USER MOD reduce.3.24.130724 H: found=0, std=0, add=774, rem=0, adj=40 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 -18:sc= 0.103 USER MOD Set 1.2: A 133 SER OG : rot -65:sc= 1.64 USER MOD Set 2.1: A 57 ASN : amide:sc= -0.209 X(o=-0.21,f=-0.49) USER MOD Set 2.2: A 126 SER OG : rot 140:sc=-0.00315 USER MOD Set 3.1: A 18 ASN : amide:sc= -0.0862 X(o=-1.6,f=-1.9) USER MOD Set 3.2: A 22 GLN : amide:sc= -2.38 K(o=-1.6,f=-9.4!) USER MOD Set 3.3: A 98 SER OG : rot -133:sc= 0.817 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 85:sc= 1.13 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) USER MOD Single : A 30 SER OG : rot 180:sc= -0.109 USER MOD Single : A 31 SER OG : rot 34:sc= 0.283 USER MOD Single : A 36 GLN : amide:sc= -0.93 K(o=-0.93,f=-2.2!) USER MOD Single : A 37 MET CE :methyl -130:sc= -2.57! (180deg=-7.96!) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 41 THR OG1 : rot 80:sc= -1 USER MOD Single : A 42 THR OG1 : rot 53:sc= 0.0241 USER MOD Single : A 43 SER OG : rot 47:sc= 1.23 USER MOD Single : A 44 THR OG1 : rot -140:sc= -0.323 USER MOD Single : A 46 GLN : amide:sc= -0.291 K(o=-0.29,f=-1.1) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -89:sc= 0.955 USER MOD Single : A 53 SER OG : rot 180:sc= 0 USER MOD Single : A 56 GLN : amide:sc= -0.0031 X(o=-0.0031,f=0) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 GLN : amide:sc= -0.14 K(o=-0.14,f=-0.97) USER MOD Single : A 67 ASN : amide:sc= -0.094 K(o=-0.094,f=-0.78) USER MOD Single : A 69 MET CE :methyl -167:sc= -0.562 (180deg=-1.1) USER MOD Single : A 70 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 SER OG : rot 180:sc= -0.483 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 -70:sc= 1.27 USER MOD Single : A 85 ASN : amide:sc= -0.165 X(o=-0.16,f=-0.013) USER MOD Single : A 88 SER OG : rot 180:sc= 0.0518 USER MOD Single : A 91 SER OG : rot 180:sc= 0.0221 USER MOD Single : A 93 TYR OH : rot 180:sc= -1.77! USER MOD Single : A 95 ASN : amide:sc= -0.777 X(o=-0.78,f=-1.2) USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 107 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.87) USER MOD Single : A 108 SER OG : rot -17:sc= 0.0283 USER MOD Single : A 117 SER OG : rot 180:sc= -0.0334 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 122 SER OG : rot 84:sc= 0.108 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot 83:sc= 1.16 USER MOD Single : A 130 THR OG1 : rot 78:sc= 1.25 USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0301 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 140 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 -16.554 -0.995 -2.233 1.00 35.20 N ATOM 2 CA GLY A 17 -15.306 -1.163 -1.510 1.00 13.03 C ATOM 3 C GLY A 17 -14.733 0.155 -1.030 1.00 21.11 C ATOM 4 O GLY A 17 -13.968 0.192 -0.067 1.00 24.20 O ATOM 0 HA2 GLY A 17 -15.471 -1.817 -0.654 1.00 13.03 H new ATOM 0 HA3 GLY A 17 -14.580 -1.658 -2.155 1.00 13.03 H new ATOM 8 N ASN A 18 -15.101 1.239 -1.703 1.00 73.25 N ATOM 9 CA ASN A 18 -14.615 2.566 -1.340 1.00 53.10 C ATOM 10 C ASN A 18 -15.069 2.945 0.066 1.00 51.42 C ATOM 11 O ASN A 18 -14.352 3.626 0.798 1.00 44.13 O ATOM 12 CB ASN A 18 -15.112 3.607 -2.346 1.00 32.31 C ATOM 13 CG ASN A 18 -14.923 5.028 -1.851 1.00 25.44 C ATOM 14 OD1 ASN A 18 -13.899 5.355 -1.251 1.00 51.02 O ATOM 15 ND2 ASN A 18 -15.912 5.877 -2.099 1.00 2.41 N ATOM 0 H ASN A 18 -15.734 1.226 -2.503 1.00 73.25 H new ATOM 0 HA ASN A 18 -13.525 2.544 -1.358 1.00 53.10 H new ATOM 0 HB2 ASN A 18 -14.580 3.480 -3.289 1.00 32.31 H new ATOM 0 HB3 ASN A 18 -16.169 3.434 -2.551 1.00 32.31 H new ATOM 0 HD21 ASN A 18 -15.842 6.846 -1.789 1.00 2.41 H new ATOM 0 HD22 ASN A 18 -16.742 5.561 -2.600 1.00 2.41 H new ATOM 22 N ALA A 19 -16.266 2.500 0.437 1.00 42.03 N ATOM 23 CA ALA A 19 -16.813 2.790 1.756 1.00 55.50 C ATOM 24 C ALA A 19 -15.933 2.206 2.856 1.00 51.53 C ATOM 25 O ALA A 19 -15.734 2.828 3.900 1.00 62.03 O ATOM 26 CB ALA A 19 -18.231 2.250 1.869 1.00 51.22 C ATOM 0 H ALA A 19 -16.875 1.938 -0.158 1.00 42.03 H new ATOM 0 HA ALA A 19 -16.837 3.872 1.883 1.00 55.50 H new ATOM 0 HB1 ALA A 19 -18.628 2.474 2.859 1.00 51.22 H new ATOM 0 HB2 ALA A 19 -18.860 2.718 1.112 1.00 51.22 H new ATOM 0 HB3 ALA A 19 -18.223 1.171 1.717 1.00 51.22 H new ATOM 32 N PHE A 20 -15.411 1.008 2.617 1.00 15.15 N ATOM 33 CA PHE A 20 -14.555 0.339 3.589 1.00 54.12 C ATOM 34 C PHE A 20 -13.330 1.191 3.911 1.00 74.00 C ATOM 35 O PHE A 20 -13.032 1.452 5.076 1.00 11.20 O ATOM 36 CB PHE A 20 -14.114 -1.026 3.058 1.00 31.55 C ATOM 37 CG PHE A 20 -12.695 -1.374 3.402 1.00 41.02 C ATOM 38 CD1 PHE A 20 -12.366 -1.834 4.667 1.00 34.44 C ATOM 39 CD2 PHE A 20 -11.688 -1.241 2.459 1.00 44.43 C ATOM 40 CE1 PHE A 20 -11.060 -2.153 4.985 1.00 31.33 C ATOM 41 CE2 PHE A 20 -10.379 -1.559 2.773 1.00 22.10 C ATOM 42 CZ PHE A 20 -10.066 -2.017 4.038 1.00 61.52 C ATOM 0 H PHE A 20 -15.566 0.480 1.758 1.00 15.15 H new ATOM 0 HA PHE A 20 -15.129 0.197 4.505 1.00 54.12 H new ATOM 0 HB2 PHE A 20 -14.775 -1.794 3.460 1.00 31.55 H new ATOM 0 HB3 PHE A 20 -14.230 -1.040 1.974 1.00 31.55 H new ATOM 0 HD1 PHE A 20 -13.139 -1.944 5.413 1.00 34.44 H new ATOM 0 HD2 PHE A 20 -11.928 -0.885 1.468 1.00 44.43 H new ATOM 0 HE1 PHE A 20 -10.817 -2.509 5.975 1.00 31.33 H new ATOM 0 HE2 PHE A 20 -9.603 -1.449 2.030 1.00 22.10 H new ATOM 0 HZ PHE A 20 -9.045 -2.268 4.285 1.00 61.52 H new ATOM 52 N ALA A 21 -12.624 1.620 2.870 1.00 52.11 N ATOM 53 CA ALA A 21 -11.433 2.444 3.041 1.00 33.43 C ATOM 54 C ALA A 21 -11.799 3.846 3.511 1.00 13.31 C ATOM 55 O ALA A 21 -11.063 4.465 4.279 1.00 41.21 O ATOM 56 CB ALA A 21 -10.646 2.508 1.741 1.00 74.34 C ATOM 0 H ALA A 21 -12.856 1.411 1.899 1.00 52.11 H new ATOM 0 HA ALA A 21 -10.809 1.985 3.808 1.00 33.43 H new ATOM 0 HB1 ALA A 21 -9.759 3.126 1.882 1.00 74.34 H new ATOM 0 HB2 ALA A 21 -10.344 1.502 1.448 1.00 74.34 H new ATOM 0 HB3 ALA A 21 -11.270 2.941 0.959 1.00 74.34 H new ATOM 62 N GLN A 22 -12.940 4.344 3.044 1.00 41.01 N ATOM 63 CA GLN A 22 -13.402 5.677 3.416 1.00 65.22 C ATOM 64 C GLN A 22 -13.739 5.740 4.902 1.00 40.00 C ATOM 65 O GLN A 22 -13.428 6.721 5.577 1.00 10.34 O ATOM 66 CB GLN A 22 -14.626 6.066 2.585 1.00 63.41 C ATOM 67 CG GLN A 22 -15.346 7.300 3.104 1.00 44.21 C ATOM 68 CD GLN A 22 -14.422 8.492 3.258 1.00 43.35 C ATOM 69 OE1 GLN A 22 -13.303 8.495 2.743 1.00 53.13 O ATOM 70 NE2 GLN A 22 -14.886 9.513 3.969 1.00 62.12 N ATOM 0 H GLN A 22 -13.561 3.845 2.408 1.00 41.01 H new ATOM 0 HA GLN A 22 -12.597 6.383 3.215 1.00 65.22 H new ATOM 0 HB2 GLN A 22 -14.315 6.243 1.556 1.00 63.41 H new ATOM 0 HB3 GLN A 22 -15.324 5.229 2.567 1.00 63.41 H new ATOM 0 HG2 GLN A 22 -16.155 7.558 2.421 1.00 44.21 H new ATOM 0 HG3 GLN A 22 -15.802 7.072 4.067 1.00 44.21 H new ATOM 0 HE21 GLN A 22 -15.819 9.467 4.378 1.00 62.12 H new ATOM 0 HE22 GLN A 22 -14.309 10.343 4.106 1.00 62.12 H new ATOM 79 N SER A 23 -14.377 4.688 5.404 1.00 1.53 N ATOM 80 CA SER A 23 -14.760 4.626 6.810 1.00 20.11 C ATOM 81 C SER A 23 -13.528 4.629 7.710 1.00 13.42 C ATOM 82 O SER A 23 -13.473 5.356 8.703 1.00 41.55 O ATOM 83 CB SER A 23 -15.597 3.373 7.077 1.00 1.10 C ATOM 84 OG SER A 23 -16.970 3.614 6.826 1.00 15.12 O ATOM 0 H SER A 23 -14.640 3.867 4.859 1.00 1.53 H new ATOM 0 HA SER A 23 -15.357 5.509 7.038 1.00 20.11 H new ATOM 0 HB2 SER A 23 -15.247 2.556 6.446 1.00 1.10 H new ATOM 0 HB3 SER A 23 -15.463 3.056 8.111 1.00 1.10 H new ATOM 0 HG SER A 23 -17.483 2.798 7.002 1.00 15.12 H new ATOM 90 N LEU A 24 -12.542 3.812 7.356 1.00 70.55 N ATOM 91 CA LEU A 24 -11.310 3.720 8.130 1.00 3.10 C ATOM 92 C LEU A 24 -10.471 4.984 7.972 1.00 44.41 C ATOM 93 O LEU A 24 -9.996 5.554 8.955 1.00 13.23 O ATOM 94 CB LEU A 24 -10.499 2.498 7.693 1.00 52.52 C ATOM 95 CG LEU A 24 -9.012 2.518 8.049 1.00 30.23 C ATOM 96 CD1 LEU A 24 -8.515 1.108 8.338 1.00 50.30 C ATOM 97 CD2 LEU A 24 -8.203 3.151 6.928 1.00 10.13 C ATOM 0 H LEU A 24 -12.572 3.204 6.538 1.00 70.55 H new ATOM 0 HA LEU A 24 -11.578 3.613 9.181 1.00 3.10 H new ATOM 0 HB2 LEU A 24 -10.947 1.611 8.140 1.00 52.52 H new ATOM 0 HB3 LEU A 24 -10.592 2.392 6.612 1.00 52.52 H new ATOM 0 HG LEU A 24 -8.881 3.120 8.948 1.00 30.23 H new ATOM 0 HD11 LEU A 24 -7.455 1.140 8.590 1.00 50.30 H new ATOM 0 HD12 LEU A 24 -9.074 0.690 9.175 1.00 50.30 H new ATOM 0 HD13 LEU A 24 -8.660 0.483 7.457 1.00 50.30 H new ATOM 0 HD21 LEU A 24 -7.147 3.156 7.199 1.00 10.13 H new ATOM 0 HD22 LEU A 24 -8.339 2.576 6.012 1.00 10.13 H new ATOM 0 HD23 LEU A 24 -8.542 4.175 6.768 1.00 10.13 H new ATOM 109 N SER A 25 -10.294 5.419 6.728 1.00 2.31 N ATOM 110 CA SER A 25 -9.512 6.615 6.440 1.00 51.32 C ATOM 111 C SER A 25 -10.138 7.844 7.092 1.00 13.12 C ATOM 112 O SER A 25 -9.436 8.726 7.584 1.00 42.45 O ATOM 113 CB SER A 25 -9.400 6.826 4.930 1.00 33.12 C ATOM 114 OG SER A 25 -8.715 5.749 4.313 1.00 63.15 O ATOM 0 H SER A 25 -10.682 4.960 5.904 1.00 2.31 H new ATOM 0 HA SER A 25 -8.514 6.474 6.855 1.00 51.32 H new ATOM 0 HB2 SER A 25 -10.396 6.922 4.498 1.00 33.12 H new ATOM 0 HB3 SER A 25 -8.874 7.759 4.728 1.00 33.12 H new ATOM 0 HG SER A 25 -9.347 5.024 4.124 1.00 63.15 H new ATOM 120 N SER A 26 -11.467 7.894 7.091 1.00 71.11 N ATOM 121 CA SER A 26 -12.190 9.015 7.678 1.00 41.03 C ATOM 122 C SER A 26 -11.778 9.227 9.131 1.00 30.21 C ATOM 123 O SER A 26 -11.602 10.358 9.580 1.00 54.01 O ATOM 124 CB SER A 26 -13.699 8.777 7.592 1.00 11.22 C ATOM 125 OG SER A 26 -14.398 9.608 8.504 1.00 33.34 O ATOM 0 H SER A 26 -12.064 7.171 6.690 1.00 71.11 H new ATOM 0 HA SER A 26 -11.939 9.913 7.114 1.00 41.03 H new ATOM 0 HB2 SER A 26 -14.044 8.974 6.577 1.00 11.22 H new ATOM 0 HB3 SER A 26 -13.918 7.731 7.806 1.00 11.22 H new ATOM 0 HG SER A 26 -15.360 9.439 8.429 1.00 33.34 H new ATOM 131 N ASN A 27 -11.628 8.127 9.863 1.00 70.45 N ATOM 132 CA ASN A 27 -11.237 8.189 11.266 1.00 52.25 C ATOM 133 C ASN A 27 -9.749 8.496 11.405 1.00 1.10 C ATOM 134 O ASN A 27 -9.329 9.186 12.333 1.00 12.33 O ATOM 135 CB ASN A 27 -11.565 6.870 11.968 1.00 51.51 C ATOM 136 CG ASN A 27 -12.131 7.081 13.359 1.00 62.21 C ATOM 137 OD1 ASN A 27 -13.249 7.569 13.520 1.00 1.12 O ATOM 138 ND2 ASN A 27 -11.356 6.711 14.375 1.00 74.03 N ATOM 0 H ASN A 27 -11.772 7.182 9.507 1.00 70.45 H new ATOM 0 HA ASN A 27 -11.801 8.994 11.738 1.00 52.25 H new ATOM 0 HB2 ASN A 27 -12.283 6.311 11.368 1.00 51.51 H new ATOM 0 HB3 ASN A 27 -10.662 6.262 12.034 1.00 51.51 H new ATOM 0 HD21 ASN A 27 -11.682 6.828 15.334 1.00 74.03 H new ATOM 0 HD22 ASN A 27 -10.435 6.310 14.195 1.00 74.03 H new ATOM 145 N LEU A 28 -8.955 7.978 10.473 1.00 14.30 N ATOM 146 CA LEU A 28 -7.513 8.196 10.489 1.00 34.31 C ATOM 147 C LEU A 28 -7.176 9.640 10.129 1.00 31.40 C ATOM 148 O LEU A 28 -6.208 10.207 10.635 1.00 61.30 O ATOM 149 CB LEU A 28 -6.822 7.241 9.514 1.00 12.34 C ATOM 150 CG LEU A 28 -5.389 6.842 9.868 1.00 22.23 C ATOM 151 CD1 LEU A 28 -4.469 8.052 9.814 1.00 52.01 C ATOM 152 CD2 LEU A 28 -5.340 6.194 11.244 1.00 32.05 C ATOM 0 H LEU A 28 -9.286 7.404 9.697 1.00 14.30 H new ATOM 0 HA LEU A 28 -7.152 7.999 11.498 1.00 34.31 H new ATOM 0 HB2 LEU A 28 -7.422 6.334 9.438 1.00 12.34 H new ATOM 0 HB3 LEU A 28 -6.816 7.703 8.527 1.00 12.34 H new ATOM 0 HG LEU A 28 -5.043 6.115 9.133 1.00 22.23 H new ATOM 0 HD11 LEU A 28 -3.454 7.749 10.069 1.00 52.01 H new ATOM 0 HD12 LEU A 28 -4.480 8.473 8.809 1.00 52.01 H new ATOM 0 HD13 LEU A 28 -4.813 8.803 10.526 1.00 52.01 H new ATOM 0 HD21 LEU A 28 -4.312 5.917 