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 -82:sc= 0.434 USER MOD Set 1.2: A 130 THR OG1 : rot 76:sc= 1.19 USER MOD Set 2.1: A 42 THR OG1 : rot 95:sc= 1.42 USER MOD Set 2.2: A 46 GLN : amide:sc= 0.994 K(o=2.4,f=0.29) USER MOD Set 3.1: A 37 MET CE :methyl 179:sc= -2.04 (180deg=-2.07) USER MOD Set 3.2: A 140 TYR OH : rot 180:sc= -0.0268 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 22 GLN : amide:sc= -1.28 X(o=-1.3,f=-1.1) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot -161:sc= -5.51! USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 30 SER OG : rot 43:sc= 0.218! USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot -38:sc= 0.506 USER MOD Single : A 41 THR OG1 : rot -104:sc= 1.16 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 THR OG1 : rot -97:sc= -0.03 USER MOD Single : A 53 SER OG : rot 63:sc= 1.28 USER MOD Single : A 56 GLN : amide:sc= -0.0796 K(o=-0.08,f=-1.4) USER MOD Single : A 57 ASN : amide:sc= -0.0335 X(o=-0.034,f=0) USER MOD Single : A 60 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 GLN : amide:sc= -0.481 X(o=-0.48,f=-0.2) USER MOD Single : A 67 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 69 MET CE :methyl 138:sc= -4.99! (180deg=-7!) USER MOD Single : A 70 ASN : amide:sc= -0.935 K(o=-0.94,f=-1.7) USER MOD Single : A 71 SER OG : rot -67:sc= 0.083 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 TYR OH : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -34:sc= 1.26 USER MOD Single : A 85 ASN : amide:sc= 0 X(o=0,f=-0.048) 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 154:sc= -1.18 USER MOD Single : A 95 ASN : amide:sc= -2.01 K(o=-2,f=-4.4!) USER MOD Single : A 98 SER OG : rot 90:sc= 0.513 USER MOD Single : A 99 SER OG : rot 180:sc= 0 USER MOD Single : A 103 ASN : amide:sc= -1.02 K(o=-1,f=-2!) USER MOD Single : A 107 ASN : amide:sc= 0 X(o=0,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 122 SER OG : rot 76:sc= 0.943 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 128 THR OG1 : rot -78:sc= -0.672 USER MOD Single : A 132 THR OG1 : rot 180:sc= -0.0337 USER MOD Single : A 133 SER OG : rot 180:sc= 0 USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 17 -15.822 -2.379 -1.128 1.00 40.43 N ATOM 2 CA GLY A 17 -14.422 -2.053 -0.924 1.00 0.32 C ATOM 3 C GLY A 17 -14.207 -0.583 -0.630 1.00 51.34 C ATOM 4 O GLY A 17 -13.272 -0.215 0.082 1.00 1.43 O ATOM 0 HA2 GLY A 17 -14.030 -2.647 -0.098 1.00 0.32 H new ATOM 0 HA3 GLY A 17 -13.854 -2.330 -1.813 1.00 0.32 H new ATOM 8 N ASN A 18 -15.071 0.264 -1.181 1.00 1.31 N ATOM 9 CA ASN A 18 -14.969 1.704 -0.975 1.00 12.24 C ATOM 10 C ASN A 18 -15.228 2.065 0.485 1.00 64.34 C ATOM 11 O ASN A 18 -14.464 2.813 1.094 1.00 52.11 O ATOM 12 CB ASN A 18 -15.962 2.441 -1.877 1.00 64.53 C ATOM 13 CG ASN A 18 -15.339 3.642 -2.561 1.00 70.12 C ATOM 14 OD1 ASN A 18 -14.845 4.559 -1.903 1.00 61.32 O ATOM 15 ND2 ASN A 18 -15.359 3.644 -3.889 1.00 62.30 N ATOM 0 H ASN A 18 -15.850 -0.023 -1.774 1.00 1.31 H new ATOM 0 HA ASN A 18 -13.956 2.011 -1.233 1.00 12.24 H new ATOM 0 HB2 ASN A 18 -16.343 1.753 -2.632 1.00 64.53 H new ATOM 0 HB3 ASN A 18 -16.816 2.767 -1.283 1.00 64.53 H new ATOM 0 HD21 ASN A 18 -14.955 4.426 -4.404 1.00 62.30 H new ATOM 0 HD22 ASN A 18 -15.779 2.863 -4.394 1.00 62.30 H new ATOM 22 N ALA A 19 -16.309 1.527 1.039 1.00 3.12 N ATOM 23 CA ALA A 19 -16.667 1.790 2.428 1.00 63.10 C ATOM 24 C ALA A 19 -15.567 1.324 3.376 1.00 32.31 C ATOM 25 O ALA A 19 -15.391 1.881 4.460 1.00 43.04 O ATOM 26 CB ALA A 19 -17.985 1.112 2.771 1.00 31.21 C ATOM 0 H ALA A 19 -16.952 0.906 0.548 1.00 3.12 H new ATOM 0 HA ALA A 19 -16.783 2.867 2.550 1.00 63.10 H new ATOM 0 HB1 ALA A 19 -18.240 1.317 3.811 1.00 31.21 H new ATOM 0 HB2 ALA A 19 -18.772 1.497 2.122 1.00 31.21 H new ATOM 0 HB3 ALA A 19 -17.889 0.036 2.626 1.00 31.21 H new ATOM 32 N PHE A 20 -14.831 0.298 2.961 1.00 63.23 N ATOM 33 CA PHE A 20 -13.748 -0.244 3.774 1.00 0.14 C ATOM 34 C PHE A 20 -12.633 0.782 3.951 1.00 20.54 C ATOM 35 O PHE A 20 -12.216 1.075 5.070 1.00 50.34 O ATOM 36 CB PHE A 20 -13.189 -1.517 3.134 1.00 3.12 C ATOM 37 CG PHE A 20 -11.710 -1.686 3.331 1.00 32.34 C ATOM 38 CD1 PHE A 20 -11.209 -2.186 4.522 1.00 4.21 C ATOM 39 CD2 PHE A 20 -10.821 -1.347 2.324 1.00 33.41 C ATOM 40 CE1 PHE A 20 -9.848 -2.343 4.706 1.00 54.21 C ATOM 41 CE2 PHE A 20 -9.459 -1.502 2.502 1.00 31.52 C ATOM 42 CZ PHE A 20 -8.972 -2.001 3.693 1.00 3.14 C ATOM 0 H PHE A 20 -14.965 -0.175 2.067 1.00 63.23 H new ATOM 0 HA PHE A 20 -14.152 -0.487 4.757 1.00 0.14 H new ATOM 0 HB2 PHE A 20 -13.705 -2.381 3.553 1.00 3.12 H new ATOM 0 HB3 PHE A 20 -13.406 -1.503 2.066 1.00 3.12 H new ATOM 0 HD1 PHE A 20 -11.890 -2.456 5.316 1.00 4.21 H new ATOM 0 HD2 PHE A 20 -11.196 -0.957 1.389 1.00 33.41 H new ATOM 0 HE1 PHE A 20 -9.470 -2.732 5.640 1.00 54.21 H new ATOM 0 HE2 PHE A 20 -8.776 -1.233 1.710 1.00 31.52 H new ATOM 0 HZ PHE A 20 -7.908 -2.124 3.833 1.00 3.14 H new ATOM 52 N ALA A 21 -12.154 1.324 2.836 1.00 13.03 N ATOM 53 CA ALA A 21 -11.089 2.318 2.864 1.00 5.54 C ATOM 54 C ALA A 21 -11.596 3.649 3.411 1.00 24.34 C ATOM 55 O ALA A 21 -10.864 4.367 4.093 1.00 54.53 O ATOM 56 CB ALA A 21 -10.502 2.505 1.474 1.00 55.15 C ATOM 0 H ALA A 21 -12.488 1.091 1.901 1.00 13.03 H new ATOM 0 HA ALA A 21 -10.305 1.956 3.529 1.00 5.54 H new ATOM 0 HB1 ALA A 21 -9.708 3.251 1.512 1.00 55.15 H new ATOM 0 HB2 ALA A 21 -10.094 1.558 1.121 1.00 55.15 H new ATOM 0 HB3 ALA A 21 -11.283 2.841 0.791 1.00 55.15 H new ATOM 62 N GLN A 22 -12.849 3.969 3.107 1.00 44.30 N ATOM 63 CA GLN A 22 -13.450 5.215 3.568 1.00 54.23 C ATOM 64 C GLN A 22 -13.629 5.207 5.082 1.00 3.32 C ATOM 65 O GLN A 22 -13.382 6.212 5.751 1.00 21.43 O ATOM 66 CB GLN A 22 -14.802 5.436 2.884 1.00 2.34 C ATOM 67 CG GLN A 22 -15.596 6.593 3.468 1.00 52.33 C ATOM 68 CD GLN A 22 -16.494 6.166 4.613 1.00 50.30 C ATOM 69 OE1 GLN A 22 -17.341 5.287 4.459 1.00 54.02 O ATOM 70 NE2 GLN A 22 -16.311 6.789 5.773 1.00 64.52 N ATOM 0 H GLN A 22 -13.467 3.384 2.545 1.00 44.30 H new ATOM 0 HA GLN A 22 -12.778 6.032 3.305 1.00 54.23 H new ATOM 0 HB2 GLN A 22 -14.637 5.618 1.822 1.00 2.34 H new ATOM 0 HB3 GLN A 22 -15.393 4.524 2.963 1.00 2.34 H new ATOM 0 HG2 GLN A 22 -14.907 7.361 3.819 1.00 52.33 H new ATOM 0 HG3 GLN A 22 -16.204 7.044 2.684 1.00 52.33 H new ATOM 0 HE21 GLN A 22 -15.597 7.512 5.856 1.00 64.52 H new ATOM 0 HE22 GLN A 22 -16.885 6.544 6.580 1.00 64.52 H new ATOM 79 N SER A 23 -14.056 4.068 5.616 1.00 30.25 N ATOM 80 CA SER A 23 -14.271 3.931 7.052 1.00 23.44 C ATOM 81 C SER A 23 -12.959 4.085 7.815 1.00 44.21 C ATOM 82 O SER A 23 -12.890 4.799 8.817 1.00 21.45 O ATOM 83 CB SER A 23 -14.900 2.573 7.368 1.00 72.14 C ATOM 84 OG SER A 23 -15.401 2.538 8.693 1.00 31.03 O ATOM 0 H SER A 23 -14.260 3.227 5.077 1.00 30.25 H new ATOM 0 HA SER A 23 -14.951 4.722 7.369 1.00 23.44 H new ATOM 0 HB2 SER A 23 -15.708 2.371 6.665 1.00 72.14 H new ATOM 0 HB3 SER A 23 -14.158 1.786 7.236 1.00 72.14 H new ATOM 0 HG SER A 23 -15.799 1.660 8.869 1.00 31.03 H new ATOM 90 N LEU A 24 -11.919 3.411 7.335 1.00 71.13 N ATOM 91 CA LEU A 24 -10.607 3.472 7.969 1.00 15.22 C ATOM 92 C LEU A 24 -9.963 4.839 7.758 1.00 73.54 C ATOM 93 O LEU A 24 -9.465 5.455 8.700 1.00 61.43 O ATOM 94 CB LEU A 24 -9.699 2.376 7.413 1.00 22.23 C ATOM 95 CG LEU A 24 -8.237 2.424 7.862 1.00 75.25 C ATOM 96 CD1 LEU A 24 -7.446 3.392 6.996 1.00 42.13 C ATOM 97 CD2 LEU A 24 -8.142 2.817 9.327 1.00 3.15 C ATOM 0 H LEU A 24 -11.960 2.815 6.508 1.00 71.13 H new ATOM 0 HA LEU A 24 -10.740 3.316 9.039 1.00 15.22 H new ATOM 0 HB2 LEU A 24 -10.114 1.409 7.697 1.00 22.23 H new ATOM 0 HB3 LEU A 24 -9.726 2.427 6.325 1.00 22.23 H new ATOM 0 HG LEU A 24 -7.808 1.429 7.746 1.00 75.25 H new ATOM 0 HD11 LEU A 24 -6.408 3.414 7.329 1.00 42.13 H new ATOM 0 HD12 LEU A 24 -7.487 3.067 5.956 1.00 42.13 H new ATOM 0 HD13 LEU A 24 -7.875 4.390 7.081 1.00 42.13 H new ATOM 0 HD21 LEU A 24 -7.095 2.846 9.629 1.00 3.15 H new ATOM 0 HD22 LEU A 24 -8.588 3.801 9.469 1.00 3.15 H new ATOM 0 HD23 LEU A 24 -8.675 2.086 9.935 1.00 3.15 H new ATOM 109 N SER A 25 -9.979 5.309 6.514 1.00 23.41 N ATOM 110 CA SER A 25 -9.395 6.602 6.178 1.00 3.11 C ATOM 111 C SER A 25 -10.105 7.729 6.922 1.00 43.03 C ATOM 112 O SER A 25 -9.477 8.698 7.349 1.00 52.32 O ATOM 113 CB SER A 25 -9.471 6.844 4.669 1.00 54.10 C ATOM 114 OG SER A 25 -8.994 8.135 4.335 1.00 73.02 O ATOM 0 H SER A 25 -10.390 4.813 5.723 1.00 23.41 H new ATOM 0 HA SER A 25 -8.349 6.591 6.484 1.00 3.11 H new ATOM 0 HB2 SER A 25 -8.883 6.089 4.146 1.00 54.10 H new ATOM 0 HB3 SER A 25 -10.502 6.735 4.332 1.00 54.10 H new ATOM 0 HG SER A 25 -9.320 8.384 3.445 1.00 73.02 H new ATOM 120 N SER A 26 -11.419 7.594 7.073 1.00 61.30 N ATOM 121 CA SER A 26 -12.216 8.601 7.762 1.00 11.03 C ATOM 122 C SER A 26 -11.684 8.847 9.171 1.00 71.34 C ATOM 123 O SER A 26 -11.434 9.986 9.561 1.00 51.01 O ATOM 124 CB SER A 26 -13.681 8.164 7.828 1.00 71.11 C ATOM 125 OG SER A 26 -14.336 8.743 8.944 1.00 64.42 O ATOM 0 H SER A 26 -11.953 6.797 6.727 1.00 61.30 H new ATOM 0 HA SER A 26 -12.145 9.531 7.199 1.00 11.03 H new ATOM 0 HB2 SER A 26 -14.192 8.455 6.911 1.00 71.11 H new ATOM 0 HB3 SER A 26 -13.737 7.077 7.893 1.00 71.11 H new ATOM 0 HG SER A 26 -15.271 8.450 8.963 1.00 64.42 H new ATOM 131 N ASN A 27 -11.512 7.768 9.928 1.00 71.33 N ATOM 132 CA ASN A 27 -11.009 7.865 11.294 1.00 13.20 C ATOM 133 C ASN A 27 -9.502 8.095 11.303 1.00 5.51 C ATOM 134 O ASN A 27 -8.975 8.805 12.163 1.00 34.52 O ATOM 135 CB ASN A 27 -11.348 6.594 12.076 1.00 13.31 C ATOM 136 CG ASN A 27 -11.954 6.894 13.432 1.00 2.42 C ATOM 137 OD1 ASN A 27 -11.567 7.854 14.098 1.00 0.14 O ATOM 138 ND2 ASN A 27 -12.911 6.072 13.849 1.00 44.12 N ATOM 0 H ASN A 27 -11.713 6.817 9.619 1.00 71.33 H new ATOM 0 HA ASN A 27 -11.491 8.717 11.773 1.00 13.20 H new ATOM 0 HB2 ASN A 27 -12.044 5.989 11.496 1.00 13.31 H new ATOM 0 HB3 ASN A 27 -10.444 6.000 12.209 1.00 13.31 H new ATOM 0 HD21 ASN A 27 -13.356 6.225 14.754 1.00 44.12 H new ATOM 0 HD22 ASN A 27 -13.201 5.288 13.264 1.00 44.12 H new ATOM 145 N LEU A 28 -8.811 7.491 10.342 1.00 50.31 N ATOM 146 CA LEU A 28 -7.362 7.631 10.238 1.00 22.24 C ATOM 147 C LEU A 28 -6.971 9.082 9.981 1.00 54.42 C ATOM 148 O LEU A 28 -6.014 9.592 10.564 1.00 24.14 O ATOM 149 CB LEU A 28 -6.823 6.739 9.117 1.00 2.34 C ATOM 150 CG LEU A 28 -5.310 6.769 8.906 1.00 72.00 C ATOM 151 CD1 LEU A 28 -4.924 7.911 7.979 1.00 52.32 C ATOM 152 CD2 LEU A 28 -4.587 6.893 10.239 1.00 43.14 C ATOM 0 H LEU A 28 -9.230 6.900 9.624 1.00 50.31 H new ATOM 0 HA LEU A 28 -6.923 7.319 11.186 1.00 22.24 H new ATOM 0 HB2 LEU A 28 -7.121 5.711 9.323 1.00 2.34 H new ATOM 0 HB3 LEU A 28 -7.306 7.030 8.184 1.00 2.34 H new ATOM 0 HG LEU A 28 -5.009 5.831 8.439 1.00 72.00 H new ATOM 0 HD11 LEU A 28 -3.843 7.917 7.840 1.00 52.32 H new ATOM 0 HD12 LEU A 28 -5.413 7.778 7.014 1.00 52.32 H new ATOM 0 HD13 LEU A 28 -5.239 8.858 8.418 1.00 52.32 H new ATOM 0 HD21 LEU A 28 -3.511 6.913 10.069 1.00 43.14 H new ATOM 0 HD22 LEU A 28 -4.893 7.814 10.735 1.00 43.14 H new ATOM 0 HD23 LEU A 28 -4.839 6.041 10.870 1.00 43.14 H new ATOM 164 N LEU A 29 -7.720 9.744 9.105 1.00 11.11 N ATOM 165 CA LEU