USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 776 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 129 THR OG1 : rot -91:sc= 1.2 USER MOD Set 1.2: A 130 THR OG1 : rot 72:sc= 1.23 USER MOD Set 2.1: A 57 ASN : amide:sc= -0.506 X(o=-0.97,f=-1.3) USER MOD Set 2.2: A 126 SER OG : rot 150:sc= -0.465 USER MOD Set 3.1: A 61 GLN :FLIP amide:sc= 0.167 F(o=-0.71,f=1.4) USER MOD Set 3.2: A 122 SER OG : rot -150:sc= 1.19 USER MOD Set 4.1: A 22 GLN : amide:sc= -0.272 K(o=-0.48,f=-1.3) USER MOD Set 4.2: A 95 ASN : amide:sc= -0.205 K(o=-0.48,f=-1.5) USER MOD Single : A 18 ASN : amide:sc= -0.209 K(o=-0.21,f=-0.75) USER MOD Single : A 23 SER OG : rot 86:sc= 0.712 USER MOD Single : A 25 SER OG : rot 88:sc= 1.22 USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 30 SER OG : rot 48:sc= 0.396! USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 37 MET CE :methyl -163:sc= -1.44 (180deg=-2.33) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -40:sc= 0.397 USER MOD Single : A 41 THR OG1 : rot -77:sc= 1.32 USER MOD Single : A 42 THR OG1 : rot 180:sc= -0.0764 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0.12 USER MOD Single : A 46 GLN : amide:sc= -0.139 K(o=-0.14,f=-5.2!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -81:sc= 0.572 USER MOD Single : A 53 SER OG : rot 180:sc= -0.0332 USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=-0.36) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 67 ASN : amide:sc= -0.0243 X(o=-0.024,f=0) USER MOD Single : A 69 MET CE :methyl 149:sc= -0.139 (180deg=-1.01) USER MOD Single : A 70 ASN : amide:sc= -0.0194 K(o=-0.019,f=-1.3!) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot -63:sc= 1.16 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 86:sc= 0.828 USER MOD Single : A 85 ASN : amide:sc= -0.0118 K(o=-0.012,f=-1.3) 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 21:sc= -4.1! USER MOD Single : A 98 SER OG : rot -83:sc= -1.13 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -1.18 K(o=-1.2,f=-2.7!) USER MOD Single : A 107 ASN : amide:sc= 0.14 X(o=0.14,f=0) USER MOD Single : A 108 SER OG : 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 USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 125 SER OG : rot 85:sc= 1.13 USER MOD Single : A 128 THR OG1 : rot 93:sc= 1.27 USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.217 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 TYR OH : rot -10:sc= 0.458 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 -16.558 -1.324 -2.048 1.00 4.30 N ATOM 2 CA GLY A 17 -15.245 -1.445 -1.441 1.00 73.31 C ATOM 3 C GLY A 17 -14.697 -0.112 -0.972 1.00 13.11 C ATOM 4 O GLY A 17 -13.852 -0.061 -0.080 1.00 54.45 O ATOM 0 HA2 GLY A 17 -15.301 -2.129 -0.594 1.00 73.31 H new ATOM 0 HA3 GLY A 17 -14.555 -1.885 -2.161 1.00 73.31 H new ATOM 8 N ASN A 18 -15.179 0.969 -1.576 1.00 43.43 N ATOM 9 CA ASN A 18 -14.730 2.309 -1.216 1.00 64.35 C ATOM 10 C ASN A 18 -15.075 2.627 0.235 1.00 23.43 C ATOM 11 O ASN A 18 -14.329 3.323 0.924 1.00 41.05 O ATOM 12 CB ASN A 18 -15.365 3.349 -2.142 1.00 73.31 C ATOM 13 CG ASN A 18 -16.880 3.331 -2.078 1.00 24.53 C ATOM 14 OD1 ASN A 18 -17.480 3.900 -1.166 1.00 32.14 O ATOM 15 ND2 ASN A 18 -17.505 2.676 -3.049 1.00 32.45 N ATOM 0 H ASN A 18 -15.880 0.944 -2.316 1.00 43.43 H new ATOM 0 HA ASN A 18 -13.647 2.344 -1.330 1.00 64.35 H new ATOM 0 HB2 ASN A 18 -15.004 4.341 -1.871 1.00 73.31 H new ATOM 0 HB3 ASN A 18 -15.045 3.162 -3.167 1.00 73.31 H new ATOM 0 HD21 ASN A 18 -18.524 2.630 -3.059 1.00 32.45 H new ATOM 0 HD22 ASN A 18 -16.966 2.219 -3.785 1.00 32.45 H new ATOM 22 N ALA A 19 -16.210 2.111 0.695 1.00 3.43 N ATOM 23 CA ALA A 19 -16.652 2.337 2.065 1.00 21.11 C ATOM 24 C ALA A 19 -15.644 1.783 3.066 1.00 14.34 C ATOM 25 O ALA A 19 -15.488 2.316 4.165 1.00 74.44 O ATOM 26 CB ALA A 19 -18.020 1.709 2.288 1.00 21.14 C ATOM 0 H ALA A 19 -16.840 1.533 0.138 1.00 3.43 H new ATOM 0 HA ALA A 19 -16.728 3.413 2.223 1.00 21.11 H new ATOM 0 HB1 ALA A 19 -18.338 1.885 3.316 1.00 21.14 H new ATOM 0 HB2 ALA A 19 -18.741 2.155 1.603 1.00 21.14 H new ATOM 0 HB3 ALA A 19 -17.962 0.636 2.105 1.00 21.14 H new ATOM 32 N PHE A 20 -14.963 0.709 2.680 1.00 33.51 N ATOM 33 CA PHE A 20 -13.972 0.080 3.545 1.00 45.11 C ATOM 34 C PHE A 20 -12.783 1.009 3.773 1.00 2.13 C ATOM 35 O PHE A 20 -12.386 1.259 4.911 1.00 20.30 O ATOM 36 CB PHE A 20 -13.492 -1.238 2.934 1.00 54.50 C ATOM 37 CG PHE A 20 -12.012 -1.456 3.063 1.00 70.42 C ATOM 38 CD1 PHE A 20 -11.463 -1.885 4.260 1.00 10.54 C ATOM 39 CD2 PHE A 20 -11.170 -1.232 1.986 1.00 22.41 C ATOM 40 CE1 PHE A 20 -10.102 -2.085 4.381 1.00 63.34 C ATOM 41 CE2 PHE A 20 -9.808 -1.431 2.100 1.00 44.30 C ATOM 42 CZ PHE A 20 -9.272 -1.859 3.301 1.00 75.35 C ATOM 0 H PHE A 20 -15.079 0.256 1.774 1.00 33.51 H new ATOM 0 HA PHE A 20 -14.443 -0.124 4.507 1.00 45.11 H new ATOM 0 HB2 PHE A 20 -14.016 -2.064 3.415 1.00 54.50 H new ATOM 0 HB3 PHE A 20 -13.764 -1.260 1.879 1.00 54.50 H new ATOM 0 HD1 PHE A 20 -12.107 -2.065 5.108 1.00 10.54 H new ATOM 0 HD2 PHE A 20 -11.584 -0.898 1.046 1.00 22.41 H new ATOM 0 HE1 PHE A 20 -9.687 -2.418 5.321 1.00 63.34 H new ATOM 0 HE2 PHE A 20 -9.163 -1.253 1.253 1.00 44.30 H new ATOM 0 HZ PHE A 20 -8.207 -2.016 3.394 1.00 75.35 H new ATOM 52 N ALA A 21 -12.219 1.519 2.681 1.00 13.14 N ATOM 53 CA ALA A 21 -11.078 2.421 2.763 1.00 75.03 C ATOM 54 C ALA A 21 -11.493 3.786 3.300 1.00 50.10 C ATOM 55 O ALA A 21 -10.732 4.441 4.012 1.00 20.50 O ATOM 56 CB ALA A 21 -10.423 2.567 1.396 1.00 1.25 C ATOM 0 H ALA A 21 -12.534 1.322 1.731 1.00 13.14 H new ATOM 0 HA ALA A 21 -10.356 1.991 3.458 1.00 75.03 H new ATOM 0 HB1 ALA A 21 -9.572 3.244 1.471 1.00 1.25 H new ATOM 0 HB2 ALA A 21 -10.082 1.591 1.050 1.00 1.25 H new ATOM 0 HB3 ALA A 21 -11.146 2.971 0.687 1.00 1.25 H new ATOM 62 N GLN A 22 -12.704 4.210 2.952 1.00 11.14 N ATOM 63 CA GLN A 22 -13.219 5.498 3.400 1.00 34.11 C ATOM 64 C GLN A 22 -13.558 5.463 4.886 1.00 63.33 C ATOM 65 O GLN A 22 -13.419 6.465 5.588 1.00 12.43 O ATOM 66 CB GLN A 22 -14.459 5.885 2.591 1.00 4.12 C ATOM 67 CG GLN A 22 -15.185 7.105 3.135 1.00 14.35 C ATOM 68 CD GLN A 22 -16.324 7.553 2.242 1.00 74.33 C ATOM 69 OE1 GLN A 22 -16.426 7.133 1.088 1.00 64.52 O ATOM 70 NE2 GLN A 22 -17.188 8.411 2.770 1.00 51.10 N ATOM 0 H GLN A 22 -13.346 3.681 2.362 1.00 11.14 H new ATOM 0 HA GLN A 22 -12.442 6.246 3.241 1.00 34.11 H new ATOM 0 HB2 GLN A 22 -14.164 6.078 1.560 1.00 4.12 H new ATOM 0 HB3 GLN A 22 -15.148 5.041 2.572 1.00 4.12 H new ATOM 0 HG2 GLN A 22 -15.574 6.879 4.128 1.00 14.35 H new ATOM 0 HG3 GLN A 22 -14.475 7.924 3.250 1.00 14.35 H new ATOM 0 HE21 GLN A 22 -17.065 8.733 3.730 1.00 51.10 H new ATOM 0 HE22 GLN A 22 -17.975 8.749 2.216 1.00 51.10 H new ATOM 79 N SER A 23 -14.002 4.303 5.361 1.00 60.33 N ATOM 80 CA SER A 23 -14.363 4.139 6.763 1.00 11.23 C ATOM 81 C SER A 23 -13.138 4.281 7.660 1.00 0.44 C ATOM 82 O SER A 23 -13.161 5.013 8.652 1.00 32.31 O ATOM 83 CB SER A 23 -15.017 2.775 6.986 1.00 22.24 C ATOM 84 OG SER A 23 -16.404 2.821 6.698 1.00 25.53 O ATOM 0 H SER A 23 -14.120 3.463 4.794 1.00 60.33 H new ATOM 0 HA SER A 23 -15.075 4.923 7.023 1.00 11.23 H new ATOM 0 HB2 SER A 23 -14.536 2.030 6.353 1.00 22.24 H new ATOM 0 HB3 SER A 23 -14.867 2.461 8.019 1.00 22.24 H new ATOM 0 HG SER A 23 -16.545 2.666 5.741 1.00 25.53 H new ATOM 90 N LEU A 24 -12.069 3.577 7.306 1.00 62.40 N ATOM 91 CA LEU A 24 -10.831 3.624 8.079 1.00 33.44 C ATOM 92 C LEU A 24 -10.108 4.949 7.869 1.00 63.15 C ATOM 93 O LEU A 24 -9.543 5.516 8.806 1.00 11.11 O ATOM 94 CB LEU A 24 -9.917 2.462 7.684 1.00 43.50 C ATOM 95 CG LEU A 24 -9.162 2.621 6.364 1.00 3.12 C ATOM 96 CD1 LEU A 24 -7.829 3.317 6.593 1.00 40.14 C ATOM 97 CD2 LEU A 24 -8.952 1.267 5.703 1.00 42.21 C ATOM 0 H LEU A 24 -12.033 2.967 6.489 1.00 62.40 H new ATOM 0 HA LEU A 24 -11.087 3.535 9.135 1.00 33.44 H new ATOM 0 HB2 LEU A 24 -9.188 2.312 8.481 1.00 43.50 H new ATOM 0 HB3 LEU A 24 -10.519 1.555 7.628 1.00 43.50 H new ATOM 0 HG LEU A 24 -9.762 3.239 5.696 1.00 3.12 H new ATOM 0 HD11 LEU A 24 -7.305 3.422 5.643 1.00 40.14 H new ATOM 0 HD12 LEU A 24 -8.003 4.304 7.022 1.00 40.14 H new ATOM 0 HD13 LEU A 24 -7.222 2.725 7.278 1.00 40.14 H new ATOM 0 HD21 LEU A 24 -8.413 1.400 4.765 1.00 42.21 H new ATOM 0 HD22 LEU A 24 -8.373 0.624 6.366 1.00 42.21 H new ATOM 0 HD23 LEU A 24 -9.919 0.806 5.504 1.00 42.21 H new ATOM 109 N SER A 25 -10.130 5.441 6.635 1.00 71.33 N ATOM 110 CA SER A 25 -9.475 6.701 6.301 1.00 23.22 C ATOM 111 C SER A 25 -10.120 7.862 7.050 1.00 52.41 C ATOM 112 O SER A 25 -9.437 8.793 7.479 1.00 54.41 O ATOM 113 CB SER A 25 -9.541 6.952 4.794 1.00 20.52 C ATOM 114 OG SER A 25 -8.672 6.078 4.093 1.00 44.41 O ATOM 0 H SER A 25 -10.595 4.986 5.849 1.00 71.33 H new ATOM 0 HA SER A 25 -8.430 6.630 6.604 1.00 23.22 H new ATOM 0 HB2 SER A 25 -10.563 6.812 4.443 1.00 20.52 H new ATOM 0 HB3 SER A 25 -9.270 7.986 4.582 1.00 20.52 H new ATOM 0 HG SER A 25 -9.145 5.247 3.881 1.00 44.41 H new ATOM 120 N SER A 26 -11.438 7.803 7.202 1.00 21.25 N ATOM 121 CA SER A 26 -12.177 8.851 7.895 1.00 0.24 C ATOM 122 C SER A 26 -11.614 9.077 9.295 1.00 1.44 C ATOM 123 O SER A 26 -11.315 10.206 9.680 1.00 63.20 O ATOM 124 CB SER A 26 -13.661 8.488 7.981 1.00 23.44 C ATOM 125 OG SER A 26 -14.327 9.288 8.942 1.00 60.03 O ATOM 0 H SER A 26 -12.017 7.039 6.854 1.00 21.25 H new ATOM 0 HA SER A 26 -12.070 9.774 7.326 1.00 0.24 H new ATOM 0 HB2 SER A 26 -14.128 8.622 7.005 1.00 23.44 H new ATOM 0 HB3 SER A 26 -13.766 7.435 8.244 1.00 23.44 H new ATOM 0 HG SER A 26 -15.274 9.038 8.977 1.00 60.03 H new ATOM 131 N ASN A 27 -11.476 7.994 10.053 1.00 70.33 N ATOM 132 CA ASN A 27 -10.950 8.072 11.411 1.00 53.12 C ATOM 133 C ASN A 27 -9.435 8.243 11.398 1.00 23.03 C ATOM 134 O ASN A 27 -8.876 8.992 12.202 1.00 53.12 O ATOM 135 CB ASN A 27 -11.327 6.816 12.199 1.00 2.11 C ATOM 136 CG ASN A 27 -11.356 7.060 13.695 1.00 21.12 C ATOM 137 OD1 ASN A 27 -12.014 7.985 14.172 1.00 14.32 O ATOM 138 ND2 ASN A 27 -10.639 6.230 14.444 1.00 21.31 N ATOM 0 H ASN A 27 -11.721 7.052 9.750 1.00 70.33 H new ATOM 0 HA ASN A 27 -11.391 8.943 11.896 1.00 53.12 H new ATOM 0 HB2 ASN A 27 -12.306 6.465 11.872 1.00 2.11 H new ATOM 0 HB3 ASN A 27 -10.613 6.023 11.977 1.00 2.11 H new ATOM 0 HD21 ASN A 27 -10.619 6.346 15.457 1.00 21.31 H new ATOM 0 HD22 ASN A 27 -10.109 5.477 14.006 1.00 21.31 H new ATOM 145 N LEU A 28 -8.773 7.546 10.482 1.00 73.33 N ATOM 146 CA LEU A 28 -7.321 7.621 10.363 1.00 75.20 C ATOM 147 C LEU A 28 -6.871 9.050 10.075 1.00 11.32 C ATOM 148 O LEU A 28 -5.875 9.520 10.626 1.00 40.42 O ATOM 149 CB LEU A 28 -6.832 6.687 9.254 1.00 50.03 C ATOM 150 CG LEU A 28 -5.316 6.560 9.105 1.00 62.40 C ATOM 151 CD1 LEU A 28 -4.759 7.724 8.298 1.00 35.54 C ATOM 152 CD2 LEU A 28 -4.648 6.489 10.470 1.00 11.02 C ATOM 0 H LEU A 28 -9.219 6.922 9.810 1.00 73.33 H new ATOM 0 HA LEU A 28 -6.887 7.307 11.312 1.00 75.20 H new ATOM 0 HB2 LEU A 28 -7.244 5.694 9.435 1.00 50.03 H new ATOM 0 HB3 LEU A 28 -7.242 7.035 8.306 1.00 50.03 H new ATOM 0 HG LEU A 28 -5.101 5.636 8.569 1.00 62.40 H new ATOM 0 HD11 LEU A 28 -3.679 7.616 8.202 1.00 35.54 H new ATOM 0 HD12 LEU A 28 -5.212 7.729 7.307 1.00 35.54 H new ATOM 0 HD13 LEU A 28 -4.987 8.661 8.806 1.00 35.54 H new ATOM 0 HD21 LEU A 28 -3.569 6.399 10.343 1.00 11.02 H new ATOM 0 HD22 LEU A 28 -4.873 7.395 11.033 1.00 11.02 H new ATOM 0 HD23 LEU A 28 -5.023 5.622 11.014 1.00 11.02 H new ATOM 164 N LEU A 29 -7.612 9.735 9.212 1.00 11.13 N ATOM 165 CA LEU A 29 -7.291 11.113 8.853 1.00 20.12 C ATOM 166 C LEU A 29 -7.629 12.066 9.995 1.00 22.04 C ATOM 167 O LEU A 29 -6.937 13.060 10.213 1.00 1.25 O ATOM 168 CB LEU A 29 -8.050 11.521 7.590 1.00 12.34 C ATOM 169 CG LEU A 29 -7.336 11.261 6.264 1.00 22.14 C ATOM 170 CD1 LEU A 29 -6.675 9.890 6.273 1.00 4.33 C ATOM 171 CD2 LEU A 29 -8.311 11.376 5.101 1.00 0.24 C ATOM 0 H LEU A 29 -8.439 9.360 8.748 1.00 11.13 H new ATOM 0 HA LEU A 29 -6.220 11.173 8.660 1.00 20.12 H new ATOM 0 HB2 LEU A 29 -9.003 10.992 7.576 1.00 12.34 H new ATOM 0 HB3 LEU A 29 -8.277 12.585 7.655 1.00 12.34 H new ATOM 0 HG LEU A 29 -6.560 12.016 6.138 1.00 22.14 H new ATOM 0 HD11 LEU A 29 -6.172 9.723 5.321 1.00 4.33 H new ATOM 0 HD12 LEU A 29 -5.946 9.843 7.082 1.00 4.33 H new ATOM 0 HD13 LEU A 29 -7.433 9.121 6.423 1.00 4.33 H new ATOM 0 HD21 LEU A 29 -7.785 11.188 4.165 1.00 0.24 H new ATOM 0 HD22 LEU A 29 -9.110 10.644 5.222 1.00 0.24 H new ATOM 0 HD23 LEU A 29 -8.738 12.379 5.082 1.00 0.24 H new ATOM 183 N SER A 30 -8.697 11.754 10.723 1.00 14.41 N ATOM 184 CA SER A 30 -9.130 12.585 11.842 1.00 72.51 C ATOM 185 C SER A 30 -8.410 12.182 13.125 1.00 24.44 C ATOM 186 O SER A 30 -8.736 12.665 14.210 1.00 21.20 O ATOM 187 CB SER A 30 -10.643 12.471 12.034 1.00 62.25 C ATOM 188 OG SER A 30 -10.955 11.918 13.301 1.00 33.54 O ATOM 0 H SER A 30 -9.278 10.932 10.558 1.00 14.41 H new ATOM 0 HA SER A 30 -8.878 13.621 11.614 1.00 72.51 H new ATOM 0 HB2 SER A 30 -11.100 13.456 11.941 1.00 62.25 H new ATOM 0 HB3 SER A 30 -11.067 11.847 11.247 1.00 62.25 H new ATOM 0 HG SER A 30 -10.431 12.371 13.994 1.00 33.54 H new ATOM 194 N SER A 31 -7.430 11.293 12.993 1.00 52.01 N ATOM 195 CA SER A 31 -6.666 10.822 14.143 1.00 34.22 C ATOM 196 C SER A 31 -6.232 11.990 15.023 1.00 13.11 C ATOM 197 O SER A 31 -5.829 13.040 14.526 1.00 44.23 O ATOM 198 CB SER A 31 -5.438 10.036 13.678 1.00 73.41 C ATOM 199 OG SER A 31 -5.670 8.640 13.748 1.00 21.35 O ATOM 0 H SER A 31 -7.147 10.885 12.102 1.00 52.01 H new ATOM 0 HA SER A 31 -7.308 10.166 14.731 1.00 34.22 H new ATOM 0 HB2 SER A 31 -5.189 10.316 12.654 1.00 73.41 H new ATOM 0 HB3 SER A 31 -4.580 10.297 14.297 1.00 73.41 H new ATOM 0 HG SER A 31 -4.871 8.160 13.444 1.00 21.35 H new ATOM 205 N GLY A 32 -6.321 11.798 16.336 1.00 62.14 N ATOM 206 CA GLY A 32 -5.934 12.843 17.266 1.00 15.53 C ATOM 207 C GLY A 32 -4.505 13.301 17.062 1.00 41.34 C ATOM 208 O GLY A 32 -4.128 14.392 17.493 1.00 74.41 O ATOM 0 H GLY A 32 -6.654 10.938 16.772 1.00 62.14 H new ATOM 0 HA2 GLY A 32 -6.605 13.694 17.151 1.00 15.53 H new ATOM 0 HA3 GLY A 32 -6.053 12.479 18.287 1.00 15.53 H new ATOM 212 N ASP A 33 -3.705 12.468 16.405 1.00 54.42 N ATOM 213 CA ASP A 33 -2.308 12.794 16.144 1.00 11.35 C ATOM 214 C ASP A 33 -2.114 13.238 14.698 1.00 31.31 C ATOM 215 O ASP A 33 -1.316 14.132 14.415 1.00 72.24 O ATOM 216 CB ASP A 33 -1.417 11.589 16.445 1.00 24.24 C ATOM 217 CG ASP A 33 -1.024 11.509 17.907 1.00 2.22 C ATOM 218 OD1 ASP A 33 -1.608 12.256 18.720 1.00 70.23 O ATOM 219 OD2 ASP A 33 -0.132 10.700 18.239 1.00 24.44 O ATOM 0 H ASP A 33 -4.001 11.561 16.043 1.00 54.42 H new ATOM 0 HA ASP A 33 -2.024 13.618 16.798 1.00 11.35 H new ATOM 0 HB2 ASP A 33 -1.939 10.675 16.162 1.00 24.24 H new ATOM 0 HB3 ASP A 33 -0.517 11.645 15.833 1.00 24.24 H new ATOM 224 N PHE A 34 -2.846 12.607 13.786 1.00 1.34 N ATOM 225 CA PHE A 34 -2.753 12.934 12.369 1.00 22.22 C ATOM 226 C PHE A 34 -3.334 14.318 12.092 1.00 65.13 C ATOM 227 O PHE A 34 -2.788 15.085 11.298 1.00 12.03 O ATOM 228 CB PHE A 34 -3.486 11.884 11.532 1.00 52.05 C ATOM 229 CG PHE A 34 -2.899 11.693 10.162 1.00 13.30 C ATOM 230 CD1 PHE A 34 -1.592 11.261 10.008 1.00 70.12 C ATOM 231 CD2 PHE A 34 -3.655 11.949 9.028 1.00 2.35 C ATOM 232 CE1 PHE A 34 -1.050 11.085 8.749 1.00 51.54 C ATOM 233 CE2 PHE A 34 -3.118 11.774 7.767 1.00 50.04 C ATOM 234 CZ PHE A 34 -1.814 11.341 7.627 1.00 1.41 C ATOM 0 H PHE A 34 -3.511 11.865 14.004 1.00 1.34 H new ATOM 0 HA PHE A 34 -1.699 12.939 12.091 1.00 22.22 H new ATOM 0 HB2 PHE A 34 -3.469 10.932 12.062 1.00 52.05 H new ATOM 0 HB3 PHE A 34 -4.532 12.175 11.433 1.00 52.05 H new ATOM 0 HD1 PHE A 34 -0.990 11.059 10.882 1.00 70.12 H new ATOM 0 HD2 PHE A 34 -4.675 12.289 9.132 1.00 2.35 H new ATOM 0 HE1 PHE A 34 -0.030 10.747 8.642 1.00 51.54 H new ATOM 0 HE2 PHE A 34 -3.717 11.976 6.892 1.00 50.04 H new ATOM 0 HZ PHE A 34 -1.392 11.203 6.642 1.00 1.41 H new ATOM 244 N VAL A 35 -4.445 14.630 12.752 1.00 64.34 N ATOM 245 CA VAL A 35 -5.100 15.920 12.577 1.00 40.51 C ATOM 246 C VAL A 35 -4.132 17.068 12.838 1.00 65.22 C ATOM 247 O VAL A 35 -4.185 18.101 12.169 1.00 11.12 O ATOM 248 CB VAL A 35 -6.314 16.065 13.515 1.00 22.20 C ATOM 249 CG1 VAL A 35 -7.402 15.072 13.138 1.00 21.30 C ATOM 250 CG2 VAL A 35 -5.890 15.880 14.965 1.00 62.40 C ATOM 0 H VAL A 35 -4.910 14.007 13.412 1.00 64.34 H new ATOM 0 HA VAL A 35 -5.441 15.964 11.543 1.00 40.51 H new ATOM 0 HB VAL A 35 -6.720 17.070 13.404 1.00 22.20 H new ATOM 0 HG11 VAL A 35 -8.251 15.189 13.811 1.00 21.30 H new ATOM 0 HG12 VAL A 35 -7.724 15.256 12.113 1.00 21.30 H new ATOM 0 HG13 VAL A 35 -7.012 14.057 13.219 1.00 21.30 H new ATOM 0 HG21 VAL A 35 -6.759 15.985 15.614 1.00 62.40 H new ATOM 0 HG22 VAL A 35 -5.459 14.887 15.094 1.00 62.40 H new ATOM 0 HG23 VAL A 35 -5.148 16.635 15.226 1.00 62.40 H new ATOM 260 N GLN A 36 -3.248 16.880 13.812 1.00 61.00 N ATOM 261 CA GLN A 36 -2.266 17.901 14.159 1.00 51.14 C ATOM 262 C GLN A 36 -1.307 18.152 13.000 1.00 4.11 C ATOM 263 O GLN A 36 -0.929 19.292 12.731 1.00 22.00 O ATOM 264 CB GLN A 36 -1.482 17.481 15.403 1.00 64.02 C ATOM 265 CG GLN A 36 -1.881 18.240 16.660 1.00 74.30 C ATOM 266 CD GLN A 36 -0.696 18.877 17.358 1.00 75.21 C ATOM 267 OE1 GLN A 36 -0.089 18.279 18.247 1.00 41.21 O ATOM 268 NE2 GLN A 36 -0.361 20.098 16.959 1.00 63.12 N ATOM 0 H GLN A 36 -3.191 16.031 14.375 1.00 61.00 H new ATOM 0 HA GLN A 36 -2.801 18.827 14.370 1.00 51.14 H new ATOM 0 HB2 GLN A 36 -1.628 16.414 15.571 1.00 64.02 H new ATOM 0 HB3 GLN A 36 -0.418 17.632 15.220 1.00 64.02 H new ATOM 0 HG2 GLN A 36 -2.603 19.014 16.399 1.00 74.30 H new ATOM 0 HG3 GLN A 36 -2.380 17.558 17.349 1.00 74.30 H new ATOM 0 HE21 GLN A 36 -0.892 20.556 16.218 1.00 63.12 H new ATOM 0 HE22 GLN A 36 0.428 20.578 17.393 1.00 63.12 H new ATOM 277 N MET A 37 -0.918 17.080 12.317 1.00 52.55 N ATOM 278 CA MET A 37 -0.004 17.186 11.186 1.00 3.14 C ATOM 279 C MET A 37 -0.688 17.848 9.995 1.00 72.22 C ATOM 280 O MET A 37 -0.141 18.769 9.385 1.00 1.31 O ATOM 281 CB MET A 37 0.511 15.801 10.788 1.00 13.24 C ATOM 282 CG MET A 37 1.818 15.839 10.014 1.00 25.51 C ATOM 283 SD MET A 37 1.675 15.101 8.374 1.00 44.11 S ATOM 284 CE MET A 37 1.111 13.453 8.790 1.00 5.52 C ATOM 0 H MET A 37 -1.221 16.129 12.527 1.00 52.55 H new ATOM 0 HA MET A 37 0.839 17.806 11.489 1.00 3.14 H new ATOM 0 HB2 MET A 37 0.648 15.201 11.688 1.00 13.24 H new ATOM 0 HB3 MET A 37 -0.246 15.301 10.183 1.00 13.24 H new ATOM 0 HG2 MET A 37 2.148 16.873 9.915 1.00 25.51 H new ATOM 0 HG3 MET A 37 2.586 15.312 10.580 1.00 25.51 H new ATOM 0 HE1 MET A 37 1.262 12.791 7.938 1.00 5.52 H new ATOM 0 HE2 MET A 37 1.676 13.080 9.644 1.00 5.52 H new ATOM 0 HE3 MET A 37 0.051 13.484 9.042 1.00 5.52 H new ATOM 294 N ILE A 38 -1.884 17.373 9.666 1.00 54.14 N ATOM 295 CA ILE A 38 -2.643 17.921 8.548 1.00 64.32 C ATOM 296 C ILE A 38 -3.023 19.375 8.801 1.00 43.30 C ATOM 297 O ILE A 38 -3.114 20.176 7.869 1.00 25.04 O ATOM 298 CB ILE A 38 -3.922 17.106 8.282 1.00 50.53 C ATOM 299 CG1 ILE A 38 -3.588 15.620 8.143 1.00 5.22 C ATOM 300 CG2 ILE A 38 -4.625 17.616 7.032 1.00 31.13 C ATOM 301 CD1 ILE A 38 -4.806 14.738 7.986 1.00 22.43 C ATOM 0 H ILE A 38 -2.349 16.610 10.158 1.00 54.14 H new ATOM 0 HA ILE A 38 -1.998 17.865 7.671 1.00 64.32 H new ATOM 0 HB ILE A 38 -4.596 17.229 9.130 1.00 50.53 H new ATOM 0 HG12 ILE A 38 -2.936 15.482 7.280 1.00 5.22 H new ATOM 0 HG13 ILE A 38 -3.028 15.298 9.021 1.00 5.22 H new ATOM 0 HG21 ILE A 38 -5.527 17.030 6.857 1.00 31.13 H new ATOM 0 HG22 ILE A 38 -4.893 18.664 7.167 1.00 31.13 H new ATOM 0 HG23 ILE A 38 -3.958 17.520 6.175 1.00 31.13 H new ATOM 0 HD11 ILE A 38 -4.493 13.698 7.893 1.00 22.43 H new ATOM 0 HD12 ILE A 38 -5.449 14.846 8.860 1.00 22.43 H new ATOM 0 HD13 ILE A 38 -5.356 15.033 7.092 1.00 22.43 H new ATOM 313 N SER A 39 -3.242 19.712 10.068 1.00 54.15 N ATOM 314 CA SER A 39 -3.614 21.071 10.444 1.00 2.21 C ATOM 315 C SER A 39 -2.392 21.983 10.467 1.00 30.41 C ATOM 316 O SER A 39 -2.504 23.196 10.285 1.00 34.15 O ATOM 317 CB SER A 39 -4.293 21.076 11.815 1.00 23.14 C ATOM 318 OG SER A 39 -4.906 22.327 12.077 1.00 22.22 O ATOM 0 H SER A 39 -3.168 19.063 10.851 1.00 54.15 H new ATOM 0 HA SER A 39 -4.313 21.448 9.698 1.00 2.21 H new ATOM 0 HB2 SER A 39 -5.042 20.285 11.856 1.00 23.14 H new ATOM 0 HB3 SER A 39 -3.557 20.859 12.589 1.00 23.14 H new ATOM 0 HG SER A 39 -5.334 22.303 12.958 1.00 22.22 H new ATOM 324 N SER A 40 -1.224 21.391 10.689 1.00 2.13 N ATOM 325 CA SER A 40 0.022 22.149 10.738 1.00 1.31 C ATOM 326 C SER A 40 0.664 22.229 9.357 1.00 4.12 C ATOM 327 O SER A 40 1.740 22.806 9.192 1.00 1.42 O ATOM 328 CB SER A 40 0.995 21.508 11.730 1.00 71.42 C ATOM 329 OG SER A 40 1.700 20.435 11.130 1.00 5.01 O ATOM 0 H SER A 40 -1.113 20.388 10.838 1.00 2.13 H new ATOM 0 HA SER A 40 -0.210 23.161 11.070 1.00 1.31 H new ATOM 0 HB2 SER A 40 1.702 22.257 12.087 1.00 71.42 H new ATOM 0 HB3 SER A 40 0.447 21.146 12.600 1.00 71.42 H new ATOM 0 HG SER A 40 1.090 19.921 10.561 1.00 5.01 H new ATOM 335 N THR A 41 -0.003 21.647 8.366 1.00 11.15 N ATOM 336 CA THR A 41 0.501 21.651 6.999 1.00 32.42 C ATOM 337 C THR A 41 0.853 23.065 6.546 1.00 24.35 C ATOM 338 O THR A 41 1.750 23.260 5.724 1.00 3.53 O ATOM 339 CB THR A 41 -0.525 21.051 6.019 1.00 45.32 C ATOM 340 OG1 THR A 41 -1.800 21.676 6.203 1.00 14.22 O ATOM 341 CG2 THR A 41 -0.656 19.549 6.225 1.00 54.42 C ATOM 0 H THR A 41 -0.895 21.166 8.485 1.00 11.15 H new ATOM 0 HA THR A 41 1.401 21.036 6.993 1.00 32.42 H new ATOM 0 HB THR A 41 -0.174 21.233 5.003 1.00 45.32 H new ATOM 0 HG1 THR A 41 -2.228 21.316 7.008 1.00 14.22 H new ATOM 0 HG21 THR A 41 -1.386 19.148 5.522 1.00 54.42 H new ATOM 0 HG22 THR A 41 0.310 19.073 6.056 1.00 54.42 H new ATOM 0 HG23 THR A 41 -0.986 19.349 7.244 1.00 54.42 H new ATOM 349 N THR A 42 0.142 24.048 7.089 1.00 4.34 N ATOM 350 CA THR A 42 0.379 25.443 6.741 1.00 30.10 C ATOM 351 C THR A 42 -0.126 25.753 5.336 1.00 44.14 C ATOM 352 O THR A 42 -1.098 26.487 5.163 1.00 30.23 O ATOM 353 CB THR A 42 1.876 25.797 6.827 1.00 75.53 C ATOM 354 OG1 THR A 42 2.471 25.141 7.951 1.00 4.22 O ATOM 355 CG2 THR A 42 2.070 27.301 6.948 1.00 52.23 C ATOM 0 H THR A 42 -0.602 23.904 7.771 1.00 4.34 H new ATOM 0 HA THR A 42 -0.171 26.047 7.463 1.00 30.10 H new ATOM 0 HB THR A 42 2.361 25.457 5.912 1.00 75.53 H new ATOM 0 HG1 THR A 42 3.423 25.370 7.997 1.00 4.22 H new ATOM 0 HG21 THR A 42 3.135 27.527 7.007 1.00 52.23 H new ATOM 0 HG22 THR A 42 1.642 27.794 6.075 1.00 52.23 H new ATOM 0 HG23 THR A 42 1.572 27.661 7.848 1.00 52.23 H new ATOM 363 N SER A 43 0.541 25.187 4.335 1.00 63.15 N ATOM 364 CA SER A 43 0.161 25.405 2.944 1.00 30.21 C ATOM 365 C SER A 43 -0.791 24.315 2.463 1.00 30.32 C ATOM 366 O SER A 43 -0.499 23.123 2.575 1.00 1.22 O ATOM 367 CB SER A 43 