11.479 1.00 32.05 H new ATOM 0 HD22 LEU A 28 -5.706 6.898 11.991 1.00 32.05 H new ATOM 0 HD23 LEU A 28 -5.967 5.302 11.249 1.00 32.05 H new ATOM 164 N LEU A 29 -7.983 10.229 9.254 1.00 61.40 N ATOM 165 CA LEU A 29 -7.773 11.607 8.826 1.00 5.24 C ATOM 166 C LEU A 29 -8.145 12.585 9.937 1.00 33.33 C ATOM 167 O LEU A 29 -7.501 13.618 10.110 1.00 64.34 O ATOM 168 CB LEU A 29 -8.597 11.905 7.572 1.00 1.52 C ATOM 169 CG LEU A 29 -7.880 11.713 6.236 1.00 32.01 C ATOM 170 CD1 LEU A 29 -6.598 12.531 6.195 1.00 11.13 C ATOM 171 CD2 LEU A 29 -7.581 10.240 5.998 1.00 2.31 C ATOM 0 H LEU A 29 -8.789 9.773 8.827 1.00 61.40 H new ATOM 0 HA LEU A 29 -6.715 11.732 8.596 1.00 5.24 H new ATOM 0 HB2 LEU A 29 -9.481 11.267 7.582 1.00 1.52 H new ATOM 0 HB3 LEU A 29 -8.948 12.936 7.628 1.00 1.52 H new ATOM 0 HG LEU A 29 -8.537 12.064 5.440 1.00 32.01 H new ATOM 0 HD11 LEU A 29 -6.101 12.381 5.236 1.00 11.13 H new ATOM 0 HD12 LEU A 29 -6.836 13.587 6.319 1.00 11.13 H new ATOM 0 HD13 LEU A 29 -5.936 12.211 7.000 1.00 11.13 H new ATOM 0 HD21 LEU A 29 -7.070 10.122 5.042 1.00 2.31 H new ATOM 0 HD22 LEU A 29 -6.944 9.864 6.799 1.00 2.31 H new ATOM 0 HD23 LEU A 29 -8.514 9.677 5.983 1.00 2.31 H new ATOM 183 N SER A 30 -9.189 12.248 10.688 1.00 43.52 N ATOM 184 CA SER A 30 -9.648 13.097 11.782 1.00 32.44 C ATOM 185 C SER A 30 -8.941 12.735 13.085 1.00 75.45 C ATOM 186 O SER A 30 -9.224 13.306 14.137 1.00 11.51 O ATOM 187 CB SER A 30 -11.162 12.964 11.957 1.00 34.42 C ATOM 188 OG SER A 30 -11.488 12.514 13.261 1.00 1.34 O ATOM 0 H SER A 30 -9.732 11.394 10.559 1.00 43.52 H new ATOM 0 HA SER A 30 -9.407 14.130 11.533 1.00 32.44 H new ATOM 0 HB2 SER A 30 -11.638 13.927 11.772 1.00 34.42 H new ATOM 0 HB3 SER A 30 -11.556 12.266 11.219 1.00 34.42 H new ATOM 0 HG SER A 30 -12.461 12.439 13.347 1.00 1.34 H new ATOM 194 N SER A 31 -8.020 11.780 13.004 1.00 21.15 N ATOM 195 CA SER A 31 -7.273 11.338 14.176 1.00 11.33 C ATOM 196 C SER A 31 -6.699 12.529 14.937 1.00 75.21 C ATOM 197 O SER A 31 -6.126 13.441 14.342 1.00 52.02 O ATOM 198 CB SER A 31 -6.144 10.391 13.761 1.00 31.13 C ATOM 199 OG SER A 31 -6.615 9.060 13.639 1.00 62.40 O ATOM 0 H SER A 31 -7.773 11.298 12.140 1.00 21.15 H new ATOM 0 HA SER A 31 -7.960 10.806 14.834 1.00 11.33 H new ATOM 0 HB2 SER A 31 -5.720 10.719 12.812 1.00 31.13 H new ATOM 0 HB3 SER A 31 -5.342 10.430 14.498 1.00 31.13 H new ATOM 0 HG SER A 31 -7.537 9.068 13.307 1.00 62.40 H new ATOM 205 N GLY A 32 -6.857 12.512 16.256 1.00 43.42 N ATOM 206 CA GLY A 32 -6.351 13.596 17.078 1.00 40.24 C ATOM 207 C GLY A 32 -4.859 13.807 16.904 1.00 52.01 C ATOM 208 O GLY A 32 -4.331 14.865 17.245 1.00 5.34 O ATOM 0 H GLY A 32 -7.326 11.767 16.771 1.00 43.42 H new ATOM 0 HA2 GLY A 32 -6.877 14.516 16.825 1.00 40.24 H new ATOM 0 HA3 GLY A 32 -6.565 13.384 18.126 1.00 40.24 H new ATOM 212 N ASP A 33 -4.179 12.797 16.374 1.00 54.12 N ATOM 213 CA ASP A 33 -2.739 12.876 16.155 1.00 24.22 C ATOM 214 C ASP A 33 -2.425 13.142 14.687 1.00 52.13 C ATOM 215 O ASP A 33 -1.584 13.981 14.365 1.00 61.35 O ATOM 216 CB ASP A 33 -2.062 11.581 16.608 1.00 71.11 C ATOM 217 CG ASP A 33 -1.141 11.792 17.792 1.00 65.22 C ATOM 218 OD1 ASP A 33 -1.628 11.740 18.940 1.00 13.25 O ATOM 219 OD2 ASP A 33 0.070 12.012 17.571 1.00 34.04 O ATOM 0 H ASP A 33 -4.601 11.914 16.088 1.00 54.12 H new ATOM 0 HA ASP A 33 -2.352 13.706 16.746 1.00 24.22 H new ATOM 0 HB2 ASP A 33 -2.825 10.849 16.871 1.00 71.11 H new ATOM 0 HB3 ASP A 33 -1.492 11.163 15.778 1.00 71.11 H new ATOM 224 N PHE A 34 -3.108 12.424 13.801 1.00 21.51 N ATOM 225 CA PHE A 34 -2.901 12.582 12.367 1.00 71.51 C ATOM 226 C PHE A 34 -3.424 13.932 11.887 1.00 72.10 C ATOM 227 O PHE A 34 -2.722 14.676 11.201 1.00 33.32 O ATOM 228 CB PHE A 34 -3.594 11.452 11.602 1.00 70.21 C ATOM 229 CG PHE A 34 -3.014 11.208 10.238 1.00 12.55 C ATOM 230 CD1 PHE A 34 -1.662 10.950 10.082 1.00 54.32 C ATOM 231 CD2 PHE A 34 -3.823 11.234 9.114 1.00 70.35 C ATOM 232 CE1 PHE A 34 -1.126 10.725 8.827 1.00 52.23 C ATOM 233 CE2 PHE A 34 -3.292 11.009 7.856 1.00 11.52 C ATOM 234 CZ PHE A 34 -1.943 10.754 7.713 1.00 35.21 C ATOM 0 H PHE A 34 -3.809 11.727 14.052 1.00 21.51 H new ATOM 0 HA PHE A 34 -1.829 12.538 12.173 1.00 71.51 H new ATOM 0 HB2 PHE A 34 -3.527 10.534 12.186 1.00 70.21 H new ATOM 0 HB3 PHE A 34 -4.653 11.689 11.501 1.00 70.21 H new ATOM 0 HD1 PHE A 34 -1.019 10.924 10.950 1.00 54.32 H new ATOM 0 HD2 PHE A 34 -4.879 11.432 9.220 1.00 70.35 H new ATOM 0 HE1 PHE A 34 -0.070 10.527 8.718 1.00 52.23 H new ATOM 0 HE2 PHE A 34 -3.933 11.033 6.987 1.00 11.52 H new ATOM 0 HZ PHE A 34 -1.527 10.577 6.732 1.00 35.21 H new ATOM 244 N VAL A 35 -4.664 14.243 12.252 1.00 72.30 N ATOM 245 CA VAL A 35 -5.285 15.503 11.860 1.00 62.13 C ATOM 246 C VAL A 35 -4.421 16.691 12.272 1.00 33.00 C ATOM 247 O VAL A 35 -4.388 17.713 11.586 1.00 22.41 O ATOM 248 CB VAL A 35 -6.684 15.659 12.484 1.00 65.11 C ATOM 249 CG1 VAL A 35 -6.579 16.196 13.903 1.00 33.03 C ATOM 250 CG2 VAL A 35 -7.551 16.565 11.625 1.00 13.21 C ATOM 0 H VAL A 35 -5.259 13.639 12.819 1.00 72.30 H new ATOM 0 HA VAL A 35 -5.381 15.485 10.774 1.00 62.13 H new ATOM 0 HB VAL A 35 -7.156 14.677 12.527 1.00 65.11 H new ATOM 0 HG11 VAL A 35 -7.578 16.300 14.328 1.00 33.03 H new ATOM 0 HG12 VAL A 35 -5.996 15.505 14.511 1.00 33.03 H new ATOM 0 HG13 VAL A 35 -6.088 17.169 13.888 1.00 33.03 H new ATOM 0 HG21 VAL A 35 -8.536 16.664 12.080 1.00 13.21 H new ATOM 0 HG22 VAL A 35 -7.086 17.548 11.548 1.00 13.21 H new ATOM 0 HG23 VAL A 35 -7.653 16.133 10.629 1.00 13.21 H new ATOM 260 N GLN A 36 -3.725 16.549 13.395 1.00 63.12 N ATOM 261 CA GLN A 36 -2.862 17.611 13.898 1.00 73.31 C ATOM 262 C GLN A 36 -1.791 17.971 12.875 1.00 63.43 C ATOM 263 O GLN A 36 -1.514 19.147 12.641 1.00 11.32 O ATOM 264 CB GLN A 36 -2.205 17.184 15.212 1.00 12.24 C ATOM 265 CG GLN A 36 -1.333 18.261 15.835 1.00 73.53 C ATOM 266 CD GLN A 36 0.096 18.220 15.328 1.00 74.03 C ATOM 267 OE1 GLN A 36 0.628 17.152 15.025 1.00 24.12 O ATOM 268 NE2 GLN A 36 0.724 19.386 15.232 1.00 45.21 N ATOM 0 H GLN A 36 -3.742 15.709 13.974 1.00 63.12 H new ATOM 0 HA GLN A 36 -3.479 18.492 14.078 1.00 73.31 H new ATOM 0 HB2 GLN A 36 -2.982 16.902 15.922 1.00 12.24 H new ATOM 0 HB3 GLN A 36 -1.599 16.296 15.033 1.00 12.24 H new ATOM 0 HG2 GLN A 36 -1.763 19.240 15.621 1.00 73.53 H new ATOM 0 HG3 GLN A 36 -1.334 18.142 16.919 1.00 73.53 H new ATOM 0 HE21 GLN A 36 0.244 20.247 15.494 1.00 45.21 H new ATOM 0 HE22 GLN A 36 1.686 19.421 14.896 1.00 45.21 H new ATOM 277 N MET A 37 -1.191 16.952 12.268 1.00 1.03 N ATOM 278 CA MET A 37 -0.150 17.164 11.270 1.00 60.24 C ATOM 279 C MET A 37 -0.742 17.712 9.975 1.00 41.32 C ATOM 280 O MET A 37 -0.160 18.595 9.342 1.00 31.31 O ATOM 281 CB MET A 37 0.592 15.854 10.990 1.00 42.42 C ATOM 282 CG MET A 37 2.084 16.036 10.769 1.00 50.51 C ATOM 283 SD MET A 37 2.899 14.518 10.237 1.00 13.40 S ATOM 284 CE MET A 37 2.054 14.208 8.688 1.00 25.01 C ATOM 0 H MET A 37 -1.408 15.972 12.450 1.00 1.03 H new ATOM 0 HA MET A 37 0.554 17.896 11.666 1.00 60.24 H new ATOM 0 HB2 MET A 37 0.437 15.173 11.827 1.00 42.42 H new ATOM 0 HB3 MET A 37 0.158 15.381 10.109 1.00 42.42 H new ATOM 0 HG2 MET A 37 2.244 16.811 10.020 1.00 50.51 H new ATOM 0 HG3 MET A 37 2.544 16.386 11.693 1.00 50.51 H new ATOM 0 HE1 MET A 37 1.703 13.176 8.665 1.00 25.01 H new ATOM 0 HE2 MET A 37 1.203 14.883 8.597 1.00 25.01 H new ATOM 0 HE3 MET A 37 2.741 14.376 7.859 1.00 25.01 H new ATOM 294 N ILE A 38 -1.898 17.185 9.590 1.00 60.22 N ATOM 295 CA ILE A 38 -2.568 17.624 8.371 1.00 62.25 C ATOM 296 C ILE A 38 -3.000 19.082 8.475 1.00 42.45 C ATOM 297 O ILE A 38 -2.961 19.825 7.494 1.00 24.02 O ATOM 298 CB ILE A 38 -3.802 16.756 8.063 1.00 75.11 C ATOM 299 CG1 ILE A 38 -3.415 15.276 8.026 1.00 24.45 C ATOM 300 CG2 ILE A 38 -4.430 17.177 6.743 1.00 2.05 C ATOM 301 CD1 ILE A 38 -4.599 14.345 7.887 1.00 54.45 C ATOM 0 H ILE A 38 -2.391 16.454 10.103 1.00 60.22 H new ATOM 0 HA ILE A 38 -1.847 17.518 7.560 1.00 62.25 H new ATOM 0 HB ILE A 38 -4.536 16.901 8.855 1.00 75.11 H new ATOM 0 HG12 ILE A 38 -2.732 15.108 7.194 1.00 24.45 H new ATOM 0 HG13 ILE A 38 -2.873 15.028 8.938 1.00 24.45 H new ATOM 0 HG21 ILE A 38 -5.301 16.554 6.539 1.00 2.05 H new ATOM 0 HG22 ILE A 38 -4.737 18.221 6.803 1.00 2.05 H new ATOM 0 HG23 ILE A 38 -3.703 17.058 5.940 1.00 2.05 H new ATOM 0 HD11 ILE A 38 -4.250 13.313 7.868 1.00 54.45 H new ATOM 0 HD12 ILE A 38 -5.273 14.484 8.732 1.00 54.45 H new ATOM 0 HD13 ILE A 38 -5.129 14.566 6.961 1.00 54.45 H new ATOM 313 N SER A 39 -3.409 19.488 9.672 1.00 13.32 N ATOM 314 CA SER A 39 -3.852 20.859 9.907 1.00 60.11 C ATOM 315 C SER A 39 -2.667 21.762 10.232 1.00 4.31 C ATOM 316 O SER A 39 -2.722 22.976 10.028 1.00 33.34 O ATOM 317 CB SER A 39 -4.869 20.901 11.048 1.00 35.13 C ATOM 318 OG SER A 39 -6.115 20.362 10.641 1.00 25.55 O ATOM 0 H SER A 39 -3.443 18.887 10.496 1.00 13.32 H new ATOM 0 HA SER A 39 -4.326 21.224 8.996 1.00 60.11 H new ATOM 0 HB2 SER A 39 -4.487 20.339 11.900 1.00 35.13 H new ATOM 0 HB3 SER A 39 -5.005 21.930 11.380 1.00 35.13 H new ATOM 0 HG SER A 39 -6.747 20.399 11.389 1.00 25.55 H new ATOM 324 N SER A 40 -1.595 21.163 10.739 1.00 5.23 N ATOM 325 CA SER A 40 -0.396 21.914 11.098 1.00 32.23 C ATOM 326 C SER A 40 0.312 22.432 9.850 1.00 25.22 C ATOM 327 O SER A 40 0.885 23.522 9.855 1.00 2.32 O ATOM 328 CB SER A 40 0.557 21.035 11.912 1.00 54.21 C ATOM 329 OG SER A 40 1.881 21.536 11.861 1.00 74.32 O ATOM 0 H SER A 40 -1.531 20.160 10.911 1.00 5.23 H new ATOM 0 HA SER A 40 -0.698 22.768 11.705 1.00 32.23 H new ATOM 0 HB2 SER A 40 0.221 20.991 12.948 1.00 54.21 H new ATOM 0 HB3 SER A 40 0.535 20.016 11.527 1.00 54.21 H new ATOM 0 HG SER A 40 2.470 20.958 12.390 1.00 74.32 H new ATOM 335 N THR A 41 0.271 21.642 8.783 1.00 41.34 N ATOM 336 CA THR A 41 0.911 22.020 7.527 1.00 11.43 C ATOM 337 C THR A 41 0.385 23.359 7.025 1.00 32.12 C ATOM 338 O THR A 41 1.092 24.096 6.335 1.00 3.33 O ATOM 339 CB THR A 41 0.686 20.952 6.441 1.00 74.43 C ATOM 340 OG1 THR A 41 1.541 21.206 5.320 1.00 45.23 O ATOM 341 CG2 THR A 41 -0.766 20.941 5.984 1.00 43.33 C ATOM 0 H THR A 41 -0.198 20.736 8.762 1.00 41.34 H new ATOM 0 HA THR A 41 1.979 22.105 7.727 1.00 11.43 H new ATOM 0 HB THR A 41 0.924 19.977 6.867 1.00 74.43 H new ATOM 0 HG1 THR A 41 2.443 20.876 5.515 1.00 45.23 H new ATOM 0 HG21 THR A 41 -0.900 20.178 5.217 1.00 43.33 H new ATOM 0 HG22 THR A 41 -1.413 20.719 6.833 1.00 43.33 H new ATOM 0 HG23 THR A 41 -1.026 21.917 5.575 1.00 43.33 H new ATOM 349 N THR A 42 -0.859 23.671 7.373 1.00 51.33 N ATOM 350 CA THR A 42 -1.478 24.923 6.957 1.00 10.02 C ATOM 351 C THR A 42 -1.240 25.187 5.475 1.00 52.01 C ATOM 352 O THR A 42 -0.751 26.251 5.095 1.00 53.15 O ATOM 353 CB THR A 42 -0.941 26.114 7.773 1.00 51.14 C ATOM 354 OG1 THR A 42 0.469 25.974 7.973 1.00 63.53 O ATOM 355 CG2 THR A 42 -1.644 26.209 9.119 1.00 65.22 C ATOM 0 H THR A 42 -1.458 23.073 7.942 1.00 51.33 H new ATOM 0 HA THR A 42 -2.548 24.822 7.138 1.00 10.02 H new ATOM 0 HB THR A 42 -1.139 27.028 7.214 1.00 51.14 H new ATOM 0 HG1 THR A 42 0.910 25.837 7.109 1.00 63.53 H new ATOM 0 HG21 THR A 42 -1.248 27.057 9.677 1.00 65.22 H new ATOM 0 HG22 THR A 42 -2.714 26.346 8.962 1.00 65.22 H new ATOM 0 HG23 THR A 42 -1.474 25.292 9.684 1.00 65.22 H new ATOM 363 N SER A 43 -1.591 24.214 4.640 1.00 2.11 N ATOM 364 CA SER A 43 -1.412 24.341 3.199 1.00 35.42 C ATOM 365 C SER A 43 -1.907 