A 29 -7.454 11.139 8.771 1.00 23.03 C ATOM 166 C LEU A 29 -7.850 12.059 9.922 1.00 50.35 C ATOM 167 O LEU A 29 -7.184 13.060 10.188 1.00 40.22 O ATOM 168 CB LEU A 29 -8.211 11.535 7.503 1.00 73.33 C ATOM 169 CG LEU A 29 -7.449 11.370 6.187 1.00 42.41 C ATOM 170 CD1 LEU A 29 -6.801 9.996 6.114 1.00 21.10 C ATOM 171 CD2 LEU A 29 -8.378 11.589 5.002 1.00 5.22 C ATOM 0 H LEU A 29 -8.516 9.337 8.614 1.00 11.11 H new ATOM 0 HA LEU A 29 -6.384 11.247 8.595 1.00 23.03 H new ATOM 0 HB2 LEU A 29 -9.123 10.941 7.448 1.00 73.33 H new ATOM 0 HB3 LEU A 29 -8.514 12.578 7.596 1.00 73.33 H new ATOM 0 HG LEU A 29 -6.661 12.122 6.148 1.00 42.41 H new ATOM 0 HD11 LEU A 29 -6.263 9.897 5.171 1.00 21.10 H new ATOM 0 HD12 LEU A 29 -6.104 9.878 6.943 1.00 21.10 H new ATOM 0 HD13 LEU A 29 -7.571 9.227 6.175 1.00 21.10 H new ATOM 0 HD21 LEU A 29 -7.819 11.468 4.074 1.00 5.22 H new ATOM 0 HD22 LEU A 29 -9.188 10.861 5.035 1.00 5.22 H new ATOM 0 HD23 LEU A 29 -8.793 12.596 5.046 1.00 5.22 H new ATOM 183 N SER A 30 -8.939 11.713 10.601 1.00 4.12 N ATOM 184 CA SER A 30 -9.425 12.509 11.722 1.00 73.23 C ATOM 185 C SER A 30 -8.742 12.094 13.021 1.00 62.51 C ATOM 186 O SER A 30 -9.062 12.602 14.094 1.00 2.45 O ATOM 187 CB SER A 30 -10.942 12.360 11.860 1.00 31.34 C ATOM 188 OG SER A 30 -11.291 11.873 13.145 1.00 13.11 O ATOM 0 H SER A 30 -9.501 10.887 10.395 1.00 4.12 H new ATOM 0 HA SER A 30 -9.185 13.554 11.524 1.00 73.23 H new ATOM 0 HB2 SER A 30 -11.422 13.324 11.690 1.00 31.34 H new ATOM 0 HB3 SER A 30 -11.315 11.678 11.095 1.00 31.34 H new ATOM 0 HG SER A 30 -10.757 12.333 13.825 1.00 13.11 H new ATOM 194 N SER A 31 -7.795 11.167 12.913 1.00 23.13 N ATOM 195 CA SER A 31 -7.067 10.679 14.079 1.00 44.11 C ATOM 196 C SER A 31 -6.562 11.841 14.928 1.00 12.35 C ATOM 197 O SER A 31 -6.204 12.897 14.408 1.00 24.55 O ATOM 198 CB SER A 31 -5.891 9.803 13.642 1.00 33.34 C ATOM 199 OG SER A 31 -5.357 9.083 14.740 1.00 45.25 O ATOM 0 H SER A 31 -7.514 10.739 12.031 1.00 23.13 H new ATOM 0 HA SER A 31 -7.752 10.082 14.681 1.00 44.11 H new ATOM 0 HB2 SER A 31 -6.219 9.106 12.871 1.00 33.34 H new ATOM 0 HB3 SER A 31 -5.114 10.426 13.199 1.00 33.34 H new ATOM 0 HG SER A 31 -4.608 8.529 14.435 1.00 45.25 H new ATOM 205 N GLY A 32 -6.536 11.638 16.242 1.00 31.45 N ATOM 206 CA GLY A 32 -6.073 12.676 17.145 1.00 33.12 C ATOM 207 C GLY A 32 -4.678 13.159 16.805 1.00 11.42 C ATOM 208 O GLY A 32 -4.295 14.272 17.166 1.00 70.43 O ATOM 0 H GLY A 32 -6.827 10.773 16.697 1.00 31.45 H new ATOM 0 HA2 GLY A 32 -6.764 13.518 17.111 1.00 33.12 H new ATOM 0 HA3 GLY A 32 -6.084 12.296 18.167 1.00 33.12 H new ATOM 212 N ASP A 33 -3.915 12.321 16.113 1.00 75.22 N ATOM 213 CA ASP A 33 -2.553 12.668 15.725 1.00 20.21 C ATOM 214 C ASP A 33 -2.509 13.172 14.285 1.00 1.14 C ATOM 215 O ASP A 33 -1.725 14.060 13.950 1.00 34.24 O ATOM 216 CB ASP A 33 -1.630 11.459 15.883 1.00 0.13 C ATOM 217 CG ASP A 33 -1.868 10.716 17.183 1.00 14.01 C ATOM 218 OD1 ASP A 33 -1.379 11.183 18.231 1.00 52.51 O ATOM 219 OD2 ASP A 33 -2.543 9.665 17.151 1.00 33.12 O ATOM 0 H ASP A 33 -4.217 11.395 15.809 1.00 75.22 H new ATOM 0 HA ASP A 33 -2.208 13.467 16.382 1.00 20.21 H new ATOM 0 HB2 ASP A 33 -1.781 10.778 15.046 1.00 0.13 H new ATOM 0 HB3 ASP A 33 -0.592 11.790 15.841 1.00 0.13 H new ATOM 224 N PHE A 34 -3.357 12.597 13.436 1.00 44.45 N ATOM 225 CA PHE A 34 -3.414 12.986 12.032 1.00 5.43 C ATOM 226 C PHE A 34 -3.984 14.394 11.880 1.00 43.22 C ATOM 227 O PHE A 34 -3.464 15.207 11.115 1.00 13.45 O ATOM 228 CB PHE A 34 -4.263 11.991 11.239 1.00 25.03 C ATOM 229 CG PHE A 34 -3.966 11.988 9.767 1.00 1.52 C ATOM 230 CD1 PHE A 34 -4.178 13.124 9.002 1.00 24.55 C ATOM 231 CD2 PHE A 34 -3.475 10.850 9.148 1.00 11.14 C ATOM 232 CE1 PHE A 34 -3.905 13.126 7.647 1.00 24.02 C ATOM 233 CE2 PHE A 34 -3.200 10.846 7.794 1.00 24.24 C ATOM 234 CZ PHE A 34 -3.416 11.985 7.042 1.00 30.43 C ATOM 0 H PHE A 34 -4.013 11.861 13.697 1.00 44.45 H new ATOM 0 HA PHE A 34 -2.398 12.980 11.638 1.00 5.43 H new ATOM 0 HB2 PHE A 34 -4.100 10.989 11.636 1.00 25.03 H new ATOM 0 HB3 PHE A 34 -5.317 12.225 11.388 1.00 25.03 H new ATOM 0 HD1 PHE A 34 -4.561 14.019 9.470 1.00 24.55 H new ATOM 0 HD2 PHE A 34 -3.305 9.956 9.730 1.00 11.14 H new ATOM 0 HE1 PHE A 34 -4.074 14.018 7.062 1.00 24.02 H new ATOM 0 HE2 PHE A 34 -2.816 9.953 7.323 1.00 24.24 H new ATOM 0 HZ PHE A 34 -3.203 11.983 5.983 1.00 30.43 H new ATOM 244 N VAL A 35 -5.056 14.673 12.613 1.00 13.43 N ATOM 245 CA VAL A 35 -5.699 15.981 12.561 1.00 4.24 C ATOM 246 C VAL A 35 -4.704 17.094 12.865 1.00 43.40 C ATOM 247 O VAL A 35 -4.768 18.175 12.279 1.00 31.30 O ATOM 248 CB VAL A 35 -6.872 16.071 13.556 1.00 43.03 C ATOM 249 CG1 VAL A 35 -8.008 15.155 13.126 1.00 5.13 C ATOM 250 CG2 VAL A 35 -6.404 15.729 14.963 1.00 62.54 C ATOM 0 H VAL A 35 -5.498 14.011 13.250 1.00 13.43 H new ATOM 0 HA VAL A 35 -6.082 16.105 11.548 1.00 4.24 H new ATOM 0 HB VAL A 35 -7.245 17.095 13.560 1.00 43.03 H new ATOM 0 HG11 VAL A 35 -8.828 15.232 13.840 1.00 5.13 H new ATOM 0 HG12 VAL A 35 -8.359 15.451 12.137 1.00 5.13 H new ATOM 0 HG13 VAL A 35 -7.652 14.125 13.092 1.00 5.13 H new ATOM 0 HG21 VAL A 35 -7.245 15.798 15.653 1.00 62.54 H new ATOM 0 HG22 VAL A 35 -6.005 14.715 14.977 1.00 62.54 H new ATOM 0 HG23 VAL A 35 -5.626 16.429 15.268 1.00 62.54 H new ATOM 260 N GLN A 36 -3.782 16.823 13.784 1.00 34.24 N ATOM 261 CA GLN A 36 -2.773 17.802 14.166 1.00 44.42 C ATOM 262 C GLN A 36 -1.894 18.172 12.975 1.00 53.11 C ATOM 263 O GLN A 36 -1.496 19.325 12.819 1.00 62.14 O ATOM 264 CB GLN A 36 -1.907 17.258 15.303 1.00 40.44 C ATOM 265 CG GLN A 36 -1.873 18.159 16.526 1.00 3.23 C ATOM 266 CD GLN A 36 -0.495 18.733 16.791 1.00 40.45 C ATOM 267 OE1 GLN A 36 0.474 17.996 16.975 1.00 73.45 O ATOM 268 NE2 GLN A 36 -0.400 20.059 16.811 1.00 61.03 N ATOM 0 H GLN A 36 -3.714 15.933 14.277 1.00 34.24 H new ATOM 0 HA GLN A 36 -3.287 18.700 14.508 1.00 44.42 H new ATOM 0 HB2 GLN A 36 -2.280 16.277 15.595 1.00 40.44 H new ATOM 0 HB3 GLN A 36 -0.890 17.116 14.938 1.00 40.44 H new ATOM 0 HG2 GLN A 36 -2.582 18.975 16.391 1.00 3.23 H new ATOM 0 HG3 GLN A 36 -2.201 17.593 17.398 1.00 3.23 H new ATOM 0 HE21 GLN A 36 -1.229 20.632 16.653 1.00 61.03 H new ATOM 0 HE22 GLN A 36 0.502 20.503 16.984 1.00 61.03 H new ATOM 277 N MET A 37 -1.595 17.183 12.137 1.00 53.51 N ATOM 278 CA MET A 37 -0.765 17.405 10.959 1.00 25.22 C ATOM 279 C MET A 37 -1.514 18.224 9.912 1.00 10.24 C ATOM 280 O MET A 37 -0.963 19.161 9.334 1.00 64.10 O ATOM 281 CB MET A 37 -0.327 16.068 10.359 1.00 21.23 C ATOM 282 CG MET A 37 0.981 15.545 10.932 1.00 70.50 C ATOM 283 SD MET A 37 1.956 14.635 9.717 1.00 12.03 S ATOM 284 CE MET A 37 2.302 15.926 8.525 1.00 4.41 C ATOM 0 H MET A 37 -1.915 16.221 12.253 1.00 53.51 H new ATOM 0 HA MET A 37 0.118 17.964 11.268 1.00 25.22 H new ATOM 0 HB2 MET A 37 -1.110 15.329 10.529 1.00 21.23 H new ATOM 0 HB3 MET A 37 -0.223 16.180 9.280 1.00 21.23 H new ATOM 0 HG2 MET A 37 1.568 16.382 11.310 1.00 70.50 H new ATOM 0 HG3 MET A 37 0.768 14.896 11.781 1.00 70.50 H new ATOM 0 HE1 MET A 37 2.914 15.522 7.719 1.00 4.41 H new ATOM 0 HE2 MET A 37 1.365 16.303 8.115 1.00 4.41 H new ATOM 0 HE3 MET A 37 2.837 16.739 9.015 1.00 4.41 H new ATOM 294 N ILE A 38 -2.770 17.864 9.674 1.00 74.23 N ATOM 295 CA ILE A 38 -3.593 18.568 8.697 1.00 35.23 C ATOM 296 C ILE A 38 -3.795 20.024 9.096 1.00 42.43 C ATOM 297 O ILE A 38 -3.920 20.901 8.240 1.00 4.44 O ATOM 298 CB ILE A 38 -4.970 17.897 8.534 1.00 33.41 C ATOM 299 CG1 ILE A 38 -4.804 16.399 8.263 1.00 42.32 C ATOM 300 CG2 ILE A 38 -5.753 18.560 7.411 1.00 51.14 C ATOM 301 CD1 ILE A 38 -6.116 15.665 8.105 1.00 64.22 C ATOM 0 H ILE A 38 -3.240 17.090 10.143 1.00 74.23 H new ATOM 0 HA ILE A 38 -3.061 18.525 7.747 1.00 35.23 H new ATOM 0 HB ILE A 38 -5.529 18.019 9.462 1.00 33.41 H new ATOM 0 HG12 ILE A 38 -4.211 16.265 7.358 1.00 42.32 H new ATOM 0 HG13 ILE A 38 -4.242 15.950 9.082 1.00 42.32 H new ATOM 0 HG21 ILE A 38 -6.724 18.075 7.308 1.00 51.14 H new ATOM 0 HG22 ILE A 38 -5.898 19.615 7.642 1.00 51.14 H new ATOM 0 HG23 ILE A 38 -5.200 18.466 6.477 1.00 51.14 H new ATOM 0 HD11 ILE A 38 -5.922 14.609 7.915 1.00 64.22 H new ATOM 0 HD12 ILE A 38 -6.703 15.768 9.018 1.00 64.22 H new ATOM 0 HD13 ILE A 38 -6.671 16.088 7.268 1.00 64.22 H new ATOM 313 N SER A 39 -3.823 20.278 10.400 1.00 2.23 N ATOM 314 CA SER A 39 -4.009 21.630 10.913 1.00 15.25 C ATOM 315 C SER A 39 -2.690 22.394 10.928 1.00 24.22 C ATOM 316 O SER A 39 -2.670 23.623 10.847 1.00 70.50 O ATOM 317 CB SER A 39 -4.603 21.585 12.324 1.00 72.11 C ATOM 318 OG SER A 39 -4.856 22.892 12.812 1.00 61.42 O ATOM 0 H SER A 39 -3.719 19.564 11.121 1.00 2.23 H new ATOM 0 HA SER A 39 -4.701 22.151 10.251 1.00 15.25 H new ATOM 0 HB2 SER A 39 -5.530 21.011 12.314 1.00 72.11 H new ATOM 0 HB3 SER A 39 -3.916 21.069 12.995 1.00 72.11 H new ATOM 0 HG SER A 39 -5.236 22.837 13.714 1.00 61.42 H new ATOM 324 N SER A 40 -1.589 21.657 11.033 1.00 64.40 N ATOM 325 CA SER A 40 -0.263 22.263 11.062 1.00 40.43 C ATOM 326 C SER A 40 0.252 22.514 9.647 1.00 32.34 C ATOM 327 O SER A 40 1.369 22.996 9.456 1.00 74.42 O ATOM 328 CB SER A 40 0.716 21.366 11.822 1.00 55.35 C ATOM 329 OG SER A 40 1.963 22.014 12.009 1.00 13.40 O ATOM 0 H SER A 40 -1.589 20.639 11.099 1.00 64.40 H new ATOM 0 HA SER A 40 -0.341 23.221 11.577 1.00 40.43 H new ATOM 0 HB2 SER A 40 0.293 21.099 12.790 1.00 55.35 H new ATOM 0 HB3 SER A 40 0.865 20.437 11.272 1.00 55.35 H new ATOM 0 HG SER A 40 2.181 22.540 11.211 1.00 13.40 H new ATOM 335 N THR A 41 -0.571 22.182 8.658 1.00 31.34 N ATOM 336 CA THR A 41 -0.200 22.368 7.261 1.00 11.25 C ATOM 337 C THR A 41 0.021 23.841 6.942 1.00 41.31 C ATOM 338 O THR A 41 -0.932 24.597 6.749 1.00 10.24 O ATOM 339 CB THR A 41 -1.279 21.807 6.314 1.00 64.50 C ATOM 340 OG1 THR A 41 -2.530 22.461 6.552 1.00 3.53 O ATOM 341 CG2 THR A 41 -1.441 20.306 6.508 1.00 10.33 C ATOM 0 H THR A 41 -1.499 21.783 8.799 1.00 31.34 H new ATOM 0 HA THR A 41 0.730 21.822 7.106 1.00 11.25 H new ATOM 0 HB THR A 41 -0.962 21.994 5.288 1.00 64.50 H new ATOM 0 HG1 THR A 41 -3.119 21.865 7.060 1.00 3.53 H new ATOM 0 HG21 THR A 41 -2.208 19.932 5.829 1.00 10.33 H new ATOM 0 HG22 THR A 41 -0.495 19.808 6.297 1.00 10.33 H new ATOM 0 HG23 THR A 41 -1.737 20.102 7.537 1.00 10.33 H new ATOM 349 N THR A 42 1.286 24.247 6.887 1.00 72.22 N ATOM 350 CA THR A 42 1.634 25.631 6.592 1.00 13.10 C ATOM 351 C THR A 42 1.030 26.079 5.265 1.00 23.13 C ATOM 352 O THR A 42 0.815 27.269 5.041 1.00 14.32 O ATOM 353 CB THR A 42 3.161 25.829 6.542 1.00 53.51 C ATOM 354 OG1 THR A 42 3.822 24.651 7.015 1.00 22.14 O ATOM 355 CG2 THR A 42 3.579 27.025 7.384 1.00 74.10 C ATOM 0 H THR A 42 2.087 23.636 7.043 1.00 72.22 H new ATOM 0 HA THR A 42 1.223 26.239 7.398 1.00 13.10 H new ATOM 0 HB THR A 42 3.448 26.016 5.507 1.00 53.51 H new ATOM 0 HG1 THR A 42 4.065 24.084 6.253 1.00 22.14 H new ATOM 0 HG21 THR A 42 4.661 27.145 7.333 1.00 74.10 H new ATOM 0 HG22 THR A 42 3.096 27.925 7.003 1.00 74.10 H new ATOM 0 HG23 THR A 42 3.280 26.863 8.420 1.00 74.10 H new ATOM 363 N SER A 43 0.759 25.117 4.389 1.00 24.44 N ATOM 364 CA SER A 43 0.183 25.412 3.083 1.00 42.32 C ATOM 365 C SER A 