1.406 25.441 2.054 1.00 71.20 C ATOM 368 OG SER A 43 1.707 26.765 1.649 1.00 11.35 O ATOM 0 H SER A 43 1.347 24.574 4.461 1.00 63.15 H new ATOM 0 HA SER A 43 -0.352 26.364 2.879 1.00 30.21 H new ATOM 0 HB2 SER A 43 2.255 25.021 2.594 1.00 71.20 H new ATOM 0 HB3 SER A 43 1.246 24.816 1.175 1.00 71.20 H new ATOM 0 HG SER A 43 2.507 26.760 1.083 1.00 11.35 H new ATOM 374 N THR A 44 -1.934 24.731 1.925 1.00 4.23 N ATOM 375 CA THR A 44 -2.932 23.792 1.429 1.00 63.52 C ATOM 376 C THR A 44 -2.322 22.826 0.421 1.00 74.24 C ATOM 377 O THR A 44 -2.764 21.683 0.294 1.00 31.23 O ATOM 378 CB THR A 44 -4.114 24.525 0.770 1.00 55.42 C ATOM 379 OG1 THR A 44 -3.900 25.940 0.816 1.00 41.54 O ATOM 380 CG2 THR A 44 -5.422 24.181 1.469 1.00 42.53 C ATOM 0 H THR A 44 -2.191 25.713 1.822 1.00 4.23 H new ATOM 0 HA THR A 44 -3.297 23.233 2.291 1.00 63.52 H new ATOM 0 HB THR A 44 -4.180 24.202 -0.269 1.00 55.42 H new ATOM 0 HG1 THR A 44 -4.656 26.399 0.393 1.00 41.54 H new ATOM 0 HG21 THR A 44 -6.243 24.711 0.986 1.00 42.53 H new ATOM 0 HG22 THR A 44 -5.596 23.107 1.406 1.00 42.53 H new ATOM 0 HG23 THR A 44 -5.364 24.479 2.516 1.00 42.53 H new ATOM 388 N ASP A 45 -1.304 23.290 -0.298 1.00 3.45 N ATOM 389 CA ASP A 45 -0.633 22.466 -1.295 1.00 21.23 C ATOM 390 C ASP A 45 0.013 21.245 -0.645 1.00 72.33 C ATOM 391 O ASP A 45 0.016 20.155 -1.219 1.00 53.44 O ATOM 392 CB ASP A 45 0.427 23.284 -2.036 1.00 0.41 C ATOM 393 CG ASP A 45 -0.138 23.998 -3.248 1.00 2.31 C ATOM 394 OD1 ASP A 45 -1.357 24.272 -3.262 1.00 20.14 O ATOM 395 OD2 ASP A 45 0.640 24.286 -4.181 1.00 23.54 O ATOM 0 H ASP A 45 -0.926 24.233 -0.208 1.00 3.45 H new ATOM 0 HA ASP A 45 -1.381 22.123 -2.010 1.00 21.23 H new ATOM 0 HB2 ASP A 45 0.859 24.017 -1.354 1.00 0.41 H new ATOM 0 HB3 ASP A 45 1.237 22.625 -2.350 1.00 0.41 H new ATOM 400 N GLN A 46 0.557 21.436 0.552 1.00 61.45 N ATOM 401 CA GLN A 46 1.207 20.350 1.277 1.00 72.14 C ATOM 402 C GLN A 46 0.204 19.259 1.635 1.00 33.11 C ATOM 403 O GLN A 46 0.587 18.145 1.992 1.00 31.13 O ATOM 404 CB GLN A 46 1.873 20.884 2.546 1.00 53.13 C ATOM 405 CG GLN A 46 3.382 21.029 2.427 1.00 33.23 C ATOM 406 CD GLN A 46 3.792 22.315 1.737 1.00 20.42 C ATOM 407 OE1 GLN A 46 2.961 23.014 1.156 1.00 23.31 O ATOM 408 NE2 GLN A 46 5.080 22.633 1.796 1.00 24.34 N ATOM 0 H GLN A 46 0.561 22.331 1.040 1.00 61.45 H new ATOM 0 HA GLN A 46 1.970 19.918 0.629 1.00 72.14 H new ATOM 0 HB2 GLN A 46 1.441 21.854 2.792 1.00 53.13 H new ATOM 0 HB3 GLN A 46 1.645 20.214 3.375 1.00 53.13 H new ATOM 0 HG2 GLN A 46 3.826 20.998 3.422 1.00 33.23 H new ATOM 0 HG3 GLN A 46 3.782 20.180 1.873 1.00 33.23 H new ATOM 0 HE21 GLN A 46 5.734 22.024 2.288 1.00 24.34 H new ATOM 0 HE22 GLN A 46 5.416 23.486 1.349 1.00 24.34 H new ATOM 417 N ALA A 47 -1.080 19.586 1.537 1.00 4.43 N ATOM 418 CA ALA A 47 -2.137 18.633 1.849 1.00 64.20 C ATOM 419 C ALA A 47 -2.067 17.416 0.934 1.00 60.42 C ATOM 420 O ALA A 47 -2.415 16.304 1.334 1.00 14.02 O ATOM 421 CB ALA A 47 -3.500 19.301 1.737 1.00 0.33 C ATOM 0 H ALA A 47 -1.413 20.504 1.244 1.00 4.43 H new ATOM 0 HA ALA A 47 -1.994 18.293 2.875 1.00 64.20 H new ATOM 0 HB1 ALA A 47 -4.280 18.577 1.973 1.00 0.33 H new ATOM 0 HB2 ALA A 47 -3.555 20.135 2.437 1.00 0.33 H new ATOM 0 HB3 ALA A 47 -3.642 19.670 0.721 1.00 0.33 H new ATOM 427 N VAL A 48 -1.614 17.632 -0.297 1.00 22.45 N ATOM 428 CA VAL A 48 -1.496 16.551 -1.269 1.00 14.00 C ATOM 429 C VAL A 48 -0.374 15.591 -0.890 1.00 74.44 C ATOM 430 O VAL A 48 -0.456 14.390 -1.151 1.00 1.23 O ATOM 431 CB VAL A 48 -1.235 17.097 -2.685 1.00 31.02 C ATOM 432 CG1 VAL A 48 -2.298 18.114 -3.069 1.00 53.24 C ATOM 433 CG2 VAL A 48 0.156 17.707 -2.773 1.00 72.02 C ATOM 0 H VAL A 48 -1.323 18.546 -0.645 1.00 22.45 H new ATOM 0 HA VAL A 48 -2.445 16.015 -1.264 1.00 14.00 H new ATOM 0 HB VAL A 48 -1.288 16.268 -3.391 1.00 31.02 H new ATOM 0 HG11 VAL A 48 -2.097 18.489 -4.073 1.00 53.24 H new ATOM 0 HG12 VAL A 48 -3.279 17.640 -3.048 1.00 53.24 H new ATOM 0 HG13 VAL A 48 -2.281 18.943 -2.362 1.00 53.24 H new ATOM 0 HG21 VAL A 48 0.323 18.088 -3.781 1.00 72.02 H new ATOM 0 HG22 VAL A 48 0.241 18.525 -2.057 1.00 72.02 H new ATOM 0 HG23 VAL A 48 0.902 16.946 -2.544 1.00 72.02 H new ATOM 443 N SER A 49 0.675 16.129 -0.276 1.00 20.40 N ATOM 444 CA SER A 49 1.816 15.319 0.136 1.00 72.43 C ATOM 445 C SER A 49 1.422 14.345 1.242 1.00 72.54 C ATOM 446 O SER A 49 1.730 13.155 1.175 1.00 3.30 O ATOM 447 CB SER A 49 2.958 16.218 0.616 1.00 41.43 C ATOM 448 OG SER A 49 4.214 15.590 0.426 1.00 4.51 O ATOM 0 H SER A 49 0.759 17.121 -0.053 1.00 20.40 H new ATOM 0 HA SER A 49 2.152 14.744 -0.727 1.00 72.43 H new ATOM 0 HB2 SER A 49 2.934 17.163 0.073 1.00 41.43 H new ATOM 0 HB3 SER A 49 2.821 16.453 1.671 1.00 41.43 H new ATOM 0 HG SER A 49 4.928 16.185 0.739 1.00 4.51 H new ATOM 454 N VAL A 50 0.736 14.859 2.257 1.00 63.22 N ATOM 455 CA VAL A 50 0.297 14.036 3.378 1.00 25.30 C ATOM 456 C VAL A 50 -0.750 13.020 2.937 1.00 75.01 C ATOM 457 O VAL A 50 -0.752 11.877 3.393 1.00 32.12 O ATOM 458 CB VAL A 50 -0.285 14.897 4.514 1.00 65.22 C ATOM 459 CG1 VAL A 50 -1.417 15.770 3.995 1.00 21.04 C ATOM 460 CG2 VAL A 50 -0.760 14.017 5.660 1.00 1.22 C ATOM 0 H VAL A 50 0.472 15.842 2.327 1.00 63.22 H new ATOM 0 HA VAL A 50 1.177 13.509 3.747 1.00 25.30 H new ATOM 0 HB VAL A 50 0.502 15.550 4.891 1.00 65.22 H new ATOM 0 HG11 VAL A 50 -1.816 16.372 4.812 1.00 21.04 H new ATOM 0 HG12 VAL A 50 -1.040 16.427 3.211 1.00 21.04 H new ATOM 0 HG13 VAL A 50 -2.207 15.138 3.590 1.00 21.04 H new ATOM 0 HG21 VAL A 50 -1.168 14.642 6.454 1.00 1.22 H new ATOM 0 HG22 VAL A 50 -1.532 13.337 5.301 1.00 1.22 H new ATOM 0 HG23 VAL A 50 0.080 13.440 6.048 1.00 1.22 H new ATOM 470 N ALA A 51 -1.639 13.446 2.045 1.00 1.14 N ATOM 471 CA ALA A 51 -2.693 12.573 1.540 1.00 3.41 C ATOM 472 C ALA A 51 -2.107 11.411 0.745 1.00 63.13 C ATOM 473 O ALA A 51 -2.533 10.266 0.895 1.00 61.55 O ATOM 474 CB ALA A 51 -3.668 13.365 0.682 1.00 44.41 C ATOM 0 H ALA A 51 -1.651 14.389 1.657 1.00 1.14 H new ATOM 0 HA ALA A 51 -3.231 12.161 2.394 1.00 3.41 H new ATOM 0 HB1 ALA A 51 -4.449 12.701 0.312 1.00 44.41 H new ATOM 0 HB2 ALA A 51 -4.118 14.157 1.280 1.00 44.41 H new ATOM 0 HB3 ALA A 51 -3.136 13.805 -0.161 1.00 44.41 H new ATOM 480 N THR A 52 -1.129 11.714 -0.103 1.00 40.32 N ATOM 481 CA THR A 52 -0.486 10.695 -0.923 1.00 75.12 C ATOM 482 C THR A 52 0.490 9.862 -0.102 1.00 51.13 C ATOM 483 O THR A 52 0.766 8.708 -0.430 1.00 1.42 O ATOM 484 CB THR A 52 0.266 11.323 -2.112 1.00 41.21 C ATOM 485 OG1 THR A 52 1.331 12.153 -1.635 1.00 63.22 O ATOM 486 CG2 THR A 52 -0.677 12.147 -2.974 1.00 50.12 C ATOM 0 H THR A 52 -0.765 12.657 -0.240 1.00 40.32 H new ATOM 0 HA THR A 52 -1.278 10.050 -1.303 1.00 75.12 H new ATOM 0 HB THR A 52 0.678 10.517 -2.719 1.00 41.21 H new ATOM 0 HG1 THR A 52 0.972 13.026 -1.372 1.00 63.22 H new ATOM 0 HG21 THR A 52 -0.123 12.580 -3.807 1.00 50.12 H new ATOM 0 HG22 THR A 52 -1.471 11.507 -3.360 1.00 50.12 H new ATOM 0 HG23 THR A 52 -1.114 12.945 -2.374 1.00 50.12 H new ATOM 494 N SER A 53 1.011 10.455 0.968 1.00 62.43 N ATOM 495 CA SER A 53 1.961 9.766 1.837 1.00 51.35 C ATOM 496 C SER A 53 1.369 8.464 2.366 1.00 54.14 C ATOM 497 O SER A 53 2.014 7.416 2.330 1.00 51.22 O ATOM 498 CB SER A 53 2.361 10.670 3.005 1.00 61.34 C ATOM 499 OG SER A 53 3.766 10.849 3.050 1.00 2.30 O ATOM 0 H SER A 53 0.792 11.409 1.254 1.00 62.43 H new ATOM 0 HA SER A 53 2.848 9.528 1.249 1.00 51.35 H new ATOM 0 HB2 SER A 53 1.870 11.638 2.905 1.00 61.34 H new ATOM 0 HB3 SER A 53 2.016 10.233 3.942 1.00 61.34 H new ATOM 0 HG SER A 53 3.998 11.431 3.803 1.00 2.30 H new ATOM 505 N VAL A 54 0.134 8.538 2.855 1.00 54.23 N ATOM 506 CA VAL A 54 -0.547 7.366 3.390 1.00 20.42 C ATOM 507 C VAL A 54 -0.897 6.379 2.281 1.00 4.12 C ATOM 508 O VAL A 54 -0.897 5.167 2.493 1.00 33.42 O ATOM 509 CB VAL A 54 -1.833 7.759 4.139 1.00 13.24 C ATOM 510 CG1 VAL A 54 -1.555 8.879 5.129 1.00 13.05 C ATOM 511 CG2 VAL A 54 -2.920 8.165 3.154 1.00 20.43 C ATOM 0 H VAL A 54 -0.414 9.397 2.891 1.00 54.23 H new ATOM 0 HA VAL A 54 0.141 6.891 4.089 1.00 20.42 H new ATOM 0 HB VAL A 54 -2.185 6.892 4.698 1.00 13.24 H new ATOM 0 HG11 VAL A 54 -2.476 9.143 5.648 1.00 13.05 H new ATOM 0 HG12 VAL A 54 -0.812 8.547 5.854 1.00 13.05 H new ATOM 0 HG13 VAL A 54 -1.177 9.751 4.595 1.00 13.05 H new ATOM 0 HG21 VAL A 54 -3.822 8.440 3.701 1.00 20.43 H new ATOM 0 HG22 VAL A 54 -2.578 9.017 2.566 1.00 20.43 H new ATOM 0 HG23 VAL A 54 -3.139 7.330 2.489 1.00 20.43 H new ATOM 521 N ALA A 55 -1.195 6.908 1.099 1.00 44.31 N ATOM 522 CA ALA A 55 -1.545 6.074 -0.043 1.00 72.04 C ATOM 523 C ALA A 55 -0.353 5.239 -0.499 1.00 51.43 C ATOM 524 O ALA A 55 -0.514 4.104 -0.947 1.00 1.33 O ATOM 525 CB ALA A 55 -2.056 6.935 -1.189 1.00 51.11 C ATOM 0 H ALA A 55 -1.201 7.910 0.908 1.00 44.31 H new ATOM 0 HA ALA A 55 -2.337 5.392 0.267 1.00 72.04 H new ATOM 0 HB1 ALA A 55 -2.314 6.298 -2.035 1.00 51.11 H new ATOM 0 HB2 ALA A 55 -2.940 7.484 -0.865 1.00 51.11 H new ATOM 0 HB3 ALA A 55 -1.281 7.640 -1.488 1.00 51.11 H new ATOM 531 N GLN A 56 0.841 5.809 -0.384 1.00 44.34 N ATOM 532 CA GLN A 56 2.060 5.118 -0.785 1.00 65.34 C ATOM 533 C GLN A 56 2.311 3.900 0.098 1.00 54.11 C ATOM 534 O GLN A 56 2.747 2.854 -0.380 1.00 32.23 O ATOM 535 CB GLN A 56 3.259 6.066 -0.718 1.00 51.23 C ATOM 536 CG GLN A 56 4.358 5.730 -1.713 1.00 4.44 C ATOM 537 CD GLN A 56 5.571 5.109 -1.052 1.00 24.55 C ATOM 538 OE1 GLN A 56 5.483 4.037 -0.449 1.00 5.40 O ATOM 539 NE2 GLN A 56 6.714 5.775 -1.162 1.00 42.03 N ATOM 0 H GLN A 56 0.991 6.748 -0.016 1.00 44.34 H new ATOM 0 HA GLN A 56 1.932 4.780 -1.813 1.00 65.34 H new ATOM 0 HB2 GLN A 56 2.916 7.085 -0.899 1.00 51.23 H new ATOM 0 HB3 GLN A 56 3.674 6.043 0.290 1.00 51.23 H new ATOM 0 HG2 GLN A 56 3.966 5.043 -2.464 1.00 4.44 H new ATOM 0 HG3 GLN A 56 4.659 6.637 -2.237 1.00 4.44 H new ATOM 0 HE21 GLN A 56 6.742 6.659 -1.670 1.00 42.03 H new ATOM 0 HE22 GLN A 56 7.564 5.403 -0.739 1.00 42.03 H new ATOM 548 N ASN A 57 2.034 4.045 1.390 1.00 3.21 N ATOM 549 CA ASN A 57 2.231 2.956 2.341 1.00 54.15 C ATOM 550 C ASN A 57 1.281 1.800 2.047 1.00 2.14 C ATOM 551 O ASN A 57 1.697 0.643 1.974 1.00 25.14 O ATOM 552 CB ASN A 57 2.017 3.457 3.771 1.00 33.35 C ATOM 553 CG ASN A 57 3.317 3.847 4.448 1.00 75.31 C ATOM 554 OD1 ASN A 57 4.287 3.089 4.435 1.00 4.20 O ATOM 555 ND2 ASN A 57 3.341 5.034 5.042 1.00 50.14 N ATOM 0 H ASN A 57 1.673 4.905 1.802 1.00 3.21 H new ATOM 0 HA ASN A 57 3.255 2.596 2.238 1.00 54.15 H new ATOM 0 HB2 ASN A 57 1.347 4.316 3.755 1.00 33.35 H new ATOM 0 HB3 ASN A 57 1.525 2.680 4.356 1.00 33.35 H new ATOM 0 HD21 ASN A 57 4.188 5.351 5.513 1.00 50.14 H new ATOM 0 HD22 ASN A 57 2.512 5.629 5.027 1.00 50.14 H new ATOM 562 N VAL A 58 0.002 2.119 1.879 1.00 11.12 N ATOM 563 CA VAL A 58 -1.008 1.107 1.592 1.00 50.12 C ATOM 564 C VAL A 58 -0.786 0.484 0.218 1.00 3.04 C ATOM 565 O VAL A 58 -0.997 -0.713 0.026 1.00 2.41 O ATOM 566 CB VAL A 58 -2.428 1.698 1.652 1.00 12.31 C ATOM 567 CG1 VAL A 58 -2.764 2.142 3.068 1.00 31.45 C ATOM 568 CG2 VAL A 58 -2.565 2.857 0.676 1.00 30.32 C ATOM 0 H VAL A 58 -0.360 3.071 1.937 1.00 11.12 H new ATOM 0 HA VAL A 58 -0.911 0.337 2.357 1.00 50.12 H new ATOM 0 HB VAL A 58 -3.137 0.922 1.362 1.00 12.31 H new ATOM 0 HG11 VAL A 58 -3.772 2.557 3.090 1.00 31.45 H new ATOM 0 HG12 VAL A 58 -2.710 1.286 3.740 1.00 31.45 H new ATOM 0 HG13 VAL A 58 -2.052 2.902 