23.091 2.478 1.00 34.12 C ATOM 366 O SER A 43 -1.315 22.017 2.593 1.00 41.03 O ATOM 367 CB SER A 43 0.060 24.587 2.866 1.00 23.32 C ATOM 368 OG SER A 43 0.327 25.970 2.719 1.00 2.23 O ATOM 0 H SER A 43 -2.001 23.329 4.937 1.00 2.11 H new ATOM 0 HA SER A 43 -2.001 25.193 2.858 1.00 35.42 H new ATOM 0 HB2 SER A 43 0.688 24.174 3.656 1.00 23.32 H new ATOM 0 HB3 SER A 43 0.320 24.064 1.946 1.00 23.32 H new ATOM 0 HG SER A 43 -0.080 26.462 3.462 1.00 2.23 H new ATOM 374 N THR A 44 -2.999 23.238 1.733 1.00 44.01 N ATOM 375 CA THR A 44 -3.575 22.123 0.993 1.00 33.44 C ATOM 376 C THR A 44 -2.539 21.471 0.084 1.00 15.43 C ATOM 377 O THR A 44 -2.560 20.259 -0.127 1.00 31.22 O ATOM 378 CB THR A 44 -4.777 22.574 0.142 1.00 23.23 C ATOM 379 OG1 THR A 44 -5.288 21.468 -0.611 1.00 43.40 O ATOM 380 CG2 THR A 44 -4.379 23.697 -0.802 1.00 71.44 C ATOM 0 H THR A 44 -3.502 24.119 1.627 1.00 44.01 H new ATOM 0 HA THR A 44 -3.914 21.396 1.731 1.00 33.44 H new ATOM 0 HB THR A 44 -5.552 22.943 0.814 1.00 23.23 H new ATOM 0 HG1 THR A 44 -5.535 21.770 -1.510 1.00 43.40 H new ATOM 0 HG21 THR A 44 -5.244 23.999 -1.393 1.00 71.44 H new ATOM 0 HG22 THR A 44 -4.019 24.548 -0.224 1.00 71.44 H new ATOM 0 HG23 THR A 44 -3.588 23.350 -1.467 1.00 71.44 H new ATOM 388 N ASP A 45 -1.635 22.283 -0.450 1.00 34.11 N ATOM 389 CA ASP A 45 -0.588 21.785 -1.336 1.00 34.03 C ATOM 390 C ASP A 45 0.284 20.756 -0.622 1.00 1.12 C ATOM 391 O ASP A 45 0.540 19.674 -1.150 1.00 5.25 O ATOM 392 CB ASP A 45 0.276 22.941 -1.841 1.00 2.41 C ATOM 393 CG ASP A 45 0.679 22.772 -3.291 1.00 70.24 C ATOM 394 OD1 ASP A 45 -0.212 22.818 -4.165 1.00 35.13 O ATOM 395 OD2 ASP A 45 1.887 22.595 -3.555 1.00 73.32 O ATOM 0 H ASP A 45 -1.605 23.289 -0.286 1.00 34.11 H new ATOM 0 HA ASP A 45 -1.067 21.301 -2.187 1.00 34.03 H new ATOM 0 HB2 ASP A 45 -0.271 23.877 -1.726 1.00 2.41 H new ATOM 0 HB3 ASP A 45 1.172 23.017 -1.225 1.00 2.41 H new ATOM 400 N GLN A 46 0.735 21.102 0.579 1.00 71.31 N ATOM 401 CA GLN A 46 1.580 20.209 1.363 1.00 3.33 C ATOM 402 C GLN A 46 0.772 19.035 1.909 1.00 41.44 C ATOM 403 O GLN A 46 1.314 17.960 2.159 1.00 44.13 O ATOM 404 CB GLN A 46 2.234 20.973 2.516 1.00 34.10 C ATOM 405 CG GLN A 46 3.605 21.533 2.175 1.00 63.42 C ATOM 406 CD GLN A 46 3.652 22.159 0.794 1.00 0.44 C ATOM 407 OE1 GLN A 46 3.852 21.470 -0.206 1.00 11.34 O ATOM 408 NE2 GLN A 46 3.468 23.473 0.733 1.00 71.11 N ATOM 0 H GLN A 46 0.530 21.993 1.030 1.00 71.31 H new ATOM 0 HA GLN A 46 2.358 19.818 0.708 1.00 3.33 H new ATOM 0 HB2 GLN A 46 1.580 21.792 2.815 1.00 34.10 H new ATOM 0 HB3 GLN A 46 2.326 20.309 3.375 1.00 34.10 H new ATOM 0 HG2 GLN A 46 3.883 22.280 2.918 1.00 63.42 H new ATOM 0 HG3 GLN A 46 4.344 20.734 2.233 1.00 63.42 H new ATOM 0 HE21 GLN A 46 3.305 24.005 1.588 1.00 71.11 H new ATOM 0 HE22 GLN A 46 3.489 23.950 -0.169 1.00 71.11 H new ATOM 417 N ALA A 47 -0.527 19.251 2.089 1.00 31.01 N ATOM 418 CA ALA A 47 -1.410 18.210 2.603 1.00 44.04 C ATOM 419 C ALA A 47 -1.437 17.004 1.670 1.00 53.22 C ATOM 420 O ALA A 47 -1.586 15.866 2.115 1.00 42.02 O ATOM 421 CB ALA A 47 -2.815 18.760 2.800 1.00 0.01 C ATOM 0 H ALA A 47 -0.991 20.136 1.887 1.00 31.01 H new ATOM 0 HA ALA A 47 -1.022 17.882 3.567 1.00 44.04 H new ATOM 0 HB1 ALA A 47 -3.463 17.972 3.184 1.00 0.01 H new ATOM 0 HB2 ALA A 47 -2.786 19.585 3.511 1.00 0.01 H new ATOM 0 HB3 ALA A 47 -3.203 19.117 1.846 1.00 0.01 H new ATOM 427 N VAL A 48 -1.294 17.261 0.374 1.00 43.12 N ATOM 428 CA VAL A 48 -1.301 16.196 -0.622 1.00 65.14 C ATOM 429 C VAL A 48 -0.154 15.219 -0.390 1.00 75.43 C ATOM 430 O VAL A 48 -0.291 14.017 -0.623 1.00 12.42 O ATOM 431 CB VAL A 48 -1.199 16.762 -2.051 1.00 13.41 C ATOM 432 CG1 VAL A 48 -1.295 15.644 -3.076 1.00 54.12 C ATOM 433 CG2 VAL A 48 -2.278 17.808 -2.287 1.00 41.30 C ATOM 0 H VAL A 48 -1.172 18.198 -0.011 1.00 43.12 H new ATOM 0 HA VAL A 48 -2.250 15.670 -0.515 1.00 65.14 H new ATOM 0 HB VAL A 48 -0.228 17.243 -2.165 1.00 13.41 H new ATOM 0 HG11 VAL A 48 -1.221 16.063 -4.079 1.00 54.12 H new ATOM 0 HG12 VAL A 48 -0.482 14.935 -2.918 1.00 54.12 H new ATOM 0 HG13 VAL A 48 -2.251 15.131 -2.967 1.00 54.12 H new ATOM 0 HG21 VAL A 48 -2.191 18.198 -3.301 1.00 41.30 H new ATOM 0 HG22 VAL A 48 -3.260 17.354 -2.155 1.00 41.30 H new ATOM 0 HG23 VAL A 48 -2.157 18.623 -1.574 1.00 41.30 H new ATOM 443 N SER A 49 0.979 15.743 0.066 1.00 21.14 N ATOM 444 CA SER A 49 2.152 14.917 0.326 1.00 2.32 C ATOM 445 C SER A 49 1.847 13.853 1.376 1.00 35.40 C ATOM 446 O SER A 49 2.243 12.695 1.237 1.00 13.15 O ATOM 447 CB SER A 49 3.322 15.787 0.792 1.00 53.23 C ATOM 448 OG SER A 49 4.339 15.843 -0.195 1.00 3.52 O ATOM 0 H SER A 49 1.110 16.735 0.263 1.00 21.14 H new ATOM 0 HA SER A 49 2.426 14.418 -0.603 1.00 2.32 H new ATOM 0 HB2 SER A 49 2.967 16.794 1.010 1.00 53.23 H new ATOM 0 HB3 SER A 49 3.732 15.386 1.719 1.00 53.23 H new ATOM 0 HG SER A 49 5.075 16.406 0.125 1.00 3.52 H new ATOM 454 N VAL A 50 1.138 14.254 2.427 1.00 23.32 N ATOM 455 CA VAL A 50 0.778 13.336 3.501 1.00 3.11 C ATOM 456 C VAL A 50 -0.190 12.266 3.008 1.00 73.04 C ATOM 457 O VAL A 50 0.025 11.074 3.223 1.00 12.04 O ATOM 458 CB VAL A 50 0.139 14.083 4.688 1.00 63.02 C ATOM 459 CG1 VAL A 50 -0.238 13.107 5.791 1.00 12.13 C ATOM 460 CG2 VAL A 50 1.083 15.155 5.210 1.00 3.32 C ATOM 0 H VAL A 50 0.802 15.208 2.557 1.00 23.32 H new ATOM 0 HA VAL A 50 1.701 12.862 3.834 1.00 3.11 H new ATOM 0 HB VAL A 50 -0.772 14.571 4.342 1.00 63.02 H new ATOM 0 HG11 VAL A 50 -0.688 13.652 6.621 1.00 12.13 H new ATOM 0 HG12 VAL A 50 -0.952 12.380 5.405 1.00 12.13 H new ATOM 0 HG13 VAL A 50 0.655 12.589 6.139 1.00 12.13 H new ATOM 0 HG21 VAL A 50 0.617 15.673 6.048 1.00 3.32 H new ATOM 0 HG22 VAL A 50 2.012 14.692 5.541 1.00 3.32 H new ATOM 0 HG23 VAL A 50 1.297 15.870 4.415 1.00 3.32 H new ATOM 470 N ALA A 51 -1.255 12.701 2.344 1.00 14.32 N ATOM 471 CA ALA A 51 -2.256 11.781 1.817 1.00 2.35 C ATOM 472 C ALA A 51 -1.629 10.785 0.847 1.00 1.34 C ATOM 473 O ALA A 51 -1.989 9.607 0.832 1.00 43.44 O ATOM 474 CB ALA A 51 -3.375 12.552 1.134 1.00 15.55 C ATOM 0 H ALA A 51 -1.447 13.685 2.158 1.00 14.32 H new ATOM 0 HA ALA A 51 -2.674 11.221 2.653 1.00 2.35 H new ATOM 0 HB1 ALA A 51 -4.115 11.852 0.746 1.00 15.55 H new ATOM 0 HB2 ALA A 51 -3.849 13.219 1.854 1.00 15.55 H new ATOM 0 HB3 ALA A 51 -2.964 13.138 0.312 1.00 15.55 H new ATOM 480 N THR A 52 -0.689 11.264 0.039 1.00 14.52 N ATOM 481 CA THR A 52 -0.013 10.418 -0.936 1.00 14.43 C ATOM 482 C THR A 52 0.967 9.470 -0.253 1.00 51.32 C ATOM 483 O THR A 52 1.230 8.373 -0.748 1.00 3.52 O ATOM 484 CB THR A 52 0.744 11.258 -1.980 1.00 23.41 C ATOM 485 OG1 THR A 52 1.508 12.278 -1.328 1.00 62.52 O ATOM 486 CG2 THR A 52 -0.222 11.893 -2.969 1.00 33.35 C ATOM 0 H THR A 52 -0.378 12.235 0.041 1.00 14.52 H new ATOM 0 HA THR A 52 -0.785 9.837 -1.441 1.00 14.43 H new ATOM 0 HB THR A 52 1.415 10.597 -2.528 1.00 23.41 H new ATOM 0 HG1 THR A 52 0.958 13.082 -1.222 1.00 62.52 H new ATOM 0 HG21 THR A 52 0.337 12.481 -3.697 1.00 33.35 H new ATOM 0 HG22 THR A 52 -0.780 11.112 -3.486 1.00 33.35 H new ATOM 0 HG23 THR A 52 -0.916 12.541 -2.434 1.00 33.35 H new ATOM 494 N SER A 53 1.504 9.899 0.884 1.00 63.32 N ATOM 495 CA SER A 53 2.457 9.090 1.633 1.00 31.50 C ATOM 496 C SER A 53 1.770 7.881 2.261 1.00 33.32 C ATOM 497 O SER A 53 2.273 6.760 2.192 1.00 71.41 O ATOM 498 CB SER A 53 3.129 9.929 2.720 1.00 41.04 C ATOM 499 OG SER A 53 4.541 9.900 2.588 1.00 15.33 O ATOM 0 H SER A 53 1.295 10.803 1.307 1.00 63.32 H new ATOM 0 HA SER A 53 3.217 8.734 0.937 1.00 31.50 H new ATOM 0 HB2 SER A 53 2.776 10.959 2.659 1.00 41.04 H new ATOM 0 HB3 SER A 53 2.845 9.552 3.702 1.00 41.04 H new ATOM 0 HG SER A 53 4.947 10.445 3.294 1.00 15.33 H new ATOM 505 N VAL A 54 0.615 8.117 2.874 1.00 0.30 N ATOM 506 CA VAL A 54 -0.145 7.050 3.513 1.00 42.40 C ATOM 507 C VAL A 54 -0.720 6.089 2.480 1.00 74.01 C ATOM 508 O VAL A 54 -0.800 4.882 2.713 1.00 43.52 O ATOM 509 CB VAL A 54 -1.294 7.613 4.369 1.00 45.42 C ATOM 510 CG1 VAL A 54 -0.745 8.404 5.547 1.00 13.13 C ATOM 511 CG2 VAL A 54 -2.217 8.476 3.521 1.00 43.43 C ATOM 0 H VAL A 54 0.185 9.039 2.942 1.00 0.30 H new ATOM 0 HA VAL A 54 0.549 6.512 4.159 1.00 42.40 H new ATOM 0 HB VAL A 54 -1.874 6.778 4.762 1.00 45.42 H new ATOM 0 HG11 VAL A 54 -1.572 8.794 6.140 1.00 13.13 H new ATOM 0 HG12 VAL A 54 -0.129 7.753 6.167 1.00 13.13 H new ATOM 0 HG13 VAL A 54 -0.140 9.233 5.179 1.00 13.13 H new ATOM 0 HG21 VAL A 54 -3.023 8.866 4.142 1.00 43.43 H new ATOM 0 HG22 VAL A 54 -1.652 9.306 3.098 1.00 43.43 H new ATOM 0 HG23 VAL A 54 -2.638 7.875 2.715 1.00 43.43 H new ATOM 521 N ALA A 55 -1.120 6.631 1.333 1.00 23.12 N ATOM 522 CA ALA A 55 -1.685 5.821 0.262 1.00 14.21 C ATOM 523 C ALA A 55 -0.642 4.873 -0.318 1.00 63.35 C ATOM 524 O ALA A 55 -0.962 3.751 -0.712 1.00 21.53 O ATOM 525 CB ALA A 55 -2.255 6.714 -0.831 1.00 3.21 C ATOM 0 H ALA A 55 -1.063 7.627 1.123 1.00 23.12 H new ATOM 0 HA ALA A 55 -2.491 5.219 0.682 1.00 14.21 H new ATOM 0 HB1 ALA A 55 -2.674 6.095 -1.625 1.00 3.21 H new ATOM 0 HB2 ALA A 55 -3.038 7.347 -0.413 1.00 3.21 H new ATOM 0 HB3 ALA A 55 -1.462 7.340 -1.239 1.00 3.21 H new ATOM 531 N GLN A 56 0.604 5.331 -0.369 1.00 32.52 N ATOM 532 CA GLN A 56 1.693 4.522 -0.904 1.00 2.11 C ATOM 533 C GLN A 56 1.862 3.235 -0.101 1.00 53.22 C ATOM 534 O GLN A 56 2.112 2.170 -0.664 1.00 12.31 O ATOM 535 CB GLN A 56 3.000 5.316 -0.893 1.00 12.40 C ATOM 536 CG GLN A 56 4.206 4.513 -1.349 1.00 73.42 C ATOM 537 CD GLN A 56 5.481 5.332 -1.372 1.00 51.22 C ATOM 538 OE1 GLN A 56 6.433 5.042 -0.647 1.00 31.42 O ATOM 539 NE2 GLN A 56 5.506 6.365 -2.207 1.00 22.22 N ATOM 0 H GLN A 56 0.885 6.257 -0.047 1.00 32.52 H new ATOM 0 HA GLN A 56 1.443 4.259 -1.932 1.00 2.11 H new ATOM 0 HB2 GLN A 56 2.890 6.188 -1.538 1.00 12.40 H new ATOM 0 HB3 GLN A 56 3.181 5.686 0.116 1.00 12.40 H new ATOM 0 HG2 GLN A 56 4.340 3.659 -0.686 1.00 73.42 H new ATOM 0 HG3 GLN A 56 4.017 4.116 -2.346 1.00 73.42 H new ATOM 0 HE21 GLN A 56 4.694 6.569 -2.790 1.00 22.22 H new ATOM 0 HE22 GLN A 56 6.337 6.954 -2.265 1.00 22.22 H new ATOM 548 N ASN A 57 1.720 3.343 1.216 1.00 41.34 N ATOM 549 CA ASN A 57 1.856 2.189 2.096 1.00 63.24 C ATOM 550 C ASN A 57 0.784 1.146 1.797 1.00 75.34 C ATOM 551 O ASN A 57 1.068 -0.049 1.727 1.00 10.14 O ATOM 552 CB ASN A 57 1.766 2.624 3.560 1.00 2.32 C ATOM 553 CG ASN A 57 2.798 1.934 4.433 1.00 34.33 C ATOM 554 OD1 ASN A 57 2.915 0.708 4.423 1.00 2.31 O ATOM 555 ND2 ASN A 57 3.550 2.721 5.194 1.00 33.33 N ATOM 0 H ASN A 57 1.511 4.218 1.697 1.00 41.34 H new ATOM 0 HA ASN A 57 2.833 1.741 1.916 1.00 63.24 H new ATOM 0 HB2 ASN A 57 1.903 3.703 3.625 1.00 2.32 H new ATOM 0 HB3 ASN A 57 0.768 2.406 3.940 1.00 2.32 H new ATOM 0 HD21 ASN A 57 4.260 2.314 5.803 1.00 33.33 H new ATOM 0 HD22 ASN A 57 3.418 3.732 5.169 1.00 33.33 H new ATOM 562 N VAL A 58 -0.449 1.609 1.619 1.00 21.14 N ATOM 563 CA VAL A 58 -1.565 0.716 1.325 1.00 41.52 C ATOM 564 C VAL A 58 -1.396 0.056 -0.039 1.00 2.34 C ATOM 565 O VAL A 58 -1.586 -1.150 -0.183 1.00 40.32 O ATOM 566 CB VAL A 58 -2.908 1.471 1.355 1.00 23.22 C ATOM 567 CG1 VAL A 58 -4.071 0.495 1.240 1.00 60.24 C ATOM 568 CG2 VAL A 58 -3.024 2.303 2.624 1.00 72.41 C ATOM 0 H VAL A 58 -0.701 2.596 1.673 1.00 21.14 H new ATOM 0 HA VAL A 58 -1.570 -0.052 2.098 1.00 41.52 H new ATOM 0 HB VAL A 58 -2.944 2.147 0.500 1.00 23.22 H new ATOM 0 HG11 VAL A 58 -5.012 1.045 1.263 1.00 60.24 H new ATOM 0 