.00 55.04 C ATOM 888 C THR A 82 -11.595 20.094 -4.303 1.00 73.21 C ATOM 889 O THR A 82 -12.705 20.525 -3.990 1.00 11.05 O ATOM 890 CB THR A 82 -11.592 19.607 -6.751 1.00 51.34 C ATOM 891 OG1 THR A 82 -10.568 18.918 -7.478 1.00 34.14 O ATOM 892 CG2 THR A 82 -12.406 20.469 -7.704 1.00 43.22 C ATOM 0 H THR A 82 -9.180 19.401 -5.941 1.00 52.22 H new ATOM 0 HA THR A 82 -11.152 21.517 -5.848 1.00 55.04 H new ATOM 0 HB THR A 82 -12.259 18.881 -6.286 1.00 51.34 H new ATOM 0 HG1 THR A 82 -10.977 18.373 -8.183 1.00 34.14 H new ATOM 0 HG21 THR A 82 -12.842 19.841 -8.481 1.00 43.22 H new ATOM 0 HG22 THR A 82 -13.202 20.969 -7.152 1.00 43.22 H new ATOM 0 HG23 THR A 82 -11.758 21.216 -8.163 1.00 43.22 H new ATOM 900 N LEU A 83 -10.883 19.291 -3.519 1.00 74.03 N ATOM 901 CA LEU A 83 -11.377 18.861 -2.216 1.00 44.35 C ATOM 902 C LEU A 83 -11.822 20.056 -1.380 1.00 44.51 C ATOM 903 O LEU A 83 -12.806 19.983 -0.645 1.00 20.20 O ATOM 904 CB LEU A 83 -10.292 18.079 -1.471 1.00 75.03 C ATOM 905 CG LEU A 83 -10.785 17.088 -0.416 1.00 32.22 C ATOM 906 CD1 LEU A 83 -11.457 17.822 0.734 1.00 54.32 C ATOM 907 CD2 LEU A 83 -11.739 16.078 -1.036 1.00 74.52 C ATOM 0 H LEU A 83 -9.963 18.925 -3.763 1.00 74.03 H new ATOM 0 HA LEU A 83 -12.239 18.213 -2.377 1.00 44.35 H new ATOM 0 HB2 LEU A 83 -9.697 17.533 -2.204 1.00 75.03 H new ATOM 0 HB3 LEU A 83 -9.625 18.793 -0.987 1.00 75.03 H new ATOM 0 HG LEU A 83 -9.923 16.549 -0.022 1.00 32.22 H new ATOM 0 HD11 LEU A 83 -11.801 17.100 1.475 1.00 54.32 H new ATOM 0 HD12 LEU A 83 -10.744 18.504 1.196 1.00 54.32 H new ATOM 0 HD13 LEU A 83 -12.308 18.388 0.356 1.00 54.32 H new ATOM 0 HD21 LEU A 83 -12.079 15.381 -0.270 1.00 74.52 H new ATOM 0 HD22 LEU A 83 -12.597 16.600 -1.459 1.00 74.52 H new ATOM 0 HD23 LEU A 83 -11.225 15.528 -1.824 1.00 74.52 H new ATOM 919 N GLY A 84 -11.090 21.161 -1.499 1.00 44.35 N ATOM 920 CA GLY A 84 -11.426 22.357 -0.750 1.00 41.13 C ATOM 921 C GLY A 84 -10.403 22.677 0.323 1.00 45.20 C ATOM 922 O GLY A 84 -9.548 21.850 0.641 1.00 52.34 O ATOM 0 H GLY A 84 -10.271 21.248 -2.101 1.00 44.35 H new ATOM 0 HA2 GLY A 84 -11.505 23.201 -1.435 1.00 41.13 H new ATOM 0 HA3 GLY A 84 -12.405 22.229 -0.288 1.00 41.13 H new ATOM 926 N ASN A 85 -10.489 23.879 0.880 1.00 1.53 N ATOM 927 CA ASN A 85 -9.563 24.307 1.923 1.00 62.13 C ATOM 928 C ASN A 85 -9.860 23.597 3.240 1.00 22.33 C ATOM 929 O ASN A 85 -8.989 23.473 4.101 1.00 52.12 O ATOM 930 CB ASN A 85 -9.645 25.822 2.118 1.00 1.53 C ATOM 931 CG ASN A 85 -10.828 26.232 2.973 1.00 1.22 C ATOM 932 OD1 ASN A 85 -11.948 26.366 2.480 1.00 11.10 O ATOM 933 ND2 ASN A 85 -10.584 26.432 4.263 1.00 53.43 N ATOM 0 H ASN A 85 -11.190 24.575 0.627 1.00 1.53 H new ATOM 0 HA ASN A 85 -8.554 24.042 1.608 1.00 62.13 H new ATOM 0 HB2 ASN A 85 -8.725 26.176 2.582 1.00 1.53 H new ATOM 0 HB3 ASN A 85 -9.718 26.307 1.145 1.00 1.53 H new ATOM 0 HD21 ASN A 85 -11.341 26.708 4.888 1.00 53.43 H new ATOM 0 HD22 ASN A 85 -9.640 26.309 4.628 1.00 53.43 H new ATOM 940 N ALA A 86 -11.096 23.132 3.389 1.00 4.04 N ATOM 941 CA ALA A 86 -11.508 22.431 4.600 1.00 52.22 C ATOM 942 C ALA A 86 -10.948 21.013 4.631 1.00 53.02 C ATOM 943 O ALA A 86 -11.569 20.080 4.122 1.00 61.44 O ATOM 944 CB ALA A 86 -13.025 22.405 4.704 1.00 33.13 C ATOM 0 H ALA A 86 -11.830 23.228 2.687 1.00 4.04 H new ATOM 0 HA ALA A 86 -11.106 22.970 5.458 1.00 52.22 H new ATOM 0 HB1 ALA A 86 -13.318 21.879 5.612 1.00 33.13 H new ATOM 0 HB2 ALA A 86 -13.405 23.426 4.737 1.00 33.13 H new ATOM 0 HB3 ALA A 86 -13.440 21.891 3.837 1.00 33.13 H new ATOM 950 N ILE A 87 -9.773 20.859 5.232 1.00 50.31 N ATOM 951 CA ILE A 87 -9.132 19.554 5.329 1.00 64.03 C ATOM 952 C ILE A 87 -9.459 18.878 6.656 1.00 21.44 C ATOM 953 O ILE A 87 -9.316 17.663 6.797 1.00 52.11 O ATOM 954 CB ILE A 87 -7.602 19.667 5.187 1.00 3.33 C ATOM 955 CG1 ILE A 87 -7.240 20.744 4.163 1.00 2.45 C ATOM 956 CG2 ILE A 87 -7.006 18.326 4.786 1.00 54.30 C ATOM 957 CD1 ILE A 87 -7.846 20.507 2.797 1.00 2.32 C ATOM 0 H ILE A 87 -9.246 21.621 5.659 1.00 50.31 H new ATOM 0 HA ILE A 87 -9.522 18.949 4.510 1.00 64.03 H new ATOM 0 HB ILE A 87 -7.184 19.955 6.152 1.00 3.33 H new ATOM 0 HG12 ILE A 87 -7.571 21.714 4.535 1.00 2.45 H new ATOM 0 HG13 ILE A 87 -6.155 20.793 4.067 1.00 2.45 H new ATOM 0 HG21 ILE A 87 -5.925 18.423 4.690 1.00 54.30 H new ATOM 0 HG22 ILE A 87 -7.237 17.582 5.549 1.00 54.30 H new ATOM 0 HG23 ILE A 87 -7.428 18.011 3.832 1.00 54.30 H new ATOM 0 HD11 ILE A 87 -7.547 21.309 2.122 1.00 2.32 H new ATOM 0 HD12 ILE A 87 -7.495 19.553 2.404 1.00 2.32 H new ATOM 0 HD13 ILE A 87 -8.933 20.488 2.879 1.00 2.32 H new ATOM 969 N SER A 88 -9.902 19.672 7.625 1.00 45.20 N ATOM 970 CA SER A 88 -10.250 19.151 8.943 1.00 63.55 C ATOM 971 C SER A 88 -11.220 17.980 8.824 1.00 53.21 C ATOM 972 O SER A 88 -11.240 17.087 9.670 1.00 32.14 O ATOM 973 CB SER A 88 -10.864 20.253 9.804 1.00 52.40 C ATOM 974 OG SER A 88 -12.255 20.378 9.560 1.00 71.34 O ATOM 0 H SER A 88 -10.029 20.679 7.523 1.00 45.20 H new ATOM 0 HA SER A 88 -9.336 18.796 9.420 1.00 63.55 H new ATOM 0 HB2 SER A 88 -10.695 20.032 10.858 1.00 52.40 H new ATOM 0 HB3 SER A 88 -10.368 21.201 9.594 1.00 52.40 H new ATOM 0 HG SER A 88 -12.624 21.089 10.125 1.00 71.34 H new ATOM 980 N ASP A 89 -12.026 17.992 7.767 1.00 43.42 N ATOM 981 CA ASP A 89 -13.000 16.932 7.536 1.00 63.44 C ATOM 982 C ASP A 89 -12.338 15.715 6.897 1.00 74.35 C ATOM 983 O ASP A 89 -12.018 15.723 5.708 1.00 32.52 O ATOM 984 CB ASP A 89 -14.134 17.438 6.643 1.00 53.43 C ATOM 985 CG ASP A 89 -14.753 18.721 