3.390 1.00 31.45 H new ATOM 0 HG21 VAL A 58 -3.575 3.262 0.732 1.00 30.32 H new ATOM 0 HG22 VAL A 58 -1.847 3.636 0.933 1.00 30.32 H new ATOM 0 HG23 VAL A 58 -2.371 2.504 -0.337 1.00 30.32 H new ATOM 578 N GLY A 59 -0.358 1.305 -0.736 1.00 23.33 N ATOM 579 CA GLY A 59 -0.114 0.816 -2.081 1.00 1.41 C ATOM 580 C GLY A 59 1.094 -0.094 -2.156 1.00 63.41 C ATOM 581 O GLY A 59 1.054 -1.139 -2.805 1.00 5.10 O ATOM 0 H GLY A 59 -0.176 2.300 -0.602 1.00 23.33 H new ATOM 0 HA2 GLY A 59 -0.993 0.277 -2.433 1.00 1.41 H new ATOM 0 HA3 GLY A 59 0.031 1.663 -2.752 1.00 1.41 H new ATOM 585 N ASN A 60 2.176 0.302 -1.491 1.00 30.04 N ATOM 586 CA ASN A 60 3.403 -0.486 -1.487 1.00 73.35 C ATOM 587 C ASN A 60 3.161 -1.868 -0.889 1.00 33.01 C ATOM 588 O ASN A 60 3.731 -2.859 -1.343 1.00 5.22 O ATOM 589 CB ASN A 60 4.497 0.239 -0.699 1.00 31.13 C ATOM 590 CG ASN A 60 5.787 -0.555 -0.638 1.00 71.10 C ATOM 591 OD1 ASN A 60 6.058 -1.248 0.343 1.00 15.51 O ATOM 592 ND2 ASN A 60 6.591 -0.457 -1.689 1.00 64.43 N ATOM 0 H ASN A 60 2.227 1.164 -0.948 1.00 30.04 H new ATOM 0 HA ASN A 60 3.729 -0.609 -2.520 1.00 73.35 H new ATOM 0 HB2 ASN A 60 4.691 1.208 -1.159 1.00 31.13 H new ATOM 0 HB3 ASN A 60 4.144 0.432 0.314 1.00 31.13 H new ATOM 0 HD21 ASN A 60 7.474 -0.968 -1.705 1.00 64.43 H new ATOM 0 HD22 ASN A 60 6.326 0.129 -2.481 1.00 64.43 H new ATOM 599 N GLN A 61 2.309 -1.925 0.130 1.00 33.43 N ATOM 600 CA GLN A 61 1.990 -3.186 0.789 1.00 75.02 C ATOM 601 C GLN A 61 1.357 -4.168 -0.191 1.00 65.25 C ATOM 602 O GLN A 61 1.546 -5.381 -0.081 1.00 11.42 O ATOM 603 CB GLN A 61 1.047 -2.945 1.969 1.00 52.11 C ATOM 604 CG GLN A 61 1.593 -3.446 3.296 1.00 14.52 C ATOM 605 CD GLN A 61 1.152 -4.861 3.611 1.00 23.54 C ATOM 606 OE1 GLN A 61 1.115 -5.198 4.896 1.00 10.33 O flip ATOM 607 NE2 GLN A 61 0.850 -5.645 2.711 1.00 74.05 N flip ATOM 0 H GLN A 61 1.828 -1.113 0.517 1.00 33.43 H new ATOM 0 HA GLN A 61 2.920 -3.619 1.159 1.00 75.02 H new ATOM 0 HB2 GLN A 61 0.844 -1.877 2.049 1.00 52.11 H new ATOM 0 HB3 GLN A 61 0.095 -3.436 1.769 1.00 52.11 H new ATOM 0 HG2 GLN A 61 2.682 -3.405 3.275 1.00 14.52 H new ATOM 0 HG3 GLN A 61 1.264 -2.781 4.094 1.00 14.52 H new ATOM 0 HE21 GLN A 61 0.893 -5.344 1.737 1.00 74.05 H new ATOM 0 HE22 GLN A 61 0.557 -6.595 2.939 1.00 74.05 H new ATOM 616 N LEU A 62 0.606 -3.638 -1.149 1.00 21.43 N ATOM 617 CA LEU A 62 -0.056 -4.469 -2.151 1.00 10.13 C ATOM 618 C LEU A 62 0.847 -4.689 -3.359 1.00 61.44 C ATOM 619 O LEU A 62 0.702 -5.671 -4.086 1.00 61.30 O ATOM 620 CB LEU A 62 -1.370 -3.821 -2.591 1.00 65.53 C ATOM 621 CG LEU A 62 -2.633 -4.657 -2.383 1.00 4.15 C ATOM 622 CD1 LEU A 62 -3.599 -3.940 -1.452 1.00 4.01 C ATOM 623 CD2 LEU A 62 -3.300 -4.958 -3.716 1.00 71.13 C ATOM 0 H LEU A 62 0.439 -2.637 -1.254 1.00 21.43 H new ATOM 0 HA LEU A 62 -0.269 -5.438 -1.701 1.00 10.13 H new ATOM 0 HB2 LEU A 62 -1.487 -2.881 -2.051 1.00 65.53 H new ATOM 0 HB3 LEU A 62 -1.293 -3.573 -3.650 1.00 65.53 H new ATOM 0 HG LEU A 62 -2.348 -5.602 -1.921 1.00 4.15 H new ATOM 0 HD11 LEU A 62 -4.492 -4.549 -1.315 1.00 4.01 H new ATOM 0 HD12 LEU A 62 -3.120 -3.776 -0.487 1.00 4.01 H new ATOM 0 HD13 LEU A 62 -3.878 -2.980 -1.886 1.00 4.01 H new ATOM 0 HD21 LEU A 62 -4.197 -5.554 -3.548 1.00 71.13 H new ATOM 0 HD22 LEU A 62 -3.572 -4.023 -4.206 1.00 71.13 H new ATOM 0 HD23 LEU A 62 -2.610 -5.513 -4.351 1.00 71.13 H new ATOM 635 N GLY A 63 1.784 -3.767 -3.568 1.00 33.31 N ATOM 636 CA GLY A 63 2.697 -3.880 -4.689 1.00 70.13 C ATOM 637 C GLY A 63 1.978 -4.102 -6.004 1.00 63.33 C ATOM 638 O GLY A 63 1.760 -5.242 -6.417 1.00 63.42 O ATOM 0 H GLY A 63 1.926 -2.945 -2.981 1.00 33.31 H new ATOM 0 HA2 GLY A 63 3.298 -2.973 -4.756 1.00 70.13 H new ATOM 0 HA3 GLY A 63 3.385 -4.706 -4.511 1.00 70.13 H new ATOM 642 N LEU A 64 1.606 -3.011 -6.665 1.00 63.24 N ATOM 643 CA LEU A 64 0.904 -3.092 -7.941 1.00 61.53 C ATOM 644 C LEU A 64 1.639 -2.298 -9.017 1.00 3.30 C ATOM 645 O LEU A 64 1.131 -1.292 -9.514 1.00 21.21 O ATOM 646 CB LEU A 64 -0.526 -2.571 -7.793 1.00 22.44 C ATOM 647 CG LEU A 64 -1.281 -3.028 -6.545 1.00 43.21 C ATOM 648 CD1 LEU A 64 -2.513 -2.165 -6.319 1.00 64.12 C ATOM 649 CD2 LEU A 64 -1.669 -4.494 -6.663 1.00 31.22 C ATOM 0 H LEU A 64 1.779 -2.060 -6.338 1.00 63.24 H new ATOM 0 HA LEU A 64 0.872 -4.138 -8.245 1.00 61.53 H new ATOM 0 HB2 LEU A 64 -0.497 -1.481 -7.797 1.00 22.44 H new ATOM 0 HB3 LEU A 64 -1.096 -2.877 -8.670 1.00 22.44 H new ATOM 0 HG LEU A 64 -0.622 -2.915 -5.684 1.00 43.21 H new ATOM 0 HD11 LEU A 64 -3.037 -2.506 -5.426 1.00 64.12 H new ATOM 0 HD12 LEU A 64 -2.210 -1.126 -6.188 1.00 64.12 H new ATOM 0 HD13 LEU A 64 -3.176 -2.244 -7.181 1.00 64.12 H new ATOM 0 HD21 LEU A 64 -2.206 -4.802 -5.766 1.00 31.22 H new ATOM 0 HD22 LEU A 64 -2.310 -4.632 -7.534 1.00 31.22 H new ATOM 0 HD23 LEU A 64 -0.770 -5.100 -6.774 1.00 31.22 H new ATOM 661 N ASP A 65 2.833 -2.755 -9.372 1.00 32.33 N ATOM 662 CA ASP A 65 3.636 -2.091 -10.392 1.00 0.32 C ATOM 663 C ASP A 65 4.094 -0.717 -9.912 1.00 23.22 C ATOM 664 O ASP A 65 3.294 0.078 -9.420 1.00 52.23 O ATOM 665 CB ASP A 65 2.836 -1.950 -11.689 1.00 22.12 C ATOM 666 CG ASP A 65 3.414 -2.782 -12.816 1.00 75.21 C ATOM 667 OD1 ASP A 65 4.498 -2.426 -13.322 1.00 33.45 O ATOM 668 OD2 ASP A 65 2.779 -3.791 -13.194 1.00 41.23 O ATOM 0 H ASP A 65 3.268 -3.585 -8.968 1.00 32.33 H new ATOM 0 HA ASP A 65 4.517 -2.703 -10.582 1.00 0.32 H new ATOM 0 HB2 ASP A 65 1.804 -2.251 -11.511 1.00 22.12 H new ATOM 0 HB3 ASP A 65 2.815 -0.902 -11.988 1.00 22.12 H new ATOM 673 N ALA A 66 5.388 -0.447 -10.055 1.00 15.44 N ATOM 674 CA ALA A 66 5.952 0.830 -9.635 1.00 12.13 C ATOM 675 C ALA A 66 5.369 1.981 -10.448 1.00 11.01 C ATOM 676 O ALA A 66 4.963 3.001 -9.894 1.00 61.10 O ATOM 677 CB ALA A 66 7.467 0.805 -9.765 1.00 63.32 C ATOM 0 H ALA A 66 6.065 -1.095 -10.458 1.00 15.44 H new ATOM 0 HA ALA A 66 5.690 0.989 -8.589 1.00 12.13 H new ATOM 0 HB1 ALA A 66 7.875 1.765 -9.448 1.00 63.32 H new ATOM 0 HB2 ALA A 66 7.873 0.013 -9.136 1.00 63.32 H new ATOM 0 HB3 ALA A 66 7.740 0.620 -10.804 1.00 63.32 H new ATOM 683 N ASN A 67 5.331 1.810 -11.765 1.00 3.25 N ATOM 684 CA ASN A 67 4.800 2.836 -12.655 1.00 13.34 C ATOM 685 C ASN A 67 3.298 3.011 -12.445 1.00 2.50 C ATOM 686 O ASN A 67 2.796 4.133 -12.394 1.00 12.33 O ATOM 687 CB ASN A 67 5.082 2.473 -14.114 1.00 3.25 C ATOM 688 CG ASN A 67 6.133 3.369 -14.739 1.00 51.34 C ATOM 689 OD1 ASN A 67 7.203 2.908 -15.136 1.00 3.41 O ATOM 690 ND2 ASN A 67 5.829 4.660 -14.832 1.00 20.51 N ATOM 0 H ASN A 67 5.662 0.970 -12.240 1.00 3.25 H new ATOM 0 HA ASN A 67 5.296 3.778 -12.420 1.00 13.34 H new ATOM 0 HB2 ASN A 67 5.412 1.436 -14.170 1.00 3.25 H new ATOM 0 HB3 ASN A 67 4.159 2.545 -14.689 1.00 3.25 H new ATOM 0 HD21 ASN A 67 6.495 5.312 -15.246 1.00 20.51 H new ATOM 0 HD22 ASN A 67 4.930 4.998 -14.490 1.00 20.51 H new ATOM 697 N ALA A 68 2.588 1.894 -12.325 1.00 51.00 N ATOM 698 CA ALA A 68 1.145 1.925 -12.118 1.00 44.02 C ATOM 699 C ALA A 68 0.798 2.533 -10.764 1.00 40.02 C ATOM 700 O ALA A 68 -0.178 3.273 -10.637 1.00 22.24 O ATOM 701 CB ALA A 68 0.566 0.523 -12.234 1.00 73.44 C ATOM 0 H ALA A 68 2.988 0.957 -12.368 1.00 51.00 H new ATOM 0 HA ALA A 68 0.704 2.553 -12.892 1.00 44.02 H new ATOM 0 HB1 ALA A 68 -0.512 0.560 -12.077 1.00 73.44 H new ATOM 0 HB2 ALA A 68 0.775 0.124 -13.227 1.00 73.44 H new ATOM 0 HB3 ALA A 68 1.020 -0.122 -11.481 1.00 73.44 H new ATOM 707 N MET A 69 1.601 2.215 -9.754 1.00 40.54 N ATOM 708 CA MET A 69 1.377 2.732 -8.408 1.00 25.41 C ATOM 709 C MET A 69 1.328 4.256 -8.413 1.00 64.21 C ATOM 710 O MET A 69 0.483 4.860 -7.752 1.00 62.45 O ATOM 711 CB MET A 69 2.480 2.247 -7.464 1.00 52.25 C ATOM 712 CG MET A 69 2.233 2.607 -6.008 1.00 62.44 C ATOM 713 SD MET A 69 2.450 1.201 -4.899 1.00 51.31 S ATOM 714 CE MET A 69 4.056 0.604 -5.420 1.00 74.05 C ATOM 0 H MET A 69 2.412 1.602 -9.841 1.00 40.54 H new ATOM 0 HA MET A 69 0.416 2.357 -8.055 1.00 25.41 H new ATOM 0 HB2 MET A 69 2.572 1.164 -7.552 1.00 52.25 H new ATOM 0 HB3 MET A 69 3.432 2.675 -7.780 1.00 52.25 H new ATOM 0 HG2 MET A 69 2.915 3.405 -5.714 1.00 62.44 H new ATOM 0 HG3 MET A 69 1.221 2.997 -5.901 1.00 62.44 H new ATOM 0 HE1 MET A 69 4.571 0.156 -4.570 1.00 74.05 H new ATOM 0 HE2 MET A 69 3.930 -0.144 -6.203 1.00 74.05 H new ATOM 0 HE3 MET A 69 4.646 1.436 -5.804 1.00 74.05 H new ATOM 724 N ASN A 70 2.239 4.872 -9.160 1.00 22.34 N ATOM 725 CA ASN A 70 2.299 6.325 -9.248 1.00 3.22 C ATOM 726 C ASN A 70 0.989 6.893 -9.787 1.00 64.22 C ATOM 727 O ASN A 70 0.530 7.946 -9.346 1.00 75.51 O ATOM 728 CB ASN A 70 3.462 6.755 -10.145 1.00 10.41 C ATOM 729 CG ASN A 70 4.809 6.567 -9.476 1.00 2.03 C ATOM 730 OD1 ASN A 70 4.920 6.626 -8.251 1.00 63.31 O ATOM 731 ND2 ASN A 70 5.842 6.340 -10.278 1.00 24.44 N ATOM 0 H ASN A 70 2.945 4.387 -9.713 1.00 22.34 H new ATOM 0 HA ASN A 70 2.458 6.718 -8.244 1.00 3.22 H new ATOM 0 HB2 ASN A 70 3.436 6.179 -11.070 1.00 10.41 H new ATOM 0 HB3 ASN A 70 3.338 7.803 -10.418 1.00 10.41 H new ATOM 0 HD21 ASN A 70 6.773 6.206 -9.884 1.00 24.44 H new ATOM 0 HD22 ASN A 70 5.704 6.299 -11.288 1.00 24.44 H new ATOM 738 N SER A 71 0.394 6.187 -10.742 1.00 62.40 N ATOM 739 CA SER A 71 -0.861 6.620 -11.345 1.00 53.24 C ATOM 740 C SER A 71 -2.011 6.503 -10.349 1.00 51.31 C ATOM 741 O SER A 71 -2.802 7.432 -10.183 1.00 71.32 O ATOM 742 CB SER A 71 -1.165 5.790 -12.594 1.00 50.51 C ATOM 743 OG SER A 71 -0.007 5.626 -13.392 1.00 3.01 O ATOM 0 H SER A 71 0.761 5.312 -11.115 1.00 62.40 H new ATOM 0 HA SER A 71 -0.756 7.667 -11.631 1.00 53.24 H new ATOM 0 HB2 SER A 71 -1.549 4.813 -12.300 1.00 50.51 H new ATOM 0 HB3 SER A 71 -1.946 6.278 -13.177 1.00 50.51 H new ATOM 0 HG SER A 71 -0.228 5.091 -14.183 1.00 3.01 H new ATOM 749 N LEU A 72 -2.096 5.354 -9.687 1.00 41.31 N ATOM 750 CA LEU A 72 -3.148 5.112 -8.707 1.00 55.31 C ATOM 751 C LEU A 72 -3.108 6.157 -7.596 1.00 24.25 C ATOM 752 O LEU A 72 -4.134 6.728 -7.227 1.00 10.14 O ATOM 753 CB LEU A 72 -3.006 3.711 -8.110 1.00 72.32 C ATOM 754 CG LEU A 72 -2.837 2.569 -9.113 1.00 2.24 C ATOM 755 CD1 LEU A 72 -1.962 1.471 -8.530 1.00 24.15 C ATOM 756 CD2 LEU A 72 -4.193 2.012 -9.520 1.00 53.41 C ATOM 0 H LEU A 72 -1.449 4.576 -9.812 1.00 41.31 H new ATOM 0 HA LEU A 72 -4.108 5.186 -9.217 1.00 55.31 H new ATOM 0 HB2 LEU A 72 -2.147 3.709 -7.439 1.00 72.32 H new ATOM 0 HB3 LEU A 72 -3.887 3.506 -7.501 1.00 72.32 H new ATOM 0 HG LEU A 72 -2.346 2.963 -10.003 1.00 2.24 H new ATOM 0 HD11 LEU A 72 -1.853 0.667 -9.258 1.00 24.15 H new ATOM 0 HD12 LEU A 72 -0.980 1.878 -8.289 1.00 24.15 H new ATOM 0 HD13 LEU A 72 -2.425 1.080 -7.624 1.00 24.15 H new ATOM 0 HD21 LEU A 72 -4.054 1.200 -10.234 1.00 53.41 H new ATOM 0 HD22 LEU A 72 -4.711 1.635 -8.638 1.00 53.41 H new ATOM 0 HD23 LEU A 72 -4.788 2.801 -9.980 1.00 53.41 H new ATOM 768 N LEU A 73 -1.914 6.403 -7.067 1.00 45.44 N ATOM 769 CA LEU A 73 -1.737 7.381 -5.999 1.00 14.43 C ATOM 770 C LEU A 73 -1.992 8.796 -6.508 1.00 50.11 C ATOM 771 O LEU A 73 -2.293 9.701 -5.732 1.00 54.14 O ATOM 772 CB LEU A 73 -0.326 7.284 -5.418 1.00 31.21 C ATOM 773 CG LEU A 73 0.131 5.886 -4.994 1.00 74.43 C ATOM 774 CD1 LEU A 73 1.638 5.751 -5.135 1.00 73.13 C ATOM 775 CD2 LEU A 73 -0.302 5.595 -3.565 1.00 1.31 C ATOM 0 H LEU A 73 -1.054 5.939 -7.360 1.00 45.44 H new ATOM 0 HA LEU A 73 -2.462 7.159 -5.216 1.00 14.43 H new ATOM 0 HB2 LEU A 73 0.377 7.665 -6.158 1.00 31.21 H new ATOM 0 HB3 LEU A 73 -0.265 7.943 -4.552 1.00 31.21 H new ATOM 0 HG LEU A 73 -0.340 5.155 -5.651 1.00 74.43 H new ATOM 0 HD11 LEU A 73 1.944 4.751 -4.829 1.00 73.13 H new ATOM 0 HD12 LEU A 73 1.922 5.915 -6.174 1.00 73.13 H new ATOM 0 HD13 LEU A 73 2.130 6.490 -4.503 1.00 73.13 H new ATOM 0 HD21 LEU A 73 0.031 4.597 -3.280 1.00 1.31 H new ATOM 0 HD22 LEU A 73 0.141 6.331 -2.894 1.00 1.31 H new ATOM 0 HD23 LEU A 73 -1.389 5.648 -3.496 1.00 1.31 H new ATOM 787 N GLY A 74 -1.873 8.979 -7.820 1.00 34.41 N ATOM 788 CA GLY A 74 -2.095 10.284 -8.411 1.00 14.22 C ATOM 789 C GLY A 74 -3.563 10.665 -8.439 1.00 64.23 C ATOM 790 O GLY A 74 -3.914 11.784 -8.815 1.00 31.53 O ATOM 0 H GLY A 74 -1.626 8.245 -8.484 1.00 34.41 H new ATOM 0 HA2 GLY A 74 -1.539 11.034 -7.848 1.00 14.22 H new ATOM 0 HA3 GLY A 74 -1.701 10.291 -9.427 1.00 14.22 H new ATOM 794 N ALA A 75 -4.422 9.732 -8.043 1.00 14.10 N ATOM 795 CA ALA A 75 -5.859 9.976 -8.024 1.00 31.05 C ATOM 796 C ALA A 75 -6.231 10.986 -6.944 1.00 53.01 C ATOM 797 O ALA A 75 -6.929 11.965 -7.209 1.00 42.23 O ATOM 798 CB ALA A 75 -6.613 8.671 -7.812 1.00 41.21 C ATOM 0 H ALA A 75 -4.148 8.800 -7.731 1.00 14.10 H new ATOM 0 HA ALA A 75 -6.144 10.395 -8.989 1.00 31.05 H new ATOM 0 HB1 ALA A 75 -7.685 8.868 -7.800 1.00 41.21 H new ATOM 0 HB2 ALA A 75 -6.380 7.980 -8.623 1.00 41.21 H new ATOM 0 HB3 ALA A 75 -6.315 8.229 -6.861 1.00 41.21 H new ATOM 804 N VAL A 76 -5.761 10.742 -5.725 1.00 71.53 N ATOM 805 CA VAL A 76 -6.043 11.630 -4.605 1.00 51.33 C ATOM 806 C VAL A 76 -5.367 12.983 -4.792 1.00 21.13 C ATOM 807 O VAL A 76 -5.917 14.021 -4.425 1.00 1.54 O ATOM 808 CB VAL A 76 -5.579 11.017 -3.270 1.00 54.42 C ATOM 809 CG1 VAL A 76 -4.097 10.682 -3.323 1.00 30.22 C ATOM 810 CG2 VAL A 76 -5.880 11.960 -2.116 1.00 53.44 C ATOM 0 H VAL A 76 -5.183 9.936 -5.488 1.00 71.53 H new ATOM 0 HA VAL A 76 -7.124 11.768 -4.576 1.00 51.33 H new ATOM 0 HB VAL A 76 -6.131 10.092 -3.105 1.00 54.42 H new ATOM 0 HG11 VAL A 76 -3.787 10.250 -2.371 1.00 30.22 H new ATOM 0 HG12 VAL A 76 -3.914 9.965 -4.123 1.00 30.22 H new ATOM 0 HG13 VAL A 76 -3.525 11.590 -3.512 1.00 30.22 H new ATOM 0 HG21 VAL A 76 -5.545 11.510 -1.181 1.00 53.44 H new ATOM 0 HG22 VAL A 76 -5.358 12.904 -2.272 1.00 53.44 H new ATOM 0 HG23 VAL A 76 -6.953 12.143 -2.066 1.00 53.44 H new ATOM 820 N SER A 77 -4.168 12.964 -5.367 1.00 53.42 N ATOM 821 CA SER A 77 -3.413 14.191 -5.600 1.00 65.32 C ATOM 822 C SER A 77 -4.256 15.212 -6.358 1.00 63.31 C ATOM 823 O SER A 77 -4.179 16.411 -6.098 1.00 51.44 O ATOM 824 CB SER A 77 -2.134 13.885 -6.383 1.00 0.33 C ATOM 825 OG SER A 77 -2.393 13.816 -7.774 1.00 52.14 O ATOM 0 H SER A 77 -3.699 12.114 -5.680 1.00 53.42 H new ATOM 0 HA SER A 77 -3.146 14.615 -4.632 1.00 65.32 H new ATOM 0 HB2 SER A 77 -1.390 14.657 -6.186 1.00 0.33 H new ATOM 0 HB3 SER A 77 -1.712 12.940 -6.041 1.00 0.33 H new ATOM 0 HG SER A 77 -3.011 13.078 -7.955 1.00 52.14 H new ATOM 831 N GLY A 78 -5.061 14.724 -7.298 1.00 41.34 N ATOM 832 CA GLY A 78 -5.906 15.607 -8.080 1.00 13.44 C ATOM 833 C GLY A 78 -7.282 15.785 -7.467 1.00 35.43 C ATOM 834 O GLY A 78 -7.934 16.809 -7.673 1.00 61.01 O ATOM 0 H GLY A 78 -5.143 13.734 -7.531 1.00 41.34 H new ATOM 0 HA2 GLY A 78 -5.423 16.580 -8.171 1.00 13.44 H new ATOM 0 HA3 GLY A 78 -6.010 15.207 -9.089 1.00 13.44 H new ATOM 838 N TYR A 79 -7.726 14.783 -6.716 1.00 10.34 N ATOM 839 CA TYR A 79 -9.036 14.832 -6.074 1.00 74.14 C ATOM 840 C TYR A 79 -9.045 15.838 -4.928 1.00 22.55 C ATOM 841 O TYR A 79 -10.057 16.485 -4.662 1.00 30.52 O ATOM 842 CB TYR A 79 -9.424 13.446 -5.558 1.00 30.44 C ATOM 843 CG TYR A 79 -10.397 12.715 -6.455 1.00 73.33 C ATOM 844 CD1 TYR A 79 -10.111 12.507 -7.799 1.00 62.55 C ATOM 845 CD2 TYR A 79 -11.601 12.231 -5.959 1.00 12.14 C ATOM 846 CE1 TYR A 79 -10.996 11.840 -8.624 1.00 13.32 C ATOM 847 CE2 TYR A 79 -12.492 11.561 -6.776 1.00 41.41 C ATOM 848 CZ TYR A 79 -12.185 11.370 -8.106 1.00 33.45 C ATOM 849 OH TYR A 79 -13.070 10.703 -8.923 1.00 54.12 O ATOM 0 H TYR A 79 -7.200 13.928 -6.537 1.00 10.34 H new ATOM 0 HA TYR A 79 -9.766 15.153 -6.817 1.00 74.14 H new ATOM 0 HB2 TYR A 79 -8.522 12.844 -5.447 1.00 30.44 H new ATOM 0 HB3 TYR A 79 -9.864 13.547 -4.566 1.00 30.44 H new ATOM 0 HD1 TYR A 79 -9.180 12.873 -8.206 1.00 62.55 H new ATOM 0 HD2 TYR A 79 -11.845 12.381 -4.918 1.00 12.14 H new ATOM 0 HE1 TYR A 79 -10.759 11.688 -9.667 1.00 13.32 H new ATOM 0 HE2 TYR A 79 -13.423 11.189 -6.375 1.00 41.41 H new ATOM 0 HH TYR A 79 -13.857 10.437 -8.404 1.00 54.12 H new ATOM 859 N VAL A 80 -7.908 15.961 -4.251 1.00 44.33 N ATOM 860 CA VAL A 80 -7.782 16.887 -3.132 1.00 44.22 C ATOM 861 C VAL A 80 -8.077 18.319 -3.567 1.00 40.11 C ATOM 862 O VAL A 80 -8.650 19.103 -2.812 1.00 13.21 O ATOM 863 CB VAL A 80 -6.372 16.832 -2.513 1.00 23.11 C ATOM 864 CG1 VAL A 80 -6.105 15.459 -1.915 1.00 64.14 C ATOM 865 CG2 VAL A 80 -5.319 17.185 -3.553 1.00 63.40 C ATOM 0 H VAL A 80 -7.061 15.431 -4.458 1.00 44.33 H new ATOM 0 HA VAL A 80 -8.512 16.579 -2.384 1.00 44.22 H new ATOM 0 HB VAL A 80 -6.317 17.568 -1.711 1.00 23.11 H new ATOM 0 HG11 VAL A 80 -5.105 15.439 -1.483 1.00 64.14 H new ATOM 0 HG12 VAL A 80 -6.841 15.251 -1.138 1.00 64.14 H new ATOM 0 HG13 VAL A 80 -6.178 14.702 -2.696 1.00 64.14 H new ATOM 0 HG21 VAL A 80 -4.329 17.141 -3.098 1.00 63.40 H new ATOM 0 HG22 VAL A 80 -5.371 16.475 -4.379 1.00 63.40 H new ATOM 0 HG23 VAL A 80 -5.501 18.192 -3.928 1.00 63.40 H new ATOM 875 N SER A 81 -7.681 18.652 -4.791 1.00 52.35 N ATOM 876 CA SER A 81 -7.900 19.989 -5.328 1.00 53.42 C ATOM 877 C SER A 81 -9.364 20.398 -5.188 1.00 45.20 C ATOM 878 O SER A 81 -9.677 21.573 -4.991 1.00 45.23 O ATOM 879 CB SER A 81 -7.483 20.048 -6.800 1.00 3.23 C ATOM 880 OG SER A 81 -6.916 21.307 -7.118 1.00 21.23 O ATOM 0 H SER A 81 -7.207 18.014 -5.430 1.00 52.35 H new ATOM 0 HA SER A 81 -7.288 20.686 -4.756 1.00 53.42 H new ATOM 0 HB2 SER A 81 -6.762 19.258 -7.009 1.00 3.23 H new ATOM 0 HB3 SER A 81 -8.350 19.865 -7.435 1.00 3.23 H new ATOM 0 HG SER A 81 -6.656 21.319 -8.063 1.00 21.23 H new ATOM 886 N THR A 82 -10.258 19.421 -5.290 1.00 24.33 N ATOM 887 CA THR A 82 -11.687 19.676 -5.176 1.00 13.11 C ATOM 888 C THR A 82 -12.056 20.119 -3.765 1.00 21.14 C ATOM 889 O THR A 82 -12.960 20.933 -3.574 1.00 34.33 O ATOM 890 CB THR A 82 -12.513 18.427 -5.542 1.00 75.23 C ATOM 891 OG1 THR A 82 -11.816 17.651 -6.524 1.00 3.52 O ATOM 892 CG2 THR A 82 -13.881 18.821 -6.077 1.00 70.53 C ATOM 0 H THR A 82 -10.016 18.443 -5.452 1.00 24.33 H new ATOM 0 HA THR A 82 -11.921 20.476 -5.878 1.00 13.11 H new ATOM 0 HB THR A 82 -12.652 17.832 -4.640 1.00 75.23 H new ATOM 0 HG1 THR A 82 -11.187 17.047 -6.077 1.00 3.52 H new ATOM 0 HG21 THR A 82 -14.446 17.923 -6.329 1.00 70.53 H new ATOM 0 HG22 THR A 82 -14.419 19.387 -5.317 1.00 70.53 H new ATOM 0 HG23 THR A 82 -13.760 19.435 -6.969 1.00 70.53 H new ATOM 900 N LEU A 83 -11.351 19.577 -2.777 1.00 1.50 N ATOM 901 CA LEU A 83 -11.604 19.917 -1.381 1.00 60.21 C ATOM 902 C LEU A 83 -10.298 20.189 -0.642 1.00 32.33 C ATOM 903 O LEU A 83 -9.962 19.499 0.321 1.00 61.40 O ATOM 904 CB LEU A 83 -12.368 18.787 -0.690 1.00 51.23 C ATOM 905 CG LEU A 83 -11.759 17.390 -0.816 1.00 31.02 C ATOM 906 CD1 LEU A 83 -11.251 16.906 0.534 1.00 73.41 C ATOM 907 CD2 LEU A 83 -12.778 16.413 -1.387 1.00 5.10 C ATOM 0 H LEU A 83 -10.600 18.901 -2.917 1.00 1.50 H new ATOM 0 HA LEU A 83 -12.209 20.823 -1.358 1.00 60.21 H new ATOM 0 HB2 LEU A 83 -12.456 19.029 0.369 1.00 51.23 H new ATOM 0 HB3 LEU A 83 -13.380 18.758 -1.095 1.00 51.23 H new ATOM 0 HG LEU A 83 -10.913 17.443 -1.502 1.00 31.02 H new ATOM 0 HD11 LEU A 83 -10.821 15.910 0.425 1.00 73.41 H new ATOM 0 HD12 LEU A 83 -10.489 17.592 0.903 1.00 73.41 H new ATOM 0 HD13 LEU A 83 -12.079 16.868 1.242 1.00 73.41 H new ATOM 0 HD21 LEU A 83 -12.327 15.424 -1.470 1.00 5.10 H new ATOM 0 HD22 LEU A 83 -13.644 16.363 -0.727 1.00 5.10 H new ATOM 0 HD23 LEU A 83 -13.093 16.752 -2.374 1.00 5.10 H new ATOM 919 N GLY A 84 -9.565 21.201 -1.098 1.00 25.43 N ATOM 920 CA GLY A 84 -8.305 21.547 -0.466 1.00 20.42 C ATOM 921 C GLY A 84 -8.477 22.534 0.671 1.00 54.32 C ATOM 922 O GLY A 84 -7.757 22.476 1.667 1.00 50.44 O ATOM 0 H GLY A 84 -9.821 21.787 -1.893 1.00 25.43 H new ATOM 0 HA2 GLY A 84 -7.831 20.641 -0.088 1.00 20.42 H new ATOM 0 HA3 GLY A 84 -7.633 21.971 -1.212 1.00 20.42 H new ATOM 926 N ASN A 85 -9.436 23.443 0.522 1.00 3.31 N ATOM 927 CA ASN A 85 -9.700 24.450 1.545 1.00 5.23 C ATOM 928 C ASN A 85 -10.403 23.831 2.748 1.00 32.32 C ATOM 929 O ASN A 85 -10.501 24.448 3.808 1.00 20.33 O ATOM 930 CB ASN A 85 -10.553 25.582 0.968 1.00 63.31 C ATOM 931 CG ASN A 85 -9.764 26.482 0.035 1.00 40.21 C ATOM 932 OD1 ASN A 85 -8.553 26.327 -0.119 1.00 21.33 O ATOM 933 ND2 ASN A 85 -10.451 27.429 -0.593 1.00 11.24 N ATOM 0 H ASN A 85 -10.042 23.503 -0.296 1.00 3.31 H new ATOM 0 HA ASN A 85 -8.744 24.857 1.875 1.00 5.23 H new ATOM 0 HB2 ASN A 85 -11.400 25.157 0.429 1.00 63.31 H new ATOM 0 HB3 ASN A 85 -10.962 26.178 1.784 1.00 63.31 H new ATOM 0 HD21 ASN A 85 -9.975 28.065 -1.233 1.00 11.24 H new ATOM 0 HD22 ASN A 85 -11.454 27.521 -0.435 1.00 11.24 H new ATOM 940 N ALA A 86 -10.892 22.606 2.576 1.00 50.22 N ATOM 941 CA ALA A 86 -11.584 21.903 3.649 1.00 61.40 C ATOM 942 C ALA A 86 -10.940 20.548 3.921 1.00 63.02 C ATOM 943 O ALA A 86 -11.462 19.508 3.514 1.00 41.20 O ATOM 944 CB ALA A 86 -13.056 21.730 3.303 1.00 74.24 C ATOM 0 H ALA A 86 -10.821 22.081 1.704 1.00 50.22 H new ATOM 0 HA ALA A 86 -11.503 22.503 4.555 1.00 61.40 H new ATOM 0 HB1 ALA A 86 -13.561 21.203 4.113 1.00 74.24 H new ATOM 0 HB2 ALA A 86 -13.515 22.709 3.165 1.00 74.24 H new ATOM 0 HB3 ALA A 86 -13.148 21.153 2.383 1.00 74.24 H new ATOM 950 N ILE A 87 -9.803 20.565 4.610 1.00 52.10 N ATOM 951 CA ILE A 87 -9.089 19.338 4.938 1.00 55.24 C ATOM 952 C ILE A 87 -9.442 18.853 6.339 1.00 22.23 C ATOM 953 O ILE A 87 -9.346 17.663 6.638 1.00 53.05 O ATOM 954 CB ILE A 87 -7.565 19.531 4.839 1.00 1.53 C ATOM 955 CG1 ILE A 87 -7.208 20.329 3.584 1.00 35.14 C ATOM 956 CG2 ILE A 87 -6.859 18.183 4.836 1.00 12.11 C ATOM 957 CD1 ILE A 87 -7.636 19.655 2.299 1.00 64.22 C ATOM 0 H ILE A 87 -9.357 21.416 4.952 1.00 52.10 H new ATOM 0 HA ILE A 87 -9.399 18.588 4.210 1.00 55.24 H new ATOM 0 HB ILE A 87 -7.229 20.093 5.710 1.00 1.53 H new ATOM 0 HG12 ILE A 87 -7.675 21.312 3.643 1.00 35.14 H new ATOM 0 HG13 ILE A 87 -6.130 20.490 3.559 1.00 35.14 H new ATOM 0 HG21 ILE A 87 -5.782 18.336 4.766 1.00 12.11 H new ATOM 0 HG22 ILE A 87 -7.090 17.649 5.758 1.00 12.11 H new ATOM 0 HG23 ILE A 87 -7.199 17.596 3.982 1.00 12.11 H new ATOM 0 HD11 ILE A 87 -7.351 20.276 1.450 1.00 64.22 H new ATOM 0 HD12 ILE A 87 -7.148 18.684 2.218 1.00 64.22 H new ATOM 0 HD13 ILE A 87 -8.717 19.519 2.302 1.00 64.22 H new ATOM 969 N SER A 88 -9.850 19.785 7.196 1.00 31.44 N ATOM 970 CA SER A 88 -10.215 19.452 8.568 1.00 50.21 C ATOM 971 C SER A 88 -11.313 18.393 8.598 1.00 12.10 C ATOM 972 O SER A 88 -11.473 17.677 9.585 1.00 15.12 O ATOM 973 CB SER A 88 -10.681 20.706 9.311 1.00 70.42 C ATOM 974 OG SER A 88 -10.142 20.751 10.621 1.00 63.20 O ATOM 0 H SER A 88 -9.936 20.775 6.964 1.00 31.44 H new ATOM 0 HA SER A 88 -9.333 19.049 9.065 1.00 50.21 H new ATOM 0 HB2 SER A 88 -10.376 21.595 8.758 1.00 70.42 H new ATOM 0 HB3 SER A 88 -11.770 20.719 9.361 1.00 70.42 H new ATOM 0 HG SER A 88 -10.453 21.562 11.075 1.00 63.20 H new ATOM 980 N ASP A 89 -12.067 18.301 7.507 