HG12 VAL A 58 -3.994 -0.053 0.301 1.00 60.24 H new ATOM 0 HG13 VAL A 58 -4.041 -0.207 2.074 1.00 60.24 H new ATOM 0 HG21 VAL A 58 -3.979 2.829 2.628 1.00 72.41 H new ATOM 0 HG22 VAL A 58 -2.966 1.649 3.494 1.00 72.41 H new ATOM 0 HG23 VAL A 58 -2.210 3.027 2.660 1.00 72.41 H new ATOM 578 N GLY A 59 -1.037 0.857 -1.037 1.00 71.52 N ATOM 579 CA GLY A 59 -0.847 0.333 -2.378 1.00 25.45 C ATOM 580 C GLY A 59 0.364 -0.574 -2.479 1.00 44.33 C ATOM 581 O GLY A 59 0.372 -1.527 -3.257 1.00 52.35 O ATOM 0 H GLY A 59 -0.874 1.859 -0.942 1.00 71.52 H new ATOM 0 HA2 GLY A 59 -1.737 -0.220 -2.679 1.00 25.45 H new ATOM 0 HA3 GLY A 59 -0.736 1.162 -3.077 1.00 25.45 H new ATOM 585 N ASN A 60 1.393 -0.275 -1.692 1.00 12.20 N ATOM 586 CA ASN A 60 2.617 -1.068 -1.698 1.00 54.13 C ATOM 587 C ASN A 60 2.330 -2.515 -1.309 1.00 54.32 C ATOM 588 O ASN A 60 2.923 -3.444 -1.854 1.00 41.35 O ATOM 589 CB ASN A 60 3.645 -0.464 -0.741 1.00 24.12 C ATOM 590 CG ASN A 60 4.808 -1.401 -0.474 1.00 34.53 C ATOM 591 OD1 ASN A 60 5.704 -1.548 -1.305 1.00 34.12 O ATOM 592 ND2 ASN A 60 4.797 -2.041 0.690 1.00 31.43 N ATOM 0 H ASN A 60 1.403 0.511 -1.042 1.00 12.20 H new ATOM 0 HA ASN A 60 3.023 -1.057 -2.710 1.00 54.13 H new ATOM 0 HB2 ASN A 60 4.022 0.469 -1.159 1.00 24.12 H new ATOM 0 HB3 ASN A 60 3.158 -0.216 0.202 1.00 24.12 H new ATOM 0 HD21 ASN A 60 5.552 -2.685 0.925 1.00 31.43 H new ATOM 0 HD22 ASN A 60 4.033 -1.888 1.349 1.00 31.43 H new ATOM 599 N GLN A 61 1.415 -2.696 -0.361 1.00 74.15 N ATOM 600 CA GLN A 61 1.049 -4.030 0.101 1.00 61.11 C ATOM 601 C GLN A 61 0.387 -4.830 -1.014 1.00 34.41 C ATOM 602 O GLN A 61 0.449 -6.060 -1.031 1.00 73.53 O ATOM 603 CB GLN A 61 0.110 -3.935 1.304 1.00 4.31 C ATOM 604 CG GLN A 61 0.745 -3.283 2.523 1.00 31.42 C ATOM 605 CD GLN A 61 1.293 -4.298 3.508 1.00 55.54 C ATOM 606 OE1 GLN A 61 0.699 -5.355 3.723 1.00 51.42 O ATOM 607 NE2 GLN A 61 2.432 -3.981 4.112 1.00 54.41 N ATOM 0 H GLN A 61 0.915 -1.937 0.101 1.00 74.15 H new ATOM 0 HA GLN A 61 1.961 -4.547 0.400 1.00 61.11 H new ATOM 0 HB2 GLN A 61 -0.776 -3.367 1.019 1.00 4.31 H new ATOM 0 HB3 GLN A 61 -0.226 -4.937 1.572 1.00 4.31 H new ATOM 0 HG2 GLN A 61 1.551 -2.624 2.200 1.00 31.42 H new ATOM 0 HG3 GLN A 61 0.005 -2.659 3.024 1.00 31.42 H new ATOM 0 HE21 GLN A 61 2.890 -3.094 3.903 1.00 54.41 H new ATOM 0 HE22 GLN A 61 2.849 -4.625 4.785 1.00 54.41 H new ATOM 616 N LEU A 62 -0.249 -4.126 -1.944 1.00 63.43 N ATOM 617 CA LEU A 62 -0.924 -4.770 -3.064 1.00 60.42 C ATOM 618 C LEU A 62 0.027 -4.952 -4.243 1.00 73.32 C ATOM 619 O LEU A 62 -0.172 -5.826 -5.086 1.00 35.51 O ATOM 620 CB LEU A 62 -2.138 -3.946 -3.496 1.00 71.41 C ATOM 621 CG LEU A 62 -3.483 -4.674 -3.481 1.00 1.53 C ATOM 622 CD1 LEU A 62 -4.167 -4.500 -2.133 1.00 71.11 C ATOM 623 CD2 LEU A 62 -4.376 -4.168 -4.603 1.00 15.33 C ATOM 0 H LEU A 62 -0.311 -3.108 -1.944 1.00 63.43 H new ATOM 0 HA LEU A 62 -1.258 -5.754 -2.736 1.00 60.42 H new ATOM 0 HB2 LEU A 62 -2.212 -3.075 -2.844 1.00 71.41 H new ATOM 0 HB3 LEU A 62 -1.960 -3.575 -4.505 1.00 71.41 H new ATOM 0 HG LEU A 62 -3.302 -5.737 -3.640 1.00 1.53 H new ATOM 0 HD11 LEU A 62 -5.123 -5.024 -2.140 1.00 71.11 H new ATOM 0 HD12 LEU A 62 -3.533 -4.911 -1.347 1.00 71.11 H new ATOM 0 HD13 LEU A 62 -4.336 -3.440 -1.945 1.00 71.11 H new ATOM 0 HD21 LEU A 62 -5.329 -4.697 -4.577 1.00 15.33 H new ATOM 0 HD22 LEU A 62 -4.551 -3.100 -4.475 1.00 15.33 H new ATOM 0 HD23 LEU A 62 -3.890 -4.344 -5.562 1.00 15.33 H new ATOM 635 N GLY A 63 1.063 -4.120 -4.293 1.00 23.52 N ATOM 636 CA GLY A 63 2.032 -4.207 -5.371 1.00 31.12 C ATOM 637 C GLY A 63 1.773 -3.192 -6.466 1.00 34.21 C ATOM 638 O GLY A 63 2.200 -2.042 -6.372 1.00 52.42 O ATOM 0 H GLY A 63 1.249 -3.388 -3.607 1.00 23.52 H new ATOM 0 HA2 GLY A 63 3.033 -4.055 -4.968 1.00 31.12 H new ATOM 0 HA3 GLY A 63 2.008 -5.210 -5.797 1.00 31.12 H new ATOM 642 N LEU A 64 1.072 -3.619 -7.511 1.00 72.20 N ATOM 643 CA LEU A 64 0.756 -2.739 -8.631 1.00 64.12 C ATOM 644 C LEU A 64 2.028 -2.280 -9.339 1.00 4.42 C ATOM 645 O LEU A 64 3.125 -2.379 -8.789 1.00 1.23 O ATOM 646 CB LEU A 64 -0.036 -1.525 -8.145 1.00 35.24 C ATOM 647 CG LEU A 64 -1.528 -1.518 -8.485 1.00 31.03 C ATOM 648 CD1 LEU A 64 -1.733 -1.496 -9.992 1.00 44.14 C ATOM 649 CD2 LEU A 64 -2.222 -2.725 -7.869 1.00 24.42 C ATOM 0 H LEU A 64 0.712 -4.569 -7.606 1.00 72.20 H new ATOM 0 HA LEU A 64 0.149 -3.300 -9.341 1.00 64.12 H new ATOM 0 HB2 LEU A 64 0.070 -1.456 -7.062 1.00 35.24 H new ATOM 0 HB3 LEU A 64 0.417 -0.628 -8.567 1.00 35.24 H new ATOM 0 HG LEU A 64 -1.971 -0.615 -8.065 1.00 31.03 H new ATOM 0 HD11 LEU A 64 -2.800 -1.491 -10.214 1.00 44.14 H new ATOM 0 HD12 LEU A 64 -1.272 -0.601 -10.409 1.00 44.14 H new ATOM 0 HD13 LEU A 64 -1.274 -2.380 -10.435 1.00 44.14 H new ATOM 0 HD21 LEU A 64 -3.282 -2.703 -8.121 1.00 24.42 H new ATOM 0 HD22 LEU A 64 -1.775 -3.640 -8.258 1.00 24.42 H new ATOM 0 HD23 LEU A 64 -2.106 -2.697 -6.786 1.00 24.42 H new ATOM 661 N ASP A 65 1.873 -1.776 -10.557 1.00 42.03 N ATOM 662 CA ASP A 65 3.007 -1.297 -11.337 1.00 70.03 C ATOM 663 C ASP A 65 3.527 0.028 -10.786 1.00 34.15 C ATOM 664 O ASP A 65 2.759 0.843 -10.277 1.00 55.10 O ATOM 665 CB ASP A 65 2.611 -1.132 -12.805 1.00 22.14 C ATOM 666 CG ASP A 65 2.778 -2.415 -13.597 1.00 41.21 C ATOM 667 OD1 ASP A 65 3.931 -2.764 -13.924 1.00 3.34 O ATOM 668 OD2 ASP A 65 1.755 -3.067 -13.891 1.00 73.21 O ATOM 0 H ASP A 65 0.972 -1.688 -11.026 1.00 42.03 H new ATOM 0 HA ASP A 65 3.804 -2.037 -11.264 1.00 70.03 H new ATOM 0 HB2 ASP A 65 1.573 -0.804 -12.864 1.00 22.14 H new ATOM 0 HB3 ASP A 65 3.219 -0.348 -13.256 1.00 22.14 H new ATOM 673 N ALA A 66 4.836 0.234 -10.889 1.00 53.25 N ATOM 674 CA ALA A 66 5.457 1.459 -10.402 1.00 35.01 C ATOM 675 C ALA A 66 4.952 2.674 -11.174 1.00 1.34 C ATOM 676 O ALA A 66 4.589 3.689 -10.580 1.00 71.15 O ATOM 677 CB ALA A 66 6.972 1.360 -10.504 1.00 72.43 C ATOM 0 H ALA A 66 5.487 -0.432 -11.305 1.00 53.25 H new ATOM 0 HA ALA A 66 5.182 1.585 -9.355 1.00 35.01 H new ATOM 0 HB1 ALA A 66 7.422 2.282 -10.137 1.00 72.43 H new ATOM 0 HB2 ALA A 66 7.323 0.521 -9.904 1.00 72.43 H new ATOM 0 HB3 ALA A 66 7.257 1.206 -11.545 1.00 72.43 H new ATOM 683 N ASN A 67 4.931 2.564 -12.498 1.00 22.43 N ATOM 684 CA ASN A 67 4.472 3.654 -13.348 1.00 70.34 C ATOM 685 C ASN A 67 2.979 3.902 -13.158 1.00 41.33 C ATOM 686 O ASN A 67 2.536 5.046 -13.067 1.00 3.35 O ATOM 687 CB ASN A 67 4.766 3.341 -14.818 1.00 51.52 C ATOM 688 CG ASN A 67 5.891 4.189 -15.376 1.00 24.02 C ATOM 689 OD1 ASN A 67 6.800 4.591 -14.650 1.00 23.01 O ATOM 690 ND2 ASN A 67 5.836 4.465 -16.674 1.00 61.25 N ATOM 0 H ASN A 67 5.227 1.730 -13.005 1.00 22.43 H new ATOM 0 HA ASN A 67 5.011 4.557 -13.060 1.00 70.34 H new ATOM 0 HB2 ASN A 67 5.026 2.287 -14.917 1.00 51.52 H new ATOM 0 HB3 ASN A 67 3.865 3.504 -15.409 1.00 51.52 H new ATOM 0 HD21 ASN A 67 6.566 5.031 -17.106 1.00 61.25 H new ATOM 0 HD22 ASN A 67 5.064 4.111 -17.238 1.00 61.25 H new ATOM 697 N ALA A 68 2.208 2.820 -13.099 1.00 10.42 N ATOM 698 CA ALA A 68 0.766 2.920 -12.915 1.00 75.32 C ATOM 699 C ALA A 68 0.424 3.491 -11.543 1.00 41.41 C ATOM 700 O ALA A 68 -0.505 4.286 -11.406 1.00 32.12 O ATOM 701 CB ALA A 68 0.115 1.556 -13.099 1.00 45.44 C ATOM 0 H ALA A 68 2.559 1.865 -13.176 1.00 10.42 H new ATOM 0 HA ALA A 68 0.375 3.602 -13.670 1.00 75.32 H new ATOM 0 HB1 ALA A 68 -0.962 1.645 -12.959 1.00 45.44 H new ATOM 0 HB2 ALA A 68 0.321 1.187 -14.104 1.00 45.44 H new ATOM 0 HB3 ALA A 68 0.520 0.858 -12.366 1.00 45.44 H new ATOM 707 N MET A 69 1.182 3.081 -10.532 1.00 14.13 N ATOM 708 CA MET A 69 0.958 3.553 -9.169 1.00 72.01 C ATOM 709 C MET A 69 1.031 5.075 -9.103 1.00 21.41 C ATOM 710 O MET A 69 0.266 5.711 -8.380 1.00 33.22 O ATOM 711 CB MET A 69 1.989 2.940 -8.219 1.00 23.40 C ATOM 712 CG MET A 69 1.462 1.745 -7.441 1.00 20.32 C ATOM 713 SD MET A 69 0.769 2.208 -5.843 1.00 35.23 S ATOM 714 CE MET A 69 -0.981 1.968 -6.149 1.00 62.32 C ATOM 0 H MET A 69 1.956 2.424 -10.629 1.00 14.13 H new ATOM 0 HA MET A 69 -0.040 3.241 -8.862 1.00 72.01 H new ATOM 0 HB2 MET A 69 2.863 2.633 -8.793 1.00 23.40 H new ATOM 0 HB3 MET A 69 2.322 3.703 -7.516 1.00 23.40 H new ATOM 0 HG2 MET A 69 0.698 1.240 -8.032 1.00 20.32 H new ATOM 0 HG3 MET A 69 2.271 1.030 -7.289 1.00 20.32 H new ATOM 0 HE1 MET A 69 -1.557 2.426 -5.345 1.00 62.32 H new ATOM 0 HE2 MET A 69 -1.251 2.430 -7.098 1.00 62.32 H new ATOM 0 HE3 MET A 69 -1.200 0.901 -6.190 1.00 62.32 H new ATOM 724 N ASN A 70 1.955 5.653 -9.864 1.00 44.35 N ATOM 725 CA ASN A 70 2.128 7.101 -9.890 1.00 15.21 C ATOM 726 C ASN A 70 0.848 7.793 -10.348 1.00 35.35 C ATOM 727 O ASN A 70 0.400 8.761 -9.736 1.00 43.31 O ATOM 728 CB ASN A 70 3.286 7.481 -10.814 1.00 62.11 C ATOM 729 CG ASN A 70 3.693 8.933 -10.663 1.00 50.21 C ATOM 730 OD1 ASN A 70 4.420 9.293 -9.737 1.00 12.42 O ATOM 731 ND2 ASN A 70 3.225 9.777 -11.576 1.00 73.25 N ATOM 0 H ASN A 70 2.595 5.141 -10.471 1.00 44.35 H new ATOM 0 HA ASN A 70 2.357 7.433 -8.877 1.00 15.21 H new ATOM 0 HB2 ASN A 70 4.143 6.842 -10.600 1.00 62.11 H new ATOM 0 HB3 ASN A 70 2.999 7.293 -11.848 1.00 62.11 H new ATOM 0 HD21 ASN A 70 3.466 10.767 -11.526 1.00 73.25 H new ATOM 0 HD22 ASN A 70 2.625 9.435 -12.327 1.00 73.25 H new ATOM 738 N SER A 71 0.264 7.288 -11.432 1.00 11.25 N ATOM 739 CA SER A 71 -0.963 7.859 -11.974 1.00 71.01 C ATOM 740 C SER A 71 -2.142 7.597 -11.043 1.00 21.24 C ATOM 741 O SER A 71 -3.027 8.441 -10.890 1.00 25.43 O ATOM 742 CB SER A 71 -1.252 7.275 -13.359 1.00 2.35 C ATOM 743 OG SER A 71 -2.106 8.126 -14.103 1.00 43.53 O ATOM 0 H SER A 71 0.621 6.486 -11.951 1.00 11.25 H new ATOM 0 HA SER A 71 -0.826 8.937 -12.062 1.00 71.01 H new ATOM 0 HB2 SER A 71 -0.316 7.131 -13.899 1.00 2.35 H new ATOM 0 HB3 SER A 71 -1.713 6.293 -13.254 1.00 2.35 H new ATOM 0 HG SER A 71 -2.274 7.731 -14.984 1.00 43.53 H new ATOM 749 N LEU A 72 -2.150 6.422 -10.423 1.00 1.12 N ATOM 750 CA LEU A 72 -3.220 6.047 -9.506 1.00 53.23 C ATOM 751 C LEU A 72 -3.216 6.940 -8.270 1.00 14.03 C ATOM 752 O LEU A 72 -4.258 7.449 -7.855 1.00 20.22 O ATOM 753 CB LEU A 72 -3.075 4.583 -9.092 1.00 32.41 C ATOM 754 CG LEU A 72 -4.114 4.058 -8.100 1.00 23.20 C ATOM 755 CD1 LEU A 72 -3.702 4.388 -6.673 1.00 31.54 C ATOM 756 CD2 LEU A 72 -5.485 4.639 -8.408 1.00 14.12 C ATOM 0 H LEU A 72 -1.427 5.712 -10.539 1.00 1.12 H new ATOM 0 HA LEU A 72 -4.170 6.179 -10.023 1.00 53.23 H new ATOM 0 HB2 LEU A 72 -3.116 3.967 -9.990 1.00 32.41 H new ATOM 0 HB3 LEU A 72 -2.085 4.446 -8.657 1.00 32.41 H new ATOM 0 HG LEU A 72 -4.170 2.974 -8.200 1.00 23.20 H new ATOM 0 HD11 LEU A 72 -4.453 4.007 -5.980 1.00 31.54 H new ATOM 0 HD12 LEU A 72 -2.740 3.925 -6.456 1.00 31.54 H new ATOM 0 HD13 LEU A 72 -3.618 5.469 -6.559 1.00 31.54 H new ATOM 0 HD21 LEU A 72 -6.212 4.255 -7.693 1.00 14.12 H new ATOM 0 HD22 LEU A 72 -5.444 5.726 -8.336 1.00 14.12 H new ATOM 0 HD23 LEU A 72 -5.783 4.353 -9.417 1.00 14.12 H new ATOM 768 N LEU A 73 -2.037 7.128 -7.687 1.00 31.35 N ATOM 769 CA LEU A 73 -1.896 7.961 -6.498 1.00 31.21 C ATOM 770 C LEU A 73 -2.158 9.428 -6.827 1.00 31.04 C ATOM 771 O LEU A 73 -2.464 10.228 -5.944 1.00 33.43 O ATOM 772 CB LEU A 73 -0.496 7.803 -5.904 1.00 22.11 C ATOM 773 CG LEU A 73 -0.433 7.350 -4.444 1.00 72.41 C ATOM 774 CD1 LEU A 73 -1.291 8.250 -3.569 1.00 60.05 C ATOM 775 CD2 LEU A 73 -0.876 5.900 -4.317 1.00 3.40 C ATOM 0 H LEU A 73 -1.165 6.715 -8.018 1.00 31.35 H new ATOM 0 HA LEU A 73 -2.634 7.634 -5.766 1.00 31.21 