7.163 1.00 24.34 C ATOM 986 OD1 ASP A 89 -14.232 19.808 6.836 1.00 1.14 O ATOM 987 OD2 ASP A 89 -15.758 18.637 7.899 1.00 43.41 O ATOM 0 H ASP A 89 -12.024 18.724 7.057 1.00 43.42 H new ATOM 0 HA ASP A 89 -13.412 16.635 8.500 1.00 63.44 H new ATOM 0 HB2 ASP A 89 -13.752 17.605 5.636 1.00 53.43 H new ATOM 0 HB3 ASP A 89 -14.904 16.670 6.569 1.00 53.43 H new ATOM 992 N ALA A 90 -12.133 14.672 7.694 1.00 25.04 N ATOM 993 CA ALA A 90 -11.510 13.448 7.206 1.00 22.14 C ATOM 994 C ALA A 90 -12.371 12.781 6.141 1.00 70.54 C ATOM 995 O ALA A 90 -11.857 12.264 5.148 1.00 40.42 O ATOM 996 CB ALA A 90 -11.257 12.489 8.361 1.00 72.53 C ATOM 0 H ALA A 90 -12.389 14.650 8.681 1.00 25.04 H new ATOM 0 HA ALA A 90 -10.555 13.711 6.751 1.00 22.14 H new ATOM 0 HB1 ALA A 90 -10.791 11.579 7.983 1.00 72.53 H new ATOM 0 HB2 ALA A 90 -10.595 12.961 9.087 1.00 72.53 H new ATOM 0 HB3 ALA A 90 -12.203 12.240 8.841 1.00 72.53 H new ATOM 1002 N SER A 91 -13.683 12.795 6.351 1.00 53.45 N ATOM 1003 CA SER A 91 -14.615 12.187 5.409 1.00 1.11 C ATOM 1004 C SER A 91 -14.513 12.850 4.039 1.00 20.11 C ATOM 1005 O SER A 91 -14.704 12.203 3.009 1.00 4.21 O ATOM 1006 CB SER A 91 -16.048 12.295 5.935 1.00 73.40 C ATOM 1007 OG SER A 91 -16.986 12.238 4.875 1.00 70.44 O ATOM 0 H SER A 91 -14.125 13.221 7.166 1.00 53.45 H new ATOM 0 HA SER A 91 -14.352 11.134 5.304 1.00 1.11 H new ATOM 0 HB2 SER A 91 -16.242 11.487 6.640 1.00 73.40 H new ATOM 0 HB3 SER A 91 -16.169 13.230 6.482 1.00 73.40 H new ATOM 0 HG SER A 91 -17.894 12.308 5.237 1.00 70.44 H new ATOM 1013 N ALA A 92 -14.210 14.143 4.036 1.00 4.12 N ATOM 1014 CA ALA A 92 -14.080 14.894 2.794 1.00 54.02 C ATOM 1015 C ALA A 92 -12.915 14.374 1.957 1.00 50.45 C ATOM 1016 O ALA A 92 -13.090 14.000 0.798 1.00 32.10 O ATOM 1017 CB ALA A 92 -13.900 16.376 3.090 1.00 74.14 C ATOM 0 H ALA A 92 -14.050 14.693 4.880 1.00 4.12 H new ATOM 0 HA ALA A 92 -14.996 14.758 2.218 1.00 54.02 H new ATOM 0 HB1 ALA A 92 -13.804 16.925 2.153 1.00 74.14 H new ATOM 0 HB2 ALA A 92 -14.766 16.745 3.640 1.00 74.14 H new ATOM 0 HB3 ALA A 92 -13.001 16.521 3.689 1.00 74.14 H new ATOM 1023 N TYR A 93 -11.727 14.355 2.552 1.00 14.33 N ATOM 1024 CA TYR A 93 -10.533 13.884 1.861 1.00 50.41 C ATOM 1025 C TYR A 93 -10.603 12.381 1.617 1.00 13.03 C ATOM 1026 O TYR A 93 -10.368 11.909 0.505 1.00 33.21 O ATOM 1027 CB TYR A 93 -9.282 14.225 2.671 1.00 21.20 C ATOM 1028 CG TYR A 93 -8.015 13.616 2.114 1.00 33.42 C ATOM 1029 CD1 TYR A 93 -7.696 12.285 2.353 1.00 53.53 C ATOM 1030 CD2 TYR A 93 -7.140 14.371 1.344 1.00 44.44 C ATOM 1031 CE1 TYR A 93 -6.539 11.726 1.846 1.00 21.41 C ATOM 1032 CE2 TYR A 93 -5.981 13.820 0.831 1.00 4.22 C ATOM 1033 CZ TYR A 93 -5.684 12.497 1.086 1.00 74.23 C ATOM 1034 OH TYR A 93 -4.533 11.942 0.577 1.00 52.31 O ATOM 0 H TYR A 93 -11.566 14.661 3.512 1.00 14.33 H new ATOM 0 HA TYR A 93 -10.480 14.387 0.896 1.00 50.41 H new ATOM 0 HB2 TYR A 93 -9.168 15.308 2.709 1.00 21.20 H new ATOM 0 HB3 TYR A 93 -9.419 13.883 3.697 1.00 21.20 H new ATOM 0 HD1 TYR A 93 -8.364 11.677 2.945 1.00 53.53 H new ATOM 0 HD2 TYR A 93 -7.369 15.407 1.143 1.00 44.44 H new ATOM 0 HE1 TYR A 93 -6.305 10.690 2.044 1.00 21.41 H new ATOM 0 HE2 TYR A 93 -5.312 14.422 0.234 1.00 4.22 H new ATOM 0 HH TYR A 93 -4.587 10.965 0.636 1.00 52.31 H new ATOM 1044 N ALA A 94 -10.928 11.632 2.666 1.00 24.14 N ATOM 1045 CA ALA A 94 -11.031 10.180 2.568 1.00 45.32 C ATOM 1046 C ALA A 94 -12.018 9.775 1.480 1.00 34.43 C ATOM 1047 O ALA A 94 -11.898 8.701 0.889 1.00 12.52 O ATOM 1048 CB ALA A 94 -11.444 9.590 3.906 1.00 31.54 C ATOM 0 H ALA A 94 -11.125 12.007 3.594 1.00 24.14 H new ATOM 0 HA ALA A 94 -10.051 9.786 2.298 1.00 45.32 H new ATOM 0 HB1 ALA A 94 -11.517 8.506 3.819 1.00 31.54 H new ATOM 0 HB2 ALA A 94 -10.700 9.844 4.661 1.00 31.54 H new ATOM 0 HB3 ALA A 94 -12.412 9.996 4.200 1.00 31.54 H new ATOM 1054 N ASN A 95 -12.995 10.637 1.220 1.00 12.14 N ATOM 1055 CA ASN A 95 -14.005 10.366 0.203 1.00 44.41 C ATOM 1056 C ASN A 95 -13.380 10.337 -1.188 1.00 72.21 C ATOM 1057 O ASN A 95 -13.729 9.496 -2.018 1.00 0.24 O ATOM 1058 CB ASN A 95 -15.109 11.424 0.256 1.00 32.23 C ATOM 1059 CG ASN A 95 -16.040 11.350 -0.938 1.00 65.51 C ATOM 1060 OD1 ASN A 95 -16.713 10.340 -1.151 1.00 74.42 O ATOM 1061 ND2 ASN A 95 -16.081 12.418 -1.724 1.00 52.31 N ATOM 0 H ASN A 95 -13.109 11.530 1.700 1.00 12.14 H new ATOM 0 HA ASN A 95 -14.439 9.387 0.408 1.00 44.41 H new ATOM 0 HB2 ASN A 95 -15.686 11.297 1.172 1.00 32.23 H new ATOM 0 HB3 ASN A 95 -14.657 12.415 0.300 1.00 32.23 H new ATOM 0 HD21 ASN A 95 -16.688 12.425 -2.544 1.00 52.31 H new ATOM 0 HD22 ASN A 95 -15.506 13.232 -1.508 1.00 52.31 H new ATOM 1068 N ALA A 96 -12.457 11.259 -1.437 1.00 21.42 N ATOM 1069 CA ALA A 96 -11.782 11.336 -2.727 1.00 3.35 C ATOM 1070 C ALA A 96 -10.843 10.151 -2.928 1.00 73.10 C ATOM 1071 O ALA A 96 -10.932 9.440 -3.929 1.00 21.45 O ATOM 1072 CB ALA A 96 -11.015 12.645 -2.843 1.00 23.35 C ATOM 0 H ALA A 96 -12.159 11.964 -0.762 1.00 21.42 H new ATOM 0 HA ALA A 96 -12.541 11.301 -3.509 1.00 3.35 H new ATOM 0 HB1 ALA A 96 -10.516 12.690 -3.811 1.00 23.35 H new ATOM 0 HB2 ALA A 96 -11.708 13.482 -2.753 1.00 23.35 H new ATOM 0 HB3 ALA A 96 -10.271 12.703 -2.048 1.00 23.35 H new ATOM 1078 N ILE A 97 -9.945 9.945 -1.971 1.00 53.20 N ATOM 1079 CA ILE A 97 -8.990 8.845 -2.044 1.00 14.24 C ATOM 1080 C ILE A 97 -9.706 7.499 -2.084 1.00 1.15 C ATOM 1081 O ILE A 97 -9.227 6.548 -2.703 1.00 54.52 O ATOM 1082 CB ILE A 97 -8.020 8.863 -0.849 1.00 4.20 C ATOM 1083 CG1 ILE A 97 -6.891 7.854 -1.068 1.00 24.14 C ATOM 1084 CG2 ILE A 97 -8.764 8.562 0.443 1.00 24.13 C ATOM 1085 CD1 ILE A 97 -5.531 8.368 -0.649 1.00 22.02 C ATOM 0 H ILE A 97 -9.858 10.525 -1.136 1.00 53.20 H new ATOM 0 HA ILE A 97 -8.422 8.979 -2.964 1.00 14.24 H new ATOM 0 HB ILE A 97 -7.583 9.858 -0.769 1.00 4.20 H new ATOM 0 HG12 ILE A 97 -7.114 6.945 -0.510 1.00 24.14 H new ATOM 0 HG13 ILE A 97 -6.858 7.581 -2.123 1.00 24.14 H new ATOM 0 HG21 ILE A 97 -8.064 8.578 1.278 1.00 24.13 H new ATOM 0 HG22 ILE A 97 -9.536 9.315 0.602 1.00 24.13 H new ATOM 0 HG23 ILE A 97 -9.226 7.577 0.376 1.00 24.13 H new ATOM 0 HD11 ILE A 97 -4.779 7.600 -0.833 1.00 22.02 H new ATOM 0 HD12 ILE A 97 -5.286 9.261 -1.225 1.00 22.02 H new ATOM 0 HD13 ILE A 97 -5.546 8.614 0.413 1.00 22.02 H new ATOM 1097 N SER A 98 -10.855 7.426 -1.420 1.00 61.31 N ATOM 1098 CA SER A 98 -11.637 6.195 -1.378 1.00 3.12 C ATOM 1099 C SER A 98 -12.027 5.751 -2.784 1.00 30.53 C ATOM 1100 O SER A 98 -11.985 4.563 -3.106 1.00 44.53 O ATOM 1101 CB SER A 98 -12.891 6.391 -0.525 1.00 33.42 C ATOM 1102 OG SER A 98 -13.846 5.376 -0.781 1.00 32.33 O ATOM 0 H SER A 98 -11.265 8.204 -0.904 1.00 61.31 H new ATOM 0 HA SER A 98 -11.020 5.417 -0.929 1.00 3.12 H new ATOM 0 HB2 SER A 98 -12.621 6.383 0.531 1.00 33.42 H new ATOM 0 HB3 SER A 98 -13.328 7.367 -0.735 1.00 33.42 H new ATOM 0 HG SER A 98 -13.535 4.530 -0.398 1.00 32.33 H new ATOM 1108 N SER A 99 -12.409 6.714 -3.617 1.00 30.32 N ATOM 1109 CA SER A 99 -12.812 6.423 -4.987 1.00 51.05 C ATOM 1110 C SER A 99 -11.620 5.956 -5.817 1.00 4.12 C ATOM 1111 O SER A 99 -11.756 5.102 -6.693 1.00 73.04 O ATOM 1112 CB SER A 99 -13.440 7.662 -5.630 1.00 53.13 C ATOM 1113 OG SER A 99 -14.634 7.329 -6.317 1.00 53.32 O ATOM 0 H SER A 99 -12.448 7.702 -3.367 1.00 30.32 H new ATOM 0 HA SER A 99 -13.550 5.621 -4.960 1.00 51.05 H new ATOM 0 HB2 SER A 99 -13.654 8.406 -4.862 1.00 53.13 H new ATOM 0 HB3 SER A 99 -12.731 8.115 -6.324 1.00 53.13 H new ATOM 0 HG SER A 99 -15.017 8.137 -6.718 1.00 53.32 H new ATOM 1119 N ALA A 100 -10.451 6.520 -5.533 1.00 11.51 N ATOM 1120 CA ALA A 100 -9.235 6.162 -6.250 1.00 44.11 C ATOM 1121 C ALA A 100 -8.815 4.729 -5.937 1.00 51.31 C ATOM 1122 O ALA A 100 -8.640 3.912 -6.840 1.00 64.43 O ATOM 1123 CB ALA A 100 -8.113 7.130 -5.905 1.00 62.32 C ATOM 0 H ALA A 100 -10.321 7.228 -4.810 1.00 11.51 H new ATOM 0 HA ALA A 100 -9.440 6.228 -7.318 1.00 44.11 H new ATOM 0 HB1 ALA A 100 -7.211 6.850 -6.448 1.00 62.32 H new ATOM 0 HB2 ALA A 100 -8.406 8.142 -6.186 1.00 62.32 H new ATOM 0 HB3 ALA A 100 -7.917 7.093 -4.833 1.00 62.32 H new ATOM 1129 N ILE A 101 -8.657 4.432 -4.651 1.00 42.42 N ATOM 1130 CA ILE A 101 -8.258 3.098 -4.219 1.00 54.21 C ATOM 1131 C ILE A 101 -9.360 2.080 -4.495 1.00 43.11 C ATOM 1132 O ILE A 101 -9.089 0.965 -4.942 1.00 53.02 O ATOM 1133 CB ILE A 101 -7.915 3.072 -2.718 1.00 30.21 C ATOM 1134 CG1 ILE A 101 -6.944 4.204 -2.374 1.00 30.11 C ATOM 1135 CG2 ILE A 101 -7.322 1.725 -2.335 1.00 32.14 C ATOM 1136 CD1 ILE A 101 -6.545 4.236 -0.916 1.00 61.32 C ATOM 0 H ILE A 101 -8.799 5.097 -3.891 1.00 42.42 H new ATOM 0 HA ILE A 101 -7.369 2.833 -4.791 1.00 54.21 H new ATOM 0 HB ILE A 101 -8.832 3.220 -2.148 1.00 30.21 H new ATOM 0 HG12 ILE A 101 -6.047 4.101 -2.985 1.00 30.11 H new ATOM 0 HG13 ILE A 101 -7.402 5.157 -2.638 1.00 30.11 H new ATOM 0 HG21 ILE A 101 -7.084 1.721 -1.271 1.00 32.14 H new ATOM 0 HG22 ILE A 101 -8.043 0.936 -2.549 1.00 32.14 H new ATOM 0 HG23 ILE A 101 -6.413 1.551 -2.910 1.00 32.14 H new ATOM 0 HD11 ILE A 101 -5.856 5.063 -0.745 1.00 61.32 H new ATOM 0 HD12 ILE A 101 -7.433 4.370 -0.299 1.00 61.32 H new ATOM 0 HD13 ILE A 101 -6.058 3.298 -0.651 1.00 61.32 H new ATOM 1148 N GLY A 102 -10.601 2.472 -4.228 1.00 24.11 N ATOM 1149 CA GLY A 102 -11.724 1.581 -4.455 1.00 11.22 C ATOM 1150 C GLY A 102 -11.858 1.176 -5.910 1.00 52.30 C ATOM 1151 O GLY A 102 -12.315 0.076 -6.215 1.00 24.51 O ATOM 0 H GLY A 102 -10.849 3.390 -3.859 1.00 24.11 H new ATOM 0 HA2 GLY A 102 -11.605 0.688 -3.842 1.00 11.22 H new ATOM 0 HA3 GLY A 102 -12.643 2.070 -4.131 1.00 11.22 H new ATOM 1155 N ASN A 103 -11.458 2.068 -6.810 1.00 52.41 N ATOM 1156 CA ASN A 103 -11.537 1.797 -8.241 1.00 13.40 C ATOM 1157 C ASN A 103 -10.571 0.686 -8.638 1.00 70.24 C ATOM 1158 O ASN A 103 -10.954 -0.274 -9.308 1.00 10.41 O ATOM 1159 CB ASN A 103 -11.229 3.066 -9.039 1.00 51.20 C ATOM 1160 CG ASN A 103 -12.482 3.832 -9.415 1.00 71.50 C ATOM 1161 OD1 ASN A 103 -13.514 3.720 -8.751 1.00 71.45 O ATOM 1162 ND2 ASN A 103 -12.399 4.616 -10.484 1.00 31.53 N ATOM 0 H ASN A 103 -11.076 2.984 -6.574 1.00 52.41 H new ATOM 0 HA ASN A 103 -12.552 1.470 -8.468 1.00 13.40 H new ATOM 0 HB2 ASN A 103 -10.575 3.711 -8.452 1.00 51.20 H new ATOM 0 HB3 ASN A 103 -10.684 2.799 -9.945 1.00 51.20 H new ATOM 0 HD21 ASN A 103 -13.210 5.156 -10.785 1.00 31.53 H new ATOM 0 HD22 ASN A 103 -11.524 4.678 -11.004 1.00 31.53 H new ATOM 1169 N VAL A 104 -9.316 0.821 -8.221 1.00 55.21 N ATOM 1170 CA VAL A 104 -8.296 -0.171 -8.533 1.00 1.04 C ATOM 1171 C VAL A 104 -8.533 -1.463 -7.760 1.00 24.42 C ATOM 1172 O VAL A 104 -8.297 -2.559 -8.272 1.00 51.42 O ATOM 1173 CB VAL A 104 -6.884 0.354 -8.209 1.00 72.22 C ATOM 1174 CG1 VAL A 104 -6.787 0.757 -6.746 1.00 44.03 C ATOM 1175 CG2 VAL A 104 -5.835 -0.691 -8.555 1.00 63.31 C ATOM 0 H VAL A 104 -8.982 1.609 -7.666 1.00 55.21 H new ATOM 0 HA VAL A 104 -8.366 -0.371 -9.602 1.00 1.04 H new ATOM 0 HB VAL A 104 -6.695 1.239 -8.817 1.00 72.22 H new ATOM 0 HG11 VAL A 104 -5.783 1.125 -6.536 1.00 44.03 H