1.00 14.30 N ATOM 981 CA ASP A 89 -13.149 17.329 7.406 1.00 15.30 C ATOM 982 C ASP A 89 -12.609 15.949 7.045 1.00 52.04 C ATOM 983 O ASP A 89 -12.266 15.689 5.892 1.00 31.54 O ATOM 984 CB ASP A 89 -14.172 17.781 6.362 1.00 3.44 C ATOM 985 CG ASP A 89 -14.989 18.970 6.829 1.00 73.50 C ATOM 986 OD1 ASP A 89 -16.045 18.751 7.460 1.00 42.50 O ATOM 987 OD2 ASP A 89 -14.576 20.117 6.561 1.00 24.55 O ATOM 0 H ASP A 89 -11.948 18.888 6.681 1.00 14.30 H new ATOM 0 HA ASP A 89 -13.638 17.263 8.378 1.00 15.30 H new ATOM 0 HB2 ASP A 89 -13.654 18.040 5.438 1.00 3.44 H new ATOM 0 HB3 ASP A 89 -14.841 16.952 6.131 1.00 3.44 H new ATOM 992 N ALA A 90 -12.536 15.069 8.038 1.00 71.24 N ATOM 993 CA ALA A 90 -12.038 13.717 7.823 1.00 22.53 C ATOM 994 C ALA A 90 -12.962 12.931 6.899 1.00 61.14 C ATOM 995 O ALA A 90 -12.504 12.151 6.064 1.00 22.02 O ATOM 996 CB ALA A 90 -11.882 12.995 9.154 1.00 34.30 C ATOM 0 H ALA A 90 -12.815 15.268 8.999 1.00 71.24 H new ATOM 0 HA ALA A 90 -11.062 13.788 7.343 1.00 22.53 H new ATOM 0 HB1 ALA A 90 -11.509 11.986 8.979 1.00 34.30 H new ATOM 0 HB2 ALA A 90 -11.176 13.539 9.782 1.00 34.30 H new ATOM 0 HB3 ALA A 90 -12.849 12.943 9.655 1.00 34.30 H new ATOM 1002 N SER A 91 -14.265 13.144 7.053 1.00 35.14 N ATOM 1003 CA SER A 91 -15.253 12.452 6.234 1.00 73.52 C ATOM 1004 C SER A 91 -15.057 12.774 4.755 1.00 23.02 C ATOM 1005 O SER A 91 -14.978 11.875 3.918 1.00 42.30 O ATOM 1006 CB SER A 91 -16.668 12.841 6.668 1.00 51.50 C ATOM 1007 OG SER A 91 -17.644 12.174 5.885 1.00 23.14 O ATOM 0 H SER A 91 -14.661 13.789 7.737 1.00 35.14 H new ATOM 0 HA SER A 91 -15.118 11.380 6.375 1.00 73.52 H new ATOM 0 HB2 SER A 91 -16.810 12.593 7.720 1.00 51.50 H new ATOM 0 HB3 SER A 91 -16.797 13.919 6.574 1.00 51.50 H new ATOM 0 HG SER A 91 -18.539 12.438 6.183 1.00 23.14 H new ATOM 1013 N ALA A 92 -14.977 14.064 4.443 1.00 34.33 N ATOM 1014 CA ALA A 92 -14.787 14.505 3.066 1.00 4.52 C ATOM 1015 C ALA A 92 -13.374 14.197 2.581 1.00 23.03 C ATOM 1016 O ALA A 92 -13.186 13.678 1.481 1.00 13.12 O ATOM 1017 CB ALA A 92 -15.075 15.994 2.947 1.00 64.21 C ATOM 0 H ALA A 92 -15.041 14.821 5.124 1.00 34.33 H new ATOM 0 HA ALA A 92 -15.487 13.958 2.434 1.00 4.52 H new ATOM 0 HB1 ALA A 92 -14.930 16.311 1.914 1.00 64.21 H new ATOM 0 HB2 ALA A 92 -16.105 16.190 3.245 1.00 64.21 H new ATOM 0 HB3 ALA A 92 -14.397 16.549 3.596 1.00 64.21 H new ATOM 1023 N TYR A 93 -12.386 14.519 3.409 1.00 72.40 N ATOM 1024 CA TYR A 93 -10.991 14.278 3.062 1.00 42.24 C ATOM 1025 C TYR A 93 -10.745 12.798 2.784 1.00 15.03 C ATOM 1026 O TYR A 93 -10.134 12.438 1.779 1.00 31.34 O ATOM 1027 CB TYR A 93 -10.073 14.755 4.189 1.00 34.22 C ATOM 1028 CG TYR A 93 -8.626 14.891 3.775 1.00 61.11 C ATOM 1029 CD1 TYR A 93 -8.281 15.468 2.559 1.00 33.14 C ATOM 1030 CD2 TYR A 93 -7.601 14.442 4.600 1.00 51.52 C ATOM 1031 CE1 TYR A 93 -6.960 15.593 2.176 1.00 24.32 C ATOM 1032 CE2 TYR A 93 -6.278 14.565 4.227 1.00 42.05 C ATOM 1033 CZ TYR A 93 -5.961 15.140 3.014 1.00 54.42 C ATOM 1034 OH TYR A 93 -4.644 15.263 2.637 1.00 40.21 O ATOM 0 H TYR A 93 -12.526 14.947 4.324 1.00 72.40 H new ATOM 0 HA TYR A 93 -10.767 14.841 2.156 1.00 42.24 H new ATOM 0 HB2 TYR A 93 -10.430 15.718 4.554 1.00 34.22 H new ATOM 0 HB3 TYR A 93 -10.140 14.055 5.021 1.00 34.22 H new ATOM 0 HD1 TYR A 93 -9.060 15.825 1.902 1.00 33.14 H new ATOM 0 HD2 TYR A 93 -7.844 13.989 5.550 1.00 51.52 H new ATOM 0 HE1 TYR A 93 -6.710 16.043 1.226 1.00 24.32 H new ATOM 0 HE2 TYR A 93 -5.495 14.213 4.882 1.00 42.05 H new ATOM 0 HH TYR A 93 -4.563 15.959 1.952 1.00 40.21 H new ATOM 1044 N ALA A 94 -11.228 11.946 3.682 1.00 41.14 N ATOM 1045 CA ALA A 94 -11.065 10.505 3.533 1.00 2.00 C ATOM 1046 C ALA A 94 -11.895 9.976 2.369 1.00 62.32 C ATOM 1047 O ALA A 94 -11.456 9.097 1.630 1.00 23.52 O ATOM 1048 CB ALA A 94 -11.447 9.795 4.823 1.00 33.12 C ATOM 0 H ALA A 94 -11.735 12.229 4.520 1.00 41.14 H new ATOM 0 HA ALA A 94 -10.016 10.303 3.317 1.00 2.00 H new ATOM 0 HB1 ALA A 94 -11.321 8.720 4.698 1.00 33.12 H new ATOM 0 HB2 ALA A 94 -10.807 10.144 5.633 1.00 33.12 H new ATOM 0 HB3 ALA A 94 -12.488 10.012 5.064 1.00 33.12 H new ATOM 1054 N ASN A 95 -13.099 10.517 2.212 1.00 75.14 N ATOM 1055 CA ASN A 95 -13.991 10.098 1.138 1.00 23.22 C ATOM 1056 C ASN A 95 -13.366 10.374 -0.226 1.00 35.54 C ATOM 1057 O ASN A 95 -13.541 9.599 -1.168 1.00 45.14 O ATOM 1058 CB ASN A 95 -15.334 10.822 1.251 1.00 13.22 C ATOM 1059 CG ASN A 95 -16.235 10.559 0.058 1.00 3.35 C ATOM 1060 OD1 ASN A 95 -16.157 9.504 -0.572 1.00 41.24 O ATOM 1061 ND2 ASN A 95 -17.096 11.522 -0.256 1.00 64.52 N ATOM 0 H ASN A 95 -13.479 11.247 2.815 1.00 75.14 H new ATOM 0 HA ASN A 95 -14.155 9.025 1.233 1.00 23.22 H new ATOM 0 HB2 ASN A 95 -15.840 10.503 2.162 1.00 13.22 H new ATOM 0 HB3 ASN A 95 -15.159 11.894 1.342 1.00 13.22 H new ATOM 0 HD21 ASN A 95 -17.728 11.403 -1.048 1.00 64.52 H new ATOM 0 HD22 ASN A 95 -17.125 12.380 0.295 1.00 64.52 H new ATOM 1068 N ALA A 96 -12.636 11.480 -0.326 1.00 33.33 N ATOM 1069 CA ALA A 96 -11.984 11.855 -1.575 1.00 3.31 C ATOM 1070 C ALA A 96 -10.830 10.911 -1.896 1.00 33.34 C ATOM 1071 O ALA A 96 -10.776 10.330 -2.979 1.00 62.24 O ATOM 1072 CB ALA A 96 -11.488 13.291 -1.499 1.00 60.10 C ATOM 0 H ALA A 96 -12.481 12.132 0.443 1.00 33.33 H new ATOM 0 HA ALA A 96 -12.717 11.777 -2.378 1.00 3.31 H new ATOM 0 HB1 ALA A 96 -11.003 13.559 -2.438 1.00 60.10 H new ATOM 0 HB2 ALA A 96 -12.332 13.958 -1.323 1.00 60.10 H new ATOM 0 HB3 ALA A 96 -10.773 13.386 -0.682 1.00 60.10 H new ATOM 1078 N ILE A 97 -9.912 10.764 -0.948 1.00 24.23 N ATOM 1079 CA ILE A 97 -8.759 9.890 -1.132 1.00 2.24 C ATOM 1080 C ILE A 97 -9.191 8.436 -1.285 1.00 71.43 C ATOM 1081 O ILE A 97 -8.638 7.697 -2.100 1.00 34.13 O ATOM 1082 CB ILE A 97 -7.777 9.999 0.050 1.00 23.40 C ATOM 1083 CG1 ILE A 97 -6.581 9.068 -0.166 1.00 42.40 C ATOM 1084 CG2 ILE A 97 -8.480 9.672 1.357 1.00 14.50 C ATOM 1085 CD1 ILE A 97 -5.312 9.548 0.503 1.00 43.40 C ATOM 0 H ILE A 97 -9.943 11.238 -0.045 1.00 24.23 H new ATOM 0 HA ILE A 97 -8.257 10.216 -2.043 1.00 2.24 H new ATOM 0 HB ILE A 97 -7.411 11.024 0.105 1.00 23.40 H new ATOM 0 HG12 ILE A 97 -6.829 8.077 0.213 1.00 42.40 H new ATOM 0 HG13 ILE A 97 -6.401 8.964 -1.236 1.00 42.40 H new ATOM 0 HG21 ILE A 97 -7.772 9.754 2.181 1.00 14.50 H new ATOM 0 HG22 ILE A 97 -9.301 10.371 1.513 1.00 14.50 H new ATOM 0 HG23 ILE A 97 -8.872 8.656 1.315 1.00 14.50 H new ATOM 0 HD11 ILE A 97 -4.507 8.839 0.307 1.00 43.40 H new ATOM 0 HD12 ILE A 97 -5.039 10.526 0.106 1.00 43.40 H new ATOM 0 HD13 ILE A 97 -5.474 9.625 1.578 1.00 43.40 H new ATOM 1097 N SER A 98 -10.182 8.032 -0.498 1.00 13.31 N ATOM 1098 CA SER A 98 -10.689 6.665 -0.544 1.00 3.01 C ATOM 1099 C SER A 98 -11.372 6.384 -1.879 1.00 73.12 C ATOM 1100 O SER A 98 -11.262 5.288 -2.427 1.00 2.03 O ATOM 1101 CB SER A 98 -11.668 6.422 0.605 1.00 73.11 C ATOM 1102 OG SER A 98 -12.380 5.210 0.420 1.00 20.01 O ATOM 0 H SER A 98 -10.651 8.632 0.180 1.00 13.31 H new ATOM 0 HA SER A 98 -9.843 5.986 -0.439 1.00 3.01 H new ATOM 0 HB2 SER A 98 -11.124 6.388 1.549 1.00 73.11 H new ATOM 0 HB3 SER A 98 -12.370 7.253 0.671 1.00 73.11 H new ATOM 0 HG SER A 98 -13.141 5.366 -0.177 1.00 20.01 H new ATOM 1108 N SER A 99 -12.078 7.385 -2.398 1.00 3.45 N ATOM 1109 CA SER A 99 -12.783 7.245 -3.665 1.00 73.22 C ATOM 1110 C SER A 99 -11.800 7.205 -4.833 1.00 1.35 C ATOM 1111 O SER A 99 -12.020 6.503 -5.818 1.00 14.33 O ATOM 1112 CB SER A 99 -13.769 8.400 -3.855 1.00 0.12 C ATOM 1113 OG SER A 99 -14.457 8.287 -5.089 1.00 25.33 O ATOM 0 H SER A 99 -12.176 8.301 -1.960 1.00 3.45 H new ATOM 0 HA SER A 99 -13.334 6.305 -3.643 1.00 73.22 H new ATOM 0 HB2 SER A 99 -14.487 8.408 -3.035 1.00 0.12 H new ATOM 0 HB3 SER A 99 -13.234 9.349 -3.819 1.00 0.12 H new ATOM 0 HG SER A 99 -15.082 9.036 -5.185 1.00 25.33 H new ATOM 1119 N ALA A 100 -10.716 7.964 -4.710 1.00 32.55 N ATOM 1120 CA ALA A 100 -9.699 8.014 -5.752 1.00 64.24 C ATOM 1121 C ALA A 100 -8.956 6.686 -5.859 1.00 24.13 C ATOM 1122 O ALA A 100 -8.927 6.064 -6.921 1.00 12.15 O ATOM 1123 CB ALA A 100 -8.720 9.147 -5.481 1.00 4.41 C ATOM 0 H ALA A 100 -10.520 8.552 -3.900 1.00 32.55 H new ATOM 0 HA ALA A 100 -10.198 8.199 -6.703 1.00 64.24 H new ATOM 0 HB1 ALA A 100 -7.966 9.172 -6.268 1.00 4.41 H new ATOM 0 HB2 ALA A 100 -9.257 10.095 -5.463 1.00 4.41 H new ATOM 0 HB3 ALA A 100 -8.235 8.986 -4.518 1.00 4.41 H new ATOM 1129 N ILE A 101 -8.356 6.258 -4.752 1.00 62.31 N ATOM 1130 CA ILE A 101 -7.614 5.004 -4.722 1.00 12.24 C ATOM 1131 C ILE A 101 -8.552 3.808 -4.831 1.00 33.35 C ATOM 1132 O ILE A 101 -8.243 2.820 -5.498 1.00 15.01 O ATOM 1133 CB ILE A 101 -6.782 4.873 -3.433 1.00 62.43 C ATOM 1134 CG1 ILE A 101 -7.689 4.942 -2.205 1.00 11.32 C ATOM 1135 CG2 ILE A 101 -5.720 5.962 -3.376 1.00 52.11 C ATOM 1136 CD1 ILE A 101 -8.059 3.585 -1.649 1.00 73.41 C ATOM 0 H ILE A 101 -8.370 6.762 -3.865 1.00 62.31 H new ATOM 0 HA ILE A 101 -6.941 5.015 -5.580 1.00 12.24 H new ATOM 0 HB ILE A 101 -6.282 3.904 -3.437 1.00 62.43 H new ATOM 0 HG12 ILE A 101 -7.190 5.520 -1.427 1.00 11.32 H new ATOM 0 HG13 ILE A 101 -8.601 5.479 -2.467 1.00 11.32 H new ATOM 0 HG21 ILE A 101 -5.140 5.857 -2.459 1.00 52.11 H new ATOM 0 HG22 ILE A 101 -5.058 5.870 -4.237 1.00 52.11 H new ATOM 0 HG23 ILE A 101 -6.201 6.940 -3.391 1.00 52.11 H new ATOM 0 HD11 ILE A 101 -8.704 3.712 -0.779 1.00 73.41 H new ATOM 0 HD12 ILE A 101 -8.586 3.011 -2.411 1.00 73.41 H new ATOM 0 HD13 ILE A 101 -7.154 3.053 -1.355 1.00 73.41 H new ATOM 1148 N GLY A 102 -9.704 3.903 -4.173 1.00 25.05 N ATOM 1149 CA GLY A 102 -10.671 2.821 -4.208 1.00 70.45 C ATOM 1150 C GLY A 102 -11.250 2.608 -5.592 1.00 72.42 C ATOM 1151 O GLY A 102 -11.615 1.490 -5.956 1.00 30.14 O ATOM 0 H GLY A 102 -9.985 4.710 -3.616 1.00 25.05 H new ATOM 0 HA2 GLY A 102 -10.194 1.900 -3.871 1.00 70.45 H new ATOM 0 HA3 GLY A 102 -11.479 3.036 -3.508 1.00 70.45 H new ATOM 1155 N ASN A 103 -11.335 3.684 -6.369 1.00 33.41 N ATOM 1156 CA ASN A 103 -11.876 3.610 -7.723 1.00 1.22 C ATOM 1157 C ASN A 103 -11.035 2.683 -8.594 1.00 43.41 C ATOM 1158 O ASN A 103 -11.561 1.788 -9.257 1.00 40.15 O ATOM 1159 CB ASN A 103 -11.934 5.004 -8.347 1.00 60.13 C ATOM 1160 CG ASN A 103 -13.298 5.648 -8.200 1.00 40.03 C ATOM 1161 OD1 ASN A 103 -14.314 4.959 -8.092 1.00 72.12 O ATOM 1162 ND2 ASN A 103 -13.328 6.976 -8.196 1.00 32.23 N ATOM 0 H ASN A 103 -11.036 4.617 -6.085 1.00 33.41 H new ATOM 0 HA ASN A 103 -12.886 3.205 -7.664 1.00 1.22 H new ATOM 0 HB2 ASN A 103 -11.183 5.640 -7.879 1.00 60.13 H new ATOM 0 HB3 ASN A 103 -11.680 4.936 -9.405 1.00 60.13 H new ATOM 0 HD21 ASN A 103 -14.218 7.466 -8.101 1.00 32.23 H new ATOM 0 HD22 ASN A 103 -12.461 7.506 -8.288 1.00 32.23 H new ATOM 1169 N VAL A 104 -9.723 2.902 -8.589 1.00 34.04 N ATOM 1170 CA VAL A 104 -8.807 2.085 -9.377 1.00 15.51 C ATOM 1171 C VAL A 104 -8.697 0.677 -8.806 1.00 12.11 C ATOM 1172 O VAL A 104 -8.573 -0.299 -9.550 1.00 1.20 O ATOM 1173 CB VAL A 104 -7.404 2.716 -9.437 1.00 3.21 C ATOM 1174 CG1 VAL A 104 -7.435 4.017 -10.225 1.00 34.04 C ATOM 1175 CG2 VAL A 104 -6.864 2.946 -8.034 1.00 5.25 C ATOM 0 H VAL A 104 -9.271 3.639 -8.048 1.00 34.04 H new ATOM 0 HA VAL A 104 -9.216 2.032 -10.386 1.00 15.51 H new ATOM 0 HB VAL A 104 -6.736 2.025 -9.951 1.00 3.21 H new ATOM 0 HG11 VAL A 104 -6.434 4.448 -10.256 1.00 34.04 H new ATOM 0 HG12 VAL A 104 -7.776 3.819 -11.241 1.00 34.04 H new ATOM 