H new ATOM 0 HB2 LEU A 73 0.055 7.084 -6.511 1.00 22.11 H new ATOM 0 HB3 LEU A 73 0.023 8.758 -5.990 1.00 22.11 H new ATOM 0 HG LEU A 73 0.600 7.425 -4.104 1.00 72.41 H new ATOM 0 HD11 LEU A 73 -1.234 7.913 -2.534 1.00 60.05 H new ATOM 0 HD12 LEU A 73 -0.929 9.276 -3.637 1.00 60.05 H new ATOM 0 HD13 LEU A 73 -2.326 8.207 -3.908 1.00 60.05 H new ATOM 0 HD21 LEU A 73 -0.825 5.594 -3.272 1.00 3.40 H new ATOM 0 HD22 LEU A 73 -1.901 5.800 -4.675 1.00 3.40 H new ATOM 0 HD23 LEU A 73 -0.220 5.266 -4.913 1.00 3.40 H new ATOM 787 N GLY A 74 -2.037 9.773 -8.106 1.00 0.40 N ATOM 788 CA GLY A 74 -2.267 11.142 -8.529 1.00 23.43 C ATOM 789 C GLY A 74 -3.736 11.511 -8.525 1.00 14.10 C ATOM 790 O GLY A 74 -4.088 12.688 -8.607 1.00 21.43 O ATOM 0 H GLY A 74 -1.784 9.129 -8.856 1.00 0.40 H new ATOM 0 HA2 GLY A 74 -1.724 11.819 -7.869 1.00 23.43 H new ATOM 0 HA3 GLY A 74 -1.863 11.282 -9.532 1.00 23.43 H new ATOM 794 N ALA A 75 -4.597 10.504 -8.433 1.00 13.41 N ATOM 795 CA ALA A 75 -6.038 10.729 -8.418 1.00 75.30 C ATOM 796 C ALA A 75 -6.445 11.610 -7.242 1.00 30.24 C ATOM 797 O ALA A 75 -7.129 12.618 -7.416 1.00 14.33 O ATOM 798 CB ALA A 75 -6.779 9.401 -8.367 1.00 34.03 C ATOM 0 H ALA A 75 -4.323 9.524 -8.368 1.00 13.41 H new ATOM 0 HA ALA A 75 -6.309 11.249 -9.337 1.00 75.30 H new ATOM 0 HB1 ALA A 75 -7.853 9.584 -8.356 1.00 34.03 H new ATOM 0 HB2 ALA A 75 -6.521 8.806 -9.243 1.00 34.03 H new ATOM 0 HB3 ALA A 75 -6.494 8.860 -7.465 1.00 34.03 H new ATOM 804 N VAL A 76 -6.018 11.222 -6.044 1.00 0.41 N ATOM 805 CA VAL A 76 -6.339 11.977 -4.838 1.00 52.05 C ATOM 806 C VAL A 76 -5.630 13.328 -4.830 1.00 33.45 C ATOM 807 O VAL A 76 -6.183 14.328 -4.376 1.00 2.42 O ATOM 808 CB VAL A 76 -5.949 11.198 -3.568 1.00 4.51 C ATOM 809 CG1 VAL A 76 -4.484 10.791 -3.620 1.00 21.40 C ATOM 810 CG2 VAL A 76 -6.236 12.027 -2.324 1.00 74.14 C ATOM 0 H VAL A 76 -5.450 10.390 -5.883 1.00 0.41 H new ATOM 0 HA VAL A 76 -7.417 12.136 -4.842 1.00 52.05 H new ATOM 0 HB VAL A 76 -6.552 10.292 -3.520 1.00 4.51 H new ATOM 0 HG11 VAL A 76 -4.227 10.242 -2.714 1.00 21.40 H new ATOM 0 HG12 VAL A 76 -4.313 10.157 -4.490 1.00 21.40 H new ATOM 0 HG13 VAL A 76 -3.861 11.682 -3.693 1.00 21.40 H new ATOM 0 HG21 VAL A 76 -5.954 11.461 -1.436 1.00 74.14 H new ATOM 0 HG22 VAL A 76 -5.660 12.952 -2.362 1.00 74.14 H new ATOM 0 HG23 VAL A 76 -7.299 12.263 -2.281 1.00 74.14 H new ATOM 820 N SER A 77 -4.402 13.347 -5.339 1.00 71.01 N ATOM 821 CA SER A 77 -3.614 14.574 -5.388 1.00 34.44 C ATOM 822 C SER A 77 -4.387 15.688 -6.088 1.00 63.41 C ATOM 823 O SER A 77 -4.325 16.849 -5.688 1.00 1.54 O ATOM 824 CB SER A 77 -2.289 14.325 -6.110 1.00 73.14 C ATOM 825 OG SER A 77 -1.592 15.540 -6.330 1.00 34.03 O ATOM 0 H SER A 77 -3.931 12.528 -5.723 1.00 71.01 H new ATOM 0 HA SER A 77 -3.408 14.886 -4.364 1.00 34.44 H new ATOM 0 HB2 SER A 77 -1.671 13.649 -5.519 1.00 73.14 H new ATOM 0 HB3 SER A 77 -2.478 13.832 -7.064 1.00 73.14 H new ATOM 0 HG SER A 77 -0.748 15.354 -6.792 1.00 34.03 H new ATOM 831 N GLY A 78 -5.117 15.323 -7.139 1.00 63.53 N ATOM 832 CA GLY A 78 -5.891 16.301 -7.880 1.00 20.44 C ATOM 833 C GLY A 78 -7.259 16.537 -7.272 1.00 2.55 C ATOM 834 O GLY A 78 -7.830 17.620 -7.411 1.00 33.33 O ATOM 0 H GLY A 78 -5.185 14.368 -7.490 1.00 63.53 H new ATOM 0 HA2 GLY A 78 -5.344 17.243 -7.914 1.00 20.44 H new ATOM 0 HA3 GLY A 78 -6.008 15.963 -8.910 1.00 20.44 H new ATOM 838 N TYR A 79 -7.790 15.524 -6.597 1.00 25.52 N ATOM 839 CA TYR A 79 -9.101 15.624 -5.968 1.00 74.05 C ATOM 840 C TYR A 79 -9.054 16.546 -4.754 1.00 52.35 C ATOM 841 O TYR A 79 -9.954 17.361 -4.544 1.00 32.30 O ATOM 842 CB TYR A 79 -9.598 14.239 -5.551 1.00 72.44 C ATOM 843 CG TYR A 79 -10.335 13.505 -6.648 1.00 23.44 C ATOM 844 CD1 TYR A 79 -9.891 13.553 -7.963 1.00 74.53 C ATOM 845 CD2 TYR A 79 -11.475 12.762 -6.369 1.00 72.41 C ATOM 846 CE1 TYR A 79 -10.562 12.884 -8.968 1.00 63.34 C ATOM 847 CE2 TYR A 79 -12.151 12.088 -7.367 1.00 21.32 C ATOM 848 CZ TYR A 79 -11.691 12.152 -8.667 1.00 2.40 C ATOM 849 OH TYR A 79 -12.361 11.483 -9.664 1.00 42.21 O ATOM 0 H TYR A 79 -7.331 14.622 -6.471 1.00 25.52 H new ATOM 0 HA TYR A 79 -9.793 16.047 -6.696 1.00 74.05 H new ATOM 0 HB2 TYR A 79 -8.747 13.638 -5.231 1.00 72.44 H new ATOM 0 HB3 TYR A 79 -10.257 14.343 -4.689 1.00 72.44 H new ATOM 0 HD1 TYR A 79 -9.006 14.123 -8.204 1.00 74.53 H new ATOM 0 HD2 TYR A 79 -11.839 12.710 -5.354 1.00 72.41 H new ATOM 0 HE1 TYR A 79 -10.204 12.934 -9.986 1.00 63.34 H new ATOM 0 HE2 TYR A 79 -13.035 11.514 -7.132 1.00 21.32 H new ATOM 0 HH TYR A 79 -13.133 11.016 -9.283 1.00 42.21 H new ATOM 859 N VAL A 80 -7.998 16.414 -3.959 1.00 10.23 N ATOM 860 CA VAL A 80 -7.831 17.237 -2.767 1.00 44.03 C ATOM 861 C VAL A 80 -7.706 18.712 -3.130 1.00 1.41 C ATOM 862 O VAL A 80 -8.200 19.583 -2.412 1.00 13.34 O ATOM 863 CB VAL A 80 -6.589 16.810 -1.961 1.00 52.03 C ATOM 864 CG1 VAL A 80 -6.755 15.394 -1.433 1.00 62.54 C ATOM 865 CG2 VAL A 80 -5.335 16.928 -2.813 1.00 61.42 C ATOM 0 H VAL A 80 -7.245 15.745 -4.118 1.00 10.23 H new ATOM 0 HA VAL A 80 -8.721 17.092 -2.154 1.00 44.03 H new ATOM 0 HB VAL A 80 -6.484 17.479 -1.107 1.00 52.03 H new ATOM 0 HG11 VAL A 80 -5.868 15.111 -0.867 1.00 62.54 H new ATOM 0 HG12 VAL A 80 -7.630 15.348 -0.784 1.00 62.54 H new ATOM 0 HG13 VAL A 80 -6.887 14.707 -2.269 1.00 62.54 H new ATOM 0 HG21 VAL A 80 -4.468 16.623 -2.228 1.00 61.42 H new ATOM 0 HG22 VAL A 80 -5.428 16.284 -3.688 1.00 61.42 H new ATOM 0 HG23 VAL A 80 -5.210 17.962 -3.135 1.00 61.42 H new ATOM 875 N SER A 81 -7.043 18.987 -4.248 1.00 32.23 N ATOM 876 CA SER A 81 -6.850 20.358 -4.705 1.00 74.24 C ATOM 877 C SER A 81 -8.182 21.100 -4.774 1.00 42.13 C ATOM 878 O SER A 81 -8.248 22.306 -4.530 1.00 24.32 O ATOM 879 CB SER A 81 -6.175 20.370 -6.078 1.00 60.22 C ATOM 880 OG SER A 81 -5.426 21.559 -6.268 1.00 73.33 O ATOM 0 H SER A 81 -6.630 18.278 -4.854 1.00 32.23 H new ATOM 0 HA SER A 81 -6.207 20.867 -3.987 1.00 74.24 H new ATOM 0 HB2 SER A 81 -5.519 19.504 -6.172 1.00 60.22 H new ATOM 0 HB3 SER A 81 -6.931 20.284 -6.859 1.00 60.22 H new ATOM 0 HG SER A 81 -5.003 21.542 -7.152 1.00 73.33 H new ATOM 886 N THR A 82 -9.241 20.371 -5.109 1.00 12.33 N ATOM 887 CA THR A 82 -10.571 20.959 -5.211 1.00 12.33 C ATOM 888 C THR A 82 -11.176 21.194 -3.832 1.00 13.12 C ATOM 889 O THR A 82 -11.943 22.137 -3.632 1.00 31.01 O ATOM 890 CB THR A 82 -11.520 20.062 -6.028 1.00 21.22 C ATOM 891 OG1 THR A 82 -11.905 18.921 -5.253 1.00 62.25 O ATOM 892 CG2 THR A 82 -10.855 19.604 -7.317 1.00 63.22 C ATOM 0 H THR A 82 -9.204 19.373 -5.314 1.00 12.33 H new ATOM 0 HA THR A 82 -10.455 21.915 -5.722 1.00 12.33 H new ATOM 0 HB THR A 82 -12.406 20.644 -6.281 1.00 21.22 H new ATOM 0 HG1 THR A 82 -11.134 18.326 -5.141 1.00 62.25 H new ATOM 0 HG21 THR A 82 -11.544 18.972 -7.877 1.00 63.22 H new ATOM 0 HG22 THR A 82 -10.590 20.473 -7.918 1.00 63.22 H new ATOM 0 HG23 THR A 82 -9.954 19.038 -7.080 1.00 63.22 H new ATOM 900 N LEU A 83 -10.828 20.332 -2.883 1.00 41.02 N ATOM 901 CA LEU A 83 -11.336 20.447 -1.521 1.00 10.03 C ATOM 902 C LEU A 83 -10.209 20.764 -0.543 1.00 42.14 C ATOM 903 O LEU A 83 -10.100 20.151 0.517 1.00 22.22 O ATOM 904 CB LEU A 83 -12.034 19.150 -1.105 1.00 51.42 C ATOM 905 CG LEU A 83 -11.153 17.903 -1.039 1.00 34.01 C ATOM 906 CD1 LEU A 83 -11.174 17.309 0.360 1.00 4.42 C ATOM 907 CD2 LEU A 83 -11.606 16.875 -2.065 1.00 13.24 C ATOM 0 H LEU A 83 -10.196 19.546 -3.032 1.00 41.02 H new ATOM 0 HA LEU A 83 -12.055 21.266 -1.497 1.00 10.03 H new ATOM 0 HB2 LEU A 83 -12.486 19.303 -0.125 1.00 51.42 H new ATOM 0 HB3 LEU A 83 -12.847 18.959 -1.805 1.00 51.42 H new ATOM 0 HG LEU A 83 -10.128 18.192 -1.273 1.00 34.01 H new ATOM 0 HD11 LEU A 83 -10.541 16.422 0.388 1.00 4.42 H new ATOM 0 HD12 LEU A 83 -10.800 18.044 1.073 1.00 4.42 H new ATOM 0 HD13 LEU A 83 -12.195 17.035 0.623 1.00 4.42 H new ATOM 0 HD21 LEU A 83 -10.967 15.994 -2.004 1.00 13.24 H new ATOM 0 HD22 LEU A 83 -12.638 16.590 -1.863 1.00 13.24 H new ATOM 0 HD23 LEU A 83 -11.537 17.304 -3.065 1.00 13.24 H new ATOM 919 N GLY A 84 -9.371 21.732 -0.908 1.00 65.43 N ATOM 920 CA GLY A 84 -8.264 22.116 -0.052 1.00 51.31 C ATOM 921 C GLY A 84 -8.651 23.185 0.950 1.00 4.22 C ATOM 922 O GLY A 84 -8.017 23.323 1.995 1.00 3.22 O ATOM 0 H GLY A 84 -9.440 22.256 -1.781 1.00 65.43 H new ATOM 0 HA2 GLY A 84 -7.899 21.238 0.481 1.00 51.31 H new ATOM 0 HA3 GLY A 84 -7.442 22.480 -0.668 1.00 51.31 H new ATOM 926 N ASN A 85 -9.694 23.943 0.630 1.00 44.52 N ATOM 927 CA ASN A 85 -10.163 25.008 1.511 1.00 40.22 C ATOM 928 C ASN A 85 -10.879 24.432 2.728 1.00 30.12 C ATOM 929 O ASN A 85 -10.929 25.058 3.786 1.00 72.11 O ATOM 930 CB ASN A 85 -11.100 25.950 0.752 1.00 74.52 C ATOM 931 CG ASN A 85 -10.359 27.099 0.097 1.00 70.03 C ATOM 932 OD1 ASN A 85 -10.424 27.282 -1.119 1.00 73.20 O ATOM 933 ND2 ASN A 85 -9.649 27.881 0.902 1.00 74.13 N ATOM 0 H ASN A 85 -10.231 23.841 -0.231 1.00 44.52 H new ATOM 0 HA ASN A 85 -9.295 25.570 1.855 1.00 40.22 H new ATOM 0 HB2 ASN A 85 -11.638 25.386 -0.010 1.00 74.52 H new ATOM 0 HB3 ASN A 85 -11.846 26.348 1.440 1.00 74.52 H new ATOM 0 HD21 ASN A 85 -9.129 28.670 0.518 1.00 74.13 H new ATOM 0 HD22 ASN A 85 -9.623 27.692 1.904 1.00 74.13 H new ATOM 940 N ALA A 86 -11.431 23.233 2.570 1.00 54.13 N ATOM 941 CA ALA A 86 -12.142 22.570 3.656 1.00 53.22 C ATOM 942 C ALA A 86 -11.626 21.151 3.864 1.00 42.31 C ATOM 943 O ALA A 86 -12.270 20.180 3.464 1.00 52.35 O ATOM 944 CB ALA A 86 -13.638 22.554 3.375 1.00 11.34 C ATOM 0 H ALA A 86 -11.399 22.701 1.700 1.00 54.13 H new ATOM 0 HA ALA A 86 -11.961 23.132 4.572 1.00 53.22 H new ATOM 0 HB1 ALA A 86 -14.157 22.056 4.194 1.00 11.34 H new ATOM 0 HB2 ALA A 86 -14.002 23.577 3.284 1.00 11.34 H new ATOM 0 HB3 ALA A 86 -13.828 22.017 2.446 1.00 11.34 H new ATOM 950 N ILE A 87 -10.461 21.036 4.494 1.00 54.51 N ATOM 951 CA ILE A 87 -9.859 19.735 4.755 1.00 54.12 C ATOM 952 C ILE A 87 -10.196 19.247 6.160 1.00 34.23 C ATOM 953 O ILE A 87 -10.010 18.073 6.481 1.00 73.31 O ATOM 954 CB ILE A 87 -8.329 19.780 4.592 1.00 20.35 C ATOM 955 CG1 ILE A 87 -7.948 20.622 3.374 1.00 52.45 C ATOM 956 CG2 ILE A 87 -7.768 18.371 4.465 1.00 3.01 C ATOM 957 CD1 ILE A 87 -6.457 20.687 3.126 1.00 55.01 C ATOM 0 H ILE A 87 -9.916 21.829 4.833 1.00 54.51 H new ATOM 0 HA ILE A 87 -10.273 19.042 4.023 1.00 54.12 H new ATOM 0 HB ILE A 87 -7.898 20.243 5.479 1.00 20.35 H new ATOM 0 HG12 ILE A 87 -8.437 20.211 2.491 1.00 52.45 H new ATOM 0 HG13 ILE A 87 -8.330 21.634 3.508 1.00 52.45 H new ATOM 0 HG21 ILE A 87 -6.685 18.419 4.350 1.00 3.01 H new ATOM 0 HG22 ILE A 87 -8.013 17.800 5.360 1.00 3.01 H new ATOM 0 HG23 ILE A 87 -8.204 17.883 3.593 1.00 3.01 H new ATOM 0 HD11 ILE A 87 -6.261 21.301 2.247 1.00 55.01 H new ATOM 0 HD12 ILE A 87 -5.963 21.126 3.993 1.00 55.01 H new ATOM 0 HD13 ILE A 87 -6.072 19.681 2.960 1.00 55.01 H new ATOM 969 N SER A 88 -10.693 20.154 6.994 1.00 73.24 N ATOM 970 CA SER A 88 -11.055 19.816 8.366 1.00 62.14 C ATOM 971 C SER A 88 -12.009 18.628 8.398 1.00 14.31 C ATOM 972 O SER A 88 -12.065 17.889 9.381 1.00 35.13 O ATOM 973 CB SER A 88 -11.695 21.020 9.058 1.00 41.34 C ATOM 974 OG SER A 88 -11.156 22.237 8.570 1.00 65.31 O ATOM 0 H SER A 88 -10.855 21.130 6.744 1.00 73.24 H new ATOM 0 HA SER A 88 -10.145 19.542 8.900 1.00 62.14 H new ATOM 0 HB2 SER A 88 -12.773 21.006 8.896 1.00 41.34 H new ATOM 0 HB3 SER A 88 -11.533 20.953 10.134 1.00 41.34 H new ATOM 0 HG SER