new ATOM 0 HG12 VAL A 104 -7.513 1.543 -6.536 1.00 44.03 H new ATOM 0 HG13 VAL A 104 -6.996 -0.108 -6.116 1.00 44.03 H new ATOM 0 HG21 VAL A 104 -4.844 -0.303 -8.320 1.00 63.31 H new ATOM 0 HG22 VAL A 104 -6.018 -1.596 -7.975 1.00 63.31 H new ATOM 0 HG23 VAL A 104 -5.890 -0.924 -9.618 1.00 63.31 H new ATOM 1185 N LEU A 105 -9.002 -1.331 -6.524 1.00 53.42 N ATOM 1186 CA LEU A 105 -9.274 -2.487 -5.680 1.00 23.40 C ATOM 1187 C LEU A 105 -10.358 -3.368 -6.292 1.00 14.21 C ATOM 1188 O LEU A 105 -10.227 -4.590 -6.340 1.00 13.03 O ATOM 1189 CB LEU A 105 -9.698 -2.036 -4.281 1.00 73.54 C ATOM 1190 CG LEU A 105 -8.609 -2.065 -3.207 1.00 15.31 C ATOM 1191 CD1 LEU A 105 -7.310 -1.489 -3.748 1.00 24.31 C ATOM 1192 CD2 LEU A 105 -9.061 -1.301 -1.971 1.00 24.24 C ATOM 0 H LEU A 105 -9.202 -0.433 -6.084 1.00 53.42 H new ATOM 0 HA LEU A 105 -8.357 -3.071 -5.604 1.00 23.40 H new ATOM 0 HB2 LEU A 105 -10.085 -1.019 -4.351 1.00 73.54 H new ATOM 0 HB3 LEU A 105 -10.522 -2.669 -3.951 1.00 73.54 H new ATOM 0 HG LEU A 105 -8.431 -3.102 -2.924 1.00 15.31 H new ATOM 0 HD11 LEU A 105 -6.547 -1.518 -2.970 1.00 24.31 H new ATOM 0 HD12 LEU A 105 -6.979 -2.078 -4.603 1.00 24.31 H new ATOM 0 HD13 LEU A 105 -7.471 -0.457 -4.060 1.00 24.31 H new ATOM 0 HD21 LEU A 105 -8.275 -1.331 -1.217 1.00 24.24 H new ATOM 0 HD22 LEU A 105 -9.267 -0.265 -2.239 1.00 24.24 H new ATOM 0 HD23 LEU A 105 -9.966 -1.759 -1.571 1.00 24.24 H new ATOM 1204 N ALA A 106 -11.429 -2.736 -6.763 1.00 73.43 N ATOM 1205 CA ALA A 106 -12.535 -3.461 -7.377 1.00 60.21 C ATOM 1206 C ALA A 106 -12.104 -4.113 -8.687 1.00 0.34 C ATOM 1207 O ALA A 106 -12.411 -5.275 -8.943 1.00 34.35 O ATOM 1208 CB ALA A 106 -13.713 -2.527 -7.613 1.00 64.53 C ATOM 0 H ALA A 106 -11.554 -1.724 -6.731 1.00 73.43 H new ATOM 0 HA ALA A 106 -12.843 -4.251 -6.692 1.00 60.21 H new ATOM 0 HB1 ALA A 106 -14.531 -3.082 -8.072 1.00 64.53 H new ATOM 0 HB2 ALA A 106 -14.045 -2.112 -6.661 1.00 64.53 H new ATOM 0 HB3 ALA A 106 -13.408 -1.717 -8.275 1.00 64.53 H new ATOM 1214 N ASN A 107 -11.391 -3.354 -9.513 1.00 61.34 N ATOM 1215 CA ASN A 107 -10.919 -3.858 -10.798 1.00 21.23 C ATOM 1216 C ASN A 107 -9.976 -5.043 -10.604 1.00 11.32 C ATOM 1217 O ASN A 107 -9.800 -5.863 -11.505 1.00 70.13 O ATOM 1218 CB ASN A 107 -10.209 -2.748 -11.575 1.00 71.34 C ATOM 1219 CG ASN A 107 -10.315 -2.934 -13.076 1.00 72.51 C ATOM 1220 OD1 ASN A 107 -9.559 -3.702 -13.673 1.00 10.32 O ATOM 1221 ND2 ASN A 107 -11.257 -2.232 -13.694 1.00 70.14 N ATOM 0 H ASN A 107 -11.128 -2.389 -9.316 1.00 61.34 H new ATOM 0 HA ASN A 107 -11.784 -4.195 -11.369 1.00 21.23 H new ATOM 0 HB2 ASN A 107 -10.638 -1.784 -11.300 1.00 71.34 H new ATOM 0 HB3 ASN A 107 -9.158 -2.723 -11.288 1.00 71.34 H new ATOM 0 HD21 ASN A 107 -11.377 -2.317 -14.703 1.00 70.14 H new ATOM 0 HD22 ASN A 107 -11.861 -1.608 -13.159 1.00 70.14 H new ATOM 1228 N SER A 108 -9.373 -5.125 -9.422 1.00 23.40 N ATOM 1229 CA SER A 108 -8.445 -6.206 -9.111 1.00 22.23 C ATOM 1230 C SER A 108 -9.074 -7.197 -8.136 1.00 44.20 C ATOM 1231 O SER A 108 -8.409 -8.106 -7.643 1.00 23.14 O ATOM 1232 CB SER A 108 -7.151 -5.643 -8.521 1.00 52.31 C ATOM 1233 OG SER A 108 -7.417 -4.840 -7.385 1.00 50.42 O ATOM 0 H SER A 108 -9.510 -4.456 -8.664 1.00 23.40 H new ATOM 0 HA SER A 108 -8.214 -6.731 -10.038 1.00 22.23 H new ATOM 0 HB2 SER A 108 -6.487 -6.462 -8.244 1.00 52.31 H new ATOM 0 HB3 SER A 108 -6.631 -5.052 -9.275 1.00 52.31 H new ATOM 0 HG SER A 108 -7.721 -3.955 -7.674 1.00 50.42 H new ATOM 1239 N GLY A 109 -10.361 -7.012 -7.861 1.00 13.42 N ATOM 1240 CA GLY A 109 -11.060 -7.895 -6.946 1.00 23.14 C ATOM 1241 C GLY A 109 -10.362 -8.008 -5.604 1.00 74.41 C ATOM 1242 O GLY A 109 -9.865 -9.076 -5.244 1.00 61.40 O ATOM 0 H GLY A 109 -10.933 -6.265 -8.256 1.00 13.42 H new ATOM 0 HA2 GLY A 109 -12.075 -7.527 -6.795 1.00 23.14 H new ATOM 0 HA3 GLY A 109 -11.143 -8.885 -7.394 1.00 23.14 H new ATOM 1246 N SER A 110 -10.324 -6.906 -4.864 1.00 41.43 N ATOM 1247 CA SER A 110 -9.677 -6.884 -3.557 1.00 33.31 C ATOM 1248 C SER A 110 -10.706 -6.720 -2.443 1.00 54.24 C ATOM 1249 O SER A 110 -11.780 -6.154 -2.655 1.00 73.13 O ATOM 1250 CB SER A 110 -8.651 -5.752 -3.491 1.00 41.03 C ATOM 1251 OG SER A 110 -7.666 -5.896 -4.499 1.00 33.05 O ATOM 0 H SER A 110 -10.734 -6.016 -5.147 1.00 41.43 H new ATOM 0 HA SER A 110 -9.166 -7.836 -3.417 1.00 33.31 H new ATOM 0 HB2 SER A 110 -9.156 -4.793 -3.606 1.00 41.03 H new ATOM 0 HB3 SER A 110 -8.174 -5.746 -2.511 1.00 41.03 H new ATOM 0 HG SER A 110 -7.937 -5.393 -5.295 1.00 33.05 H new ATOM 1257 N ILE A 111 -10.371 -7.215 -1.258 1.00 30.10 N ATOM 1258 CA ILE A 111 -11.266 -7.122 -0.111 1.00 52.33 C ATOM 1259 C ILE A 111 -12.727 -7.182 -0.545 1.00 20.31 C ATOM 1260 O ILE A 111 -13.540 -6.353 -0.141 1.00 4.23 O ATOM 1261 CB ILE A 111 -11.031 -5.822 0.682 1.00 65.51 C ATOM 1262 CG1 ILE A 111 -11.274 -4.603 -0.212 1.00 31.33 C ATOM 1263 CG2 ILE A 111 -9.620 -5.797 1.251 1.00 73.22 C ATOM 1264 CD1 ILE A 111 -10.045 -4.162 -0.976 1.00 1.21 C ATOM 0 H ILE A 111 -9.486 -7.685 -1.066 1.00 30.10 H new ATOM 0 HA ILE A 111 -11.045 -7.975 0.530 1.00 52.33 H new ATOM 0 HB ILE A 111 -11.737 -5.786 1.512 1.00 65.51 H new ATOM 0 HG12 ILE A 111 -12.069 -4.834 -0.921 1.00 31.33 H new ATOM 0 HG13 ILE A 111 -11.626 -3.775 0.403 1.00 31.33 H new ATOM 0 HG21 ILE A 111 -9.469 -4.873 1.809 1.00 73.22 H new ATOM 0 HG22 ILE A 111 -9.481 -6.649 1.916 1.00 73.22 H new ATOM 0 HG23 ILE A 111 -8.898 -5.851 0.436 1.00 73.22 H new ATOM 0 HD11 ILE A 111 -10.289 -3.294 -1.589 1.00 1.21 H new ATOM 