0 HG13 VAL A 104 -8.117 4.718 -9.743 1.00 34.04 H new ATOM 0 HG21 VAL A 104 -5.872 3.393 -8.095 1.00 5.25 H new ATOM 0 HG22 VAL A 104 -7.531 3.617 -7.493 1.00 5.25 H new ATOM 0 HG23 VAL A 104 -6.802 1.994 -7.507 1.00 5.25 H new ATOM 1185 N LEU A 105 -8.741 0.576 -7.483 1.00 13.53 N ATOM 1186 CA LEU A 105 -8.646 -0.716 -6.810 1.00 71.13 C ATOM 1187 C LEU A 105 -9.777 -1.641 -7.246 1.00 14.22 C ATOM 1188 O LEU A 105 -9.596 -2.853 -7.350 1.00 13.33 O ATOM 1189 CB LEU A 105 -8.683 -0.527 -5.293 1.00 12.04 C ATOM 1190 CG LEU A 105 -7.448 -1.003 -4.526 1.00 75.44 C ATOM 1191 CD1 LEU A 105 -7.370 -2.522 -4.533 1.00 30.42 C ATOM 1192 CD2 LEU A 105 -6.186 -0.400 -5.123 1.00 23.32 C ATOM 0 H LEU A 105 -8.842 1.373 -6.854 1.00 13.53 H new ATOM 0 HA LEU A 105 -7.698 -1.175 -7.090 1.00 71.13 H new ATOM 0 HB2 LEU A 105 -8.831 0.532 -5.083 1.00 12.04 H new ATOM 0 HB3 LEU A 105 -9.554 -1.054 -4.903 1.00 12.04 H new ATOM 0 HG LEU A 105 -7.533 -0.668 -3.492 1.00 75.44 H new ATOM 0 HD11 LEU A 105 -6.486 -2.843 -3.983 1.00 30.42 H new ATOM 0 HD12 LEU A 105 -8.261 -2.934 -4.060 1.00 30.42 H new ATOM 0 HD13 LEU A 105 -7.307 -2.878 -5.561 1.00 30.42 H new ATOM 0 HD21 LEU A 105 -5.317 -0.749 -4.565 1.00 23.32 H new ATOM 0 HD22 LEU A 105 -6.095 -0.705 -6.165 1.00 23.32 H new ATOM 0 HD23 LEU A 105 -6.240 0.687 -5.067 1.00 23.32 H new ATOM 1204 N ALA A 106 -10.946 -1.060 -7.502 1.00 53.20 N ATOM 1205 CA ALA A 106 -12.105 -1.831 -7.931 1.00 72.24 C ATOM 1206 C ALA A 106 -11.799 -2.625 -9.197 1.00 53.23 C ATOM 1207 O ALA A 106 -12.284 -3.742 -9.373 1.00 42.52 O ATOM 1208 CB ALA A 106 -13.296 -0.913 -8.158 1.00 12.23 C ATOM 0 H ALA A 106 -11.114 -0.057 -7.419 1.00 53.20 H new ATOM 0 HA ALA A 106 -12.351 -2.539 -7.140 1.00 72.24 H new ATOM 0 HB1 ALA A 106 -14.155 -1.503 -8.478 1.00 12.23 H new ATOM 0 HB2 ALA A 106 -13.538 -0.395 -7.230 1.00 12.23 H new ATOM 0 HB3 ALA A 106 -13.050 -0.182 -8.929 1.00 12.23 H new ATOM 1214 N ASN A 107 -10.992 -2.041 -10.076 1.00 2.42 N ATOM 1215 CA ASN A 107 -10.622 -2.693 -11.327 1.00 23.41 C ATOM 1216 C ASN A 107 -9.794 -3.947 -11.061 1.00 31.53 C ATOM 1217 O ASN A 107 -9.846 -4.911 -11.826 1.00 54.14 O ATOM 1218 CB ASN A 107 -9.836 -1.730 -12.216 1.00 43.35 C ATOM 1219 CG ASN A 107 -10.102 -1.956 -13.692 1.00 35.45 C ATOM 1220 OD1 ASN A 107 -10.486 -1.036 -14.413 1.00 51.43 O ATOM 1221 ND2 ASN A 107 -9.898 -3.187 -14.147 1.00 63.23 N ATOM 0 H ASN A 107 -10.581 -1.117 -9.945 1.00 2.42 H new ATOM 0 HA ASN A 107 -11.538 -2.984 -11.841 1.00 23.41 H new ATOM 0 HB2 ASN A 107 -10.097 -0.704 -11.956 1.00 43.35 H new ATOM 0 HB3 ASN A 107 -8.770 -1.847 -12.020 1.00 43.35 H new ATOM 0 HD21 ASN A 107 -10.060 -3.400 -15.131 1.00 63.23 H new ATOM 0 HD22 ASN A 107 -9.579 -3.919 -13.512 1.00 63.23 H new ATOM 1228 N SER A 108 -9.033 -3.928 -9.973 1.00 45.14 N ATOM 1229 CA SER A 108 -8.191 -5.061 -9.609 1.00 5.45 C ATOM 1230 C SER A 108 -8.802 -5.840 -8.447 1.00 22.30 C ATOM 1231 O SER A 108 -8.183 -6.754 -7.902 1.00 41.23 O ATOM 1232 CB SER A 108 -6.787 -4.583 -9.232 1.00 1.44 C ATOM 1233 OG SER A 108 -6.514 -3.313 -9.797 1.00 3.24 O ATOM 0 H SER A 108 -8.982 -3.140 -9.327 1.00 45.14 H new ATOM 0 HA SER A 108 -8.122 -5.722 -10.473 1.00 5.45 H new ATOM 0 HB2 SER A 108 -6.696 -4.529 -8.147 1.00 1.44 H new ATOM 0 HB3 SER A 108 -6.048 -5.305 -9.578 1.00 1.44 H new ATOM 0 HG SER A 108 -5.612 -3.028 -9.541 1.00 3.24 H new ATOM 1239 N GLY A 109 -10.024 -5.472 -8.073 1.00 50.21 N ATOM 1240 CA GLY A 109 -10.701 -6.145 -6.980 1.00 4.33 C ATOM 1241 C GLY A 109 -10.841 -5.263 -5.754 1.00 51.23 C ATOM 1242 O GLY A 109 -9.890 -4.592 -5.352 1.00 14.32 O ATOM 0 H GLY A 109 -10.557 -4.719 -8.508 1.00 50.21 H new ATOM 0 HA2 GLY A 109 -11.690 -6.463 -7.310 1.00 4.33 H new ATOM 0 HA3 GLY A 109 -10.149 -7.046 -6.714 1.00 4.33 H new ATOM 1327 N ALA A 116 -13.068 -8.156 4.236 1.00 61.42 N ATOM 1328 CA ALA A 116 -13.234 -6.725 4.457 1.00 73.31 C ATOM 1329 C ALA A 116 -12.454 -6.264 5.684 1.00 33.54 C ATOM 1330 O ALA A 116 -12.316 -7.005 6.658 1.00 54.42 O ATOM 1331 CB ALA A 116 -14.709 -6.382 4.609 1.00 72.33 C ATOM 0 HA ALA A 116 -12.837 -6.200 3.588 1.00 73.31 H new ATOM 0 HB1 ALA A 116 -14.818 -5.310 4.774 1.00 72.33 H new ATOM 0 HB2 ALA A 116 -15.244 -6.666 3.703 1.00 72.33 H new ATOM 0 HB3 ALA A 116 -15.123 -6.924 5.460 1.00 72.33 H new ATOM 1337 N SER A 117 -11.943 -5.040 5.628 1.00 44.53 N ATOM 1338 CA SER A 117 -11.171 -4.482 6.734 1.00 22.33 C ATOM 1339 C SER A 117 -9.881 -5.267 6.947 1.00 20.55 C ATOM 1340 O SER A 117 -9.227 -5.140 7.981 1.00 64.13 O ATOM 1341 CB SER A 117 -12.003 -4.488 8.018 1.00 73.33 C ATOM 1342 OG SER A 117 -11.832 -3.283 8.743 1.00 42.12 O ATOM 0 H SER A 117 -12.049 -4.414 4.829 1.00 44.53 H new ATOM 0 HA SER A 117 -10.912 -3.454 6.482 1.00 22.33 H new ATOM 0 HB2 SER A 117 -13.056 -4.621 7.772 1.00 73.33 H new ATOM 0 HB3 SER A 117 -11.712 -5.334 8.640 1.00 73.33 H new ATOM 0 HG SER A 117 -12.375 -3.312 9.558 1.00 42.12 H new ATOM 1348 N SER A 118 -9.522 -6.082 5.959 1.00 11.00 N ATOM 1349 CA SER A 118 -8.313 -6.893 6.039 1.00 71.22 C ATOM 1350 C SER A 118 -7.067 -6.027 5.877 1.00 65.12 C ATOM 1351 O SER A 118 -6.135 -6.105 6.677 1.00 71.31 O ATOM 1352 CB SER A 118 -8.333 -7.983 4.966 1.00 33.23 C ATOM 1353 OG SER A 118 -7.025 -8.253 4.488 1.00 14.23 O ATOM 0 H SER A 118 -10.051 -6.198 5.095 1.00 11.00 H new ATOM 0 HA SER A 118 -8.284 -7.362 7.023 1.00 71.22 H new ATOM 0 HB2 SER A 118 -8.769 -8.894 5.377 1.00 33.23 H new ATOM 0 HB3 SER A 118 -8.969 -7.671 4.138 1.00 33.23 H new ATOM 0 HG SER A 118 -7.065 -8.954 3.804 1.00 14.23 H new ATOM 1359 N ALA A 119 -7.058 -5.203 4.835 1.00 40.45 N ATOM 1360 CA ALA A 119 -5.929 -4.320 4.568 1.00 2.32 C ATOM 1361 C ALA A 119 -5.939 -3.117 5.505 1.00 14.42 C ATOM 1362 O ALA A 119 -4.924 -2.442 5.675 1.00 33.12 O ATOM 1363 CB ALA A 119 -5.947 -3.862 3.117 1.00 13.45 C ATOM 0 H ALA A 119 -7.820 -5.128 4.161 1.00 40.45 H new ATOM 0 HA ALA A 119 -5.012 -4.880 4.748 1.00 2.32 H new ATOM 0 HB1 ALA A 119 -5.098 -3.203 2.933 1.00 13.45 H new ATOM 0 HB2 ALA A 119 -5.882 -4.730 2.461 1.00 13.45 H new ATOM 0 HB3 ALA A 119 -6.874 -3.324 2.917 1.00 13.45 H new ATOM 1369 N ALA A 120 -7.093 -2.854 6.112 1.00 31.30 N ATOM 1370 CA ALA A 120 -7.234 -1.733 7.032 1.00 54.30 C ATOM 1371 C ALA A 120 -6.231 -1.832 8.176 1.00 74.10 C ATOM 1372 O ALA A 120 -5.676 -0.826 8.617 1.00 43.31 O ATOM 1373 CB ALA A 120 -8.654 -1.672 7.576 1.00 23.52 C ATOM 0 H ALA A 120 -7.943 -3.403 5.982 1.00 31.30 H new ATOM 0 HA ALA A 120 -7.028 -0.815 6.481 1.00 54.30 H new ATOM 0 HB1 ALA A 120 -8.745 -0.830 8.262 1.00 23.52 H new ATOM 0 HB2 ALA A 120 -9.355 -1.545 6.751 1.00 23.52 H new ATOM 0 HB3 ALA A 120 -8.881 -2.597 8.106 1.00 23.52 H new ATOM 1379 N SER A 121 -6.003 -3.051 8.652 1.00 24.55 N ATOM 1380 CA SER A 121 -5.070 -3.281 9.749 1.00 22.11 C ATOM 1381 C SER A 121 -3.677 -2.770 9.393 1.00 12.44 C ATOM 1382 O SER A 121 -3.060 -2.031 10.162 1.00 25.12 O ATOM 1383 CB SER A 121 -5.005 -4.772 10.088 1.00 22.41 C ATOM 1384 OG SER A 121 -4.219 -4.999 11.245 1.00 61.13 O ATOM 0 H SER A 121 -6.451 -3.895 8.296 1.00 24.55 H new ATOM 0 HA SER A 121 -5.430 -2.732 10.619 1.00 22.11 H new ATOM 0 HB2 SER A 121 -6.013 -5.156 10.248 1.00 22.41 H new ATOM 0 HB3 SER A 121 -4.585 -5.322 9.246 1.00 22.41 H new ATOM 0 HG SER A 121 -4.195 -5.959 11.441 1.00 61.13 H new ATOM 1390 N SER A 122 -3.188 -3.167 8.222 1.00 11.55 N ATOM 1391 CA SER A 122 -1.867 -2.752 7.766 1.00 2.01 C ATOM 1392 C SER A 122 -1.867 -1.277 7.370 1.00 34.32 C ATOM 1393 O SER A 122 -0.927 -0.544 7.670 1.00 54.34 O ATOM 1394 CB SER A 122 -1.422 -3.609 6.580 1.00 22.43 C ATOM 1395 OG SER A 122 -0.599 -4.681 7.007 1.00 23.14 O ATOM 0 H SER A 122 -3.687 -3.775 7.573 1.00 11.55 H new ATOM 0 HA SER A 122 -1.166 -2.890 8.589 1.00 2.01 H new ATOM 0 HB2 SER A 122 -2.297 -4.002 6.062 1.00 22.43 H new ATOM 0 HB3 SER A 122 -0.879 -2.992 5.865 1.00 22.43 H new ATOM 0 HG SER A 122 0.033 -4.912 6.295 1.00 23.14 H new ATOM 1401 N ALA A 123 -2.929 -0.854 6.693 1.00 0.23 N ATOM 1402 CA ALA A 123 -3.055 0.531 6.257 1.00 42.02 C ATOM 1403 C ALA A 123 -3.026 1.486 7.446 1.00 4.41 C ATOM 1404 O ALA A 123 -2.324 2.496 7.425 1.00 43.23 O ATOM 1405 CB ALA A 123 -4.336 0.719 5.458 1.00 45.11 C ATOM 0 H ALA A 123 -3.715 -1.451 6.434 1.00 0.23 H new ATOM 0 HA ALA A 123 -2.204 0.763 5.617 1.00 42.02 H new ATOM 0 HB1 ALA A 123 -4.417 1.758 5.139 1.00 45.11 H new ATOM 0 HB2 ALA A 123 -4.317 0.071 4.582 1.00 45.11 H new ATOM 0 HB3 ALA A 123 -5.194 0.463 6.080 1.00 45.11 H new ATOM 1411 N ALA A 124 -3.791 1.158 8.482 1.00 35.32 N ATOM 1412 CA ALA A 124 -3.852 1.986 9.680 1.00 31.14 C ATOM 1413 C ALA A 124 -2.557 1.887 10.481 1.00 21.10 C ATOM 1414 O ALA A 124 -2.136 2.851 11.119 1.00 31.04 O ATOM 1415 CB ALA A 124 -5.039 1.584 10.540 1.00 12.33 C ATOM 0 H ALA A 124 -4.377 0.324 8.516 1.00 35.32 H new ATOM 0 HA ALA A 124 -3.979 3.023 9.369 1.00 31.14 H new ATOM 0 HB1 ALA A 124 -5.072 2.211 11.431 1.00 12.33 H new ATOM 0 HB2 ALA A 124 -5.960 1.713 9.972 1.00 12.33 H new ATOM 0 HB3 ALA A 124 -4.938 0.540 10.835 1.00 12.33 H new ATOM 1421 N SER A 125 -1.933 0.715 10.443 1.00 42.24 N ATOM 1422 CA SER A 125 -0.688 0.489 11.169 1.00 21.31 C ATOM 1423 C SER A 125 0.443 1.328 10.585 1.00 43.13 C ATOM 1424 O SER A 125 1.209 1.955 11.318 1.00 23.31 O ATOM 1425 CB SER A 125 -0.312 -0.995 11.128 1.00 43.21 C ATOM 1426 OG SER A 125 -1.109 -1.748 12.025 1.00 64.13 O ATOM 0 H SER A 125 -2.268 -0.093 9.918 1.00 42.24 H new ATOM 0 HA SER A 125 -0.841 0.790 12.205 1.00 21.31 H new ATOM 0 HB2 SER A 125 -0.439 -1.378 10.115 1.00 43.21 H new ATOM 0 HB3 SER A 125 0.741 -1.114 11.384 1.00 43.21 H new ATOM 0 HG SER A 125 -1.952 -1.991 11.589 1.00 64.13 H new ATOM 1432 N SER A 126 0.542 1.337 9.260 1.00 74.53 N ATOM 1433 CA SER A 126 1.581 2.096 8.574 1.00 22.15 C ATOM 1434 C SER A 126 1.505 3.575 8.942 1.00 23.32 C ATOM 1435 O SER A 126 2.519 4.205 9.243 1.00 62.13 O ATOM 1436 CB SER A 126 1.450 1.928 7.059 1.00 24.30 C ATOM 1437 OG SER A 126 2.725 1.836 6.445 1.00 0.13 O ATOM 0 H SER A 126 -0.086 0.826 8.639 1.00 74.53 H new ATOM 0 HA SER A 126 2.549 1.709 8.892 1.00 22.15 H new ATOM 0 HB2 SER A 126 0.871 1.032 6.838 1.00 24.30 H new ATOM 0 HB3 SER A 126 0.902 2.773 6.642 1.00 24.30 H new ATOM 0 HG SER A 126 2.661 1.281 5.640 1.00 0.13 H new ATOM 1443 N VAL A 127 0.294 4.123 8.917 1.00 22.00 N ATOM 1444 CA VAL A 127 0.084 5.527 9.248 1.00 11.41 C ATOM 1445 C VAL A 127 0.292 5.777 10.738 1.00 51.42 C ATOM 1446 O VAL A 127 1.012 6.695 11.130 1.00 21.10 O ATOM 1447 CB VAL A 127 -1.331 5.991 8.853 1.00 63.54 C ATOM 1448 CG1 VAL A 127 -1.566 7.427 9.299 1.00 31.44 C ATOM 1449 CG2 VAL A 127 -1.538 5.850 7.352 1.00 60.54 C ATOM 0 H VAL A 127 -0.556 3.616 8.671 1.00 22.00 H new ATOM 0 HA VAL A 127 0.818 6.100 8.681 1.00 11.41 H new ATOM 0 HB VAL A 127 -2.058 5.355 9.359 1.00 63.54 H new ATOM 0 HG11 VAL A 127 -2.570 7.738 9.011 1.00 31.44 H new ATOM 0 HG12 VAL A 127 -1.462 7.493 10.382 1.00 31.44 H new ATOM 0 HG13 VAL A 127 -0.834 8.080 8.823 1.00 31.44 H new ATOM 0 HG21 VAL A 127 -2.543 6.182 7.090 1.00 60.54 H new ATOM 0 HG22 VAL A 127 -0.805 6.461 6.825 1.00 60.54 H new ATOM 0 HG23 VAL A 127 -1.415 4.806 7.064 1.00 60.54 H new ATOM 1459 N THR A 128 -0.346 4.954 11.564 1.00 11.43 N ATOM 1460 CA THR A 128 -0.232 5.085 13.012 1.00 51.20 C ATOM 1461 C THR A 128 1.223 5.009 13.458 1.00 64.23 C ATOM 1462 