43 -0.589 24.212 2.546 1.00 32.11 C ATOM 366 O SER A 43 -0.397 23.082 2.995 1.00 73.42 O ATOM 367 CB SER A 43 1.283 25.809 2.095 1.00 4.33 C ATOM 368 OG SER A 43 1.157 27.167 1.711 1.00 72.24 O ATOM 0 H SER A 43 0.929 24.126 4.560 1.00 24.44 H new ATOM 0 HA SER A 43 -0.510 26.245 3.199 1.00 42.32 H new ATOM 0 HB2 SER A 43 2.260 25.645 2.549 1.00 4.33 H new ATOM 0 HB3 SER A 43 1.231 25.172 1.212 1.00 4.33 H new ATOM 0 HG SER A 43 1.872 27.397 1.081 1.00 72.24 H new ATOM 374 N THR A 44 -1.466 24.465 1.579 1.00 24.21 N ATOM 375 CA THR A 44 -2.270 23.407 0.979 1.00 14.52 C ATOM 376 C THR A 44 -1.391 22.276 0.460 1.00 73.51 C ATOM 377 O THR A 44 -1.781 21.109 0.491 1.00 31.24 O ATOM 378 CB THR A 44 -3.133 23.944 -0.178 1.00 2.41 C ATOM 379 OG1 THR A 44 -2.297 24.547 -1.173 1.00 71.41 O ATOM 380 CG2 THR A 44 -4.143 24.963 0.328 1.00 41.13 C ATOM 0 H THR A 44 -1.638 25.394 1.195 1.00 24.21 H new ATOM 0 HA THR A 44 -2.924 23.025 1.763 1.00 14.52 H new ATOM 0 HB THR A 44 -3.675 23.106 -0.617 1.00 2.41 H new ATOM 0 HG1 THR A 44 -2.853 24.885 -1.906 1.00 71.41 H new ATOM 0 HG21 THR A 44 -4.741 25.328 -0.507 1.00 41.13 H new ATOM 0 HG22 THR A 44 -4.796 24.494 1.064 1.00 41.13 H new ATOM 0 HG23 THR A 44 -3.617 25.798 0.790 1.00 41.13 H new ATOM 388 N ASP A 45 -0.201 22.628 -0.016 1.00 51.21 N ATOM 389 CA ASP A 45 0.735 21.641 -0.541 1.00 1.21 C ATOM 390 C ASP A 45 1.140 20.646 0.542 1.00 62.22 C ATOM 391 O ASP A 45 1.303 19.456 0.275 1.00 11.14 O ATOM 392 CB ASP A 45 1.976 22.333 -1.106 1.00 42.34 C ATOM 393 CG ASP A 45 1.665 23.173 -2.329 1.00 64.21 C ATOM 394 OD1 ASP A 45 1.371 22.586 -3.393 1.00 14.33 O ATOM 395 OD2 ASP A 45 1.714 24.415 -2.224 1.00 72.35 O ATOM 0 H ASP A 45 0.138 23.590 -0.049 1.00 51.21 H new ATOM 0 HA ASP A 45 0.237 21.095 -1.342 1.00 1.21 H new ATOM 0 HB2 ASP A 45 2.417 22.967 -0.336 1.00 42.34 H new ATOM 0 HB3 ASP A 45 2.721 21.581 -1.365 1.00 42.34 H new ATOM 400 N GLN A 46 1.303 21.144 1.763 1.00 13.43 N ATOM 401 CA GLN A 46 1.691 20.299 2.887 1.00 43.43 C ATOM 402 C GLN A 46 0.647 19.217 3.141 1.00 40.51 C ATOM 403 O GLN A 46 0.984 18.052 3.351 1.00 1.32 O ATOM 404 CB GLN A 46 1.883 21.146 4.147 1.00 63.50 C ATOM 405 CG GLN A 46 3.340 21.336 4.536 1.00 64.15 C ATOM 406 CD GLN A 46 3.943 22.596 3.946 1.00 53.13 C ATOM 407 OE1 GLN A 46 3.904 23.663 4.560 1.00 14.01 O ATOM 408 NE2 GLN A 46 4.502 22.482 2.746 1.00 23.01 N ATOM 0 H GLN A 46 1.173 22.128 2.000 1.00 13.43 H new ATOM 0 HA GLN A 46 2.635 19.815 2.636 1.00 43.43 H new ATOM 0 HB2 GLN A 46 1.427 22.124 3.991 1.00 63.50 H new ATOM 0 HB3 GLN A 46 1.353 20.676 4.975 1.00 63.50 H new ATOM 0 HG2 GLN A 46 3.420 21.374 5.622 1.00 64.15 H new ATOM 0 HG3 GLN A 46 3.916 20.472 4.204 1.00 64.15 H new ATOM 0 HE21 GLN A 46 4.513 21.579 2.272 1.00 23.01 H new ATOM 0 HE22 GLN A 46 4.921 23.298 2.299 1.00 23.01 H new ATOM 417 N ALA A 47 -0.622 19.611 3.121 1.00 33.22 N ATOM 418 CA ALA A 47 -1.716 18.675 3.348 1.00 62.24 C ATOM 419 C ALA A 47 -1.730 17.579 2.288 1.00 51.11 C ATOM 420 O ALA A 47 -2.104 16.440 2.562 1.00 22.13 O ATOM 421 CB ALA A 47 -3.047 19.411 3.366 1.00 54.45 C ATOM 0 H ALA A 47 -0.918 20.572 2.950 1.00 33.22 H new ATOM 0 HA ALA A 47 -1.561 18.204 4.319 1.00 62.24 H new ATOM 0 HB1 ALA A 47 -3.854 18.699 3.536 1.00 54.45 H new ATOM 0 HB2 ALA A 47 -3.042 20.152 4.165 1.00 54.45 H new ATOM 0 HB3 ALA A 47 -3.200 19.910 2.409 1.00 54.45 H new ATOM 427 N VAL A 48 -1.319 17.933 1.073 1.00 21.04 N ATOM 428 CA VAL A 48 -1.284 16.979 -0.030 1.00 64.11 C ATOM 429 C VAL A 48 -0.242 15.893 0.217 1.00 75.15 C ATOM 430 O VAL A 48 -0.474 14.719 -0.075 1.00 0.45 O ATOM 431 CB VAL A 48 -0.975 17.679 -1.366 1.00 65.04 C ATOM 432 CG1 VAL A 48 -1.163 16.715 -2.528 1.00 72.35 C ATOM 433 CG2 VAL A 48 -1.850 18.911 -1.537 1.00 61.31 C ATOM 0 H VAL A 48 -1.006 18.872 0.828 1.00 21.04 H new ATOM 0 HA VAL A 48 -2.272 16.523 -0.088 1.00 64.11 H new ATOM 0 HB VAL A 48 0.066 18.001 -1.356 1.00 65.04 H new ATOM 0 HG11 VAL A 48 -0.940 17.226 -3.465 1.00 72.35 H new ATOM 0 HG12 VAL A 48 -0.490 15.866 -2.409 1.00 72.35 H new ATOM 0 HG13 VAL A 48 -2.194 16.361 -2.544 1.00 72.35 H new ATOM 0 HG21 VAL A 48 -1.618 19.393 -2.487 1.00 61.31 H new ATOM 0 HG22 VAL A 48 -2.899 18.616 -1.527 1.00 61.31 H new ATOM 0 HG23 VAL A 48 -1.661 19.608 -0.721 1.00 61.31 H new ATOM 443 N SER A 49 0.905 16.293 0.755 1.00 64.10 N ATOM 444 CA SER A 49 1.985 15.353 1.037 1.00 40.14 C ATOM 445 C SER A 49 1.530 14.284 2.026 1.00 62.23 C ATOM 446 O SER A 49 1.842 13.104 1.869 1.00 4.15 O ATOM 447 CB SER A 49 3.202 16.095 1.594 1.00 1.34 C ATOM 448 OG SER A 49 3.933 16.726 0.557 1.00 51.42 O ATOM 0 H SER A 49 1.111 17.260 1.004 1.00 64.10 H new ATOM 0 HA SER A 49 2.262 14.864 0.103 1.00 40.14 H new ATOM 0 HB2 SER A 49 2.877 16.841 2.319 1.00 1.34 H new ATOM 0 HB3 SER A 49 3.848 15.395 2.124 1.00 1.34 H new ATOM 0 HG SER A 49 4.704 17.195 0.939 1.00 51.42 H new ATOM 454 N VAL A 50 0.789 14.707 3.046 1.00 71.13 N ATOM 455 CA VAL A 50 0.289 13.787 4.061 1.00 51.35 C ATOM 456 C VAL A 50 -0.688 12.783 3.459 1.00 52.50 C ATOM 457 O VAL A 50 -0.557 11.577 3.659 1.00 34.32 O ATOM 458 CB VAL A 50 -0.407 14.542 5.208 1.00 31.52 C ATOM 459 CG1 VAL A 50 -0.740 13.591 6.348 1.00 51.02 C ATOM 460 CG2 VAL A 50 0.464 15.689 5.696 1.00 11.04 C ATOM 0 H VAL A 50 0.522 15.681 3.191 1.00 71.13 H new ATOM 0 HA VAL A 50 1.152 13.254 4.459 1.00 51.35 H new ATOM 0 HB VAL A 50 -1.340 14.960 4.831 1.00 31.52 H new ATOM 0 HG11 VAL A 50 -1.231 14.142 7.150 1.00 51.02 H new ATOM 0 HG12 VAL A 50 -1.405 12.807 5.986 1.00 51.02 H new ATOM 0 HG13 VAL A 50 0.178 13.141 6.727 1.00 51.02 H new ATOM 0 HG21 VAL A 50 -0.043 16.212 6.507 1.00 11.04 H new ATOM 0 HG22 VAL A 50 1.415 15.296 6.056 1.00 11.04 H new ATOM 0 HG23 VAL A 50 0.646 16.382 4.875 1.00 11.04 H new ATOM 470 N ALA A 51 -1.670 13.292 2.720 1.00 5.03 N ATOM 471 CA ALA A 51 -2.668 12.440 2.087 1.00 72.41 C ATOM 472 C ALA A 51 -2.030 11.527 1.046 1.00 53.04 C ATOM 473 O ALA A 51 -2.408 10.362 0.911 1.00 12.41 O ATOM 474 CB ALA A 51 -3.759 13.290 1.450 1.00 0.25 C ATOM 0 H ALA A 51 -1.795 14.289 2.546 1.00 5.03 H new ATOM 0 HA ALA A 51 -3.115 11.811 2.857 1.00 72.41 H new ATOM 0 HB1 ALA A 51 -4.498 12.641 0.981 1.00 0.25 H new ATOM 0 HB2 ALA A 51 -4.242 13.896 2.216 1.00 0.25 H new ATOM 0 HB3 ALA A 51 -3.318 13.943 0.696 1.00 0.25 H new ATOM 480 N THR A 52 -1.063 12.063 0.308 1.00 55.40 N ATOM 481 CA THR A 52 -0.375 11.297 -0.723 1.00 4.14 C ATOM 482 C THR A 52 0.568 10.270 -0.108 1.00 33.53 C ATOM 483 O THR A 52 0.814 9.213 -0.690 1.00 43.53 O ATOM 484 CB THR A 52 0.429 12.217 -1.663 1.00 75.14 C ATOM 485 OG1 THR A 52 1.321 13.037 -0.901 1.00 14.21 O ATOM 486 CG2 THR A 52 -0.502 13.096 -2.485 1.00 22.21 C ATOM 0 H THR A 52 -0.739 13.025 0.405 1.00 55.40 H new ATOM 0 HA THR A 52 -1.143 10.781 -1.299 1.00 4.14 H new ATOM 0 HB THR A 52 1.006 11.591 -2.344 1.00 75.14 H new ATOM 0 HG1 THR A 52 0.913 13.916 -0.755 1.00 14.21 H new ATOM 0 HG21 THR A 52 0.087 13.737 -3.141 1.00 22.21 H new ATOM 0 HG22 THR A 52 -1.159 12.468 -3.086 1.00 22.21 H new ATOM 0 HG23 THR A 52 -1.102 13.714 -1.818 1.00 22.21 H new ATOM 494 N SER A 53 1.092 10.586 1.073 1.00 33.22 N ATOM 495 CA SER A 53 2.010 9.690 1.766 1.00 65.12 C ATOM 496 C SER A 53 1.277 8.461 2.293 1.00 43.22 C ATOM 497 O SER A 53 1.744 7.332 2.143 1.00 71.25 O ATOM 498 CB SER A 53 2.697 10.424 2.920 1.00 35.55 C ATOM 499 OG SER A 53 3.662 11.341 2.438 1.00 65.22 O ATOM 0 H SER A 53 0.896 11.455 1.569 1.00 33.22 H new ATOM 0 HA SER A 53 2.766 9.361 1.053 1.00 65.12 H new ATOM 0 HB2 SER A 53 1.952 10.954 3.513 1.00 35.55 H new ATOM 0 HB3 SER A 53 3.176 9.702 3.581 1.00 35.55 H new ATOM 0 HG SER A 53 3.219 12.026 1.895 1.00 65.22 H new ATOM 505 N VAL A 54 0.123 8.689 2.913 1.00 4.21 N ATOM 506 CA VAL A 54 -0.678 7.602 3.464 1.00 75.32 C ATOM 507 C VAL A 54 -1.275 6.744 2.353 1.00 12.54 C ATOM 508 O VAL A 54 -1.396 5.527 2.492 1.00 52.30 O ATOM 509 CB VAL A 54 -1.815 8.137 4.353 1.00 34.44 C ATOM 510 CG1 VAL A 54 -1.250 8.848 5.574 1.00 73.31 C ATOM 511 CG2 VAL A 54 -2.723 9.064 3.558 1.00 4.41 C ATOM 0 H VAL A 54 -0.278 9.617 3.046 1.00 4.21 H new ATOM 0 HA VAL A 54 -0.010 6.992 4.072 1.00 75.32 H new ATOM 0 HB VAL A 54 -2.410 7.292 4.698 1.00 34.44 H new ATOM 0 HG11 VAL A 54 -2.069 9.219 6.190 1.00 73.31 H new ATOM 0 HG12 VAL A 54 -0.646 8.150 6.154 1.00 73.31 H new ATOM 0 HG13 VAL A 54 -0.629 9.685 5.253 1.00 73.31 H new ATOM 0 HG21 VAL A 54 -3.521 9.433 4.203 1.00 4.41 H new ATOM 0 HG22 VAL A 54 -2.143 9.906 3.181 1.00 4.41 H new ATOM 0 HG23 VAL A 54 -3.157 8.518 2.720 1.00 4.41 H new ATOM 521 N ALA A 55 -1.648 7.387 1.251 1.00 1.41 N ATOM 522 CA ALA A 55 -2.230 6.683 0.116 1.00 53.31 C ATOM 523 C ALA A 55 -1.216 5.746 -0.528 1.00 71.02 C ATOM 524 O ALA A 55 -1.571 4.673 -1.015 1.00 35.12 O ATOM 525 CB ALA A 55 -2.759 7.678 -0.908 1.00 23.33 C ATOM 0 H ALA A 55 -1.557 8.395 1.121 1.00 1.41 H new ATOM 0 HA ALA A 55 -3.061 6.079 0.482 1.00 53.31 H new ATOM 0 HB1 ALA A 55 -3.191 7.138 -1.751 1.00 23.33 H new ATOM 0 HB2 ALA A 55 -3.524 8.303 -0.447 1.00 23.33 H new ATOM 0 HB3 ALA A 55 -1.941 8.307 -1.261 1.00 23.33 H new ATOM 531 N GLN A 56 0.048 6.158 -0.528 1.00 43.41 N ATOM 532 CA GLN A 56 1.113 5.355 -1.115 1.00 64.31 C ATOM 533 C GLN A 56 1.329 4.072 -0.320 1.00 1.44 C ATOM 534 O GLN A 56 1.507 2.997 -0.891 1.00 55.53 O ATOM 535 CB GLN A 56 2.415 6.158 -1.173 1.00 52.52 C ATOM 536 CG GLN A 56 3.503 5.494 -2.000 1.00 41.34 C ATOM 537 CD GLN A 56 4.893 5.764 -1.458 1.00 71.04 C ATOM 538 OE1 GLN A 56 5.087 6.655 -0.630 1.00 60.34 O ATOM 539 NE2 GLN A 56 5.870 4.995 -1.926 1.00 12.12 N ATOM 0 H GLN A 56 0.359 7.043 -0.128 1.00 43.41 H new ATOM 0 HA GLN A 56 0.814 5.087 -2.128 1.00 64.31 H new ATOM 0 HB2 GLN A 56 2.206 7.144 -1.588 1.00 52.52 H new ATOM 0 HB3 GLN A 56 2.783 6.311 -0.159 1.00 52.52 H new ATOM 0 HG2 GLN A 56 3.329 4.418 -2.025 1.00 41.34 H new ATOM 0 HG3 GLN A 56 3.442 5.851 -3.028 1.00 41.34 H new ATOM 0 HE21 GLN A 56 5.663 4.269 -2.612 1.00 12.12 H new ATOM 0 HE22 GLN A 56 6.827 5.131 -1.600 1.00 12.12 H new ATOM 548 N ASN A 57 1.314 4.193 1.004 1.00 63.21 N ATOM 549 CA ASN A 57 1.510 3.042 1.880 1.00 51.42 C ATOM 550 C ASN A 57 0.395 2.017 1.687 1.00 50.13 C ATOM 551 O ASN A 57 0.656 0.827 1.519 1.00 25.42 O ATOM 552 CB ASN A 57 1.558 3.490 3.342 1.00 61.24 C ATOM 553 CG ASN A 57 2.976 3.701 3.835 1.00 64.33 C ATOM 554 OD1 ASN A 57 3.377 4.822 4.148 1.00 14.13 O ATOM 555 ND2 ASN A 57 3.745 2.620 3.906 1.00 35.30 N ATOM 0 H ASN A 57 1.168 5.076 1.494 1.00 63.21 H new ATOM 0 HA ASN A 57 2.460 2.575 1.619 1.00 51.42 H new ATOM 0 HB2 ASN A 57 0.996 4.417 3.454 1.00 61.24 H new ATOM 0 HB3 ASN A 57 1.067 2.742 3.965 1.00 61.24 H new ATOM 0 HD21 ASN A 57 4.709 2.700 4.230 1.00 35.30 H new ATOM 0 HD22 ASN A 57 3.372 1.710 3.636 1.00 35.30 H new ATOM 562 N VAL A 58 -0.847 2.490 1.711 1.00 63.24 N ATOM 563 CA VAL A 58 -2.001 1.614 1.537 1.00 42.41 C ATOM 564 C VAL A 58 -2.042 1.035 0.127 1.00 5.23 C ATOM 565 O VAL A 58 -2.425 -0.118 -0.069 1.00 55.32 O ATOM 566 CB VAL A 58 -3.319 2.364 1.811 1.00 21.22 C ATOM 567 CG1 VAL A 58 -3.452 3.566 0.889 1.00 12.12 C ATOM 568 CG2 VAL A 58 -4.505 1.426 1.654 