0 HD12 ILE A 111 -9.255 -3.899 -0.273 1.00 1.21 H new ATOM 0 HD13 ILE A 111 -9.704 -4.975 -1.618 1.00 1.21 H new ATOM 1276 N SER A 112 -13.051 -8.172 -1.372 1.00 12.45 N ATOM 1277 CA SER A 112 -14.414 -8.339 -1.863 1.00 74.25 C ATOM 1278 C SER A 112 -15.409 -8.359 -0.708 1.00 32.21 C ATOM 1279 O SER A 112 -16.368 -7.587 -0.688 1.00 40.44 O ATOM 1280 CB SER A 112 -14.530 -9.632 -2.674 1.00 63.35 C ATOM 1281 OG SER A 112 -13.255 -10.201 -2.910 1.00 23.52 O ATOM 0 H SER A 112 -12.390 -8.869 -1.715 1.00 12.45 H new ATOM 0 HA SER A 112 -14.649 -7.491 -2.507 1.00 74.25 H new ATOM 0 HB2 SER A 112 -15.157 -10.346 -2.139 1.00 63.35 H new ATOM 0 HB3 SER A 112 -15.021 -9.426 -3.625 1.00 63.35 H new ATOM 0 HG SER A 112 -13.356 -11.027 -3.428 1.00 23.52 H new ATOM 1287 N GLU A 113 -15.176 -9.249 0.252 1.00 71.23 N ATOM 1288 CA GLU A 113 -16.053 -9.370 1.410 1.00 45.05 C ATOM 1289 C GLU A 113 -15.388 -10.188 2.513 1.00 44.42 C ATOM 1290 O GLU A 113 -15.450 -9.829 3.689 1.00 20.50 O ATOM 1291 CB GLU A 113 -17.379 -10.020 1.008 1.00 1.02 C ATOM 1292 CG GLU A 113 -18.282 -10.338 2.187 1.00 55.00 C ATOM 1293 CD GLU A 113 -18.075 -11.744 2.720 1.00 42.55 C ATOM 1294 OE1 GLU A 113 -17.896 -12.668 1.900 1.00 61.34 O ATOM 1295 OE2 GLU A 113 -18.090 -11.916 3.956 1.00 40.21 O ATOM 0 H GLU A 113 -14.388 -9.896 0.250 1.00 71.23 H new ATOM 0 HA GLU A 113 -16.248 -8.368 1.792 1.00 45.05 H new ATOM 0 HB2 GLU A 113 -17.908 -9.355 0.325 1.00 1.02 H new ATOM 0 HB3 GLU A 113 -17.172 -10.940 0.461 1.00 1.02 H new ATOM 0 HG2 GLU A 113 -18.096 -9.620 2.986 1.00 55.00 H new ATOM 0 HG3 GLU A 113 -19.323 -10.218 1.886 1.00 55.00 H new ATOM 1302 N SER A 114 -14.751 -11.288 2.125 1.00 3.24 N ATOM 1303 CA SER A 114 -14.076 -12.159 3.080 1.00 33.54 C ATOM 1304 C SER A 114 -13.089 -11.369 3.934 1.00 61.11 C ATOM 1305 O SER A 114 -12.933 -11.630 5.127 1.00 50.35 O ATOM 1306 CB SER A 114 -13.348 -13.287 2.348 1.00 61.10 C ATOM 1307 OG SER A 114 -12.322 -13.840 3.155 1.00 51.35 O ATOM 0 H SER A 114 -14.688 -11.597 1.155 1.00 3.24 H new ATOM 0 HA SER A 114 -14.831 -12.591 3.737 1.00 33.54 H new ATOM 0 HB2 SER A 114 -14.060 -14.066 2.075 1.00 61.10 H new ATOM 0 HB3 SER A 114 -12.920 -12.906 1.421 1.00 61.10 H new ATOM 0 HG SER A 114 -11.873 -14.560 2.665 1.00 51.35 H new ATOM 1313 N THR A 115 -12.424 -10.400 3.312 1.00 61.44 N ATOM 1314 CA THR A 115 -11.449 -9.572 4.012 1.00 51.21 C ATOM 1315 C THR A 115 -11.825 -8.097 3.933 1.00 41.14 C ATOM 1316 O THR A 115 -12.182 -7.592 2.868 1.00 62.52 O ATOM 1317 CB THR A 115 -10.033 -9.761 3.435 1.00 32.20 C ATOM 1318 OG1 THR A 115 -10.110 -10.058 2.036 1.00 23.03 O ATOM 1319 CG2 THR A 115 -9.300 -10.881 4.157 1.00 41.25 C ATOM 0 H THR A 115 -12.543 -10.169 2.326 1.00 61.44 H new ATOM 0 HA THR A 115 -11.453 -9.891 5.054 1.00 51.21 H new ATOM 0 HB THR A 115 -9.479 -8.834 3.579 1.00 32.20 H new ATOM 0 HG1 THR A 115 -9.206 -10.175 1.676 1.00 23.03 H new ATOM 0 HG21 THR A 115 -8.303 -10.996 3.732 1.00 41.25 H new ATOM 0 HG22 THR A 115 -9.218 -10.638 5.216 1.00 41.25 H new ATOM 0 HG23 THR A 115 -9.854 -11.813 4.040 1.00 41.25 H new ATOM 1327 N ALA A 116 -11.742 -7.409 5.068 1.00 71.04 N ATOM 1328 CA ALA A 116 -12.071 -5.990 5.125 1.00 64.34 C ATOM 1329 C ALA A 116 -11.803 -5.421 6.515 1.00 34.44 C ATOM 1330 O ALA A 116 -12.710 -4.907 7.170 1.00 23.11 O ATOM 1331 CB ALA A 116 -13.524 -5.768 4.732 1.00 1.41 C ATOM 0 H ALA A 116 -11.450 -7.811 5.959 1.00 71.04 H new ATOM 0 HA ALA A 116 -11.431 -5.465 4.416 1.00 64.34 H new ATOM 0 HB1 ALA A 116 -13.755 -4.704 4.779 1.00 1.41 H new ATOM 0 HB2 ALA A 116 -13.686 -6.130 3.717 1.00 1.41 H new ATOM 0 HB3 ALA A 116 -14.174 -6.311 5.418 1.00 1.41 H new ATOM 1337 N SER A 117 -10.556 -5.517 6.959 1.00 65.53 N ATOM 1338 CA SER A 117 -10.170 -5.016 8.272 1.00 24.44 C ATOM 1339 C SER A 117 -8.682 -5.244 8.527 1.00 22.42 C ATOM 1340 O SER A 117 -8.019 -4.431 9.167 1.00 1.31 O ATOM 1341 CB SER A 117 -10.996 -5.700 9.364 1.00 1.52 C ATOM 1342 OG SER A 117 -11.549 -4.748 10.257 1.00 74.05 O ATOM 0 H SER A 117 -9.794 -5.938 6.428 1.00 65.53 H new ATOM 0 HA SER A 117 -10.364 -3.944 8.295 1.00 24.44 H new ATOM 0 HB2 SER A 117 -11.796 -6.283 8.908 1.00 1.52 H new ATOM 0 HB3 SER A 117 -10.367 -6.399 9.916 1.00 1.52 H new ATOM 0 HG SER A 117 -12.073 -5.210 10.944 1.00 74.05 H new ATOM 1348 N SER A 118 -8.166 -6.360 8.019 1.00 22.13 N ATOM 1349 CA SER A 118 -6.759 -6.699 8.193 1.00 62.23 C ATOM 1350 C SER A 118 -5.864 -5.689 7.480 1.00 51.42 C ATOM 1351 O SER A 118 -4.914 -5.165 8.062 1.00 1.25 O ATOM 1352 CB SER A 118 -6.482 -8.106 7.663 1.00 33.41 C ATOM 1353 OG SER A 118 -6.792 -8.202 6.283 1.00 62.12 O ATOM 0 H SER A 118 -8.702 -7.044 7.484 1.00 22.13 H new ATOM 0 HA SER A 118 -6.533 -6.669 9.259 1.00 62.23 H new ATOM 0 HB2 SER A 118 -5.433 -8.358 7.822 1.00 33.41 H new ATOM 0 HB3 SER A 118 -7.072 -8.832 8.223 1.00 33.41 H new ATOM 0 HG SER A 118 -6.604 -9.111 5.968 1.00 62.12 H new ATOM 1359 N ALA A 119 -6.177 -5.421 6.217 1.00 5.32 N ATOM 1360 CA ALA A 119 -5.404 -4.473 5.425 1.00 25.11 C ATOM 1361 C ALA A 119 -5.592 -3.048 5.934 1.00 22.24 C ATOM 1362 O ALA A 119 -4.657 -2.248 5.928 1.00 13.04 O ATOM 1363 CB ALA A 119 -5.797 -4.566 3.958 1.00 51.04 C ATOM 0 H ALA A 119 -6.960 -5.847 5.721 1.00 5.32 H new ATOM 0 HA ALA A 119 -4.350 -4.731 5.525 1.00 25.11 H new ATOM 0 HB1 ALA A 119 -5.212 -3.852 3.379 1.00 51.04 H new ATOM 0 HB2 ALA A 119 -5.604 -5.575 3.593 1.00 51.04 H new ATOM 0 HB3 ALA A 119 -6.857 -4.338 3.850 1.00 51.04 H new ATOM 1369 N ALA A 120 -6.808 -2.738 