O THR A 128 1.649 5.741 14.352 1.00 12.31 O ATOM 1463 CB THR A 128 -1.038 3.994 13.740 1.00 73.51 C ATOM 1464 OG1 THR A 128 -2.426 4.100 13.401 1.00 72.42 O ATOM 1465 CG2 THR A 128 -0.870 4.112 15.248 1.00 14.14 C ATOM 0 H THR A 128 -0.947 4.190 11.256 1.00 11.43 H new ATOM 0 HA THR A 128 -0.639 6.062 13.274 1.00 51.20 H new ATOM 0 HB THR A 128 -0.660 3.022 13.422 1.00 73.51 H new ATOM 0 HG1 THR A 128 -2.621 3.522 12.634 1.00 72.42 H new ATOM 0 HG21 THR A 128 -1.449 3.331 15.741 1.00 14.14 H new ATOM 0 HG22 THR A 128 0.183 4.001 15.507 1.00 14.14 H new ATOM 0 HG23 THR A 128 -1.224 5.089 15.578 1.00 14.14 H new ATOM 1473 N THR A 129 1.985 4.118 12.831 1.00 71.02 N ATOM 1474 CA THR A 129 3.392 3.946 13.165 1.00 72.45 C ATOM 1475 C THR A 129 4.219 5.138 12.695 1.00 74.44 C ATOM 1476 O THR A 129 5.037 5.674 13.442 1.00 72.52 O ATOM 1477 CB THR A 129 3.965 2.661 12.537 1.00 21.02 C ATOM 1478 OG1 THR A 129 3.704 2.643 11.130 1.00 74.44 O ATOM 1479 CG2 THR A 129 3.359 1.426 13.186 1.00 21.03 C ATOM 0 H THR A 129 1.650 3.504 12.088 1.00 71.02 H new ATOM 0 HA THR A 129 3.452 3.870 14.251 1.00 72.45 H new ATOM 0 HB THR A 129 5.042 2.650 12.705 1.00 21.02 H new ATOM 0 HG1 THR A 129 2.854 2.185 10.961 1.00 74.44 H new ATOM 0 HG21 THR A 129 3.778 0.531 12.727 1.00 21.03 H new ATOM 0 HG22 THR A 129 3.586 1.427 14.252 1.00 21.03 H new ATOM 0 HG23 THR A 129 2.278 1.434 13.045 1.00 21.03 H new ATOM 1487 N THR A 130 3.999 5.550 11.449 1.00 10.14 N ATOM 1488 CA THR A 130 4.723 6.680 10.880 1.00 64.33 C ATOM 1489 C THR A 130 4.177 8.003 11.402 1.00 3.52 C ATOM 1490 O THR A 130 4.655 9.075 11.027 1.00 33.41 O ATOM 1491 CB THR A 130 4.645 6.678 9.341 1.00 21.00 C ATOM 1492 OG1 THR A 130 4.818 5.346 8.844 1.00 34.21 O ATOM 1493 CG2 THR A 130 5.708 7.589 8.744 1.00 3.10 C ATOM 0 H THR A 130 3.326 5.118 10.816 1.00 10.14 H new ATOM 0 HA THR A 130 5.764 6.574 11.185 1.00 64.33 H new ATOM 0 HB THR A 130 3.663 7.051 9.048 1.00 21.00 H new ATOM 0 HG1 THR A 130 4.020 4.815 9.047 1.00 34.21 H new ATOM 0 HG21 THR A 130 5.633 7.571 7.657 1.00 3.10 H new ATOM 0 HG22 THR A 130 5.557 8.608 9.102 1.00 3.10 H new ATOM 0 HG23 THR A 130 6.696 7.241 9.046 1.00 3.10 H new ATOM 1501 N LEU A 131 3.178 7.923 12.273 1.00 73.11 N ATOM 1502 CA LEU A 131 2.567 9.117 12.850 1.00 23.32 C ATOM 1503 C LEU A 131 3.150 9.415 14.227 1.00 25.54 C ATOM 1504 O LEU A 131 3.319 10.574 14.606 1.00 75.11 O ATOM 1505 CB LEU A 131 1.051 8.939 12.953 1.00 64.25 C ATOM 1506 CG LEU A 131 0.322 9.924 13.865 1.00 12.22 C ATOM 1507 CD1 LEU A 131 0.465 11.344 13.342 1.00 72.44 C ATOM 1508 CD2 LEU A 131 -1.147 9.546 13.990 1.00 4.01 C ATOM 0 H LEU A 131 2.773 7.044 12.596 1.00 73.11 H new ATOM 0 HA LEU A 131 2.784 9.960 12.194 1.00 23.32 H new ATOM 0 HB2 LEU A 131 0.627 9.019 11.952 1.00 64.25 H new ATOM 0 HB3 LEU A 131 0.847 7.928 13.306 1.00 64.25 H new ATOM 0 HG LEU A 131 0.776 9.877 14.855 1.00 12.22 H new ATOM 0 HD11 LEU A 131 -0.061 12.031 14.005 1.00 72.44 H new ATOM 0 HD12 LEU A 131 1.521 11.613 13.304 1.00 72.44 H new ATOM 0 HD13 LEU A 131 0.038 11.408 12.341 1.00 72.44 H new ATOM 0 HD21 LEU A 131 -1.652 10.258 14.643 1.00 4.01 H new ATOM 0 HD22 LEU A 131 -1.613 9.564 13.005 1.00 4.01 H new ATOM 0 HD23 LEU A 131 -1.230 8.544 14.412 1.00 4.01 H new ATOM 1520 N THR A 132 3.460 8.359 14.974 1.00 25.41 N ATOM 1521 CA THR A 132 4.026 8.507 16.310 1.00 31.24 C ATOM 1522 C THR A 132 5.273 7.648 16.477 1.00 34.31 C ATOM 1523 O THR A 132 6.293 8.110 16.988 1.00 50.14 O ATOM 1524 CB THR A 132 3.004 8.125 17.397 1.00 3.11 C ATOM 1525 OG1 THR A 132 2.905 6.701 17.499 1.00 34.50 O ATOM 1526 CG2 THR A 132 1.635 8.714 17.085 1.00 23.42 C ATOM 0 H THR A 132 3.329 7.392 14.676 1.00 25.41 H new ATOM 0 HA THR A 132 4.294 9.557 16.426 1.00 31.24 H new ATOM 0 HB THR A 132 3.349 8.533 18.347 1.00 3.11 H new ATOM 0 HG1 THR A 132 2.254 6.467 18.194 1.00 34.50 H new ATOM 0 HG21 THR A 132 0.930 8.431 17.867 1.00 23.42 H new ATOM 0 HG22 THR A 132 1.708 9.801 17.039 1.00 23.42 H new ATOM 0 HG23 THR A 132 1.285 8.333 16.126 1.00 23.42 H new ATOM 1534 N SER A 133 5.187 6.395 16.041 1.00 34.03 N ATOM 1535 CA SER A 133 6.309 5.470 16.146 1.00 62.15 C ATOM 1536 C SER A 133 7.530 6.011 15.408 1.00 0.41 C ATOM 1537 O SER A 133 8.667 5.671 15.734 1.00 52.13 O ATOM 1538 CB SER A 133 5.924 4.101 15.581 1.00 55.12 C ATOM 1539 OG SER A 133 6.568 3.056 16.290 1.00 54.23 O ATOM 0 H SER A 133 4.352 5.997 15.612 1.00 34.03 H new ATOM 0 HA SER A 133 6.561 5.362 17.201 1.00 62.15 H new ATOM 0 HB2 SER A 133 4.843 3.971 15.639 1.00 55.12 H new ATOM 0 HB3 SER A 133 6.195 4.050 14.527 1.00 55.12 H new ATOM 0 HG SER A 133 6.304 2.192 15.910 1.00 54.23 H new ATOM 1545 N TYR A 134 7.284 6.857 14.413 1.00 42.50 N ATOM 1546 CA TYR A 134 8.363 7.444 13.627 1.00 73.32 C ATOM 1547 C TYR A 134 8.579 8.905 14.006 1.00 41.42 C ATOM 1548 O TYR A 134 9.671 9.448 13.836 1.00 42.41 O ATOM 1549 CB TYR A 134 8.051 7.335 12.133 1.00 52.35 C ATOM 1550 CG TYR A 134 9.277 7.404 11.252 1.00 70.21 C ATOM 1551 CD1 TYR A 134 9.897 8.618 10.983 1.00 62.04 C ATOM 1552 CD2 TYR A 134 9.817 6.255 10.686 1.00 3.31 C ATOM 1553 CE1 TYR A 134 11.018 8.687 10.178 1.00 12.03 C ATOM 1554 CE2 TYR A 134 10.938 6.314 9.882 1.00 64.44 C ATOM 1555 CZ TYR A 134 11.534 7.532 9.630 1.00 74.32 C ATOM 1556 OH TYR A 134 12.650 7.594 8.827 1.00 24.14 O ATOM 0 H TYR A 134 6.349 7.151 14.132 1.00 42.50 H new ATOM 0 HA TYR A 134 9.278 6.892 13.842 1.00 73.32 H new ATOM 0 HB2 TYR A 134 7.532 6.395 11.946 1.00 52.35 H new ATOM 0 HB3 TYR A 134 7.368 8.137 11.854 1.00 52.35 H new ATOM 0 HD1 TYR A 134 9.495 9.525 11.411 1.00 62.04 H new ATOM 0 HD2 TYR A 134 9.352 5.300 10.878 1.00 3.31 H new ATOM 0 HE1 TYR A 134 11.487 9.639 9.979 1.00 12.03 H new ATOM 0 HE2 TYR A 134 11.346 5.411 9.453 1.00 64.44 H new ATOM 0 HH TYR A 134 12.885 6.692 8.523 1.00 24.14 H new ATOM 1566 N GLY A 135 7.531 9.538 14.523 1.00 3.03 N ATOM 1567 CA GLY A 135 7.626 10.931 14.921 1.00 33.22 C ATOM 1568 C GLY A 135 6.381 11.721 14.569 1.00 11.23 C ATOM 1569 O GLY A 135 5.606 11.339 13.692 1.00 52.24 O ATOM 0 H GLY A 135 6.617 9.111 14.674 1.00 3.03 H new ATOM 0 HA2 GLY A 135 7.797 10.988 15.996 1.00 33.22 H new ATOM 0 HA3 GLY A 135 8.490 11.386 14.437 1.00 33.22 H new ATOM 1573 N PRO A 136 6.174 12.849 15.266 1.00 20.34 N ATOM 1574 CA PRO A 136 5.014 13.716 15.040 1.00 51.25 C ATOM 1575 C PRO A 136 5.084 14.440 13.700 1.00 41.00 C ATOM 1576 O PRO A 136 4.587 13.945 12.690 1.00 31.31 O ATOM 1577 CB PRO A 136 5.093 14.719 16.194 1.00 11.13 C ATOM 1578 CG PRO A 136 6.534 14.750 16.572 1.00 51.32 C ATOM 1579 CD PRO A 136 7.057 13.363 16.325 1.00 3.12 C ATOM 0 HA PRO A 136 4.082 13.151 15.010 1.00 51.25 H new ATOM 0 HB2 PRO A 136 4.743 15.704 15.886 1.00 11.13 H new ATOM 0 HB3 PRO A 136 4.470 14.407 17.033 1.00 11.13 H new ATOM 0 HG2 PRO A 136 7.078 15.484 15.977 1.00 51.32 H new ATOM 0 HG3 PRO A 136 6.657 15.033 17.617 1.00 51.32 H new ATOM 0 HD2 PRO A 136 8.099 13.377 16.007 1.00 3.12 H new ATOM 0 HD3 PRO A 136 7.006 12.748 17.224 1.00 3.12 H new ATOM 1587 N ALA A 137 5.704 15.615 13.698 1.00 43.52 N ATOM 1588 CA ALA A 137 5.841 16.407 12.482 1.00 25.44 C ATOM 1589 C ALA A 137 6.910 15.822 11.564 1.00 43.31 C ATOM 1590 O ALA A 137 7.112 16.299 10.448 1.00 72.12 O ATOM 1591 CB ALA A 137 6.170 17.852 12.826 1.00 21.04 C ATOM 0 H ALA A 137 6.120 16.040 14.526 1.00 43.52 H new ATOM 0 HA ALA A 137 4.889 16.380 11.952 1.00 25.44 H new ATOM 0 HB1 ALA A 137 6.269 18.431 11.908 1.00 21.04 H new ATOM 0 HB2 ALA A 137 5.370 18.272 13.435 1.00 21.04 H new ATOM 0 HB3 ALA A 137 7.107 17.889 13.382 1.00 21.04 H new ATOM 1597 N VAL A 138 7.595 14.788 12.044 1.00 4.40 N ATOM 1598 CA VAL A 138 8.644 14.140 11.268 1.00 53.11 C ATOM 1599 C VAL A 138 8.127 13.707 9.900 1.00 34.34 C ATOM 1600 O VAL A 138 8.905 13.491 8.971 1.00 30.11 O ATOM 1601 CB VAL A 138 9.207 12.909 12.004 1.00 42.53 C ATOM 1602 CG1 VAL A 138 9.523 13.251 13.452 1.00 65.23 C ATOM 1603 CG2 VAL A 138 8.230 11.747 11.923 1.00 61.42 C ATOM 0 H VAL A 138 7.441 14.382 12.967 1.00 4.40 H new ATOM 0 HA VAL A 138 9.440 14.873 11.138 1.00 53.11 H new ATOM 0 HB VAL A 138 10.134 12.608 11.516 1.00 42.53 H new ATOM 0 HG11 VAL A 138 9.919 12.370 13.956 1.00 65.23 H new ATOM 0 HG12 VAL A 138 10.263 14.051 13.484 1.00 65.23 H new ATOM 0 HG13 VAL A 138 8.613 13.578 13.955 1.00 65.23 H new ATOM 0 HG21 VAL A 138 8.644 10.886 12.448 1.00 61.42 H new ATOM 0 HG22 VAL A 138 7.285 12.033 12.384 1.00 61.42 H new ATOM 0 HG23 VAL A 138 8.060 11.487 10.878 1.00 61.42 H new ATOM 1613 N PHE A 139 6.809 13.583 9.784 1.00 74.42 N ATOM 1614 CA PHE A 139 6.187 13.176 8.530 1.00 71.24 C ATOM 1615 C PHE A 139 6.516 14.163 7.414 1.00 50.13 C ATOM 1616 O PHE A 139 6.439 13.829 6.231 1.00 15.31 O ATOM 1617 CB PHE A 139 4.670 13.067 8.699 1.00 24.13 C ATOM 1618 CG PHE A 139 4.100 11.779 8.177 1.00 13.52 C ATOM 1619 CD1 PHE A 139 4.068 11.523 6.815 1.00 23.02 C ATOM 1620 CD2 PHE A 139 3.594 10.827 9.046 1.00 2.14 C ATOM 1621 CE1 PHE A 139 3.542 10.339 6.333 1.00 64.20 C ATOM 1622 CE2 PHE A 139 3.068 9.642 8.570 1.00 62.41 C ATOM 1623 CZ PHE A 139 3.042 9.397 7.210 1.00 23.33 C ATOM 0 H PHE A 139 6.151 13.759 10.543 1.00 74.42 H new ATOM 0 HA PHE A 139 6.586 12.199 8.257 1.00 71.24 H new ATOM 0 HB2 PHE A 139 4.422 13.163 9.756 1.00 24.13 H new ATOM 0 HB3 PHE A 139 4.194 13.901 8.183 1.00 24.13 H new ATOM 0 HD1 PHE A 139 4.458 12.256 6.124 1.00 23.02 H new ATOM 0 HD2 PHE A 139 3.611 11.014 10.110 1.00 2.14 H new ATOM 0 HE1 PHE A 139 3.522 10.151 5.270 1.00 64.20 H new ATOM 0 HE2 PHE A 139 2.678 8.908 9.259 1.00 62.41 H new ATOM 0 HZ PHE A 139 2.632 8.471 6.834 1.00 23.33 H new ATOM 1633 N TYR A 140 6.883 15.380 7.798 1.00 43.31 N ATOM 1634 CA TYR A 140 7.220 16.418 6.832 1.00 24.30 C ATOM 1635 C TYR A 140 8.707 16.757 6.893 1.00 33.31 C ATOM 1636 O TYR A 140 9.434 16.594 5.914 1.00 31.02 O ATOM 1637 CB TYR A 140 6.389 17.675 7.089 1.00 21.04 C ATOM 1638 CG TYR A 140 5.052 17.673 6.381 1.00 62.34 C ATOM 1639 CD1 TYR A 140 4.979 17.601 4.995 1.00 21.13 C ATOM 1640 CD2 TYR A 140 3.864 17.742 7.097 1.00 53.13 C ATOM 1641 CE1 TYR A 140 3.762 17.600 4.344 1.00 72.24 C ATOM 1642 CE2 TYR A 140 2.642 17.740 6.453 1.00 2.13 C ATOM 1643 CZ TYR A 140 2.595 17.668 5.076 1.00 4.20 C ATOM 1644 OH TYR A 140 1.380 17.665 4.432 1.00 64.25 O ATOM 0 H TYR A 140 6.955 15.672 8.773 1.00 43.31 H new ATOM 0 HA TYR A 140 6.992 16.038 5.836 1.00 24.30 H new ATOM 0 HB2 TYR A 140 6.223 17.777 8.161 1.00 21.04 H new ATOM 0 HB3 TYR A 140 6.958 18.548 6.770 1.00 21.04 H new ATOM 0 HD1 TYR A 140 5.890 17.545 4.418 1.00 21.13 H new ATOM 0 HD2 TYR A 140 3.896 17.798 8.175 1.00 53.13 H new ATOM 0 HE1 TYR A 140 3.724 17.546 3.266 1.00 72.24 H new ATOM 0 HE2 TYR A 140 1.727 17.795 7.025 1.00 2.13 H new ATOM 0 HH TYR A 140 1.520 17.772 3.468 1.00 64.25 H new ATOM 1654 N ALA A 141 9.151 17.230 8.053 1.00 30.42 N ATOM 1655 CA ALA A 141 10.551 17.589 8.245 1.00 61.15 C ATOM 1656 C ALA A 141 10.983 17.361 9.690 1.00 62.44 C ATOM 1657 O ALA A 141 10.161 17.274 10.603 1.00 1.21 O ATOM 1658 CB ALA A 141 10.783 19.040 7.846 1.00 12.33 C ATOM 0 H ALA A 141 8.562 17.373 8.873 1.00 30.42 H new ATOM 0 HA ALA A 141 11.156 16.946 7.606 1.00 61.15 H new ATOM 0 HB1 ALA A 141 11.832 19.295 7.994 1.00 12.33 H new ATOM 0 HB2 ALA A 141 10.522 19.175 6.796 1.00 12.33 H new ATOM 0 HB3 ALA A 141 10.161 19.690 8.461 1.00 12.33 H new