1.00 32.21 C ATOM 0 H VAL A 58 -1.080 3.473 1.849 1.00 63.24 H new ATOM 0 HA VAL A 58 -1.896 0.803 2.257 1.00 42.41 H new ATOM 0 HB VAL A 58 -3.305 2.727 2.839 1.00 21.22 H new ATOM 0 HG11 VAL A 58 -4.389 4.083 1.098 1.00 12.12 H new ATOM 0 HG12 VAL A 58 -2.617 4.247 1.056 1.00 12.12 H new ATOM 0 HG13 VAL A 58 -3.445 3.231 -0.148 1.00 12.12 H new ATOM 0 HG21 VAL A 58 -5.428 1.971 1.851 1.00 32.21 H new ATOM 0 HG22 VAL A 58 -4.526 1.032 0.638 1.00 32.21 H new ATOM 0 HG23 VAL A 58 -4.413 0.601 2.361 1.00 32.21 H new ATOM 578 N GLY A 59 -1.645 1.842 -0.851 1.00 61.31 N ATOM 579 CA GLY A 59 -1.645 1.391 -2.231 1.00 23.24 C ATOM 580 C GLY A 59 -0.583 0.341 -2.496 1.00 33.42 C ATOM 581 O GLY A 59 -0.843 -0.658 -3.167 1.00 13.34 O ATOM 0 H GLY A 59 -1.323 2.800 -0.713 1.00 61.31 H new ATOM 0 HA2 GLY A 59 -2.625 0.983 -2.477 1.00 23.24 H new ATOM 0 HA3 GLY A 59 -1.481 2.244 -2.889 1.00 23.24 H new ATOM 585 N ASN A 60 0.615 0.567 -1.972 1.00 4.32 N ATOM 586 CA ASN A 60 1.720 -0.367 -2.156 1.00 75.21 C ATOM 587 C ASN A 60 1.377 -1.738 -1.581 1.00 44.33 C ATOM 588 O ASN A 60 1.754 -2.767 -2.140 1.00 60.31 O ATOM 589 CB ASN A 60 2.990 0.174 -1.495 1.00 13.14 C ATOM 590 CG ASN A 60 4.171 -0.761 -1.661 1.00 64.10 C ATOM 591 OD1 ASN A 60 4.700 -1.293 -0.685 1.00 41.23 O ATOM 592 ND2 ASN A 60 4.591 -0.967 -2.904 1.00 45.21 N ATOM 0 H ASN A 60 0.847 1.390 -1.416 1.00 4.32 H new ATOM 0 HA ASN A 60 1.895 -0.476 -3.226 1.00 75.21 H new ATOM 0 HB2 ASN A 60 3.235 1.145 -1.926 1.00 13.14 H new ATOM 0 HB3 ASN A 60 2.804 0.334 -0.433 1.00 13.14 H new ATOM 0 HD21 ASN A 60 5.382 -1.587 -3.079 1.00 45.21 H new ATOM 0 HD22 ASN A 60 4.123 -0.505 -3.684 1.00 45.21 H new ATOM 599 N GLN A 61 0.659 -1.741 -0.463 1.00 65.43 N ATOM 600 CA GLN A 61 0.266 -2.985 0.188 1.00 22.34 C ATOM 601 C GLN A 61 -0.610 -3.828 -0.733 1.00 54.23 C ATOM 602 O GLN A 61 -0.695 -5.047 -0.583 1.00 50.42 O ATOM 603 CB GLN A 61 -0.479 -2.691 1.491 1.00 10.21 C ATOM 604 CG GLN A 61 0.381 -2.853 2.734 1.00 41.42 C ATOM 605 CD GLN A 61 1.335 -1.692 2.939 1.00 64.23 C ATOM 606 OE1 GLN A 61 2.414 -1.648 2.348 1.00 31.11 O ATOM 607 NE2 GLN A 61 0.940 -0.743 3.780 1.00 42.15 N ATOM 0 H GLN A 61 0.338 -0.897 0.011 1.00 65.43 H new ATOM 0 HA GLN A 61 1.171 -3.548 0.415 1.00 22.34 H new ATOM 0 HB2 GLN A 61 -0.865 -1.672 1.457 1.00 10.21 H new ATOM 0 HB3 GLN A 61 -1.340 -3.356 1.566 1.00 10.21 H new ATOM 0 HG2 GLN A 61 -0.264 -2.947 3.608 1.00 41.42 H new ATOM 0 HG3 GLN A 61 0.952 -3.778 2.658 1.00 41.42 H new ATOM 0 HE21 GLN A 61 0.037 -0.820 4.248 1.00 42.15 H new ATOM 0 HE22 GLN A 61 1.539 0.063 3.957 1.00 42.15 H new ATOM 616 N LEU A 62 -1.262 -3.169 -1.686 1.00 2.14 N ATOM 617 CA LEU A 62 -2.133 -3.859 -2.633 1.00 41.22 C ATOM 618 C LEU A 62 -1.319 -4.701 -3.609 1.00 4.22 C ATOM 619 O LEU A 62 -1.818 -5.675 -4.171 1.00 64.52 O ATOM 620 CB LEU A 62 -2.985 -2.846 -3.402 1.00 22.21 C ATOM 621 CG LEU A 62 -3.588 -1.711 -2.574 1.00 2.41 C ATOM 622 CD1 LEU A 62 -4.313 -0.721 -3.473 1.00 33.24 C ATOM 623 CD2 LEU A 62 -4.531 -2.265 -1.515 1.00 70.33 C ATOM 0 H LEU A 62 -1.204 -2.160 -1.823 1.00 2.14 H new ATOM 0 HA LEU A 62 -2.788 -4.523 -2.069 1.00 41.22 H new ATOM 0 HB2 LEU A 62 -2.371 -2.408 -4.189 1.00 22.21 H new ATOM 0 HB3 LEU A 62 -3.797 -3.382 -3.892 1.00 22.21 H new ATOM 0 HG LEU A 62 -2.778 -1.185 -2.069 1.00 2.41 H new ATOM 0 HD11 LEU A 62 -4.736 0.080 -2.866 1.00 33.24 H new ATOM 0 HD12 LEU A 62 -3.610 -0.299 -4.191 1.00 33.24 H new ATOM 0 HD13 LEU A 62 -5.114 -1.233 -4.007 1.00 33.24 H new ATOM 0 HD21 LEU A 62 -4.951 -1.443 -0.935 1.00 70.33 H new ATOM 0 HD22 LEU A 62 -5.337 -2.817 -1.998 1.00 70.33 H new ATOM 0 HD23 LEU A 62 -3.981 -2.933 -0.852 1.00 70.33 H new ATOM 635 N GLY A 63 -0.060 -4.318 -3.805 1.00 72.23 N ATOM 636 CA GLY A 63 0.804 -5.051 -4.713 1.00 52.10 C ATOM 637 C GLY A 63 0.165 -5.272 -6.069 1.00 10.41 C ATOM 638 O GLY A 63 -0.471 -6.301 -6.304 1.00 42.41 O ATOM 0 H GLY A 63 0.376 -3.515 -3.352 1.00 72.23 H new ATOM 0 HA2 GLY A 63 1.739 -4.505 -4.840 1.00 52.10 H new ATOM 0 HA3 GLY A 63 1.055 -6.015 -4.272 1.00 52.10 H new ATOM 642 N LEU A 64 0.332 -4.306 -6.966 1.00 31.20 N ATOM 643 CA LEU A 64 -0.234 -4.400 -8.307 1.00 50.53 C ATOM 644 C LEU A 64 0.822 -4.105 -9.366 1.00 62.31 C ATOM 645 O LEU A 64 1.315 -5.013 -10.036 1.00 11.14 O ATOM 646 CB LEU A 64 -1.406 -3.428 -8.455 1.00 63.14 C ATOM 647 CG LEU A 64 -2.803 -4.047 -8.402 1.00 72.30 C ATOM 648 CD1 LEU A 64 -3.868 -2.963 -8.359 1.00 61.15 C ATOM 649 CD2 LEU A 64 -3.023 -4.968 -9.595 1.00 23.14 C ATOM 0 H LEU A 64 0.855 -3.448 -6.789 1.00 31.20 H new ATOM 0 HA LEU A 64 -0.593 -5.419 -8.453 1.00 50.53 H new ATOM 0 HB2 LEU A 64 -1.332 -2.679 -7.667 1.00 63.14 H new ATOM 0 HB3 LEU A 64 -1.299 -2.903 -9.404 1.00 63.14 H new ATOM 0 HG LEU A 64 -2.882 -4.639 -7.490 1.00 72.30 H new ATOM 0 HD11 LEU A 64 -4.855 -3.424 -8.322 1.00 61.15 H new ATOM 0 HD12 LEU A 64 -3.722 -2.345 -7.473 1.00 61.15 H new ATOM 0 HD13 LEU A 64 -3.791 -2.342 -9.251 1.00 61.15 H new ATOM 0 HD21 LEU A 64 -4.022 -5.400 -9.542 1.00 23.14 H new ATOM 0 HD22 LEU A 64 -2.923 -4.397 -10.518 1.00 23.14 H new ATOM 0 HD23 LEU A 64 -2.281 -5.766 -9.580 1.00 23.14 H new ATOM 661 N ASP A 65 1.169 -2.830 -9.512 1.00 31.04 N ATOM 662 CA ASP A 65 2.170 -2.416 -10.487 1.00 23.12 C ATOM 663 C ASP A 65 2.837 -1.113 -10.060 1.00 21.40 C ATOM 664 O ASP A 65 2.184 -0.213 -9.535 1.00 51.54 O ATOM 665 CB ASP A 65 1.530 -2.248 -11.866 1.00 74.30 C ATOM 666 CG ASP A 65 2.033 -3.271 -12.866 1.00 21.10 C ATOM 667 OD1 ASP A 65 3.166 -3.105 -13.366 1.00 21.11 O ATOM 668 OD2 ASP A 65 1.296 -4.238 -13.148 1.00 14.32 O ATOM 0 H ASP A 65 0.771 -2.066 -8.967 1.00 31.04 H new ATOM 0 HA ASP A 65 2.933 -3.193 -10.541 1.00 23.12 H new ATOM 0 HB2 ASP A 65 0.447 -2.336 -11.774 1.00 74.30 H new ATOM 0 HB3 ASP A 65 1.738 -1.246 -12.240 1.00 74.30 H new ATOM 673 N ALA A 66 4.143 -1.021 -10.289 1.00 75.22 N ATOM 674 CA ALA A 66 4.900 0.172 -9.930 1.00 2.24 C ATOM 675 C ALA A 66 4.429 1.382 -10.729 1.00 42.33 C ATOM 676 O ALA A 66 4.196 2.454 -10.172 1.00 53.33 O ATOM 677 CB ALA A 66 6.387 -0.061 -10.146 1.00 63.01 C ATOM 0 H ALA A 66 4.699 -1.759 -10.722 1.00 75.22 H new ATOM 0 HA ALA A 66 4.727 0.378 -8.874 1.00 2.24 H new ATOM 0 HB1 ALA A 66 6.940 0.838 -9.874 1.00 63.01 H new ATOM 0 HB2 ALA A 66 6.719 -0.893 -9.525 1.00 63.01 H new ATOM 0 HB3 ALA A 66 6.570 -0.296 -11.195 1.00 63.01 H new ATOM 683 N ASN A 67 4.294 1.203 -12.040 1.00 14.52 N ATOM 684 CA ASN A 67 3.852 2.281 -12.917 1.00 70.14 C ATOM 685 C ASN A 67 2.387 2.621 -12.666 1.00 53.02 C ATOM 686 O ASN A 67 2.012 3.792 -12.601 1.00 21.11 O ATOM 687 CB ASN A 67 4.053 1.889 -14.382 1.00 55.24 C ATOM 688 CG ASN A 67 5.243 2.589 -15.011 1.00 14.55 C ATOM 689 OD1 ASN A 67 6.393 2.254 -14.730 1.00 74.35 O ATOM 690 ND2 ASN A 67 4.967 3.568 -15.865 1.00 61.22 N ATOM 0 H ASN A 67 4.484 0.322 -12.517 1.00 14.52 H new ATOM 0 HA ASN A 67 4.453 3.163 -12.698 1.00 70.14 H new ATOM 0 HB2 ASN A 67 4.192 0.810 -14.451 1.00 55.24 H new ATOM 0 HB3 ASN A 67 3.153 2.131 -14.947 1.00 55.24 H new ATOM 0 HD21 ASN A 67 5.725 4.077 -16.319 1.00 61.22 H new ATOM 0 HD22 ASN A 67 3.997 3.810 -16.067 1.00 61.22 H new ATOM 697 N ALA A 68 1.560 1.590 -12.526 1.00 22.53 N ATOM 698 CA ALA A 68 0.137 1.777 -12.280 1.00 54.32 C ATOM 699 C ALA A 68 -0.103 2.454 -10.933 1.00 23.53 C ATOM 700 O ALA A 68 -0.742 3.503 -10.860 1.00 0.11 O ATOM 701 CB ALA A 68 -0.592 0.444 -12.339 1.00 24.53 C ATOM 0 H ALA A 68 1.853 0.614 -12.579 1.00 22.53 H new ATOM 0 HA ALA A 68 -0.257 2.427 -13.061 1.00 54.32 H new ATOM 0 HB1 ALA A 68 -1.654 0.602 -12.153 1.00 24.53 H new ATOM 0 HB2 ALA A 68 -0.458 -0.000 -13.325 1.00 24.53 H new ATOM 0 HB3 ALA A 68 -0.187 -0.226 -11.581 1.00 24.53 H new ATOM 707 N MET A 69 0.414 1.846 -9.872 1.00 12.24 N ATOM 708 CA MET A 69 0.256 2.389 -8.527 1.00 52.22 C ATOM 709 C MET A 69 0.798 3.813 -8.451 1.00 2.25 C ATOM 710 O MET A 69 0.199 4.681 -7.818 1.00 42.51 O ATOM 711 CB MET A 69 0.973 1.502 -7.507 1.00 73.42 C ATOM 712 CG MET A 69 0.460 1.672 -6.086 1.00 70.22 C ATOM 713 SD MET A 69 -1.149 0.899 -5.833 1.00 4.44 S ATOM 714 CE MET A 69 -2.215 2.336 -5.803 1.00 52.41 C ATOM 0 H MET A 69 0.946 0.977 -9.916 1.00 12.24 H new ATOM 0 HA MET A 69 -0.808 2.410 -8.292 1.00 52.22 H new ATOM 0 HB2 MET A 69 0.861 0.459 -7.803 1.00 73.42 H new ATOM 0 HB3 MET A 69 2.039 1.726 -7.529 1.00 73.42 H new ATOM 0 HG2 MET A 69 1.180 1.241 -5.390 1.00 70.22 H new ATOM 0 HG3 MET A 69 0.389 2.735 -5.854 1.00 70.22 H new ATOM 0 HE1 MET A 69 -3.122 2.128 -6.371 1.00 52.41 H new ATOM 0 HE2 MET A 69 -2.479 2.572 -4.772 1.00 52.41 H new ATOM 0 HE3 MET A 69 -1.695 3.184 -6.248 1.00 52.41 H new ATOM 724 N ASN A 70 1.935 4.044 -9.098 1.00 3.00 N ATOM 725 CA ASN A 70 2.559 5.364 -9.101 1.00 20.52 C ATOM 726 C ASN A 70 1.621 6.406 -9.701 1.00 12.13 C ATOM 727 O ASN A 70 1.438 7.488 -9.142 1.00 13.11 O ATOM 728 CB ASN A 70 3.871 5.329 -9.887 1.00 22.35 C ATOM 729 CG ASN A 70 5.041 4.874 -9.038 1.00 1.23 C ATOM 730 OD1 ASN A 70 4.875 4.097 -8.096 1.00 44.42 O ATOM 731 ND2 ASN A 70 6.234 5.357 -9.367 1.00 23.32 N ATOM 0 H ASN A 70 2.444 3.336 -9.627 1.00 3.00 H new ATOM 0 HA ASN A 70 2.770 5.642 -8.068 1.00 20.52 H new ATOM 0 HB2 ASN A 70 3.763 4.659 -10.740 1.00 22.35 H new ATOM 0 HB3 ASN A 70 4.079 6.322 -10.286 1.00 22.35 H new ATOM 0 HD21 ASN A 70 7.059 5.087 -8.832 1.00 23.32 H new ATOM 0 HD22 ASN A 70 6.325 5.998 -10.155 1.00 23.32 H new ATOM 738 N SER A 71 1.027 6.073 -10.843 1.00 41.23 N ATOM 739 CA SER A 71 0.111 6.982 -11.521 1.00 74.30 C ATOM 740 C SER A 71 -1.185 7.137 -10.731 1.00 71.21 C ATOM 741 O SER A 71 -1.733 8.235 -10.622 1.00 50.24 O ATOM 742 CB SER A 71 -0.197 6.472 -12.931 1.00 51.11 C ATOM 743 OG SER A 71 -1.418 5.753 -12.958 1.00 51.11 O ATOM 0 H SER A 71 1.164 5.181 -11.318 1.00 41.23 H new ATOM 0 HA SER A 71 0.593 7.957 -11.591 1.00 74.30 H new ATOM 0 HB2 SER A 71 -0.252 7.314 -13.622 1.00 51.11 H new ATOM 0 HB3 SER A 71 0.614 5.830 -13.274 1.00 51.11 H new ATOM 0 HG SER A 71 -1.323 4.927 -12.439 1.00 51.11 H new ATOM 749 N LEU A 72 -1.670 6.030 -10.179 1.00 22.31 N ATOM 750 CA LEU A 72 -2.902 6.041 -9.397 1.00 62.44 C ATOM 751 C LEU A 72 -2.738 6.883 -8.136 1.00 75.51 C ATOM 752 O LEU A 72 -3.625 7.658 -7.775 1.00 14.31 O ATOM 753 CB LEU A 72 -3.304 4.614 -9.023 1.00 70.23 C ATOM 754 CG LEU A 72 -4.565 4.473 -8.168 1.00 64.03 C ATOM 755 CD1 LEU A 72 -4.233 4.655 -6.695 1.00 43.43 C ATOM 756 CD2 LEU A 72 -5.621 5.477 -8.608 1.00 3.14 C ATOM 0 H LEU A 72 -1.229 5.114 -10.258 1.00 22.31 H new ATOM 0 HA LEU A 72 -3.688 6.485 -10.008 1.00 62.44 H new ATOM 0 HB2 LEU A 72 -3.447 4.046 -9.942 1.00 70.23 H new ATOM 0 HB3 LEU A 72 -2.474 4.152 -8.489 1.00 70.23 H new ATOM 0 HG LEU A 72 -4.967 3.469 -8.307 1.00 64.03 H new ATOM 0 HD11 LEU A 72 -5.142 4.551 -6.102 1.00 43.43 H new ATOM 0 HD12 LEU A 72 -3.511 3.898 -6.388 1.00 43.43 H new ATOM 0 HD13 LEU A 72 -3.808 5.646 -6.538 1.00 43.43 H new ATOM 0 HD21 LEU A 72 -6.511 5.363 -7.990 1.00 3.14 H new ATOM 0 HD22 LEU A 72 -5.230 6.488 -8.498 1.00 3.14 H new ATOM 0 HD23 LEU A 72 -5.879 5.299 -9.652 1.00 3.14 H new ATOM 768 N LEU A 73 -1.599 6.727 -7.470 1.00 33.43 N ATOM 769 