A 88 -11.583 22.991 9.028 1.00 65.31 H new ATOM 980 N ASP A 89 -12.762 18.452 7.317 1.00 22.13 N ATOM 981 CA ASP A 89 -13.716 17.354 7.221 1.00 60.21 C ATOM 982 C ASP A 89 -13.013 16.055 6.835 1.00 13.13 C ATOM 983 O ASP A 89 -12.633 15.862 5.681 1.00 12.35 O ATOM 984 CB ASP A 89 -14.803 17.682 6.195 1.00 40.23 C ATOM 985 CG ASP A 89 -16.021 18.325 6.830 1.00 50.32 C ATOM 986 OD1 ASP A 89 -16.567 17.742 7.789 1.00 12.44 O ATOM 987 OD2 ASP A 89 -16.428 19.411 6.366 1.00 43.11 O ATOM 0 H ASP A 89 -12.730 19.056 6.496 1.00 22.13 H new ATOM 0 HA ASP A 89 -14.178 17.221 8.199 1.00 60.21 H new ATOM 0 HB2 ASP A 89 -14.395 18.352 5.438 1.00 40.23 H new ATOM 0 HB3 ASP A 89 -15.103 16.768 5.683 1.00 40.23 H new ATOM 992 N ALA A 90 -12.842 15.170 7.811 1.00 21.30 N ATOM 993 CA ALA A 90 -12.186 13.890 7.573 1.00 3.13 C ATOM 994 C ALA A 90 -12.923 13.081 6.511 1.00 53.51 C ATOM 995 O ALA A 90 -12.303 12.414 5.684 1.00 2.41 O ATOM 996 CB ALA A 90 -12.091 13.097 8.869 1.00 35.44 C ATOM 0 H ALA A 90 -13.148 15.315 8.773 1.00 21.30 H new ATOM 0 HA ALA A 90 -11.180 14.090 7.205 1.00 3.13 H new ATOM 0 HB1 ALA A 90 -11.599 12.143 8.677 1.00 35.44 H new ATOM 0 HB2 ALA A 90 -11.513 13.663 9.600 1.00 35.44 H new ATOM 0 HB3 ALA A 90 -13.093 12.916 9.259 1.00 35.44 H new ATOM 1002 N SER A 91 -14.251 13.149 6.538 1.00 23.34 N ATOM 1003 CA SER A 91 -15.074 12.420 5.580 1.00 62.33 C ATOM 1004 C SER A 91 -14.837 12.932 4.163 1.00 42.24 C ATOM 1005 O SER A 91 -14.711 12.150 3.221 1.00 34.45 O ATOM 1006 CB SER A 91 -16.554 12.553 5.942 1.00 34.45 C ATOM 1007 OG SER A 91 -16.864 13.875 6.345 1.00 51.45 O ATOM 0 H SER A 91 -14.779 13.702 7.213 1.00 23.34 H new ATOM 0 HA SER A 91 -14.791 11.368 5.620 1.00 62.33 H new ATOM 0 HB2 SER A 91 -17.167 12.278 5.084 1.00 34.45 H new ATOM 0 HB3 SER A 91 -16.799 11.858 6.745 1.00 34.45 H new ATOM 0 HG SER A 91 -17.816 13.934 6.569 1.00 51.45 H new ATOM 1013 N ALA A 92 -14.777 14.251 4.018 1.00 53.53 N ATOM 1014 CA ALA A 92 -14.554 14.870 2.717 1.00 5.22 C ATOM 1015 C ALA A 92 -13.120 14.655 2.246 1.00 20.45 C ATOM 1016 O ALA A 92 -12.883 14.266 1.102 1.00 11.30 O ATOM 1017 CB ALA A 92 -14.874 16.356 2.776 1.00 30.42 C ATOM 0 H ALA A 92 -14.880 14.913 4.787 1.00 53.53 H new ATOM 0 HA ALA A 92 -15.221 14.395 1.998 1.00 5.22 H new ATOM 0 HB1 ALA A 92 -14.703 16.804 1.797 1.00 30.42 H new ATOM 0 HB2 ALA A 92 -15.917 16.492 3.060 1.00 30.42 H new ATOM 0 HB3 ALA A 92 -14.231 16.838 3.513 1.00 30.42 H new ATOM 1023 N TYR A 93 -12.166 14.908 3.134 1.00 24.21 N ATOM 1024 CA TYR A 93 -10.754 14.746 2.810 1.00 72.20 C ATOM 1025 C TYR A 93 -10.429 13.285 2.509 1.00 15.14 C ATOM 1026 O TYR A 93 -9.804 12.972 1.497 1.00 1.13 O ATOM 1027 CB TYR A 93 -9.882 15.248 3.961 1.00 64.32 C ATOM 1028 CG TYR A 93 -8.399 15.184 3.669 1.00 14.43 C ATOM 1029 CD1 TYR A 93 -7.931 15.110 2.364 1.00 0.01 C ATOM 1030 CD2 TYR A 93 -7.468 15.197 4.699 1.00 11.13 C ATOM 1031 CE1 TYR A 93 -6.577 15.051 2.092 1.00 1.42 C ATOM 1032 CE2 TYR A 93 -6.113 15.140 4.439 1.00 62.23 C ATOM 1033 CZ TYR A 93 -5.672 15.067 3.133 1.00 33.04 C ATOM 1034 OH TYR A 93 -4.323 15.009 2.868 1.00 22.13 O ATOM 0 H TYR A 93 -12.345 15.227 4.086 1.00 24.21 H new ATOM 0 HA TYR A 93 -10.542 15.338 1.920 1.00 72.20 H new ATOM 0 HB2 TYR A 93 -10.155 16.278 4.190 1.00 64.32 H new ATOM 0 HB3 TYR A 93 -10.094 14.657 4.852 1.00 64.32 H new ATOM 0 HD1 TYR A 93 -8.637 15.098 1.547 1.00 0.01 H new ATOM 0 HD2 TYR A 93 -7.810 15.253 5.722 1.00 11.13 H new ATOM 0 HE1 TYR A 93 -6.230 14.993 1.071 1.00 1.42 H new ATOM 0 HE2 TYR A 93 -5.403 15.152 5.252 1.00 62.23 H new ATOM 0 HH TYR A 93 -3.823 15.031 3.710 1.00 22.13 H new ATOM 1044 N ALA A 94 -10.861 12.396 3.398 1.00 31.10 N ATOM 1045 CA ALA A 94 -10.620 10.968 3.227 1.00 11.34 C ATOM 1046 C ALA A 94 -11.396 10.417 2.036 1.00 15.33 C ATOM 1047 O ALA A 94 -10.998 9.424 1.430 1.00 0.44 O ATOM 1048 CB ALA A 94 -10.992 10.215 4.497 1.00 53.20 C ATOM 0 H ALA A 94 -11.379 12.639 4.243 1.00 31.10 H new ATOM 0 HA ALA A 94 -9.557 10.825 3.030 1.00 11.34 H new ATOM 0 HB1 ALA A 94 -10.807 9.150 4.356 1.00 53.20 H new ATOM 0 HB2 ALA A 94 -10.388 10.581 5.327 1.00 53.20 H new ATOM 0 HB3 ALA A 94 -12.047 10.374 4.718 1.00 53.20 H new ATOM 1054 N ASN A 95 -12.507 11.068 1.708 1.00 53.40 N ATOM 1055 CA ASN A 95 -13.342 10.644 0.589 1.00 23.31 C ATOM 1056 C ASN A 95 -12.519 10.534 -0.691 1.00 11.13 C ATOM 1057 O ASN A 95 -12.638 9.562 -1.436 1.00 73.33 O ATOM 1058 CB ASN A 95 -14.496 11.626 0.385 1.00 32.42 C ATOM 1059 CG ASN A 95 -15.837 11.029 0.765 1.00 31.33 C ATOM 1060 OD1 ASN A 95 -16.606 11.628 1.518 1.00 61.32 O ATOM 1061 ND2 ASN A 95 -16.124 9.839 0.248 1.00 61.22 N ATOM 0 H ASN A 95 -12.851 11.892 2.201 1.00 53.40 H new ATOM 0 HA ASN A 95 -13.750 9.661 0.824 1.00 23.31 H new ATOM 0 HB2 ASN A 95 -14.318 12.521 0.981 1.00 32.42 H new ATOM 0 HB3 ASN A 95 -14.523 11.939 -0.659 1.00 32.42 H new ATOM 0 HD21 ASN A 95 -17.011 9.387 0.471 1.00 61.22 H new ATOM 0 HD22 ASN A 95 -15.458 9.378 -0.372 1.00 61.22 H new ATOM 1068 N ALA A 96 -11.684 11.538 -0.939 1.00 53.35 N ATOM 1069 CA ALA A 96 -10.841 11.553 -2.128 1.00 0.13 C ATOM 1070 C ALA A 96 -9.740 10.503 -2.033 1.00 3.32 C ATOM 1071 O ALA A 96 -9.514 9.740 -2.973 1.00 1.23 O ATOM 1072 CB ALA A 96 -10.238 12.935 -2.328 1.00 50.15 C ATOM 0 H ALA A 96 -11.573 12.351 -0.333 1.00 53.35 H new ATOM 0 HA ALA A 96 -11.464 11.311 -2.989 1.00 0.13 H new ATOM 0 HB1 ALA A 96 -9.611 12.933 -3.219 1.00 50.15 H new ATOM 0 HB2 ALA A 96 -11.037 13.667 -2.449 1.00 50.15 H new ATOM 0 HB3 ALA A 96 -9.634 13.197 -1.460 1.00 50.15 H new ATOM 1078 N ILE A 97 -9.056 10.469 -0.893 1.00 34.44 N ATOM 1079 CA ILE A 97 -7.980 9.512 -0.676 1.00 74.50 C ATOM 1080 C ILE A 97 -8.475 8.079 -0.845 1.00 74.22 C ATOM 1081 O ILE A 97 -7.869 7.282 -1.562 1.00 52.31 O ATOM 1082 CB ILE A 97 -7.361 9.666 0.725 1.00 42.33 C ATOM 1083 CG1 ILE A 97 -6.834 11.090 0.919 1.00 52.14 C ATOM 1084 CG2 ILE A 97 -6.247 8.651 0.929 1.00 13.52 C ATOM 1085 CD1 ILE A 97 -6.930 11.581 2.347 1.00 74.41 C ATOM 0 H ILE A 97 -9.229 11.094 -0.106 1.00 34.44 H new ATOM 0 HA ILE A 97 -7.217 9.722 -1.426 1.00 74.50 H new ATOM 0 HB ILE A 97 -8.135 9.479 1.470 1.00 42.33 H new ATOM 0 HG12 ILE A 97 -5.793 11.130 0.599 1.00 52.14 H new ATOM 0 HG13 ILE A 97 -7.393 11.767 0.272 1.00 52.14 H new ATOM 0 HG21 ILE A 97 -5.821 8.774 1.925 1.00 13.52 H new ATOM 0 HG22 ILE A 97 -6.650 7.643 0.829 1.00 13.52 H new ATOM 0 HG23 ILE A 97 -5.471 8.807 0.180 1.00 13.52 H new ATOM 0 HD11 ILE A 97 -6.539 12.596 2.410 1.00 74.41 H new ATOM 0 HD12 ILE A 97 -7.973 11.574 2.665 1.00 74.41 H new ATOM 0 HD13 ILE A 97 -6.348 10.927 2.996 1.00 74.41 H new ATOM 1097 N SER A 98 -9.582 7.760 -0.183 1.00 65.20 N ATOM 1098 CA SER A 98 -10.157 6.422 -0.257 1.00 15.13 C ATOM 1099 C SER A 98 -10.689 6.138 -1.659 1.00 62.32 C ATOM 1100 O SER A 98 -10.605 5.010 -2.149 1.00 50.33 O ATOM 1101 CB SER A 98 -11.285 6.272 0.767 1.00 5.31 C ATOM 1102 OG SER A 98 -12.361 7.145 0.473 1.00 42.23 O ATOM 0 H SER A 98 -10.099 8.409 0.410 1.00 65.20 H new ATOM 0 HA SER A 98 -9.371 5.702 -0.031 1.00 15.13 H new ATOM 0 HB2 SER A 98 -11.640 5.241 0.773 1.00 5.31 H new ATOM 0 HB3 SER A 98 -10.904 6.483 1.766 1.00 5.31 H new ATOM 0 HG SER A 98 -12.644 7.603 1.292 1.00 42.23 H new ATOM 1108 N SER A 99 -11.233 7.167 -2.300 1.00 61.32 N ATOM 1109 CA SER A 99 -11.780 7.027 -3.645 1.00 40.32 C ATOM 1110 C SER A 99 -10.671 6.771 -4.659 1.00 43.40 C ATOM 1111 O SER A 99 -10.857 6.033 -5.626 1.00 63.22 O ATOM 1112 CB SER A 99 -12.562 8.284 -4.032 1.00 32.21 C ATOM 1113 OG SER A 99 -12.664 8.406 -5.441 1.00 51.21 O ATOM 0 H SER A 99 -11.307 8.107 -1.910 1.00 61.32 H new ATOM 0 HA SER A 99 -12.455 6.171 -3.649 1.00 40.32 H new ATOM 0 HB2 SER A 99 -13.559 8.245 -3.594 1.00 32.21 H new ATOM 0 HB3 SER A 99 -12.068 9.165 -3.622 1.00 32.21 H new ATOM 0 HG SER A 99 -13.169 9.216 -5.664 1.00 51.21 H new ATOM 1119 N ALA A 100 -9.515 7.386 -4.431 1.00 54.21 N ATOM 1120 CA ALA A 100 -8.374 7.225 -5.323 1.00 52.31 C ATOM 1121 C ALA A 100 -7.822 5.806 -5.257 1.00 23.13 C ATOM 1122 O ALA A 100 -7.751 5.108 -6.270 1.00 42.44 O ATOM 1123 CB ALA A 100 -7.286 8.232 -4.977 1.00 72.35 C ATOM 0 H ALA A 100 -9.344 8.001 -3.635 1.00 54.21 H new ATOM 0 HA ALA A 100 -8.713 7.409 -6.342 1.00 52.31 H new ATOM 0 HB1 ALA A 100 -6.440 8.100 -5.652 1.00 72.35 H new ATOM 0 HB2 ALA A 100 -7.679 9.243 -5.082 1.00 72.35 H new ATOM 0 HB3 ALA A 100 -6.959 8.075 -3.949 1.00 72.35 H new ATOM 1129 N ILE A 101 -7.433 5.383 -4.059 1.00 31.32 N ATOM 1130 CA ILE A 101 -6.888 4.044 -3.862 1.00 1.41 C ATOM 1131 C ILE A 101 -7.963 2.979 -4.052 1.00 3.40 C ATOM 1132 O ILE A 101 -7.703 1.913 -4.607 1.00 53.14 O ATOM 1133 CB ILE A 101 -6.268 3.889 -2.460 1.00 60.12 C ATOM 1134 CG1 ILE A 101 -7.199 4.483 -1.399 1.00 61.30 C ATOM 1135 CG2 ILE A 101 -4.902 4.558 -2.407 1.00 75.54 C ATOM 1136 CD1 ILE A 101 -7.497 3.535 -0.260 1.00 21.54 C ATOM 0 H ILE A 101 -7.485 5.947 -3.211 1.00 31.32 H new ATOM 0 HA ILE A 101 -6.109 3.907 -4.612 1.00 1.41 H new ATOM 0 HB ILE A 101 -6.139 2.827 -2.251 1.00 60.12 H new ATOM 0 HG12 ILE A 101 -6.747 5.390 -0.998 1.00 61.30 H new ATOM 0 HG13 ILE A 101 -8.136 4.776 -1.872 1.00 61.30 H new ATOM 0 HG21 ILE A 101 -4.477 4.440 -1.410 1.00 75.54 H new ATOM 0 HG22 ILE A 101 -4.241 4.095 -3.140 1.00 75.54 H new ATOM 0 HG23 ILE A 101 -5.008 5.619 -2.633 1.00 75.54 H new ATOM 0 HD11 ILE A 101 -8.162 4.021 0.454 1.00 21.54 H new ATOM 0 HD12 ILE A 101 -7.977 2.638 -0.650 1.00 21.54 H new ATOM 0 HD13 ILE A 101 -6.567 3.261 0.238 1.00 21.54 H new ATOM 1148 N GLY A 102 -9.172 3.277 -3.585 1.00 70.15 N ATOM 1149 CA GLY A 102 -10.270 2.337 -3.714 1.00 1.21 C ATOM 1150 C GLY A 102 -10.569 1.991 -5.158 1.00 74.23 C ATOM 1151 O GLY A 102 -11.029 0.889 -5.458 1.00 3.51 O ATOM 0 H GLY A 102 -9.410 4.153 -3.120 1.00 70.15 H new ATOM 0 HA2 GLY A 102 -10.030 1.425 -3.167 1.00 1.21 H new ATOM 0 HA3 GLY A 102 -11.162 2.760 -3.252 1.00 1.21 H new ATOM 1155 N ASN A 103 -10.311 2.934 -6.058 1.00 51.00 N ATOM 1156 CA ASN A 103 -10.559 2.724 -7.480 1.00 21.21 C ATOM 1157 C ASN A 103 -9.690 1.593 -8.022 1.00 52.12 C ATOM 1158 O ASN A 103 -10.189 0.665 -8.659 1.00 63.01 O ATOM 1159 CB ASN A 103 -10.286 4.011 -8.261 1.00 52.04 C ATOM 1160 CG ASN A 103 -10.175 3.767 -9.755 1.00 10.30 C ATOM 1161 OD1 ASN A 103 -11.090 3.224 -10.375 1.00 71.45 O ATOM 1162 ND2 ASN A 103 -9.053 4.170 -10.339 1.00 3.15 N ATOM 0 H ASN A 103 -9.930 3.852 -5.828 1.00 51.00 H new ATOM 0 HA ASN A 103 -11.606 2.446 -7.604 1.00 21.21 H new ATOM 0 HB2 ASN A 103 -11.087 4.725 -8.071 1.00 52.04 H new ATOM 0 HB3 ASN A 103 -9.363 4.463 -7.900 1.00 52.04 H new ATOM 0 HD21 ASN A 103 -8.923 4.034 -11.341 1.00 3.15 H new ATOM 0 HD22 ASN A 103 -8.321 4.616 -9.785 1.00 3.15 H new ATOM 1169 N VAL A 104 -8.390 1.676 -7.763 1.00 41.33 N ATOM 1170 CA VAL A 104 -7.453 0.660 -8.224 1.00 25.22 C ATOM 1171 C VAL A 104 -7.624 -0.639 -7.443 1.00 60.14 C ATOM 1172 O VAL A 104 -7.489 -1.732 -7.996 1.00 45.15 O ATOM 1173 CB VAL A 104 -5.994 1.138 -8.089 1.00 24.23 C ATOM 1174 CG1 VAL A 104 -5.699 1.555 -6.656 1.00 30.35 C ATOM 1175 CG2 VAL A 104 -5.033 0.051 -8.545 1.00 64.24 C ATOM 0 H VAL A 104 -7.961 2.437 -7.236 1.00 41.33 H new ATOM 0 HA VAL A 104 -7.673 0.481 -9.276 1.00 25.22 H new ATOM 0 HB VAL A 104 -5.854 2.008 -8.731 1.00 24.23 H new ATOM 0 HG11 VAL A 104 -4.664 1.889 -6.580 1.00 30.35 H new ATOM 0 HG12 VAL A 104 -6.365 2.369 -6.369 1.00 30.35 H new ATOM 0 HG13 VAL A 104 -5.856 0.706 -5.990 1.00 30.35 H new ATOM 0 HG21 VAL A 104 -4.007 0.406 -8.443 1.00 64.24 H new ATOM 0 HG22 VAL A 104 -5.172 -0.839 -7.931 1.00 64.24 H new ATOM 0 HG23 VAL A 104 -5.230 -0.194 -9.589 1.00 64.24 H new ATOM 1185 N LEU A 105 -7.922 -0.514 -6.155 1.00 42.45 N ATOM 1186 CA LEU A 105 -8.112 -1.678 -5.297 1.00 54.43 C ATOM 1187 C LEU A 105 -9.358 -2.458 -5.706 1.00 44.34 C ATOM 1188 O LEU A 105 -9.350 -3.688 -5.738 1.00 65.22 O ATOM 1189 CB LEU A 105 -8.228 -1.244 -3.834 1.00 2.03 C ATOM 1190 CG LEU A 105 -6.936 -1.296 -3.016 1.00 10.42 C ATOM 1191 CD1 LEU A 105 -5.841 -0.488 -3.695 1.00 43.31 C ATOM 1192 CD2 LEU A 105 -7.180 -0.788 -1.603 1.00 51.41 C ATOM 0 H LEU A 105 -8.037 0.382 -5.681 1.00 42.45 H new ATOM 0 HA LEU A 105 -7.244 -2.328 -5.410 1.00 54.43 H new ATOM 0 HB2 LEU A 105 -8.611 -0.224 -3.807 1.00 2.03 H new ATOM 0 HB3 LEU A 105 -8.970 -1.876 -3.346 1.00 2.03 H new ATOM 0 HG LEU A 105 -6.607 -2.334 -2.956 1.00 10.42 H new ATOM 0 HD11 LEU A 105 -4.930 -0.537 -3.099 1.00 43.31 H new ATOM 0 HD12 LEU A 105 -5.648 -0.898 -4.686 1.00 43.31 H new ATOM 0 HD13 LEU A 105 -6.159 0.550 -3.787 1.00 43.31 H new ATOM 0 HD21 LEU A 105 -6.251 -0.832 -1.035 1.00 51.41 H new ATOM 0 HD22 LEU A 105 -7.533 0.243 -1.643 1.00 51.41 H new ATOM 0 HD23 LEU A 105 -7.932 -1.410 -1.117 1.00 51.41 H new ATOM 1204 N ALA A 106 -10.427 -1.734 -6.022 1.00 71.21 N ATOM 1205 CA ALA A 106 -11.678 -2.358 -6.434 1.00 52.44 C ATOM 1206 C ALA A 106 -11.508 -3.108 -7.751 1.00 30.13 C ATOM 1207 O ALA A 106 -12.103 -4.167 -7.952 1.00 22.41 O ATOM 1208 CB ALA A 106 -12.774 -1.309 -6.558 1.00 75.44 C ATOM 0 H ALA A 106 -10.451 -0.715 -6.000 1.00 71.21 H new ATOM 0 HA ALA A 106 -11.966 -3.080 -5.670 1.00 52.44 H new ATOM 0 HB1 ALA A 106 -13.703 -1.788 -6.866 1.00 75.44 H new ATOM 0 HB2 ALA A 106 -12.920 -0.820 -5.595 1.00 75.44 H new ATOM 0 HB3 ALA A 106 -12.485 -0.567 -7.302 1.00 75.44 H new ATOM 1214 N ASN A 107 -10.695 -2.553 -8.643 1.00 74.23 N ATOM 1215 CA ASN A 107 -10.450 -3.171 -9.942 1.00 2.20 C ATOM 1216 C ASN A 107 -9.805 -4.543 -9.779 1.00 3.45 C ATOM 1217 O ASN A 107 -9.938 -5.411 -10.641 1.00 12.43 O ATOM 1218 CB ASN A 107 -9.555 -2.272 -10.796 1.00 70.10 C ATOM 1219 CG ASN A 107 -9.900 -2.346 -12.271 1.00 50.12 C ATOM 1220 OD1 ASN A 107 -11.071 -2.398 -12.644 1.00 12.42 O ATOM 1221 ND2 ASN A 107 -8.876 -2.351 -13.118 1.00 61.24 N ATOM 0 H ASN A 107 -10.195 -1.677 -8.491 1.00 74.23 H new ATOM 0 HA ASN A 107 -11.410 -3.298 -10.443 1.00 2.20 H new ATOM 0 HB2 ASN A 107 -9.649 -1.241 -10.455 1.00 70.10 H new ATOM 0 HB3 ASN A 107 -8.514 -2.561 -10.654 1.00 70.10 H new ATOM 0 HD21 ASN A 107 -9.045 -2.399 -14.123 1.00 61.24 H new ATOM 0 HD22 ASN A 107 -7.921 -2.306 -12.763 1.00 61.24 H new ATOM 1228 N SER A 108 -9.103 -4.732 -8.664 1.00 15.03 N ATOM 1229 CA SER A 108 -8.434 -5.998 -8.388 1.00 12.31 C ATOM 1230 C SER A 108 -9.427 -7.037 -7.874 1.00 45.53 C ATOM 1231 O SER A 108 -9.123 -8.228 -7.820 1.00 11.51 O ATOM 1232 CB SER A 108 -7.315 -5.795 -7.365 1.00 12.25 C ATOM 1233 OG SER A 108 -6.659 -7.017 -7.076 1.00 12.25 O ATOM 0 H SER A 108 -8.984 -4.025 -7.939 1.00 15.03 H new ATOM 0 HA SER A 108 -8.003 -6.364 -9.320 1.00 12.31 H new ATOM 0 HB2 SER A 108 -6.594 -5.074 -7.749 1.00 12.25 H new ATOM 0 HB3 SER A 108 -7.728 -5.375 -6.448 1.00 12.25 H new ATOM 0 HG SER A 108 -7.219 -7.766 -7.368 1.00 12.25 H new ATOM 1239 N GLY A 109 -10.615 -6.574 -7.498 1.00 22.15 N ATOM 1240 CA GLY A 109 -11.634 -7.476 -6.991 1.00 53.32 C ATOM 1241 C GLY A 109 -11.936 -7.244 -5.524 1.00 32.11 C ATOM 1242 O GLY A 109 -12.576 -6.256 -5.163 1.00 3.14 O ATOM 0 H GLY A 109 -10.890 -5.593 -7.535 1.00 22.15 H new ATOM 0 HA2 GLY A 109 -12.548 -7.350 -7.571 1.00 53.32 H new ATOM 0 HA3 GLY A 109 -11.306 -8.506 -7.133 1.00 53.32 H new ATOM 1327 N ALA A 116 -11.462 -7.896 4.473 1.00 12.14 N ATOM 1328 CA ALA A 116 -11.356 -6.443 4.501 1.00 15.51 C ATOM 1329 C ALA A 116 -11.058 -5.940 5.909 1.00 15.31 C ATOM 1330 O ALA A 116 -11.664 -4.974 6.376 1.00 64.43 O ATOM 1331 CB ALA A 116 -12.637 -5.811 3.973 1.00 41.34 C ATOM 0 HA ALA A 116 -10.526 -6.152 3.857 1.00 15.51 H new ATOM 0 HB1 ALA A 116 -12.545 -4.725 3.999 1.00 41.34 H new ATOM 0 HB2 ALA A 116 -12.807 -6.136 2.947 1.00 41.34 H new ATOM 0 HB3 ALA A 116 -13.478 -6.119 4.595 1.00 41.34 H new ATOM 1337 N SER A 117 -10.124 -6.603 6.584 1.00 53.13 N ATOM 1338 CA SER A 117 -9.749 -6.225 7.941 1.00 12.42 C ATOM 1339 C SER A 117 -8.231 -6.207 8.101 1.00 53.22 C ATOM 1340 O SER A 117 -7.665 -5.259 8.646 1.00 14.14 O ATOM 1341 CB SER A 117 -10.368 -7.195 8.951 1.00 52.42 C ATOM 1342 OG SER A 117 -9.945 -8.525 8.707 1.00 72.05 O ATOM 0 H SER A 117 -9.613 -7.404 6.213 1.00 53.13 H new ATOM 0 HA SER A 117 -10.128 -5.221 8.131 1.00 12.42 H new ATOM 0 HB2 SER A 117 -10.087 -6.900 9.962 1.00 52.42 H new ATOM 0 HB3 SER A 117 -11.455 -7.140 8.894 1.00 52.42 H new ATOM 0 HG SER A 117 -10.353 -9.124 9.367 1.00 72.05 H new ATOM 1348 N SER A 118 -7.580 -7.261 7.622 1.00 61.03 N ATOM 1349 CA SER A 118 -6.128 -7.369 7.713 1.00 22.11 C ATOM 1350 C SER A 118 -5.450 -6.262 6.912 1.00 3.12 C ATOM 1351 O SER A 118 -4.528 -5.605 7.398 1.00 13.13 O ATOM 1352 CB SER A 118 -5.664 -8.737 7.209 1.00 74.33 C ATOM 1353 OG SER A 118 -4.391 -8.649 6.596 1.00 62.42 O ATOM 0 H SER A 118 -8.034 -8.053 7.167 1.00 61.03 H new ATOM 0 HA SER A 118 -5.845 -7.261 8.760 1.00 22.11 H new ATOM 0 HB2 SER A 118 -5.623 -9.440 8.041 1.00 74.33 H new ATOM 0 HB3 SER A 118 -6.388 -9.130 6.496 1.00 74.33 H new ATOM 0 HG SER A 118 -4.116 -9.536 6.284 1.00 62.42 H new ATOM 1359 N ALA A 119 -5.910 -6.063 5.682 1.00 13.54 N ATOM 1360 CA ALA A 119 -5.350 -5.036 4.813 1.00 10.41 C ATOM 1361 C ALA A 119 -5.484 -3.653 5.443 1.00 63.13 C ATOM 1362 O ALA A 119 -4.519 -2.891 5.501 1.00 22.23 O ATOM 1363 CB ALA A 119 -6.030 -5.066 3.454 1.00 73.42 C ATOM 0 H ALA A 119 -6.670 -6.600 5.264 1.00 13.54 H new ATOM 0 HA ALA A 119 -4.289 -5.246 4.680 1.00 10.41 H new ATOM 0 HB1 ALA A 119 -5.601 -4.293 2.816 1.00 73.42 H new ATOM 0 HB2 ALA A 119 -5.879 -6.042 2.993 1.00 73.42 H new ATOM 0 HB3 ALA A 119 -7.098 -4.884 3.577 1.00 73.42 H new ATOM 1369 N ALA A 120 -6.686 -3.334 5.912 1.00 41.30 N ATOM 1370 CA ALA A 120 -6.944 -2.044 6.538 1.00 42.12 C ATOM 1371 C ALA A 120 -6.164 -1.897 7.840 1.00 62.20 C ATOM 1372 O ALA A 120 -5.595 -0.842 8.119 1.00 33.14 O ATOM 1373 CB ALA A 120 -8.434 -1.870 6.791 1.00 1.44 C ATOM 0 H ALA A 120 -7.496 -3.952 5.870 1.00 41.30 H new ATOM 0 HA ALA A 120 -6.608 -1.264 5.855 1.00 42.12 H new ATOM 0 HB1 ALA A 120 -8.613 -0.902 7.259 1.00 1.44 H new ATOM 0 HB2 ALA A 120 -8.972 -1.920 5.844 1.00 1.44 H new ATOM 0 HB3 ALA A 120 -8.786 -2.663 7.451 1.00 1.44 H new ATOM 1379 N SER A 121 -6.140 -2.964 8.632 1.00 11.33 N ATOM 1380 CA SER A 121 -5.433 -2.954 9.908 1.00 65.14 C ATOM 1381 C SER A 121 -3.943 -2.705 9.699 1.00 40.02 C ATOM 1382 O SER A 121 -3.325 -1.926 10.425 1.00 21.23 O ATOM 1383 CB SER A 121 -5.644 -4.279 10.643 1.00 61.11 C ATOM 1384 OG SER A 121 -5.128 -4.218 11.962 1.00 51.41 O ATOM 0 H SER A 121 -6.602 -3.847 8.413 1.00 11.33 H new ATOM 0 HA SER A 121 -5.838 -2.144 10.515 1.00 65.14 H new ATOM 0 HB2 SER A 121 -6.708 -4.515 10.676 1.00 61.11 H new ATOM 0 HB3 SER A 121 -5.155 -5.085 10.095 1.00 61.11 H new ATOM 0 HG SER A 121 -5.276 -5.076 12.411 1.00 51.41 H new ATOM 1390 N SER A 122 -3.371 -3.374 8.703 1.00 61.52 N ATOM 1391 CA SER A 122 -1.952 -3.231 8.400 1.00 40.41 C ATOM 1392 C SER A 122 -1.664 -1.867 7.778 1.00 32.23 C ATOM 1393 O SER A 122 -0.740 -1.168 8.189 1.00 65.32 O ATOM 1394 CB SER A 122 -1.495 -4.343 7.455 1.00 61.13 C ATOM 1395 OG SER A 122 -1.526 -5.604 8.099 1.00 75.43 O ATOM 0 H SER A 122 -3.869 -4.021 8.092 1.00 61.52 H new ATOM 0 HA SER A 122 -1.397 -3.309 9.335 1.00 40.41 H new ATOM 0 HB2 SER A 122 -2.139 -4.364 6.576 1.00 61.13 H new ATOM 0 HB3 SER A 122 -0.484 -4.135 7.105 1.00 61.13 H new ATOM 0 HG SER A 122 -2.434 -5.970 8.059 1.00 75.43 H new ATOM 1401 N ALA A 123 -2.465 -1.499 6.783 1.00 24.21 N ATOM 1402 CA ALA A 123 -2.299 -0.219 6.104 1.00 34.21 C ATOM 1403 C ALA A 123 -2.440 0.943 7.080 1.00 2.33 C ATOM 1404 O ALA A 123 -1.639 1.877 7.069 1.00 25.52 O ATOM 1405 CB ALA A 123 -3.309 -0.088 4.974 1.00 53.34 C ATOM 0 H ALA A 123 -3.234 -2.068 6.430 1.00 24.21 H new ATOM 0 HA ALA A 123 -1.294 -0.185 5.684 1.00 34.21 H new ATOM 0 HB1 ALA A 123 -3.175 0.872 4.475 1.00 53.34 H new ATOM 0 HB2 ALA A 123 -3.158 -0.894 4.256 1.00 53.34 H new ATOM 0 HB3 ALA A 123 -4.319 -0.148 5.380 1.00 53.34 H new ATOM 1411 N ALA A 124 -3.464 0.880 7.924 1.00 11.25 N ATOM 1412 CA ALA A 124 -3.709 1.926 8.909 1.00 61.41 C ATOM 1413 C ALA A 124 -2.658 1.900 10.013 1.00 62.32 C ATOM 1414 O ALA A 124 -2.327 2.933 10.594 1.00 62.45 O ATOM 1415 CB ALA A 124 -5.103 1.779 9.501 1.00 1.51 C ATOM 0 H ALA A 124 -4.138 0.115 7.945 1.00 11.25 H new ATOM 0 HA ALA A 124 -3.641 2.889 8.402 1.00 61.41 H new ATOM 0 HB1 ALA A 124 -5.272 2.567 10.235 1.00 1.51 H new ATOM 0 HB2 ALA A 124 -5.846 1.858 8.707 1.00 1.51 H new ATOM 0 HB3 ALA A 124 -5.192 0.807 9.986 1.00 1.51 H new ATOM 1421 N SER A 125 -2.135 0.710 10.298 1.00 34.02 N ATOM 1422 CA SER A 125 -1.125 0.547 11.335 1.00 3.30 C ATOM 1423 C SER A 125 0.177 1.239 10.938 1.00 24.25 C ATOM 1424 O SER A 125 0.871 1.808 11.781 1.00 45.40 O ATOM 1425 CB SER A 125 -0.868 -0.938 11.599 1.00 61.41 C ATOM 1426 OG SER A 125 0.441 -1.147 12.100 1.00 22.01 O ATOM 0 H SER A 125 -2.395 -0.155 9.824 1.00 34.02 H new ATOM 0 HA SER A 125 -1.499 1.010 12.248 1.00 3.30 H new ATOM 0 HB2 SER A 125 -1.599 -1.315 12.314 1.00 61.41 H new ATOM 0 HB3 SER A 125 -1.003 -1.503 10.677 1.00 61.41 H new ATOM 0 HG SER A 125 0.580 -2.103 12.262 1.00 22.01 H new ATOM 1432 N SER A 126 0.501 1.182 9.651 1.00 34.22 N ATOM 1433 CA SER A 126 1.720 1.798 9.141 1.00 4.44 C ATOM 1434 C SER A 126 1.734 3.297 9.434 1.00 24.21 C ATOM 1435 O SER A 126 2.746 3.846 9.867 1.00 25.42 O ATOM 1436 CB SER A 126 1.847 1.558 7.636 1.00 2.52 C ATOM 1437 OG SER A 126 3.046 0.869 7.330 1.00 0.12 O ATOM 0 H SER A 126 -0.064 0.715 8.942 1.00 34.22 H new ATOM 0 HA SER A 126 2.570 1.339 9.646 1.00 4.44 H new ATOM 0 HB2 SER A 126 0.992 0.981 7.283 1.00 2.52 H new ATOM 0 HB3 SER A 126 1.827 2.512 7.109 1.00 2.52 H new ATOM 0 HG SER A 126 2.872 0.204 6.632 1.00 0.12 H new ATOM 1443 N VAL A 127 0.603 3.950 9.190 1.00 52.41 N ATOM 1444 CA VAL A 127 0.483 5.385 9.426 1.00 24.24 C ATOM 1445 C VAL A 127 0.505 5.699 10.919 1.00 35.32 C ATOM 1446 O VAL A 127 1.152 6.651 11.354 1.00 3.34 O ATOM 1447 CB VAL A 127 -0.812 5.948 8.813 1.00 55.22 C ATOM 1448 CG1 VAL A 127 -0.940 7.435 9.109 1.00 32.32 C ATOM 1449 CG2 VAL A 127 -0.847 5.690 7.314 1.00 22.15 C ATOM 0 H VAL A 127 -0.243 3.509 8.829 1.00 52.41 H new ATOM 0 HA VAL A 127 1.339 5.858 8.945 1.00 24.24 H new ATOM 0 HB VAL A 127 -1.661 5.437 9.267 1.00 55.22 H new ATOM 0 HG11 VAL A 127 -1.861 7.816 8.668 1.00 32.32 H new ATOM 0 HG12 VAL A 127 -0.963 7.591 10.188 1.00 32.32 H new ATOM 0 HG13 VAL A 127 -0.088 7.965 8.684 1.00 32.32 H new ATOM 0 HG21 VAL A 127 -1.769 6.094 6.897 1.00 22.15 H new ATOM 0 HG22 VAL A 127 0.008 6.174 6.841 1.00 22.15 H new ATOM 0 HG23 VAL A 127 -0.805 4.617 7.128 1.00 22.15 H new ATOM 1459 N THR A 128 -0.209 4.892 11.698 1.00 33.12 N ATOM 1460 CA THR A 128 -0.274 5.084 13.141 1.00 4.14 C ATOM 1461 C THR A 128 1.123 5.184 13.746 1.00 