6.377 1.00 64.44 N ATOM 1370 CA ALA A 120 -7.117 -1.411 6.891 1.00 1.41 C ATOM 1371 C ALA A 120 -6.353 -1.129 8.180 1.00 64.03 C ATOM 1372 O ALA A 120 -5.759 -0.063 8.342 1.00 32.24 O ATOM 1373 CB ALA A 120 -8.614 -1.270 7.121 1.00 4.22 C ATOM 0 H ALA A 120 -7.593 -3.389 6.389 1.00 64.44 H new ATOM 0 HA ALA A 120 -6.804 -0.679 6.147 1.00 1.41 H new ATOM 0 HB1 ALA A 120 -8.831 -0.273 7.505 1.00 4.22 H new ATOM 0 HB2 ALA A 120 -9.142 -1.419 6.179 1.00 4.22 H new ATOM 0 HB3 ALA A 120 -8.943 -2.017 7.844 1.00 4.22 H new ATOM 1379 N SER A 121 -6.372 -2.093 9.097 1.00 1.21 N ATOM 1380 CA SER A 121 -5.685 -1.947 10.375 1.00 10.35 C ATOM 1381 C SER A 121 -4.175 -2.059 10.194 1.00 51.21 C ATOM 1382 O SER A 121 -3.404 -1.379 10.873 1.00 12.44 O ATOM 1383 CB SER A 121 -6.173 -3.007 11.364 1.00 24.21 C ATOM 1384 OG SER A 121 -7.336 -2.571 12.047 1.00 65.24 O ATOM 0 H SER A 121 -6.856 -2.983 8.978 1.00 1.21 H new ATOM 0 HA SER A 121 -5.913 -0.958 10.773 1.00 10.35 H new ATOM 0 HB2 SER A 121 -6.386 -3.934 10.832 1.00 24.21 H new ATOM 0 HB3 SER A 121 -5.385 -3.227 12.085 1.00 24.21 H new ATOM 0 HG SER A 121 -7.629 -3.267 12.672 1.00 65.24 H new ATOM 1390 N SER A 122 -3.757 -2.923 9.274 1.00 64.01 N ATOM 1391 CA SER A 122 -2.338 -3.128 9.006 1.00 32.23 C ATOM 1392 C SER A 122 -1.712 -1.875 8.402 1.00 54.13 C ATOM 1393 O SER A 122 -0.727 -1.350 8.917 1.00 4.51 O ATOM 1394 CB SER A 122 -2.143 -4.316 8.062 1.00 2.25 C ATOM 1395 OG SER A 122 -2.210 -5.543 8.768 1.00 34.52 O ATOM 0 H SER A 122 -4.381 -3.492 8.702 1.00 64.01 H new ATOM 0 HA SER A 122 -1.841 -3.340 9.953 1.00 32.23 H new ATOM 0 HB2 SER A 122 -2.908 -4.297 7.285 1.00 2.25 H new ATOM 0 HB3 SER A 122 -1.178 -4.233 7.562 1.00 2.25 H new ATOM 0 HG SER A 122 -3.135 -5.867 8.775 1.00 34.52 H new ATOM 1401 N ALA A 123 -2.293 -1.404 7.304 1.00 53.44 N ATOM 1402 CA ALA A 123 -1.794 -0.211 6.629 1.00 11.12 C ATOM 1403 C ALA A 123 -1.823 0.999 7.558 1.00 63.23 C ATOM 1404 O ALA A 123 -0.883 1.791 7.587 1.00 21.22 O ATOM 1405 CB ALA A 123 -2.610 0.066 5.374 1.00 4.10 C ATOM 0 H ALA A 123 -3.109 -1.829 6.863 1.00 53.44 H new ATOM 0 HA ALA A 123 -0.758 -0.393 6.343 1.00 11.12 H new ATOM 0 HB1 ALA A 123 -2.227 0.959 4.880 1.00 4.10 H new ATOM 0 HB2 ALA A 123 -2.535 -0.784 4.696 1.00 4.10 H new ATOM 0 HB3 ALA A 123 -3.654 0.222 5.646 1.00 4.10 H new ATOM 1411 N ALA A 124 -2.908 1.132 8.313 1.00 10.11 N ATOM 1412 CA ALA A 124 -3.057 2.245 9.243 1.00 14.45 C ATOM 1413 C ALA A 124 -2.116 2.095 10.434 1.00 34.43 C ATOM 1414 O ALA A 124 -1.685 3.084 11.025 1.00 0.20 O ATOM 1415 CB ALA A 124 -4.500 2.347 9.717 1.00 61.21 C ATOM 0 H ALA A 124 -3.696 0.484 8.299 1.00 10.11 H new ATOM 0 HA ALA A 124 -2.793 3.163 8.718 1.00 14.45 H new ATOM 0 HB1 ALA A 124 -4.597 3.182 10.411 1.00 61.21 H new ATOM 0 HB2 ALA A 124 -5.154 2.509 8.860 1.00 61.21 H new ATOM 0 HB3 ALA A 124 -4.784 1.423 10.220 1.00 61.21 H new ATOM 1421 N SER A 125 -1.803 0.851 10.781 1.00 15.31 N ATOM 1422 CA SER A 125 -0.918 0.571 11.905 1.00 44.13 C ATOM 1423 C SER A 125 0.491 1.088 11.628 1.00 15.30 C ATOM 1424 O SER A 125 1.178 1.566 12.531 1.00 43.41 O ATOM 1425 CB SER A 125 -0.874 -0.932 12.186 1.00 21.11 C ATOM 1426 OG SER A 125 0.222 -1.264 13.022 1.00 31.41 O ATOM 0 H SER A 125 -2.149 0.021 10.300 1.00 15.31 H new ATOM 0 HA SER A 125 -1.311 1.086 12.782 1.00 44.13 H new ATOM 0 HB2 SER A 125 -1.805 -1.244 12.660 1.00 21.11 H new ATOM 0 HB3 SER A 125 -0.797 -1.479 11.246 1.00 21.11 H new ATOM 0 HG SER A 125 0.226 -2.230 13.187 1.00 31.41 H new ATOM 1432 N SER A 126 0.915 0.989 10.371 1.00 15.53 N ATOM 1433 CA SER A 126 2.243 1.443 9.976 1.00 60.15 C ATOM 1434 C SER A 126 2.360 2.959 10.107 1.00 62.51 C ATOM 1435 O SER A 126 3.331 3.472 10.665 1.00 11.25 O ATOM 1436 CB SER A 126 2.540 1.021 8.536 1.00 22.41 C ATOM 1437 OG SER A 126 3.233 -0.215 8.499 1.00 14.23 O ATOM 0 H SER A 126 0.358 0.599 9.610 1.00 15.53 H new ATOM 0 HA SER A 126 2.972 0.981 10.642 1.00 60.15 H new ATOM 0 HB2 SER A 126 1.607 0.935 7.979 1.00 22.41 H new ATOM 0 HB3 SER A 126 3.135 1.790 8.044 1.00 22.41 H new ATOM 0 HG SER A 126 3.409 -0.463 7.568 1.00 14.23 H new ATOM 1443 N VAL A 127 1.364 3.670 9.590 1.00 3.40 N ATOM 1444 CA VAL A 127 1.355 5.127 9.649 1.00 12.34 C ATOM 1445 C VAL A 127 1.102 5.618 11.071 1.00 63.31 C ATOM 1446 O VAL A 127 1.730 6.572 11.532 1.00 31.43 O ATOM 1447 CB VAL A 127 0.282 5.720 8.717 1.00 51.23 C ATOM 1448 CG1 VAL A 127 -1.092 5.164 9.060 1.00 0.34 C ATOM 1449 CG2 VAL A 127 0.287 7.240 8.797 1.00 75.43 C ATOM 0 H VAL A 127 0.553 3.261 9.126 1.00 3.40 H new ATOM 0 HA VAL A 127 2.338 5.463 9.320 1.00 12.34 H new ATOM 0 HB VAL A 127 0.518 5.432 7.692 1.00 51.23 H new ATOM 0 HG11 VAL A 127 -1.836 5.595 8.391 1.00 0.34 H new ATOM 0 HG12 VAL A 127 -1.085 4.080 8.945 1.00 0.34 H new ATOM 0 HG13 VAL A 127 -1.340 5.418 10.090 1.00 0.34 H new ATOM 0 HG21 VAL A 127 -0.477 7.642 8.132 1.00 75.43 H new ATOM 0 HG22 VAL A 127 0.078 7.551 9.820 1.00 75.43 H new ATOM 0 HG23 VAL A 127 1.264 7.617 8.496 1.00 75.43 H new ATOM 1459 N THR A 128 0.178 4.958 11.763 1.00 21.33 N ATOM 1460 CA THR A 128 -0.159 5.326 13.133 1.00 72.23 C ATOM 1461 C THR A 128 1.036 5.139 14.061 1.00 40.24 C ATOM 1462 O THR A 128 1.326 5.996 14.898 1.00 21.42 O ATOM 1463 CB THR A 128 -1.341 4.494 13.663 1.00 1.14 C ATOM 1464 OG1 THR A 128 -2.503 4.727 12.860 1.00 12.31 O ATOM 1465 CG2 THR A 128 -1.642 4.845 15.113 1.00 64.14 C ATOM 0 H THR A 128 -0.350 4.166 11.397 1.00 21.33 H new ATOM 0 HA THR A 128 -0.443 6.378 13.118 1.00 72.23 H new ATOM 0 HB