CA LEU A 73 -1.319 7.475 -6.250 1.00 64.21 C ATOM 770 C LEU A 73 -1.412 8.978 -6.499 1.00 24.14 C ATOM 771 O LEU A 73 -1.631 9.758 -5.572 1.00 74.33 O ATOM 772 CB LEU A 73 0.071 7.119 -5.719 1.00 44.14 C ATOM 773 CG LEU A 73 0.111 6.405 -4.367 1.00 73.14 C ATOM 774 CD1 LEU A 73 -0.593 7.235 -3.305 1.00 34.14 C ATOM 775 CD2 LEU A 73 -0.521 5.026 -4.474 1.00 63.34 C ATOM 0 H LEU A 73 -0.855 6.090 -7.754 1.00 33.43 H new ATOM 0 HA LEU A 73 -2.067 7.202 -5.505 1.00 64.21 H new ATOM 0 HB2 LEU A 73 0.569 6.488 -6.455 1.00 44.14 H new ATOM 0 HB3 LEU A 73 0.654 8.037 -5.640 1.00 44.14 H new ATOM 0 HG LEU A 73 1.153 6.283 -4.072 1.00 73.14 H new ATOM 0 HD11 LEU A 73 -0.555 6.712 -2.350 1.00 34.14 H new ATOM 0 HD12 LEU A 73 -0.097 8.201 -3.210 1.00 34.14 H new ATOM 0 HD13 LEU A 73 -1.633 7.388 -3.593 1.00 34.14 H new ATOM 0 HD21 LEU A 73 -0.484 4.532 -3.503 1.00 63.34 H new ATOM 0 HD22 LEU A 73 -1.559 5.125 -4.791 1.00 63.34 H new ATOM 0 HD23 LEU A 73 0.026 4.431 -5.205 1.00 63.34 H new ATOM 787 N GLY A 74 -1.244 9.376 -7.756 1.00 42.44 N ATOM 788 CA GLY A 74 -1.314 10.783 -8.104 1.00 34.44 C ATOM 789 C GLY A 74 -2.738 11.305 -8.127 1.00 23.23 C ATOM 790 O GLY A 74 -2.967 12.494 -8.341 1.00 4.20 O ATOM 0 H GLY A 74 -1.061 8.749 -8.540 1.00 42.44 H new ATOM 0 HA2 GLY A 74 -0.730 11.361 -7.388 1.00 34.44 H new ATOM 0 HA3 GLY A 74 -0.859 10.935 -9.083 1.00 34.44 H new ATOM 794 N ALA A 75 -3.696 10.411 -7.907 1.00 11.12 N ATOM 795 CA ALA A 75 -5.104 10.787 -7.902 1.00 74.31 C ATOM 796 C ALA A 75 -5.416 11.737 -6.750 1.00 64.24 C ATOM 797 O ALA A 75 -5.989 12.807 -6.953 1.00 25.11 O ATOM 798 CB ALA A 75 -5.982 9.546 -7.817 1.00 62.22 C ATOM 0 H ALA A 75 -3.523 9.422 -7.730 1.00 11.12 H new ATOM 0 HA ALA A 75 -5.318 11.308 -8.836 1.00 74.31 H new ATOM 0 HB1 ALA A 75 -7.031 9.842 -7.814 1.00 62.22 H new ATOM 0 HB2 ALA A 75 -5.788 8.904 -8.676 1.00 62.22 H new ATOM 0 HB3 ALA A 75 -5.756 9.002 -6.900 1.00 62.22 H new ATOM 804 N VAL A 76 -5.034 11.339 -5.540 1.00 61.04 N ATOM 805 CA VAL A 76 -5.272 12.155 -4.358 1.00 0.42 C ATOM 806 C VAL A 76 -4.430 13.426 -4.387 1.00 72.14 C ATOM 807 O VAL A 76 -4.876 14.488 -3.955 1.00 45.44 O ATOM 808 CB VAL A 76 -4.959 11.376 -3.065 1.00 53.11 C ATOM 809 CG1 VAL A 76 -3.626 10.655 -3.187 1.00 24.13 C ATOM 810 CG2 VAL A 76 -4.963 12.311 -1.867 1.00 3.01 C ATOM 0 H VAL A 76 -4.558 10.456 -5.354 1.00 61.04 H new ATOM 0 HA VAL A 76 -6.329 12.422 -4.367 1.00 0.42 H new ATOM 0 HB VAL A 76 -5.736 10.627 -2.914 1.00 53.11 H new ATOM 0 HG11 VAL A 76 -3.421 10.110 -2.265 1.00 24.13 H new ATOM 0 HG12 VAL A 76 -3.666 9.954 -4.021 1.00 24.13 H new ATOM 0 HG13 VAL A 76 -2.834 11.383 -3.362 1.00 24.13 H new ATOM 0 HG21 VAL A 76 -4.740 11.745 -0.963 1.00 3.01 H new ATOM 0 HG22 VAL A 76 -4.207 13.084 -2.006 1.00 3.01 H new ATOM 0 HG23 VAL A 76 -5.944 12.776 -1.772 1.00 3.01 H new ATOM 820 N SER A 77 -3.210 13.309 -4.901 1.00 20.40 N ATOM 821 CA SER A 77 -2.303 14.447 -4.984 1.00 52.34 C ATOM 822 C SER A 77 -2.961 15.613 -5.714 1.00 75.43 C ATOM 823 O SER A 77 -2.780 16.773 -5.346 1.00 72.41 O ATOM 824 CB SER A 77 -1.012 14.047 -5.701 1.00 24.55 C ATOM 825 OG SER A 77 -0.554 15.085 -6.549 1.00 30.42 O ATOM 0 H SER A 77 -2.827 12.437 -5.266 1.00 20.40 H new ATOM 0 HA SER A 77 -2.064 14.763 -3.969 1.00 52.34 H new ATOM 0 HB2 SER A 77 -0.243 13.809 -4.966 1.00 24.55 H new ATOM 0 HB3 SER A 77 -1.183 13.144 -6.287 1.00 24.55 H new ATOM 0 HG SER A 77 0.273 14.804 -6.993 1.00 30.42 H new ATOM 831 N GLY A 78 -3.728 15.296 -6.754 1.00 74.52 N ATOM 832 CA GLY A 78 -4.402 16.326 -7.521 1.00 55.44 C ATOM 833 C GLY A 78 -5.794 16.623 -6.996 1.00 62.15 C ATOM 834 O GLY A 78 -6.260 17.760 -7.061 1.00 63.33 O ATOM 0 H GLY A 78 -3.894 14.343 -7.078 1.00 74.52 H new ATOM 0 HA2 GLY A 78 -3.807 17.239 -7.500 1.00 55.44 H new ATOM 0 HA3 GLY A 78 -4.469 16.013 -8.563 1.00 55.44 H new ATOM 838 N TYR A 79 -6.458 15.597 -6.478 1.00 1.22 N ATOM 839 CA TYR A 79 -7.808 15.752 -5.944 1.00 70.04 C ATOM 840 C TYR A 79 -7.842 16.815 -4.852 1.00 41.32 C ATOM 841 O TYR A 79 -8.667 17.728 -4.884 1.00 14.51 O ATOM 842 CB TYR A 79 -8.314 14.419 -5.391 1.00 13.12 C ATOM 843 CG TYR A 79 -9.821 14.289 -5.413 1.00 44.11 C ATOM 844 CD1 TYR A 79 -10.629 15.240 -4.803 1.00 71.23 C ATOM 845 CD2 TYR A 79 -10.435 13.214 -6.045 1.00 14.55 C ATOM 846 CE1 TYR A 79 -12.006 15.124 -4.822 1.00 51.41 C ATOM 847 CE2 TYR A 79 -11.812 13.091 -6.067 1.00 23.51 C ATOM 848 CZ TYR A 79 -12.592 14.047 -5.455 1.00 42.44 C ATOM 849 OH TYR A 79 -13.963 13.930 -5.476 1.00 4.20 O ATOM 0 H TYR A 79 -6.085 14.649 -6.416 1.00 1.22 H new ATOM 0 HA TYR A 79 -8.460 16.072 -6.757 1.00 70.04 H new ATOM 0 HB2 TYR A 79 -7.879 13.605 -5.971 1.00 13.12 H new ATOM 0 HB3 TYR A 79 -7.962 14.303 -4.366 1.00 13.12 H new ATOM 0 HD1 TYR A 79 -10.174 16.084 -4.306 1.00 71.23 H new ATOM 0 HD2 TYR A 79 -9.827 12.463 -6.527 1.00 14.55 H new ATOM 0 HE1 TYR A 79 -12.620 15.873 -4.344 1.00 51.41 H new ATOM 0 HE2 TYR A 79 -12.274 12.249 -6.562 1.00 23.51 H new ATOM 0 HH TYR A 79 -14.215 13.117 -5.962 1.00 4.20 H new ATOM 859 N VAL A 80 -6.938 16.691 -3.884 1.00 74.53 N ATOM 860 CA VAL A 80 -6.863 17.642 -2.782 1.00 44.13 C ATOM 861 C VAL A 80 -6.617 19.057 -3.293 1.00 2.41 C ATOM 862 O VAL A 80 -7.142 20.026 -2.745 1.00 1.34 O ATOM 863 CB VAL A 80 -5.746 17.265 -1.791 1.00 73.03 C ATOM 864 CG1 VAL A 80 -6.047 15.927 -1.132 1.00 23.31 C ATOM 865 CG2 VAL A 80 -4.398 17.231 -2.496 1.00 1.24 C ATOM 0 H VAL A 80 -6.248 15.941 -3.842 1.00 74.53 H new ATOM 0 HA VAL A 80 -7.823 17.606 -2.267 1.00 44.13 H new ATOM 0 HB VAL A 80 -5.703 18.025 -1.011 1.00 73.03 H new ATOM 0 HG11 VAL A 80 -5.247 15.677 -0.435 1.00 23.31 H new ATOM 0 HG12 VAL A 80 -6.992 15.992 -0.592 1.00 23.31 H new ATOM 0 HG13 VAL A 80 -6.118 15.153 -1.896 1.00 23.31 H new ATOM 0 HG21 VAL A 80 -3.620 16.963 -1.781 1.00 1.24 H new ATOM 0 HG22 VAL A 80 -4.425 16.492 -3.297 1.00 1.24 H new ATOM 0 HG23 VAL A 80 -4.182 18.213 -2.916 1.00 1.24 H new ATOM 875 N SER A 81 -5.816 19.169 -4.347 1.00 43.33 N ATOM 876 CA SER A 81 -5.496 20.467 -4.931 1.00 33.21 C ATOM 877 C SER A 81 -6.765 21.193 -5.366 1.00 13.30 C ATOM 878 O SER A 81 -6.847 22.420 -5.300 1.00 11.52 O ATOM 879 CB SER A 81 -4.558 20.295 -6.127 1.00 4.14 C ATOM 880 OG SER A 81 -4.895 21.190 -7.172 1.00 74.52 O ATOM 0 H SER A 81 -5.376 18.376 -4.815 1.00 43.33 H new ATOM 0 HA SER A 81 -4.996 21.067 -4.171 1.00 33.21 H new ATOM 0 HB2 SER A 81 -3.528 20.468 -5.814 1.00 4.14 H new ATOM 0 HB3 SER A 81 -4.612 19.269 -6.491 1.00 4.14 H new ATOM 0 HG SER A 81 -4.280 21.061 -7.924 1.00 74.52 H new ATOM 886 N THR A 82 -7.755 20.427 -5.812 1.00 2.14 N ATOM 887 CA THR A 82 -9.020 20.995 -6.259 1.00 72.13 C ATOM 888 C THR A 82 -9.936 21.295 -5.079 1.00 14.14 C ATOM 889 O THR A 82 -10.802 22.169 -5.157 1.00 30.43 O ATOM 890 CB THR A 82 -9.748 20.048 -7.233 1.00 15.01 C ATOM 891 OG1 THR A 82 -10.291 18.932 -6.518 1.00 42.40 O ATOM 892 CG2 THR A 82 -8.801 19.551 -8.315 1.00 50.31 C ATOM 0 H THR A 82 -7.705 19.410 -5.873 1.00 2.14 H new ATOM 0 HA THR A 82 -8.784 21.925 -6.776 1.00 72.13 H new ATOM 0 HB THR A 82 -10.557 20.603 -7.708 1.00 15.01 H new ATOM 0 HG1 THR A 82 -9.698 18.702 -5.772 1.00 42.40 H new ATOM 0 HG21 THR A 82 -9.338 18.884 -8.990 1.00 50.31 H new ATOM 0 HG22 THR A 82 -8.412 20.400 -8.877 1.00 50.31 H new ATOM 0 HG23 THR A 82 -7.973 19.011 -7.854 1.00 50.31 H new ATOM 900 N LEU A 83 -9.743 20.566 -3.986 1.00 73.12 N ATOM 901 CA LEU A 83 -10.552 20.754 -2.787 1.00 0.33 C ATOM 902 C LEU A 83 -10.433 22.184 -2.269 1.00 43.33 C ATOM 903 O LEU A 83 -9.789 23.029 -2.889 1.00 30.03 O ATOM 904 CB LEU A 83 -10.126 19.767 -1.699 1.00 45.54 C ATOM 905 CG LEU A 83 -10.329 18.286 -2.018 1.00 74.23 C ATOM 906 CD1 LEU A 83 -9.963 17.426 -0.818 1.00 72.53 C ATOM 907 CD2 LEU A 83 -11.766 18.026 -2.444 1.00 73.31 C ATOM 0 H LEU A 83 -9.033 19.838 -3.905 1.00 73.12 H new ATOM 0 HA LEU A 83 -11.594 20.568 -3.049 1.00 0.33 H new ATOM 0 HB2 LEU A 83 -9.070 19.930 -1.482 1.00 45.54 H new ATOM 0 HB3 LEU A 83 -10.678 20.001 -0.789 1.00 45.54 H new ATOM 0 HG LEU A 83 -9.671 18.018 -2.845 1.00 74.23 H new ATOM 0 HD11 LEU A 83 -10.114 16.375 -1.064 1.00 72.53 H new ATOM 0 HD12 LEU A 83 -8.918 17.591 -0.557 1.00 72.53 H new ATOM 0 HD13 LEU A 83 -10.595 17.695 0.029 1.00 72.53 H new ATOM 0 HD21 LEU A 83 -11.893 16.967 -2.667 1.00 73.31 H new ATOM 0 HD22 LEU A 83 -12.442 18.310 -1.637 1.00 73.31 H new ATOM 0 HD23 LEU A 83 -11.994 18.614 -3.333 1.00 73.31 H new ATOM 919 N GLY A 84 -11.056 22.447 -1.124 1.00 22.13 N ATOM 920 CA GLY A 84 -11.004 23.775 -0.540 1.00 11.55 C ATOM 921 C GLY A 84 -10.475 23.763 0.880 1.00 54.33 C ATOM 922 O GLY A 84 -9.723 22.868 1.263 1.00 51.14 O ATOM 0 H GLY A 84 -11.595 21.765 -0.591 1.00 22.13 H new ATOM 0 HA2 GLY A 84 -10.371 24.415 -1.155 1.00 11.55 H new ATOM 0 HA3 GLY A 84 -12.003 24.212 -0.549 1.00 11.55 H new ATOM 926 N ASN A 85 -10.869 24.762 1.665 1.00 31.12 N ATOM 927 CA ASN A 85 -10.427 24.864 3.051 1.00 2.22 C ATOM 928 C ASN A 85 -11.121 23.822 3.922 1.00 31.23 C ATOM 929 O ASN A 85 -10.733 23.598 5.068 1.00 32.22 O ATOM 930 CB ASN A 85 -10.705 26.267 3.595 1.00 72.44 C ATOM 931 CG ASN A 85 -9.513 27.192 3.447 1.00 22.44 C ATOM 932 OD1 ASN A 85 -8.825 27.178 2.426 1.00 21.11 O ATOM 933 ND2 ASN A 85 -9.262 28.003 4.468 1.00 13.54 N ATOM 0 H ASN A 85 -11.493 25.511 1.365 1.00 31.12 H new ATOM 0 HA ASN A 85 -9.354 24.677 3.078 1.00 2.22 H new ATOM 0 HB2 ASN A 85 -11.560 26.694 3.071 1.00 72.44 H new ATOM 0 HB3 ASN A 85 -10.979 26.198 4.648 1.00 72.44 H new ATOM 0 HD21 ASN A 85 -8.473 28.648 4.425 1.00 13.54 H new ATOM 0 HD22 ASN A 85 -9.858 27.981 5.295 1.00 13.54 H new ATOM 940 N ALA A 86 -12.150 23.188 3.370 1.00 33.44 N ATOM 941 CA ALA A 86 -12.897 22.167 4.094 1.00 40.01 C ATOM 942 C ALA A 86 -12.129 20.850 4.138 1.00 54.14 C ATOM 943 O ALA A 86 -12.617 19.820 3.674 1.00 72.02 O ATOM 944 CB ALA A 86 -14.264 21.961 3.457 1.00 70.11 C ATOM 0 H ALA A 86 -12.486 23.364 2.423 1.00 33.44 H new ATOM 0 HA ALA A 86 -13.033 22.512 5.119 1.00 40.01 H new ATOM 0 HB1 ALA A 86 -14.811 21.196 4.008 1.00 70.11 H new ATOM 0 HB2 ALA A 86 -14.823 22.897 3.484 1.00 70.11 H new ATOM 0 HB3 ALA A 86 -14.139 21.643 2.422 1.00 70.11 H new ATOM 950 N ILE A 87 -10.924 20.892 4.696 1.00 3.43 N ATOM 951 CA ILE A 87 -10.088 19.702 4.799 1.00 50.52 C ATOM 952 C ILE A 87 -10.233 19.046 6.169 1.00 52.53 C ATOM 953 O ILE A 87 -9.902 17.874 6.344 1.00 1.21 O ATOM 954 CB ILE A 87 -8.605 20.033 4.556 1.00 44.43 C ATOM 955 CG1 ILE A 87 -8.452 20.903 3.306 1.00 23.01 C ATOM 956 CG2 ILE A 87 -7.792 18.754 4.421 1.00 41.33 C ATOM 957 CD1 ILE A 87 -8.878 20.209 2.031 1.00 23.22 C ATOM 0 H ILE A 87 -10.505 21.737 5.084 1.00 3.43 H new ATOM 0 HA ILE A 87 -10.428 19.010 4.029 1.00 50.52 H new ATOM 0 HB ILE A 87 -8.227 20.591 5.413 1.00 44.43 H new ATOM 0 HG12 ILE A 87 -9.042 21.811 3.431 1.00 23.01 H new ATOM 0 HG13 ILE A 87 -7.410 21.210 3.212 1.00 23.01 H new ATOM 0 HG21 ILE A 87 -6.745 19.005 4.249 1.00 41.33 H new ATOM 0 HG22 ILE A 87 -7.880 18.169 5.336 1.00 41.33 H new ATOM 0 HG23 ILE A 87 -8.168 18.171 3.580 1.00 41.33 H new ATOM 0 HD11 ILE A 87 -8.742 20.884 1.186 1.00 23.22 H new