70.03 C ATOM 1462 O THR A 128 1.423 6.116 14.492 1.00 22.14 O ATOM 1463 CB THR A 128 -1.036 3.935 13.828 1.00 62.44 C ATOM 1464 OG1 THR A 128 -2.266 3.685 13.140 1.00 5.34 O ATOM 1465 CG2 THR A 128 -1.321 4.270 15.284 1.00 30.42 C ATOM 0 H THR A 128 -0.750 4.099 11.353 1.00 33.12 H new ATOM 0 HA THR A 128 -0.810 6.018 13.311 1.00 4.14 H new ATOM 0 HB THR A 128 -0.413 3.041 13.793 1.00 62.44 H new ATOM 0 HG1 THR A 128 -2.097 3.105 12.368 1.00 5.34 H new ATOM 0 HG21 THR A 128 -1.860 3.444 15.749 1.00 30.42 H new ATOM 0 HG22 THR A 128 -0.381 4.432 15.811 1.00 30.42 H new ATOM 0 HG23 THR A 128 -1.927 5.174 15.337 1.00 30.42 H new ATOM 1473 N THR A 129 1.976 4.218 13.417 1.00 14.14 N ATOM 1474 CA THR A 129 3.340 4.198 13.928 1.00 20.00 C ATOM 1475 C THR A 129 4.183 5.300 13.293 1.00 31.24 C ATOM 1476 O THR A 129 4.967 5.963 13.970 1.00 13.20 O ATOM 1477 CB THR A 129 4.016 2.838 13.670 1.00 74.54 C ATOM 1478 OG1 THR A 129 5.362 2.857 14.160 1.00 62.04 O ATOM 1479 CG2 THR A 129 4.018 2.507 12.184 1.00 15.11 C ATOM 0 H THR A 129 1.745 3.440 12.799 1.00 14.14 H new ATOM 0 HA THR A 129 3.277 4.367 15.003 1.00 20.00 H new ATOM 0 HB THR A 129 3.449 2.071 14.197 1.00 74.54 H new ATOM 0 HG1 THR A 129 5.651 3.785 14.287 1.00 62.04 H new ATOM 0 HG21 THR A 129 4.500 1.542 12.027 1.00 15.11 H new ATOM 0 HG22 THR A 129 2.992 2.463 11.820 1.00 15.11 H new ATOM 0 HG23 THR A 129 4.563 3.278 11.640 1.00 15.11 H new ATOM 1487 N THR A 130 4.013 5.488 11.988 1.00 70.35 N ATOM 1488 CA THR A 130 4.757 6.509 11.262 1.00 73.01 C ATOM 1489 C THR A 130 4.195 7.900 11.536 1.00 21.41 C ATOM 1490 O THR A 130 3.750 8.593 10.619 1.00 2.04 O ATOM 1491 CB THR A 130 4.732 6.249 9.744 1.00 43.23 C ATOM 1492 OG1 THR A 130 5.081 4.886 9.475 1.00 72.11 O ATOM 1493 CG2 THR A 130 5.698 7.176 9.020 1.00 22.34 C ATOM 0 H THR A 130 3.367 4.947 11.413 1.00 70.35 H new ATOM 0 HA THR A 130 5.787 6.460 11.616 1.00 73.01 H new ATOM 0 HB THR A 130 3.723 6.445 9.381 1.00 43.23 H new ATOM 0 HG1 THR A 130 4.310 4.309 9.657 1.00 72.11 H new ATOM 0 HG21 THR A 130 5.663 6.974 7.949 1.00 22.34 H new ATOM 0 HG22 THR A 130 5.414 8.212 9.203 1.00 22.34 H new ATOM 0 HG23 THR A 130 6.710 7.007 9.388 1.00 22.34 H new ATOM 1501 N LEU A 131 4.216 8.302 12.801 1.00 33.14 N ATOM 1502 CA LEU A 131 3.707 9.612 13.197 1.00 24.01 C ATOM 1503 C LEU A 131 3.927 9.854 14.687 1.00 65.25 C ATOM 1504 O LEU A 131 4.325 10.945 15.098 1.00 65.30 O ATOM 1505 CB LEU A 131 2.218 9.725 12.865 1.00 25.41 C ATOM 1506 CG LEU A 131 1.516 10.990 13.355 1.00 24.21 C ATOM 1507 CD1 LEU A 131 1.814 12.160 12.431 1.00 21.31 C ATOM 1508 CD2 LEU A 131 0.015 10.760 13.460 1.00 50.33 C ATOM 0 H LEU A 131 4.580 7.741 13.571 1.00 33.14 H new ATOM 0 HA LEU A 131 4.256 10.371 12.639 1.00 24.01 H new ATOM 0 HB2 LEU A 131 2.102 9.665 11.783 1.00 25.41 H new ATOM 0 HB3 LEU A 131 1.705 8.862 13.289 1.00 25.41 H new ATOM 0 HG LEU A 131 1.897 11.232 14.347 1.00 24.21 H new ATOM 0 HD11 LEU A 131 1.305 13.052 12.797 1.00 21.31 H new ATOM 0 HD12 LEU A 131 2.889 12.340 12.407 1.00 21.31 H new ATOM 0 HD13 LEU A 131 1.462 11.928 11.426 1.00 21.31 H new ATOM 0 HD21 LEU A 131 -0.469 11.672 13.811 1.00 50.33 H new ATOM 0 HD22 LEU A 131 -0.381 10.492 12.481 1.00 50.33 H new ATOM 0 HD23 LEU A 131 -0.181 9.951 14.164 1.00 50.33 H new ATOM 1520 N THR A 132 3.669 8.828 15.493 1.00 41.14 N ATOM 1521 CA THR A 132 3.839 8.930 16.936 1.00 45.41 C ATOM 1522 C THR A 132 5.033 8.107 17.408 1.00 54.24 C ATOM 1523 O THR A 132 5.761 8.513 18.313 1.00 2.42 O ATOM 1524 CB THR A 132 2.578 8.460 17.686 1.00 62.11 C ATOM 1525 OG1 THR A 132 2.481 7.032 17.635 1.00 70.34 O ATOM 1526 CG2 THR A 132 1.327 9.080 17.080 1.00 21.01 C ATOM 0 H THR A 132 3.342 7.918 15.170 1.00 41.14 H new ATOM 0 HA THR A 132 4.014 9.982 17.160 1.00 45.41 H new ATOM 0 HB THR A 132 2.658 8.781 18.725 1.00 62.11 H new ATOM 0 HG1 THR A 132 1.678 6.741 18.115 1.00 70.34 H new ATOM 0 HG21 THR A 132 0.449 8.734 17.625 1.00 21.01 H new ATOM 0 HG22 THR A 132 1.391 10.166 17.146 1.00 21.01 H new ATOM 0 HG23 THR A 132 1.244 8.784 16.034 1.00 21.01 H new ATOM 1534 N SER A 133 5.227 6.948 16.787 1.00 23.20 N ATOM 1535 CA SER A 133 6.333 6.066 17.146 1.00 33.31 C ATOM 1536 C SER A 133 7.670 6.678 16.745 1.00 44.54 C ATOM 1537 O SER A 133 8.637 6.644 17.507 1.00 33.35 O ATOM 1538 CB SER A 133 6.162 4.702 16.474 1.00 3.11 C ATOM 1539 OG SER A 133 6.905 4.630 15.269 1.00 2.43 O ATOM 0 H SER A 133 4.634 6.598 16.034 1.00 23.20 H new ATOM 0 HA SER A 133 6.324 5.935 18.228 1.00 33.31 H new ATOM 0 HB2 SER A 133 6.488 3.915 17.154 1.00 3.11 H new ATOM 0 HB3 SER A 133 5.107 4.526 16.265 1.00 3.11 H new ATOM 0 HG SER A 133 6.546 5.274 14.624 1.00 2.43 H new ATOM 1545 N TYR A 134 7.719 7.241 15.542 1.00 1.43 N ATOM 1546 CA TYR A 134 8.938 7.861 15.038 1.00 61.35 C ATOM 1547 C TYR A 134 8.872 9.379 15.169 1.00 22.30 C ATOM 1548 O TYR A 134 9.900 10.055 15.208 1.00 20.22 O ATOM 1549 CB TYR A 134 9.164 7.474 13.575 1.00 35.41 C ATOM 1550 CG TYR A 134 10.012 6.235 13.399 1.00 34.53 C ATOM 1551 CD1 TYR A 134 9.861 5.141 14.243 1.00 15.34 C ATOM 1552 CD2 TYR A 134 10.962 6.156 12.389 1.00 55.11 C ATOM 1553 CE1 TYR A 134 10.633 4.006 14.087 1.00 3.01 C ATOM 1554 CE2 TYR A 134 11.738 5.024 12.225 1.00 0.31 C ATOM 1555 CZ TYR A 134 11.571 3.953 13.077 1.00 42.33 C ATOM 1556 OH TYR A 134 12.340 2.824 12.917 1.00 4.02 O ATOM 0 H TYR A 134 6.929 7.280 14.899 1.00 1.43 H new ATOM 0 HA TYR A 134 9.774 7.499 15.637 1.00 61.35 H new ATOM 0 HB2 TYR A 134 8.198 7.313 13.097 1.00 35.41 H new ATOM 0 HB3 TYR A 134 9.641 8.306 13.057 1.00 35.41 H new ATOM 0 HD1 TYR A 134 9.127 5.179 15.035 1.00 15.34 H new ATOM 0 HD2 TYR A 134 11.097 6.993 11.720 1.00 55.11 H new ATOM 0 HE1 TYR A 134 10.503 3.165 14.752 1.00 3.01 H new ATOM 0 HE2 TYR A 134 12.471 4.979 11.433 1.00 0.31 H new ATOM 0 HH TYR A 134 12.950 2.948 12.160 1.00 4.02 H new ATOM 1566 N GLY A 135 7.656 9.910 15.238 1.00 34.24 N ATOM 1567 CA GLY A 135 7.477 11.344 15.366 1.00 74.35 C ATOM 1568 C GLY A 135 6.768 11.948 14.170 1.00 34.13 C ATOM 1569 O GLY A 135 6.735 11.370 13.084 1.00 70.50 O ATOM 0 H GLY A 135 6.790 9.372 15.207 1.00 34.24 H new ATOM 0 HA2 GLY A 135 6.905 11.557 16.269 1.00 74.35 H new ATOM 0 HA3 GLY A 135 8.450 11.819 15.486 1.00 74.35 H new ATOM 1573 N PRO A 136 6.182 13.138 14.364 1.00 41.42 N ATOM 1574 CA PRO A 136 5.459 13.847 13.304 1.00 2.43 C ATOM 1575 C PRO A 136 6.391 14.373 12.218 1.00 70.51 C ATOM 1576 O PRO A 136 6.158 14.155 11.029 1.00 63.25 O ATOM 1577 CB PRO A 136 4.792 15.010 14.044 1.00 5.34 C ATOM 1578 CG PRO A 136 5.650 15.237 15.242 1.00 35.13 C ATOM 1579 CD PRO A 136 6.180 13.886 15.633 1.00 45.41 C ATOM 0 HA PRO A 136 4.756 13.195 12.785 1.00 2.43 H new ATOM 0 HB2 PRO A 136 4.742 15.901 13.418 1.00 5.34 H new ATOM 0 HB3 PRO A 136 3.770 14.763 14.330 1.00 5.34 H new ATOM 0 HG2 PRO A 136 6.464 15.925 15.014 1.00 35.13 H new ATOM 0 HG3 PRO A 136 5.076 15.681 16.055 1.00 35.13 H new ATOM 0 HD2 PRO A 136 7.181 13.955 16.060 1.00 45.41 H new ATOM 0 HD3 PRO A 136 5.547 13.407 16.380 1.00 45.41 H new ATOM 1587 N ALA A 137 7.445 15.066 12.634 1.00 21.30 N ATOM 1588 CA ALA A 137 8.414 15.620 11.695 1.00 4.23 C ATOM 1589 C ALA A 137 8.970 14.538 10.777 1.00 10.22 C ATOM 1590 O ALA A 137 9.368 14.813 9.645 1.00 51.13 O ATOM 1591 CB ALA A 137 9.543 16.308 12.448 1.00 3.50 C ATOM 0 H ALA A 137 7.650 15.258 13.615 1.00 21.30 H new ATOM 0 HA ALA A 137 7.903 16.357 11.075 1.00 4.23 H new ATOM 0 HB1 ALA A 137 10.259 16.717 11.735 1.00 3.50 H new ATOM 0 HB2 ALA A 137 9.135 17.115 13.057 1.00 3.50 H new ATOM 0 HB3 ALA A 137 10.044 15.585 13.092 1.00 3.50 H new ATOM 1597 N VAL A 138 8.996 13.303 11.272 1.00 43.30 N ATOM 1598 CA VAL A 138 9.503 12.179 10.495 1.00 12.03 C ATOM 1599 C VAL A 138 8.709 11.998 9.206 1.00 41.24 C ATOM 1600 O VAL A 138 9.216 11.460 8.222 1.00 44.22 O ATOM 1601 CB VAL A 138 9.452 10.869 11.304 1.00 11.23 C ATOM 1602 CG1 VAL A 138 9.813 9.682 10.423 1.00 55.10 C ATOM 1603 CG2 VAL A 138 10.379 10.951 12.507 1.00 41.20 C ATOM 0 H VAL A 138 8.672 13.057 12.207 1.00 43.30 H new ATOM 0 HA VAL A 138 10.540 12.407 10.250 1.00 12.03 H new ATOM 0 HB VAL A 138 8.434 10.725 11.666 1.00 11.23 H new ATOM 0 HG11 VAL A 138 9.772 8.766 11.012 1.00 55.10 H new ATOM 0 HG12 VAL A 138 9.106 9.614 9.596 1.00 55.10 H new ATOM 0 HG13 VAL A 138 10.821 9.815 10.029 1.00 55.10 H new ATOM 0 HG21 VAL A 138 10.331 10.017 13.068 1.00 41.20 H new ATOM 0 HG22 VAL A 138 11.401 11.118 12.168 1.00 41.20 H new ATOM 0 HG23 VAL A 138 10.070 11.776 13.149 1.00 41.20 H new ATOM 1613 N PHE A 139 7.461 12.453 9.219 1.00 74.33 N ATOM 1614 CA PHE A 139 6.594 12.341 8.050 1.00 44.31 C ATOM 1615 C PHE A 139 7.138 13.170 6.890 1.00 52.30 C ATOM 1616 O PHE A 139 7.182 12.708 5.751 1.00 22.51 O ATOM 1617 CB PHE A 139 5.175 12.795 8.397 1.00 74.41 C ATOM 1618 CG PHE A 139 4.109 11.861 7.900 1.00 73.35 C ATOM 1619 CD1 PHE A 139 3.687 10.795 8.676 1.00 24.34 C ATOM 1620 CD2 PHE A 139 3.529 12.050 6.654 1.00 2.33 C ATOM 1621 CE1 PHE A 139 2.707 9.933 8.222 1.00 31.21 C ATOM 1622 CE2 PHE A 139 2.548 11.193 6.196 1.00 30.24 C ATOM 1623 CZ PHE A 139 2.136 10.132 6.980 1.00 11.01 C ATOM 0 H PHE A 139 7.027 12.903 10.025 1.00 74.33 H new ATOM 0 HA PHE A 139 6.568 11.295 7.745 1.00 44.31 H new ATOM 0 HB2 PHE A 139 5.087 12.891 9.479 1.00 74.41 H new ATOM 0 HB3 PHE A 139 5.005 13.785 7.974 1.00 74.41 H new ATOM 0 HD1 PHE A 139 4.129 10.635 9.648 1.00 24.34 H new ATOM 0 HD2 PHE A 139 3.848 12.876 6.036 1.00 2.33 H new ATOM 0 HE1 PHE A 139 2.388 9.105 8.837 1.00 31.21 H new ATOM 0 HE2 PHE A 139 2.103 11.352 5.225 1.00 30.24 H new ATOM 0 HZ PHE A 139 1.370 9.460 6.623 1.00 11.01 H new ATOM 1633 N TYR A 140 7.547 14.398 7.189 1.00 51.25 N ATOM 1634 CA TYR A 140 8.084 15.294 6.171 1.00 40.22 C ATOM 1635 C TYR A 140 9.204 14.617 5.386 1.00 52.14 C ATOM 1636 O TYR A 140 9.333 14.809 4.177 1.00 13.32 O ATOM 1637 CB TYR A 140 8.603 16.580 6.816 1.00 24.53 C ATOM 1638 CG TYR A 140 7.611 17.231 7.753 1.00 25.52 C ATOM 1639 CD1 TYR A 140 6.249 17.216 7.474 1.00 73.25 C ATOM 1640 CD2 TYR A 140 8.034 17.861 8.917 1.00 32.21 C ATOM 1641 CE1 TYR A 140 5.340 17.811 8.326 1.00 2.12 C ATOM 1642 CE2 TYR A 140 7.131 18.457 9.775 1.00 4.34 C ATOM 1643 CZ TYR A 140 5.784 18.430 9.476 1.00 22.21 C ATOM 1644 OH TYR A 140 4.882 19.022 10.329 1.00 73.14 O ATOM 0 H TYR A 140 7.517 14.796 8.128 1.00 51.25 H new ATOM 0 HA TYR A 140 7.279 15.542 5.480 1.00 40.22 H new ATOM 0 HB2 TYR A 140 9.517 16.357 7.366 1.00 24.53 H new ATOM 0 HB3 TYR A 140 8.868 17.289 6.031 1.00 24.53 H new ATOM 0 HD1 TYR A 140 5.896 16.731 6.576 1.00 73.25 H new ATOM 0 HD2 TYR A 140 9.087 17.885 9.155 1.00 32.21 H new ATOM 0 HE1 TYR A 140 4.286 17.792 8.093 1.00 2.12 H new ATOM 0 HE2 TYR A 140 7.477 18.942 10.676 1.00 4.34 H new ATOM 0 HH TYR A 140 5.359 19.411 11.091 1.00 73.14 H new ATOM 1654 N ALA A 141 10.010 13.824 6.083 1.00 2.15 N ATOM 1655 CA ALA A 141 11.118 13.116 5.453 1.00 71.55 C ATOM 1656 C ALA A 141 12.147 14.093 4.895 1.00 10.22 C ATOM 1657 O ALA A 141 12.290 14.258 3.682 1.00 10.44 O ATOM 1658 CB ALA A 141 10.600 12.204 4.349 1.00 42.10 C ATOM 0 H ALA A 141 9.917 13.655 7.085 1.00 2.15 H new ATOM 0 HA ALA A 141 11.608 12.508 6.213 1.00 71.55 H new ATOM 0 HB1 ALA A 141 11.437 11.681 3.886 1.00 42.10 H new ATOM 0 HB2 ALA A 141 9.907 11.477 4.773 1.00 42.10 H new ATOM 0 HB3 ALA A 141 10.084 12.800 3.596 1.00 42.10 H new