THR A 128 -1.068 3.440 13.609 1.00 1.14 H new ATOM 0 HG1 THR A 128 -2.404 4.267 12.001 1.00 12.31 H new ATOM 0 HG21 THR A 128 -2.481 4.245 15.466 1.00 64.14 H new ATOM 0 HG22 THR A 128 -0.765 4.640 15.727 1.00 64.14 H new ATOM 0 HG23 THR A 128 -1.896 5.902 15.186 1.00 64.14 H new ATOM 1473 N THR A 129 1.729 4.014 13.909 1.00 5.10 N ATOM 1474 CA THR A 129 2.891 3.716 14.734 1.00 23.51 C ATOM 1475 C THR A 129 3.958 4.796 14.595 1.00 52.33 C ATOM 1476 O THR A 129 4.680 5.098 15.545 1.00 23.14 O ATOM 1477 CB THR A 129 3.508 2.353 14.365 1.00 2.15 C ATOM 1478 OG1 THR A 129 2.589 1.299 14.676 1.00 55.51 O ATOM 1479 CG2 THR A 129 4.815 2.130 15.111 1.00 72.43 C ATOM 0 H THR A 129 1.504 3.295 13.221 1.00 5.10 H new ATOM 0 HA THR A 129 2.543 3.683 15.767 1.00 23.51 H new ATOM 0 HB THR A 129 3.715 2.351 13.295 1.00 2.15 H new ATOM 0 HG1 THR A 129 2.106 1.036 13.865 1.00 55.51 H new ATOM 0 HG21 THR A 129 5.231 1.161 14.834 1.00 72.43 H new ATOM 0 HG22 THR A 129 5.522 2.917 14.849 1.00 72.43 H new ATOM 0 HG23 THR A 129 4.629 2.151 16.185 1.00 72.43 H new ATOM 1487 N THR A 130 4.051 5.379 13.404 1.00 42.04 N ATOM 1488 CA THR A 130 5.029 6.426 13.139 1.00 2.15 C ATOM 1489 C THR A 130 4.628 7.736 13.810 1.00 20.41 C ATOM 1490 O THR A 130 5.418 8.340 14.536 1.00 40.43 O ATOM 1491 CB THR A 130 5.199 6.668 11.627 1.00 0.43 C ATOM 1492 OG1 THR A 130 4.982 5.449 10.908 1.00 4.33 O ATOM 1493 CG2 THR A 130 6.587 7.207 11.317 1.00 32.20 C ATOM 0 H THR A 130 3.460 5.143 12.607 1.00 42.04 H new ATOM 0 HA THR A 130 5.977 6.084 13.553 1.00 2.15 H new ATOM 0 HB THR A 130 4.462 7.408 11.315 1.00 0.43 H new ATOM 0 HG1 THR A 130 5.357 5.530 10.006 1.00 4.33 H new ATOM 0 HG21 THR A 130 6.683 7.370 10.243 1.00 32.20 H new ATOM 0 HG22 THR A 130 6.736 8.151 11.842 1.00 32.20 H new ATOM 0 HG23 THR A 130 7.338 6.487 11.643 1.00 32.20 H new ATOM 1501 N LEU A 131 3.397 8.167 13.564 1.00 41.51 N ATOM 1502 CA LEU A 131 2.890 9.406 14.147 1.00 73.45 C ATOM 1503 C LEU A 131 3.103 9.424 15.657 1.00 64.11 C ATOM 1504 O LEU A 131 3.375 10.472 16.244 1.00 51.24 O ATOM 1505 CB LEU A 131 1.403 9.571 13.828 1.00 30.41 C ATOM 1506 CG LEU A 131 1.070 10.380 12.574 1.00 64.12 C ATOM 1507 CD1 LEU A 131 1.372 11.854 12.795 1.00 40.24 C ATOM 1508 CD2 LEU A 131 1.844 9.850 11.377 1.00 64.34 C ATOM 0 H LEU A 131 2.731 7.679 12.966 1.00 41.51 H new ATOM 0 HA LEU A 131 3.444 10.238 13.711 1.00 73.45 H new ATOM 0 HB2 LEU A 131 0.962 8.579 13.724 1.00 30.41 H new ATOM 0 HB3 LEU A 131 0.920 10.046 14.681 1.00 30.41 H new ATOM 0 HG LEU A 131 0.005 10.274 12.369 1.00 64.12 H new ATOM 0 HD11 LEU A 131 1.129 12.415 11.892 1.00 40.24 H new ATOM 0 HD12 LEU A 131 0.774 12.227 13.626 1.00 40.24 H new ATOM 0 HD13 LEU A 131 2.430 11.978 13.025 1.00 40.24 H new ATOM 0 HD21 LEU A 131 1.595 10.438 10.493 1.00 64.34 H new ATOM 0 HD22 LEU A 131 2.914 9.925 11.573 1.00 64.34 H new ATOM 0 HD23 LEU A 131 1.579 8.807 11.206 1.00 64.34 H new ATOM 1520 N THR A 132 2.981 8.258 16.281 1.00 33.15 N ATOM 1521 CA THR A 132 3.161 8.140 17.723 1.00 21.20 C ATOM 1522 C THR A 132 4.622 7.884 18.075 1.00 63.43 C ATOM 1523 O THR A 132 5.100 8.306 19.127 1.00 25.43 O ATOM 1524 CB THR A 132 2.299 7.004 18.306 1.00 1.40 C ATOM 1525 OG1 THR A 132 2.820 5.734 17.900 1.00 14.50 O ATOM 1526 CG2 THR A 132 0.853 7.134 17.849 1.00 0.12 C ATOM 0 H THR A 132 2.758 7.381 15.811 1.00 33.15 H new ATOM 0 HA THR A 132 2.845 9.087 18.159 1.00 21.20 H new ATOM 0 HB THR A 132 2.329 7.077 19.393 1.00 1.40 H new ATOM 0 HG1 THR A 132 2.267 5.018 18.276 1.00 14.50 H new ATOM 0 HG21 THR A 132 0.263 6.321 18.273 1.00 0.12 H new ATOM 0 HG22 THR A 132 0.450 8.089 18.185 1.00 0.12 H new ATOM 0 HG23 THR A 132 0.809 7.085 16.761 1.00 0.12 H new ATOM 1534 N SER A 133 5.328 7.190 17.186 1.00 64.02 N ATOM 1535 CA SER A 133 6.734 6.877 17.406 1.00 64.52 C ATOM 1536 C SER A 133 7.546 8.147 17.636 1.00 44.34 C ATOM 1537 O SER A 133 8.206 8.298 18.665 1.00 31.40 O ATOM 1538 CB SER A 133 7.300 6.107 16.210 1.00 74.11 C ATOM 1539 OG SER A 133 7.113 4.711 16.367 1.00 11.05 O ATOM 0 H SER A 133 4.949 6.835 16.308 1.00 64.02 H new ATOM 0 HA SER A 133 6.806 6.255 18.298 1.00 64.52 H new ATOM 0 HB2 SER A 133 6.812 6.442 15.294 1.00 74.11 H new ATOM 0 HB3 SER A 133 8.363 6.325 16.103 1.00 74.11 H new ATOM 0 HG SER A 133 6.161 4.496 16.274 1.00 11.05 H new ATOM 1545 N TYR A 134 7.492 9.059 16.672 1.00 24.11 N ATOM 1546 CA TYR A 134 8.223 10.317 16.766 1.00 11.34 C ATOM 1547 C TYR A 134 8.332 10.989 15.401 1.00 33.23 C ATOM 1548 O TYR A 134 8.622 12.181 15.304 1.00 63.34 O ATOM 1549 CB TYR A 134 9.620 10.077 17.342 1.00 4.23 C ATOM 1550 CG TYR A 134 10.710 10.839 16.624 1.00 74.34 C ATOM 1551 CD1 TYR A 134 11.341 10.301 15.508 1.00 10.00 C ATOM 1552 CD2 TYR A 134 11.110 12.096 17.060 1.00 44.21 C ATOM 1553 CE1 TYR A 134 12.338 10.993 14.849 1.00 50.22 C ATOM 1554 CE2 TYR A 134 12.105 12.796 16.405 1.00 33.35 C ATOM 1555 CZ TYR A 134 12.716 12.241 15.301 1.00 15.40 C ATOM 1556 OH TYR A 134 13.709 12.934 14.647 1.00 12.31 O ATOM 0 H TYR A 134 6.949 8.950 15.815 1.00 24.11 H new ATOM 0 HA TYR A 134 7.671 10.979 17.433 1.00 11.34 H new ATOM 0 HB2 TYR A 134 9.623 10.360 18.395 1.00 4.23 H new ATOM 0 HB3 TYR A 134 9.844 9.011 17.298 1.00 4.23 H new ATOM 0 HD1 TYR A 134 11.046 9.325 15.150 1.00 10.00 H new ATOM 0 HD2 TYR A 134 10.635 12.533 17.926 1.00 44.21 H new ATOM 0 HE1 TYR A 134 12.819 10.560 13.985 1.00 50.22 H new ATOM 0 HE2 TYR A 134 12.403 13.773 16.756 1.00 33.35 H new ATOM 0 HH TYR A 134 13.854 13.795 15.091 1.00 12.31 H