ATOM 0 HD12 ILE A 87 -8.271 19.316 1.883 1.00 23.22 H new ATOM 0 HD13 ILE A 87 -9.928 19.926 2.104 1.00 23.22 H new ATOM 969 N SER A 88 -10.731 19.811 7.135 1.00 54.24 N ATOM 970 CA SER A 88 -10.920 19.305 8.490 1.00 72.00 C ATOM 971 C SER A 88 -11.929 18.162 8.507 1.00 10.55 C ATOM 972 O SER A 88 -12.012 17.405 9.476 1.00 43.21 O ATOM 973 CB SER A 88 -11.387 20.429 9.416 1.00 13.53 C ATOM 974 OG SER A 88 -12.465 21.147 8.842 1.00 42.31 O ATOM 0 H SER A 88 -11.011 20.783 7.005 1.00 54.24 H new ATOM 0 HA SER A 88 -9.963 18.925 8.847 1.00 72.00 H new ATOM 0 HB2 SER A 88 -11.694 20.011 10.375 1.00 13.53 H new ATOM 0 HB3 SER A 88 -10.558 21.108 9.615 1.00 13.53 H new ATOM 0 HG SER A 88 -12.747 21.859 9.454 1.00 42.31 H new ATOM 980 N ASP A 89 -12.697 18.042 7.429 1.00 11.53 N ATOM 981 CA ASP A 89 -13.702 16.991 7.320 1.00 12.14 C ATOM 982 C ASP A 89 -13.063 15.668 6.910 1.00 60.15 C ATOM 983 O ASP A 89 -12.708 15.474 5.747 1.00 31.21 O ATOM 984 CB ASP A 89 -14.777 17.387 6.307 1.00 53.43 C ATOM 985 CG ASP A 89 -16.180 17.141 6.826 1.00 33.24 C ATOM 986 OD1 ASP A 89 -16.488 17.599 7.946 1.00 13.12 O ATOM 987 OD2 ASP A 89 -16.971 16.491 6.111 1.00 24.41 O ATOM 0 H ASP A 89 -12.643 18.659 6.619 1.00 11.53 H new ATOM 0 HA ASP A 89 -14.165 16.863 8.298 1.00 12.14 H new ATOM 0 HB2 ASP A 89 -14.665 18.442 6.057 1.00 53.43 H new ATOM 0 HB3 ASP A 89 -14.629 16.823 5.386 1.00 53.43 H new ATOM 992 N ALA A 90 -12.916 14.763 7.871 1.00 11.23 N ATOM 993 CA ALA A 90 -12.321 13.459 7.610 1.00 51.21 C ATOM 994 C ALA A 90 -13.185 12.643 6.656 1.00 73.02 C ATOM 995 O ALA A 90 -12.671 11.933 5.791 1.00 75.42 O ATOM 996 CB ALA A 90 -12.111 12.703 8.914 1.00 42.23 C ATOM 0 H ALA A 90 -13.201 14.909 8.839 1.00 11.23 H new ATOM 0 HA ALA A 90 -11.352 13.618 7.136 1.00 51.21 H new ATOM 0 HB1 ALA A 90 -11.666 11.731 8.703 1.00 42.23 H new ATOM 0 HB2 ALA A 90 -11.446 13.274 9.562 1.00 42.23 H new ATOM 0 HB3 ALA A 90 -13.071 12.563 9.412 1.00 42.23 H new ATOM 1002 N SER A 91 -14.499 12.746 6.820 1.00 54.05 N ATOM 1003 CA SER A 91 -15.435 12.013 5.976 1.00 54.23 C ATOM 1004 C SER A 91 -15.276 12.414 4.512 1.00 23.14 C ATOM 1005 O SER A 91 -15.139 11.561 3.635 1.00 53.42 O ATOM 1006 CB SER A 91 -16.874 12.267 6.430 1.00 65.22 C ATOM 1007 OG SER A 91 -17.793 12.023 5.381 1.00 62.54 O ATOM 0 H SER A 91 -14.940 13.330 7.530 1.00 54.05 H new ATOM 0 HA SER A 91 -15.213 10.950 6.071 1.00 54.23 H new ATOM 0 HB2 SER A 91 -17.109 11.625 7.279 1.00 65.22 H new ATOM 0 HB3 SER A 91 -16.974 13.297 6.772 1.00 65.22 H new ATOM 0 HG SER A 91 -18.705 12.191 5.699 1.00 62.54 H new ATOM 1013 N ALA A 92 -15.293 13.717 4.257 1.00 72.12 N ATOM 1014 CA ALA A 92 -15.148 14.233 2.900 1.00 10.44 C ATOM 1015 C ALA A 92 -13.723 14.046 2.391 1.00 31.24 C ATOM 1016 O ALA A 92 -13.509 13.579 1.273 1.00 2.24 O ATOM 1017 CB ALA A 92 -15.541 15.702 2.850 1.00 10.22 C ATOM 0 H ALA A 92 -15.406 14.436 4.972 1.00 72.12 H new ATOM 0 HA ALA A 92 -15.815 13.668 2.249 1.00 10.44 H new ATOM 0 HB1 ALA A 92 -15.428 16.074 1.832 1.00 10.22 H new ATOM 0 HB2 ALA A 92 -16.579 15.812 3.164 1.00 10.22 H new ATOM 0 HB3 ALA A 92 -14.898 16.274 3.519 1.00 10.22 H new ATOM 1023 N TYR A 93 -12.751 14.415 3.219 1.00 75.43 N ATOM 1024 CA TYR A 93 -11.346 14.291 2.851 1.00 64.01 C ATOM 1025 C TYR A 93 -10.995 12.842 2.521 1.00 41.34 C ATOM 1026 O TYR A 93 -10.390 12.559 1.488 1.00 3.01 O ATOM 1027 CB TYR A 93 -10.454 14.797 3.985 1.00 53.20 C ATOM 1028 CG TYR A 93 -9.034 15.091 3.554 1.00 54.11 C ATOM 1029 CD1 TYR A 93 -8.774 15.773 2.371 1.00 22.23 C ATOM 1030 CD2 TYR A 93 -7.954 14.688 4.328 1.00 24.22 C ATOM 1031 CE1 TYR A 93 -7.480 16.042 1.972 1.00 50.23 C ATOM 1032 CE2 TYR A 93 -6.657 14.955 3.938 1.00 1.11 C ATOM 1033 CZ TYR A 93 -6.424 15.632 2.760 1.00 51.32 C ATOM 1034 OH TYR A 93 -5.132 15.900 2.366 1.00 72.03 O ATOM 0 H TYR A 93 -12.911 14.802 4.149 1.00 75.43 H new ATOM 0 HA TYR A 93 -11.174 14.899 1.963 1.00 64.01 H new ATOM 0 HB2 TYR A 93 -10.892 15.703 4.404 1.00 53.20 H new ATOM 0 HB3 TYR A 93 -10.436 14.053 4.782 1.00 53.20 H new ATOM 0 HD1 TYR A 93 -9.598 16.098 1.753 1.00 22.23 H new ATOM 0 HD2 TYR A 93 -8.132 14.156 5.251 1.00 24.22 H new ATOM 0 HE1 TYR A 93 -7.295 16.570 1.048 1.00 50.23 H new ATOM 0 HE2 TYR A 93 -5.829 14.635 4.553 1.00 1.11 H new ATOM 0 HH TYR A 93 -4.552 15.945 3.155 1.00 72.03 H new ATOM 1044 N ALA A 94 -11.381 11.931 3.407 1.00 12.44 N ATOM 1045 CA ALA A 94 -11.112 10.512 3.210 1.00 71.11 C ATOM 1046 C ALA A 94 -11.927 9.953 2.049 1.00 43.32 C ATOM 1047 O ALA A 94 -11.477 9.057 1.338 1.00 34.52 O ATOM 1048 CB ALA A 94 -11.406 9.736 4.486 1.00 10.21 C ATOM 0 H ALA A 94 -11.881 12.150 4.269 1.00 12.44 H new ATOM 0 HA ALA A 94 -10.056 10.400 2.965 1.00 71.11 H new ATOM 0 HB1 ALA A 94 -11.201 8.678 4.324 1.00 10.21 H new ATOM 0 HB2 ALA A 94 -10.774 10.109 5.292 1.00 10.21 H new ATOM 0 HB3 ALA A 94 -12.454 9.865 4.757 1.00 10.21 H new ATOM 1054 N ASN A 95 -13.129 10.490 1.864 1.00 62.11 N ATOM 1055 CA ASN A 95 -14.008 10.044 0.790 1.00 25.24 C ATOM 1056 C ASN A 95 -13.366 10.283 -0.573 1.00 72.15 C ATOM 1057 O ASN A 95 -13.539 9.493 -1.500 1.00 54.12 O ATOM 1058 CB ASN A 95 -15.352 10.769 0.868 1.00 50.42 C ATOM 1059 CG ASN A 95 -16.384 9.994 1.663 1.00 52.33 C ATOM 1060 OD1 ASN A 95 -16.056 9.337 2.652 1.00 54.32 O ATOM 1061 ND2 ASN A 95 -17.638 10.066 1.234 1.00 43.41 N ATOM 0 H ASN A 95 -13.516 11.234 2.444 1.00 62.11 H new ATOM 0 HA ASN A 95 -14.174 8.973 0.911 1.00 25.24 H new ATOM 0 HB2 ASN A 95 -15.207 11.748 1.324 1.00 50.42 H new ATOM 0 HB3 ASN A 95 -15.728 10.940 -0.141 1.00 50.42 H new ATOM 0 HD21 ASN A 95 -18.376 9.565 1.729 1.00 43.41 H new ATOM 0 HD22 ASN A 95 -17.864 10.623 0.410 1.00 43.41 H new ATOM 1068 N ALA A 96 -12.624 11.381 -0.688 1.00 4.24 N ATOM 1069 CA ALA A 96 -11.953 11.723 -1.936 1.00 14.44 C ATOM 1070 C ALA A 96 -10.807 10.760 -2.225 1.00 52.24 C ATOM 1071 O ALA A 96 -10.745 10.159 -3.298 1.00 14.43 O ATOM 1072 CB ALA A 96 -11.443 13.156 -1.884 1.00 64.14 C ATOM 0 H ALA A 96 -12.473 12.048 0.069 1.00 4.24 H new ATOM 0 HA ALA A 96 -12.677 11.636 -2.746 1.00 14.44 H new ATOM 0 HB1 ALA A 96 -10.944 13.399 -2.822 1.00 64.14 H new ATOM 0 HB2 ALA A 96 -12.282 13.835 -1.733 1.00 64.14 H new ATOM 0 HB3 ALA A 96 -10.738 13.261 -1.060 1.00 64.14 H new ATOM 1078 N ILE A 97 -9.902 10.620 -1.264 1.00 61.31 N ATOM 1079 CA ILE A 97 -8.758 9.729 -1.417 1.00 11.15 C ATOM 1080 C ILE A 97 -9.203 8.274 -1.509 1.00 24.42 C ATOM 1081 O ILE A 97 -8.580 7.466 -2.199 1.00 60.33 O ATOM 1082 CB ILE A 97 -7.767 9.878 -0.247 1.00 14.15 C ATOM 1083 CG1 ILE A 97 -8.359 9.278 1.031 1.00 14.23 C ATOM 1084 CG2 ILE A 97 -7.414 11.343 -0.036 1.00 25.14 C ATOM 1085 CD1 ILE A 97 -7.460 9.421 2.239 1.00 73.25 C ATOM 0 H ILE A 97 -9.938 11.112 -0.371 1.00 61.31 H new ATOM 0 HA ILE A 97 -8.259 10.013 -2.343 1.00 11.15 H new ATOM 0 HB ILE A 97 -6.854 9.335 -0.492 1.00 14.15 H new ATOM 0 HG12 ILE A 97 -9.314 9.760 1.240 1.00 14.23 H new ATOM 0 HG13 ILE A 97 -8.565 8.221 0.865 1.00 14.23 H new ATOM 0 HG21 ILE A 97 -6.713 11.432 0.794 1.00 25.14 H new ATOM 0 HG22 ILE A 97 -6.957 11.741 -0.942 1.00 25.14 H new ATOM 0 HG23 ILE A 97 -8.319 11.906 0.191 1.00 25.14 H new ATOM 0 HD11 ILE A 97 -7.944 8.974 3.107 1.00 73.25 H new ATOM 0 HD12 ILE A 97 -6.513 8.915 2.050 1.00 73.25 H new ATOM 0 HD13 ILE A 97 -7.274 10.478 2.431 1.00 73.25 H new ATOM 1097 N SER A 98 -10.286 7.946 -0.811 1.00 21.40 N ATOM 1098 CA SER A 98 -10.814 6.586 -0.813 1.00 61.03 C ATOM 1099 C SER A 98 -11.351 6.214 -2.191 1.00 60.12 C ATOM 1100 O SER A 98 -11.242 5.068 -2.623 1.00 20.22 O ATOM 1101 CB SER A 98 -11.919 6.445 0.236 1.00 73.44 C ATOM 1102 OG SER A 98 -11.385 6.466 1.547 1.00 60.11 O ATOM 0 H SER A 98 -10.815 8.603 -0.237 1.00 21.40 H new ATOM 0 HA SER A 98 -10.000 5.905 -0.565 1.00 61.03 H new ATOM 0 HB2 SER A 98 -12.639 7.255 0.121 1.00 73.44 H new ATOM 0 HB3 SER A 98 -12.460 5.512 0.075 1.00 73.44 H new ATOM 0 HG SER A 98 -11.357 7.389 1.874 1.00 60.11 H new ATOM 1108 N SER A 99 -11.935 7.193 -2.875 1.00 43.40 N ATOM 1109 CA SER A 99 -12.494 6.970 -4.202 1.00 35.40 C ATOM 1110 C SER A 99 -11.387 6.786 -5.235 1.00 51.01 C ATOM 1111 O SER A 99 -11.524 6.006 -6.178 1.00 0.44 O ATOM 1112 CB SER A 99 -13.393 8.140 -4.605 1.00 23.01 C ATOM 1113 OG SER A 99 -13.518 8.228 -6.014 1.00 42.20 O ATOM 0 H SER A 99 -12.033 8.148 -2.531 1.00 43.40 H new ATOM 0 HA SER A 99 -13.090 6.058 -4.168 1.00 35.40 H new ATOM 0 HB2 SER A 99 -14.379 8.016 -4.157 1.00 23.01 H new ATOM 0 HB3 SER A 99 -12.980 9.070 -4.215 1.00 23.01 H new ATOM 0 HG SER A 99 -14.099 8.983 -6.244 1.00 42.20 H new ATOM 1119 N ALA A 100 -10.288 7.510 -5.050 1.00 30.01 N ATOM 1120 CA ALA A 100 -9.155 7.426 -5.964 1.00 41.32 C ATOM 1121 C ALA A 100 -8.463 6.072 -5.859 1.00 14.55 C ATOM 1122 O ALA A 100 -8.382 5.329 -6.836 1.00 63.44 O ATOM 1123 CB ALA A 100 -8.166 8.549 -5.683 1.00 34.11 C ATOM 0 H ALA A 100 -10.158 8.161 -4.276 1.00 30.01 H new ATOM 0 HA ALA A 100 -9.532 7.534 -6.981 1.00 41.32 H new ATOM 0 HB1 ALA A 100 -7.325 8.474 -6.372 1.00 34.11 H new ATOM 0 HB2 ALA A 100 -8.660 9.511 -5.817 1.00 34.11 H new ATOM 0 HB3 ALA A 100 -7.803 8.467 -4.658 1.00 34.11 H new ATOM 1129 N ILE A 101 -7.967 5.758 -4.666 1.00 74.30 N ATOM 1130 CA ILE A 101 -7.284 4.492 -4.434 1.00 60.21 C ATOM 1131 C ILE A 101 -8.265 3.325 -4.447 1.00 74.13 C ATOM 1132 O ILE A 101 -7.959 2.247 -4.956 1.00 4.24 O ATOM 1133 CB ILE A 101 -6.529 4.497 -3.092 1.00 12.54 C ATOM 1134 CG1 ILE A 101 -7.498 4.768 -1.938 1.00 61.50 C ATOM 1135 CG2 ILE A 101 -5.419 5.537 -3.112 1.00 22.42 C ATOM 1136 CD1 ILE A 101 -7.901 3.521 -1.183 1.00 71.42 C ATOM 0 H ILE A 101 -8.026 6.363 -3.847 1.00 74.30 H new ATOM 0 HA ILE A 101 -6.567 4.369 -5.246 1.00 60.21 H new ATOM 0 HB ILE A 101 -6.079 3.516 -2.942 1.00 12.54 H new ATOM 0 HG12 ILE A 101 -7.036 5.470 -1.244 1.00 61.50 H new ATOM 0 HG13 ILE A 101 -8.393 5.250 -2.331 1.00 61.50 H new ATOM 0 HG21 ILE A 101 -4.895 5.528 -2.156 1.00 22.42 H new ATOM 0 HG22 ILE A 101 -4.717 5.305 -3.913 1.00 22.42 H new ATOM 0 HG23 ILE A 101 -5.849 6.524 -3.281 1.00 22.42 H new ATOM 0 HD11 ILE A 101 -8.588 3.788 -0.380 1.00 71.42 H new ATOM 0 HD12 ILE A 101 -8.392 2.826 -1.864 1.00 71.42 H new ATOM 0 HD13 ILE A 101 -7.014 3.049 -0.760 1.00 71.42 H new ATOM 1148 N GLY A 102 -9.451 3.549 -3.888 1.00 10.42 N ATOM 1149 CA GLY A 102 -10.462 2.509 -3.847 1.00 41.11 C ATOM 1150 C GLY A 102 -10.960 2.132 -5.227 1.00 31.42 C ATOM 1151 O GLY A 102 -11.388 1.000 -5.452 1.00 65.04 O ATOM 0 H GLY A 102 -9.729 4.433 -3.463 1.00 10.42 H new ATOM 0 HA2 GLY A 102 -10.051 1.626 -3.358 1.00 41.11 H new ATOM 0 HA3 GLY A 102 -11.302 2.847 -3.240 1.00 41.11 H new ATOM 1155 N ASN A 103 -10.906 3.082 -6.155 1.00 41.13 N ATOM 1156 CA ASN A 103 -11.358 2.843 -7.520 1.00 62.31 C ATOM 1157 C ASN A 103 -10.593 1.683 -8.152 1.00 14.01 C ATOM 1158 O ASN A 103 -11.190 0.756 -8.701 1.00 44.45 O ATOM 1159 CB ASN A 103 -11.182 4.105 -8.366 1.00 41.23 C ATOM 1160 CG ASN A 103 -12.495 4.821 -8.616 1.00 53.35 C ATOM 1161 OD1 ASN A 103 -13.557 4.200 -8.652 1.00 2.02 O ATOM 1162 ND2 ASN A 103 -12.427 6.137 -8.790 1.00 34.00 N ATOM 0 H ASN A 103 -10.554 4.024 -5.986 1.00 41.13 H new ATOM 0 HA ASN A 103 -12.416 2.581 -7.485 1.00 62.31 H new ATOM 0 HB2 ASN A 103 -10.492 4.783 -7.864 1.00 41.23 H new ATOM 0 HB3 ASN A 103 -10.729 3.839 -9.321 1.00 41.23 H new ATOM 0 HD21 ASN A 103 -13.277 6.673 -8.962 1.00 34.00 H new ATOM 0 HD22 ASN A 103 -11.524 6.611 -8.752 1.00 34.00 H new ATOM 1169 N VAL A 104 -9.267 1.742 -8.071 1.00 42.01 N ATOM 1170 CA VAL A 104 -8.420 0.697 -8.633 1.00 41.22 C ATOM 1171 C VAL A 104 -8.525 -0.589 -7.822 1.00 23.44 C ATOM 1172 O VAL A 104 -8.471 -1.690 -8.373 1.00 31.33 O ATOM 1173 CB VAL A 104 -6.945 1.139 -8.686 1.00 22.44 C ATOM 1174 CG1 VAL A 104 -6.759 2.256 -9.701 1.00 43.52 C ATOM 1175 CG2 VAL A 104 -6.469 1.573 -7.308 1.00 34.42 C ATOM 0 H VAL A 104 -8.757 2.502 -7.622 1.00 42.01 H new ATOM 0 HA VAL A 104 -8.773 0.513 -9.648 1.00 41.22 H new ATOM 0 HB VAL A 104 -6.340 0.289 -9.002 1.00 22.44 H new ATOM 0 HG11 VAL A 104 -5.711 2.555 -9.725 1.00 43.52 H new ATOM 0 HG12 VAL A 104 -7.058 1.904 -10.688 1.00 43.52 H new ATOM 0 HG13 VAL A 104 -7.374 3.110 -9.419 1.00 43.52 H new ATOM 0 HG21 VAL A 104 -5.425 1.882 -7.364 1.00 34.42 H new ATOM 0 HG22 VAL A 104 -7.076 2.408 -6.960 1.00 34.42 H new ATOM 0 HG23 VAL A 104 -6.564 0.740 -6.611 1.00 34.42 H new ATOM 1185 N LEU A 105 -8.675 -0.446 -6.510 1.00 3.12 N ATOM 1186 CA LEU A 105 -8.788 -1.597 -5.621 1.00 15.11 C ATOM 1187 C LEU A 105 -9.950 -2.495 -6.038 1.00 44.32 C ATOM 1188 O LEU A 105 -9.813 -3.717 -6.092 1.00 73.15 O ATOM 1189 CB LEU A 105 -8.980 -1.135 -4.175 1.00 61.35 C ATOM 1190 CG LEU A 105 -7.727 -1.129 -3.300 1.00 71.34 C ATOM 1191 CD1 LEU A 105 -7.838 -0.071 -2.215 1.00 1.41 C ATOM 1192 CD2 LEU A 105 -7.499 -2.504 -2.688 1.00 52.23 C ATOM 0 H LEU A 105 -8.721 0.457 -6.038 1.00 3.12 H new ATOM 0 HA LEU A 105 -7.864 -2.171 -5.692 1.00 15.11 H new ATOM 0 HB2 LEU A 105 -9.394 -0.127 -4.189 1.00 61.35 H new ATOM 0 HB3 LEU A 105 -9.724 -1.778 -3.705 1.00 61.35 H new ATOM 0 HG LEU A 105 -6.869 -0.886 -3.927 1.00 71.34 H new ATOM 0 HD11 LEU A 105 -6.937 -0.082 -1.602 1.00 1.41 H new ATOM 0 HD12 LEU A 105 -7.952 0.911 -2.674 1.00 1.41 H new ATOM 0 HD13 LEU A 105 -8.705 -0.282 -1.589 1.00 1.41 H new ATOM 0 HD21 LEU A 105 -6.603 -2.482 -2.068 1.00 52.23 H new ATOM 0 HD22 LEU A 105 -8.358 -2.776 -2.075 1.00 52.23 H new ATOM 0 HD23 LEU A 105 -7.373 -3.239 -3.482 1.00 52.23 H new ATOM 1204 N ALA A 106 -11.089 -1.879 -6.334 1.00 23.00 N ATOM 1205 CA ALA A 106 -12.272 -2.623 -6.750 1.00 64.34 C ATOM 1206 C ALA A 106 -12.053 -3.288 -8.105 1.00 14.31 C ATOM 1207 O ALA A 106 -12.537 -4.392 -8.349 1.00 22.43 O ATOM 1208 CB ALA A 106 -13.483 -1.702 -6.802 1.00 3.41 C ATOM 0 H ALA A 106 -11.218 -0.868 -6.294 1.00 23.00 H new ATOM 0 HA ALA A 106 -12.456 -3.407 -6.015 1.00 64.34 H new ATOM 0 HB1 ALA A 106 -14.359 -2.270 -7.114 1.00 3.41 H new ATOM 0 HB2 ALA A 106 -13.659 -1.277 -5.814 1.00 3.41 H new ATOM 0 HB3 ALA A 106 -13.299 -0.899 -7.515 1.00 3.41 H new ATOM 1214 N ASN A 107 -11.322 -2.608 -8.982 1.00 15.41 N ATOM 1215 CA ASN A 107 -11.042 -3.133 -10.312 1.00 63.42 C ATOM 1216 C ASN A 107 -10.252 -4.436 -10.228 1.00 60.31 C ATOM 1217 O ASN A 107 -10.302 -5.265 -11.137 1.00 14.11 O ATOM 1218 CB ASN A 107 -10.264 -2.106 -11.136 1.00 41.03 C ATOM 1219 CG ASN A 107 -11.054 -1.599 -12.328 1.00 31.43 C ATOM 1220 OD1 ASN A 107 -11.696 -0.552 -12.261 1.00 50.22 O ATOM 1221 ND2 ASN A 107 -11.010 -2.345 -13.426 1.00 34.45 N ATOM 0 H ASN A 107 -10.913 -1.692 -8.795 1.00 15.41 H new ATOM 0 HA ASN A 107 -11.994 -3.336 -10.802 1.00 63.42 H new ATOM 0 HB2 ASN A 107 -9.993 -1.264 -10.499 1.00 41.03 H new ATOM 0 HB3 ASN A 107 -9.334 -2.554 -11.485 1.00 41.03 H new ATOM 0 HD21 ASN A 107 -11.522 -2.056 -14.259 1.00 34.45 H new ATOM 0 HD22 ASN A 107 -10.464 -3.206 -13.436 1.00 34.45 H new ATOM 1228 N SER A 108 -9.525 -4.611 -9.130 1.00 20.10 N ATOM 1229 CA SER A 108 -8.722 -5.811 -8.926 1.00 51.02 C ATOM 1230 C SER A 108 -9.548 -6.912 -8.266 1.00 72.23 C ATOM 1231 O SER A 108 -9.020 -7.957 -7.891 1.00 11.15 O ATOM 1232 CB SER A 108 -7.498 -5.492 -8.066 1.00 70.33 C ATOM 1233 OG SER A 108 -6.350 -6.173 -8.542 1.00 45.43 O ATOM 0 H SER A 108 -9.475 -3.936 -8.367 1.00 20.10 H new ATOM 0 HA SER A 108 -8.389 -6.165 -9.902 1.00 51.02 H new ATOM 0 HB2 SER A 108 -7.316 -4.417 -8.071 1.00 70.33 H new ATOM 0 HB3 SER A 108 -7.692 -5.777 -7.032 1.00 70.33 H new ATOM 0 HG SER A 108 -5.581 -5.952 -7.977 1.00 45.43 H new ATOM 1239 N GLY A 109 -10.848 -6.667 -8.131 1.00 44.34 N ATOM 1240 CA GLY A 109 -11.726 -7.645 -7.516 1.00 2.01 C ATOM 1241 C GLY A 109 -11.856 -7.448 -6.019 1.00 14.02 C ATOM 1242 O GLY A 109 -12.876 -6.957 -5.536 1.00 52.13 O ATOM 0 H GLY A 109 -11.308 -5.809 -8.436 1.00 44.34 H new ATOM 0 HA2 GLY A 109 -12.713 -7.582 -7.975 1.00 2.01 H new ATOM 0 HA3 GLY A 109 -11.345 -8.647 -7.716 1.00 2.01 H new ATOM 1327 N ALA A 116 -10.320 -7.811 4.202 1.00 52.44 N ATOM 1328 CA ALA A 116 -10.093 -6.435 3.777 1.00 54.41 C ATOM 1329 C ALA A 116 -9.335 -5.649 4.841 1.00 21.23 C ATOM 1330 O ALA A 116 -8.438 -4.868 4.528 1.00 63.32 O ATOM 1331 CB ALA A 116 -11.418 -5.755 3.458 1.00 65.21 C ATOM 0 HA ALA A 116 -9.482 -6.456 2.875 1.00 54.41 H new ATOM 0 HB1 ALA A 116 -11.233 -4.728 3.142 1.00 65.21 H new ATOM 0 HB2 ALA A 116 -11.921 -6.296 2.657 1.00 65.21 H new ATOM 0 HB3 ALA A 116 -12.049 -5.753 4.347 1.00 65.21 H new ATOM 1337 N SER A 117 -9.703 -5.861 6.101 1.00 73.33 N ATOM 1338 CA SER A 117 -9.061 -5.169 7.213 1.00 63.23 C ATOM 1339 C SER A 117 -7.567 -5.476 7.252 1.00 21.40 C ATOM 1340 O SER A 117 -6.786 -4.739 7.853 1.00 71.15 O ATOM 1341 CB SER A 117 -9.713 -5.571 8.536 1.00 24.41 C ATOM 1342 OG SER A 117 -9.624 -4.524 9.487 1.00 31.12 O ATOM 0 H SER A 117 -10.443 -6.507 6.377 1.00 73.33 H new ATOM 0 HA SER A 117 -9.190 -4.097 7.066 1.00 63.23 H new ATOM 0 HB2 SER A 117 -10.759 -5.825 8.367 1.00 24.41 H new ATOM 0 HB3 SER A 117 -9.227 -6.465 8.928 1.00 24.41 H new ATOM 0 HG SER A 117 -10.049 -4.805 10.324 1.00 31.12 H new ATOM 1348 N SER A 118 -7.178 -6.573 6.609 1.00 5.42 N ATOM 1349 CA SER A 118 -5.777 -6.981 6.574 1.00 20.53 C ATOM 1350 C SER A 118 -4.917 -5.915 5.906 1.00 64.12 C ATOM 1351 O SER A 118 -3.795 -5.646 6.336 1.00 70.41 O ATOM 1352 CB SER A 118 -5.632 -8.311 5.831 1.00 3.33 C ATOM 1353 OG SER A 118 -4.271 -8.698 5.742 1.00 70.25 O ATOM 0 H SER A 118 -7.812 -7.194 6.106 1.00 5.42 H new ATOM 0 HA SER A 118 -5.434 -7.107 7.601 1.00 20.53 H new ATOM 0 HB2 SER A 118 -6.200 -9.084 6.348 1.00 3.33 H new ATOM 0 HB3 SER A 118 -6.054 -8.220 4.830 1.00 3.33 H new ATOM 0 HG SER A 118 -4.204 -9.551 5.265 1.00 70.25 H new ATOM 1359 N ALA A 119 -5.450 -5.309 4.849 1.00 53.20 N ATOM 1360 CA ALA A 119 -4.732 -4.270 4.121 1.00 31.13 C ATOM 1361 C ALA A 119 -4.756 -2.951 4.883 1.00 43.35 C ATOM 1362 O ALA A 119 -3.752 -2.241 4.946 1.00 64.02 O ATOM 1363 CB ALA A 119 -5.328 -4.092 2.733 1.00 74.21 C ATOM 0 H ALA A 119 -6.376 -5.520 4.478 1.00 53.20 H new ATOM 0 HA ALA A 119 -3.692 -4.582 4.021 1.00 31.13 H new ATOM 0 HB1 ALA A 119 -4.783 -3.313 2.200 1.00 74.21 H new ATOM 0 HB2 ALA A 119 -5.253 -5.029 2.182 1.00 74.21 H new ATOM 0 HB3 ALA A 119 -6.376 -3.806 2.821 1.00 74.21 H new ATOM 1369 N ALA A 120 -5.908 -2.625 5.460 1.00 73.03 N ATOM 1370 CA ALA A 120 -6.060 -1.390 6.219 1.00 34.30 C ATOM 1371 C ALA A 120 -5.202 -1.410 7.478 1.00 41.13 C ATOM 1372 O ALA A 120 -4.615 -0.396 7.857 1.00 3.20 O ATOM 1373 CB ALA A 120 -7.523 -1.170 6.579 1.00 51.13 C ATOM 0 H ALA A 120 -6.750 -3.199 5.416 1.00 73.03 H new ATOM 0 HA ALA A 120 -5.721 -0.564 5.594 1.00 34.30 H new ATOM 0 HB1 ALA A 120 -7.623 -0.244 7.146 1.00 51.13 H new ATOM 0 HB2 ALA A 120 -8.116 -1.103 5.667 1.00 51.13 H new ATOM 0 HB3 ALA A 120 -7.879 -2.005 7.182 1.00 51.13 H new ATOM 1379 N SER A 121 -5.131 -2.570 8.124 1.00 34.13 N ATOM 1380 CA SER A 121 -4.347 -2.720 9.343 1.00 43.34 C ATOM 1381 C SER A 121 -2.870 -2.448 9.075 1.00 22.43 C ATOM 1382 O SER A 121 -2.172 -1.868 9.909 1.00 75.53 O ATOM 1383 CB SER A 121 -4.523 -4.126 9.919 1.00 14.55 C ATOM 1384 OG SER A 121 -3.403 -4.501 10.702 1.00 75.43 O ATOM 0 H SER A 121 -5.608 -3.420 7.822 1.00 34.13 H new ATOM 0 HA SER A 121 -4.707 -1.991 10.069 1.00 43.34 H new ATOM 0 HB2 SER A 121 -5.425 -4.162 10.529 1.00 14.55 H new ATOM 0 HB3 SER A 121 -4.659 -4.841 9.107 1.00 14.55 H new ATOM 0 HG SER A 121 -3.541 -5.403 11.060 1.00 75.43 H new ATOM 1390 N SER A 122 -2.399 -2.873 7.907 1.00 41.22 N ATOM 1391 CA SER A 122 -1.004 -2.679 7.530 1.00 22.35 C ATOM 1392 C SER A 122 -0.723 -1.214 7.218 1.00 61.23 C ATOM 1393 O SER A 122 0.175 -0.605 7.798 1.00 31.40 O ATOM 1394 CB SER A 122 -0.656 -3.546 6.318 1.00 21.14 C ATOM 1395 OG SER A 122 -1.107 -4.879 6.498 1.00 23.24 O ATOM 0 H SER A 122 -2.963 -3.354 7.206 1.00 41.22 H new ATOM 0 HA SER A 122 -0.381 -2.978 8.373 1.00 22.35 H new ATOM 0 HB2 SER A 122 -1.110 -3.123 5.422 1.00 21.14 H new ATOM 0 HB3 SER A 122 0.423 -3.542 6.161 1.00 21.14 H new ATOM 0 HG SER A 122 -2.078 -4.916 6.367 1.00 23.24 H new ATOM 1401 N ALA A 123 -1.499 -0.652 6.295 1.00 20.05 N ATOM 1402 CA ALA A 123 -1.337 0.743 5.907 1.00 63.11 C ATOM 1403 C ALA A 123 -1.527 1.671 7.101 1.00 73.12 C ATOM 1404 O ALA A 123 -0.793 2.645 7.266 1.00 54.32 O ATOM 1405 CB ALA A 123 -2.315 1.099 4.797 1.00 62.44 C ATOM 0 H ALA A 123 -2.246 -1.143 5.803 1.00 20.05 H new ATOM 0 HA ALA A 123 -0.321 0.876 5.537 1.00 63.11 H new ATOM 0 HB1 ALA A 123 -2.183 2.144 4.517 1.00 62.44 H new ATOM 0 HB2 ALA A 123 -2.128 0.465 3.930 1.00 62.44 H new ATOM 0 HB3 ALA A 123 -3.335 0.943 5.147 1.00 62.44 H new ATOM 1411 N ALA A 124 -2.519 1.364 7.931 1.00 3.03 N ATOM 1412 CA ALA A 124 -2.805 2.172 9.111 1.00 21.44 C ATOM 1413 C ALA A 124 -1.723 1.998 10.172 1.00 72.44 C ATOM 1414 O ALA A 124 -1.453 2.911 10.951 1.00 74.31 O ATOM 1415 CB ALA A 124 -4.169 1.806 9.681 1.00 40.11 C ATOM 0 H ALA A 124 -3.138 0.562 7.808 1.00 3.03 H new ATOM 0 HA ALA A 124 -2.816 3.220 8.810 1.00 21.44 H new ATOM 0 HB1 ALA A 124 -4.371 2.416 10.561 1.00 40.11 H new ATOM 0 HB2 ALA A 124 -4.938 1.987 8.930 1.00 40.11 H new ATOM 0 HB3 ALA A 124 -4.176 0.752 9.960 1.00 40.11 H new ATOM 1421 N SER A 125 -1.108 0.820 10.195 1.00 62.14 N ATOM 1422 CA SER A 125 -0.058 0.526 11.162 1.00 23.20 C ATOM 1423 C SER A 125 1.195 1.347 10.872 1.00 22.54 C ATOM 1424 O SER A 125 1.897 1.773 11.789 1.00 32.03 O ATOM 1425 CB SER A 125 0.281 -0.967 11.141 1.00 42.31 C ATOM 1426 OG SER A 125 1.541 -1.212 11.741 1.00 22.24 O ATOM 0 H SER A 125 -1.319 0.054 9.555 1.00 62.14 H new ATOM 0 HA SER A 125 -0.426 0.795 12.152 1.00 23.20 H new ATOM 0 HB2 SER A 125 -0.492 -1.526 11.669 1.00 42.31 H new ATOM 0 HB3 SER A 125 0.288 -1.327 10.112 1.00 42.31 H new ATOM 0 HG SER A 125 1.734 -2.173 11.717 1.00 22.24 H new ATOM 1432 N SER A 126 1.467 1.565 9.590 1.00 41.33 N ATOM 1433 CA SER A 126 2.636 2.332 9.177 1.00 44.05 C ATOM 1434 C SER A 126 2.468 3.808 9.523 1.00 53.44 C ATOM 1435 O SER A 126 3.373 4.438 10.069 1.00 63.14 O ATOM 1436 CB SER A 126 2.874 2.171 7.674 1.00 73.02 C ATOM 1437 OG SER A 126 3.590 0.981 7.395 1.00 74.11 O ATOM 0 H SER A 126 0.894 1.221 8.819 1.00 41.33 H new ATOM 0 HA SER A 126 3.501 1.947 9.717 1.00 44.05 H new ATOM 0 HB2 SER A 126 1.918 2.155 7.151 