new ATOM 1566 N GLY A 135 8.095 10.212 14.347 1.00 10.50 N ATOM 1567 CA GLY A 135 8.171 10.749 13.000 1.00 20.32 C ATOM 1568 C GLY A 135 6.806 10.886 12.353 1.00 5.53 C ATOM 1569 O GLY A 135 6.412 10.081 11.510 1.00 53.13 O ATOM 0 H GLY A 135 7.852 9.223 14.402 1.00 10.50 H new ATOM 0 HA2 GLY A 135 8.656 11.725 13.028 1.00 20.32 H new ATOM 0 HA3 GLY A 135 8.796 10.099 12.388 1.00 20.32 H new ATOM 1573 N PRO A 136 6.060 11.926 12.753 1.00 41.44 N ATOM 1574 CA PRO A 136 4.720 12.190 12.219 1.00 12.43 C ATOM 1575 C PRO A 136 4.754 12.647 10.766 1.00 70.50 C ATOM 1576 O PRO A 136 4.574 11.846 9.849 1.00 23.24 O ATOM 1577 CB PRO A 136 4.195 13.311 13.120 1.00 1.14 C ATOM 1578 CG PRO A 136 5.416 13.995 13.627 1.00 44.02 C ATOM 1579 CD PRO A 136 6.467 12.925 13.756 1.00 54.32 C ATOM 0 HA PRO A 136 4.097 11.295 12.220 1.00 12.43 H new ATOM 0 HB2 PRO A 136 3.558 13.999 12.565 1.00 1.14 H new ATOM 0 HB3 PRO A 136 3.596 12.913 13.939 1.00 1.14 H new ATOM 0 HG2 PRO A 136 5.738 14.778 12.940 1.00 44.02 H new ATOM 0 HG3 PRO A 136 5.225 14.473 14.588 1.00 44.02 H new ATOM 0 HD2 PRO A 136 7.465 13.315 13.553 1.00 54.32 H new ATOM 0 HD3 PRO A 136 6.488 12.501 14.760 1.00 54.32 H new ATOM 1587 N ALA A 137 4.987 13.939 10.561 1.00 64.13 N ATOM 1588 CA ALA A 137 5.048 14.503 9.219 1.00 23.50 C ATOM 1589 C ALA A 137 6.411 14.253 8.580 1.00 54.34 C ATOM 1590 O ALA A 137 6.621 14.557 7.406 1.00 34.04 O ATOM 1591 CB ALA A 137 4.745 15.993 9.256 1.00 60.13 C ATOM 0 H ALA A 137 5.137 14.616 11.309 1.00 64.13 H new ATOM 0 HA ALA A 137 4.293 14.007 8.609 1.00 23.50 H new ATOM 0 HB1 ALA A 137 4.795 16.400 8.246 1.00 60.13 H new ATOM 0 HB2 ALA A 137 3.746 16.151 9.662 1.00 60.13 H new ATOM 0 HB3 ALA A 137 5.477 16.498 9.886 1.00 60.13 H new ATOM 1597 N VAL A 138 7.333 13.698 9.360 1.00 12.03 N ATOM 1598 CA VAL A 138 8.675 13.409 8.870 1.00 13.45 C ATOM 1599 C VAL A 138 8.628 12.511 7.640 1.00 54.05 C ATOM 1600 O VAL A 138 9.592 12.433 6.877 1.00 24.32 O ATOM 1601 CB VAL A 138 9.533 12.731 9.955 1.00 44.22 C ATOM 1602 CG1 VAL A 138 9.361 13.436 11.291 1.00 43.32 C ATOM 1603 CG2 VAL A 138 9.177 11.256 10.071 1.00 1.52 C ATOM 0 H VAL A 138 7.175 13.440 10.334 1.00 12.03 H new ATOM 0 HA VAL A 138 9.128 14.364 8.602 1.00 13.45 H new ATOM 0 HB VAL A 138 10.581 12.807 9.664 1.00 44.22 H new ATOM 0 HG11 VAL A 138 9.975 12.943 12.044 1.00 43.32 H new ATOM 0 HG12 VAL A 138 9.670 14.477 11.196 1.00 43.32 H new ATOM 0 HG13 VAL A 138 8.314 13.395 11.592 1.00 43.32 H new ATOM 0 HG21 VAL A 138 9.793 10.793 10.842 1.00 1.52 H new ATOM 0 HG22 VAL A 138 8.125 11.156 10.338 1.00 1.52 H new ATOM 0 HG23 VAL A 138 9.358 10.762 9.116 1.00 1.52 H new ATOM 1613 N PHE A 139 7.500 11.834 7.450 1.00 1.21 N ATOM 1614 CA PHE A 139 7.328 10.940 6.310 1.00 0.12 C ATOM 1615 C PHE A 139 7.479 11.699 4.995 1.00 11.10 C ATOM 1616 O PHE A 139 7.799 11.113 3.960 1.00 53.31 O ATOM 1617 CB PHE A 139 5.954 10.267 6.367 1.00 23.33 C ATOM 1618 CG PHE A 139 6.004 8.846 6.852 1.00 33.14 C ATOM 1619 CD1 PHE A 139 6.888 7.938 6.289 1.00 21.01 C ATOM 1620 CD2 PHE A 139 5.167 8.417 7.870 1.00 74.13 C ATOM 1621 CE1 PHE A 139 6.935 6.631 6.733 1.00 2.13 C ATOM 1622 CE2 PHE A 139 5.210 7.109 8.317 1.00 55.10 C ATOM 1623 CZ PHE A 139 6.096 6.216 7.748 1.00 15.12 C ATOM 0 H PHE A 139 6.692 11.887 8.070 1.00 1.21 H new ATOM 0 HA PHE A 139 8.104 10.176 6.359 1.00 0.12 H new ATOM 0 HB2 PHE A 139 5.302 10.844 7.023 1.00 23.33 H new ATOM 0 HB3 PHE A 139 5.506 10.288 5.374 1.00 23.33 H new ATOM 0 HD1 PHE A 139 7.547 8.256 5.495 1.00 21.01 H new ATOM 0 HD2 PHE A 139 4.473 9.112 8.319 1.00 74.13 H new ATOM 0 HE1 PHE A 139 7.628 5.934 6.286 1.00 2.13 H new ATOM 0 HE2 PHE A 139 4.552 6.787 9.110 1.00 55.10 H new ATOM 0 HZ PHE A 139 6.133 5.194 8.096 1.00 15.12 H new ATOM 1633 N TYR A 140 7.249 13.007 5.044 1.00 30.30 N ATOM 1634 CA TYR A 140 7.357 13.846 3.858 1.00 52.12 C ATOM 1635 C TYR A 140 8.620 14.701 3.907 1.00 11.14 C ATOM 1636 O TYR A 140 9.118 15.153 2.876 1.00 11.24 O ATOM 1637 CB TYR A 140 6.125 14.745 3.729 1.00 33.22 C ATOM 1638 CG TYR A 140 6.307 15.884 2.752 1.00 1.30 C ATOM 1639 CD1 TYR A 140 6.667 15.646 1.433 1.00 74.24 C ATOM 1640 CD2 TYR A 140 6.119 17.204 3.151 1.00 34.43 C ATOM 1641 CE1 TYR A 140 6.835 16.685 0.538 1.00 31.23 C ATOM 1642 CE2 TYR A 140 6.282 18.248 2.263 1.00 61.12 C ATOM 1643 CZ TYR A 140 6.640 17.984 0.958 1.00 2.11 C ATOM 1644 OH TYR A 140 6.805 19.022 0.070 1.00 40.14 O ATOM 0 H TYR A 140 6.987 13.508 5.893 1.00 30.30 H new ATOM 0 HA TYR A 140 7.416 13.193 2.987 1.00 52.12 H new ATOM 0 HB2 TYR A 140 5.275 14.140 3.414 1.00 33.22 H new ATOM 0 HB3 TYR A 140 5.880 15.154 4.709 1.00 33.22 H new ATOM 0 HD1 TYR A 140 6.819 14.630 1.100 1.00 74.24 H new ATOM 0 HD2 TYR A 140 5.841 17.415 4.173 1.00 34.43 H new ATOM 0 HE1 TYR A 140 7.117 16.481 -0.484 1.00 31.23 H new ATOM 0 HE2 TYR A 140 6.130 19.266 2.589 1.00 61.12 H new ATOM 0 HH TYR A 140 6.629 19.872 0.524 1.00 40.14 H new ATOM 1654 N ALA A 141 9.132 14.917 5.114 1.00 25.22 N ATOM 1655 CA ALA A 141 10.339 15.714 5.300 1.00 74.31 C ATOM 1656 C ALA A 141 11.463 15.228 4.394 1.00 74.44 C ATOM 1657 O ALA A 141 11.447 14.103 3.893 1.00 61.53 O ATOM 1658 CB ALA A 141 10.778 15.673 6.756 1.00 13.22 C ATOM 0 H ALA A 141 8.730 14.552 5.977 1.00 25.22 H new ATOM 0 HA ALA A 141 10.109 16.745 5.029 1.00 74.31 H new ATOM 0 HB1 ALA A 141 11.680 16.272 6.881 1.00 13.22 H new ATOM 0 HB2 ALA A 141 9.985 16.075 7.387 1.00 13.22 H new ATOM 0 HB3 ALA A 141 10.984 14.642 7.045 1.00 13.22 H new TER 1664 ALA A 141