1.00 73.02 H new ATOM 0 HB3 SER A 126 3.429 3.030 7.297 1.00 73.02 H new ATOM 0 HG SER A 126 3.727 0.901 6.428 1.00 74.11 H new ATOM 1443 N VAL A 127 1.301 4.355 9.198 1.00 14.11 N ATOM 1444 CA VAL A 127 1.010 5.758 9.474 1.00 61.44 C ATOM 1445 C VAL A 127 0.949 6.021 10.975 1.00 43.22 C ATOM 1446 O VAL A 127 1.484 7.017 11.463 1.00 32.22 O ATOM 1447 CB VAL A 127 -0.322 6.191 8.834 1.00 21.34 C ATOM 1448 CG1 VAL A 127 -1.457 5.294 9.302 1.00 73.02 C ATOM 1449 CG2 VAL A 127 -0.616 7.649 9.153 1.00 33.01 C ATOM 0 H VAL A 127 0.541 3.848 8.743 1.00 14.11 H new ATOM 0 HA VAL A 127 1.821 6.342 9.038 1.00 61.44 H new ATOM 0 HB VAL A 127 -0.235 6.090 7.752 1.00 21.34 H new ATOM 0 HG11 VAL A 127 -2.390 5.616 8.839 1.00 73.02 H new ATOM 0 HG12 VAL A 127 -1.247 4.263 9.017 1.00 73.02 H new ATOM 0 HG13 VAL A 127 -1.549 5.359 10.386 1.00 73.02 H new ATOM 0 HG21 VAL A 127 -1.561 7.939 8.693 1.00 33.01 H new ATOM 0 HG22 VAL A 127 -0.683 7.779 10.233 1.00 33.01 H new ATOM 0 HG23 VAL A 127 0.185 8.276 8.762 1.00 33.01 H new ATOM 1459 N THR A 128 0.295 5.122 11.702 1.00 65.00 N ATOM 1460 CA THR A 128 0.163 5.256 13.147 1.00 44.31 C ATOM 1461 C THR A 128 1.525 5.428 13.810 1.00 61.42 C ATOM 1462 O THR A 128 1.730 6.347 14.603 1.00 62.20 O ATOM 1463 CB THR A 128 -0.546 4.036 13.763 1.00 24.42 C ATOM 1464 OG1 THR A 128 -0.014 2.829 13.205 1.00 24.55 O ATOM 1465 CG2 THR A 128 -2.045 4.097 13.517 1.00 22.21 C ATOM 0 H THR A 128 -0.152 4.292 11.313 1.00 65.00 H new ATOM 0 HA THR A 128 -0.441 6.146 13.328 1.00 44.31 H new ATOM 0 HB THR A 128 -0.372 4.048 14.839 1.00 24.42 H new ATOM 0 HG1 THR A 128 -0.392 2.687 12.312 1.00 24.55 H new ATOM 0 HG21 THR A 128 -2.523 3.224 13.962 1.00 22.21 H new ATOM 0 HG22 THR A 128 -2.451 5.002 13.968 1.00 22.21 H new ATOM 0 HG23 THR A 128 -2.237 4.109 12.444 1.00 22.21 H new ATOM 1473 N THR A 129 2.456 4.538 13.480 1.00 33.42 N ATOM 1474 CA THR A 129 3.799 4.589 14.042 1.00 53.41 C ATOM 1475 C THR A 129 4.551 5.823 13.556 1.00 21.11 C ATOM 1476 O THR A 129 5.179 6.532 14.343 1.00 35.43 O ATOM 1477 CB THR A 129 4.609 3.332 13.680 1.00 62.30 C ATOM 1478 OG1 THR A 129 4.558 3.105 12.266 1.00 53.44 O ATOM 1479 CG2 THR A 129 4.073 2.111 14.412 1.00 43.14 C ATOM 0 H THR A 129 2.303 3.772 12.825 1.00 33.42 H new ATOM 0 HA THR A 129 3.686 4.638 15.125 1.00 53.41 H new ATOM 0 HB THR A 129 5.643 3.495 13.985 1.00 62.30 H new ATOM 0 HG1 THR A 129 3.726 2.640 12.039 1.00 53.44 H new ATOM 0 HG21 THR A 129 4.662 1.236 14.139 1.00 43.14 H new ATOM 0 HG22 THR A 129 4.140 2.273 15.488 1.00 43.14 H new ATOM 0 HG23 THR A 129 3.032 1.948 14.134 1.00 43.14 H new ATOM 1487 N THR A 130 4.483 6.076 12.252 1.00 2.53 N ATOM 1488 CA THR A 130 5.158 7.224 11.662 1.00 41.24 C ATOM 1489 C THR A 130 4.398 8.515 11.943 1.00 3.43 C ATOM 1490 O THR A 130 3.979 9.216 11.021 1.00 41.35 O ATOM 1491 CB THR A 130 5.317 7.059 10.137 1.00 1.31 C ATOM 1492 OG1 THR A 130 5.634 5.699 9.823 1.00 0.34 O ATOM 1493 CG2 THR A 130 6.410 7.976 9.606 1.00 21.52 C ATOM 0 H THR A 130 3.967 5.501 11.586 1.00 2.53 H new ATOM 0 HA THR A 130 6.145 7.279 12.121 1.00 41.24 H new ATOM 0 HB THR A 130 4.374 7.331 9.663 1.00 1.31 H new ATOM 0 HG1 THR A 130 4.826 5.150 9.895 1.00 0.34 H new ATOM 0 HG21 THR A 130 6.505 7.843 8.528 1.00 21.52 H new ATOM 0 HG22 THR A 130 6.152 9.013 9.822 1.00 21.52 H new ATOM 0 HG23 THR A 130 7.357 7.730 10.087 1.00 21.52 H new ATOM 1501 N LEU A 131 4.223 8.825 13.224 1.00 35.44 N ATOM 1502 CA LEU A 131 3.513 10.033 13.628 1.00 53.21 C ATOM 1503 C LEU A 131 3.629 10.254 15.134 1.00 54.14 C ATOM 1504 O LEU A 131 3.890 11.367 15.590 1.00 70.14 O ATOM 1505 CB LEU A 131 2.040 9.942 13.227 1.00 22.34 C ATOM 1506 CG LEU A 131 1.451 11.178 12.549 1.00 74.31 C ATOM 1507 CD1 LEU A 131 1.464 11.015 11.036 1.00 12.33 C ATOM 1508 CD2 LEU A 131 0.036 11.437 13.046 1.00 51.24 C ATOM 0 H LEU A 131 4.563 8.256 14.000 1.00 35.44 H new ATOM 0 HA LEU A 131 3.970 10.881 13.118 1.00 53.21 H new ATOM 0 HB2 LEU A 131 1.919 9.092 12.556 1.00 22.34 H new ATOM 0 HB3 LEU A 131 1.454 9.728 14.121 1.00 22.34 H new ATOM 0 HG LEU A 131 2.069 12.038 12.807 1.00 74.31 H new ATOM 0 HD11 LEU A 131 1.041 11.905 10.571 1.00 12.33 H new ATOM 0 HD12 LEU A 131 2.490 10.879 10.693 1.00 12.33 H new ATOM 0 HD13 LEU A 131 0.871 10.144 10.759 1.00 12.33 H new ATOM 0 HD21 LEU A 131 -0.367 12.321 12.552 1.00 51.24 H new ATOM 0 HD22 LEU A 131 -0.593 10.576 12.819 1.00 51.24 H new ATOM 0 HD23 LEU A 131 0.053 11.600 14.124 1.00 51.24 H new ATOM 1520 N THR A 132 3.433 9.186 15.900 1.00 41.54 N ATOM 1521 CA THR A 132 3.517 9.263 17.354 1.00 73.43 C ATOM 1522 C THR A 132 4.773 8.571 17.869 1.00 21.15 C ATOM 1523 O THR A 132 5.398 9.032 18.824 1.00 24.24 O ATOM 1524 CB THR A 132 2.284 8.627 18.021 1.00 0.30 C ATOM 1525 OG1 THR A 132 2.365 7.200 17.941 1.00 21.14 O ATOM 1526 CG2 THR A 132 1.001 9.105 17.356 1.00 2.12 C ATOM 0 H THR A 132 3.215 8.257 15.538 1.00 41.54 H new ATOM 0 HA THR A 132 3.556 10.321 17.613 1.00 73.43 H new ATOM 0 HB THR A 132 2.267 8.932 19.067 1.00 0.30 H new ATOM 0 HG1 THR A 132 1.578 6.803 18.369 1.00 21.14 H new ATOM 0 HG21 THR A 132 0.144 8.642 17.845 1.00 2.12 H new ATOM 0 HG22 THR A 132 0.927 10.189 17.444 1.00 2.12 H new ATOM 0 HG23 THR A 132 1.012 8.827 16.302 1.00 2.12 H new ATOM 1534 N SER A 133 5.138 7.464 17.231 1.00 71.24 N ATOM 1535 CA SER A 133 6.319 6.706 17.628 1.00 43.22 C ATOM 1536 C SER A 133 7.595 7.441 17.227 1.00 61.24 C ATOM 1537 O SER A 133 8.484 7.659 18.051 1.00 75.30 O ATOM 1538 CB SER A 133 6.297 5.316 16.992 1.00 33.31 C ATOM 1539 OG SER A 133 6.806 4.339 17.884 1.00 75.14 O ATOM 0 H SER A 133 4.633 7.072 16.437 1.00 71.24 H new ATOM 0 HA SER A 133 6.305 6.601 18.713 1.00 43.22 H new ATOM 0 HB2 SER A 133 5.276 5.058 16.709 1.00 33.31 H new ATOM 0 HB3 SER A 133 6.890 5.322 16.077 1.00 33.31 H new ATOM 0 HG SER A 133 6.780 3.459 17.454 1.00 75.14 H new ATOM 1545 N TYR A 134 7.678 7.820 15.957 1.00 31.33 N ATOM 1546 CA TYR A 134 8.845 8.528 15.445 1.00 72.24 C ATOM 1547 C TYR A 134 8.552 10.017 15.282 1.00 24.43 C ATOM 1548 O TYR A 134 9.463 10.843 15.270 1.00 22.42 O ATOM 1549 CB TYR A 134 9.282 7.933 14.105 1.00 73.20 C ATOM 1550 CG TYR A 134 10.747 7.566 14.054 1.00 62.43 C ATOM 1551 CD1 TYR A 134 11.314 6.754 15.027 1.00 24.41 C ATOM 1552 CD2 TYR A 134 11.564 8.031 13.032 1.00 21.22 C ATOM 1553 CE1 TYR A 134 12.653 6.416 14.985 1.00 25.12 C ATOM 1554 CE2 TYR A 134 12.905 7.698 12.980 1.00 32.02 C ATOM 1555 CZ TYR A 134 13.444 6.891 13.959 1.00 51.53 C ATOM 1556 OH TYR A 134 14.779 6.555 13.913 1.00 52.22 O ATOM 0 H TYR A 134 6.951 7.649 15.263 1.00 31.33 H new ATOM 0 HA TYR A 134 9.653 8.412 16.167 1.00 72.24 H new ATOM 0 HB2 TYR A 134 8.686 7.044 13.901 1.00 73.20 H new ATOM 0 HB3 TYR A 134 9.068 8.649 13.312 1.00 73.20 H new ATOM 0 HD1 TYR A 134 10.697 6.380 15.831 1.00 24.41 H new ATOM 0 HD2 TYR A 134 11.145 8.664 12.264 1.00 21.22 H new ATOM 0 HE1 TYR A 134 13.078 5.784 15.751 1.00 25.12 H new ATOM 0 HE2 TYR A 134 13.526 8.068 12.178 1.00 32.02 H new ATOM 0 HH TYR A 134 15.194 6.969 13.128 1.00 52.22 H new ATOM 1566 N GLY A 135 7.270 10.350 15.158 1.00 65.53 N ATOM 1567 CA GLY A 135 6.878 11.738 14.997 1.00 71.10 C ATOM 1568 C GLY A 135 6.116 11.979 13.709 1.00 12.44 C ATOM 1569 O GLY A 135 6.201 11.204 12.758 1.00 22.32 O ATOM 0 H GLY A 135 6.497 9.684 15.166 1.00 65.53 H new ATOM 0 HA2 GLY A 135 6.260 12.038 15.843 1.00 71.10 H new ATOM 0 HA3 GLY A 135 7.767 12.368 15.013 1.00 71.10 H new ATOM 1573 N PRO A 136 5.347 13.078 13.670 1.00 4.51 N ATOM 1574 CA PRO A 136 4.549 13.444 12.497 1.00 2.40 C ATOM 1575 C PRO A 136 5.416 13.890 11.323 1.00 61.24 C ATOM 1576 O PRO A 136 5.245 13.419 10.200 1.00 74.31 O ATOM 1577 CB PRO A 136 3.692 14.608 12.999 1.00 50.03 C ATOM 1578 CG PRO A 136 4.472 15.196 14.124 1.00 2.55 C ATOM 1579 CD PRO A 136 5.198 14.047 14.769 1.00 12.13 C ATOM 0 HA PRO A 136 3.969 12.601 12.120 1.00 2.40 H new ATOM 0 HB2 PRO A 136 3.520 15.341 12.211 1.00 50.03 H new ATOM 0 HB3 PRO A 136 2.713 14.264 13.333 1.00 50.03 H new ATOM 0 HG2 PRO A 136 5.174 15.947 13.762 1.00 2.55 H new ATOM 0 HG3 PRO A 136 3.814 15.692 14.838 1.00 2.55 H new ATOM 0 HD2 PRO A 136 6.165 14.355 15.167 1.00 12.13 H new ATOM 0 HD3 PRO A 136 4.630 13.628 15.600 1.00 12.13 H new ATOM 1587 N ALA A 137 6.347 14.799 11.593 1.00 53.25 N ATOM 1588 CA ALA A 137 7.242 15.306 10.560 1.00 14.45 C ATOM 1589 C ALA A 137 8.016 14.170 9.900 1.00 3.14 C ATOM 1590 O ALA A 137 8.525 14.316 8.788 1.00 43.13 O ATOM 1591 CB ALA A 137 8.201 16.330 11.147 1.00 13.32 C ATOM 0 H ALA A 137 6.501 15.199 12.518 1.00 53.25 H new ATOM 0 HA ALA A 137 6.636 15.791 9.795 1.00 14.45 H new ATOM 0 HB1 ALA A 137 8.863 16.699 10.364 1.00 13.32 H new ATOM 0 HB2 ALA A 137 7.634 17.162 11.565 1.00 13.32 H new ATOM 0 HB3 ALA A 137 8.794 15.864 11.933 1.00 13.32 H new ATOM 1597 N VAL A 138 8.105 13.039 10.592 1.00 14.51 N ATOM 1598 CA VAL A 138 8.817 11.878 10.074 1.00 64.44 C ATOM 1599 C VAL A 138 8.239 11.431 8.736 1.00 34.31 C ATOM 1600 O VAL A 138 8.917 10.780 7.941 1.00 74.12 O ATOM 1601 CB VAL A 138 8.766 10.700 11.063 1.00 51.21 C ATOM 1602 CG1 VAL A 138 9.447 9.475 10.471 1.00 51.11 C ATOM 1603 CG2 VAL A 138 9.407 11.087 12.387 1.00 44.41 C ATOM 0 H VAL A 138 7.692 12.902 11.515 1.00 14.51 H new ATOM 0 HA VAL A 138 9.855 12.180 9.935 1.00 64.44 H new ATOM 0 HB VAL A 138 7.721 10.451 11.250 1.00 51.21 H new ATOM 0 HG11 VAL A 138 9.401 8.653 11.185 1.00 51.11 H new ATOM 0 HG12 VAL A 138 8.940 9.186 9.551 1.00 51.11 H new ATOM 0 HG13 VAL A 138 10.489 9.708 10.253 1.00 51.11 H new ATOM 0 HG21 VAL A 138 9.362 10.242 13.074 1.00 44.41 H new ATOM 0 HG22 VAL A 138 10.448 11.364 12.220 1.00 44.41 H new ATOM 0 HG23 VAL A 138 8.871 11.933 12.817 1.00 44.41 H new ATOM 1613 N PHE A 139 6.981 11.783 8.494 1.00 41.20 N ATOM 1614 CA PHE A 139 6.310 11.417 7.252 1.00 31.04 C ATOM 1615 C PHE A 139 6.847 12.235 6.082 1.00 32.04 C ATOM 1616 O PHE A 139 6.913 11.751 4.952 1.00 41.14 O ATOM 1617 CB PHE A 139 4.799 11.627 7.384 1.00 31.55 C ATOM 1618 CG PHE A 139 4.003 10.364 7.218 1.00 3.32 C ATOM 1619 CD1 PHE A 139 4.013 9.673 6.018 1.00 73.03 C ATOM 1620 CD2 PHE A 139 3.244 9.866 8.266 1.00 34.00 C ATOM 1621 CE1 PHE A 139 3.280 8.512 5.863 1.00 64.53 C ATOM 1622 CE2 PHE A 139 2.510 8.704 8.118 1.00 53.30 C ATOM 1623 CZ PHE A 139 2.529 8.026 6.915 1.00 15.02 C ATOM 0 H PHE A 139 6.405 12.321 9.141 1.00 41.20 H new ATOM 0 HA PHE A 139 6.509 10.363 7.057 1.00 31.04 H new ATOM 0 HB2 PHE A 139 4.584 12.057 8.362 1.00 31.55 H new ATOM 0 HB3 PHE A 139 4.474 12.353 6.638 1.00 31.55 H new ATOM 0 HD1 PHE A 139 4.601 10.046 5.193 1.00 73.03 H new ATOM 0 HD2 PHE A 139 3.226 10.392 9.209 1.00 34.00 H new ATOM 0 HE1 PHE A 139 3.294 7.985 4.920 1.00 64.53 H new ATOM 0 HE2 PHE A 139 1.922 8.327 8.942 1.00 53.30 H new ATOM 0 HZ PHE A 139 1.957 7.117 6.797 1.00 15.02 H new ATOM 1633 N TYR A 140 7.230 13.476 6.361 1.00 2.34 N ATOM 1634 CA TYR A 140 7.759 14.362 5.332 1.00 75.31 C ATOM 1635 C TYR A 140 8.952 13.726 4.625 1.00 34.43 C ATOM 1636 O TYR A 140 9.241 14.036 3.471 1.00 61.05 O ATOM 1637 CB TYR A 140 8.170 15.702 5.946 1.00 62.24 C ATOM 1638 CG TYR A 140 7.005 16.517 6.458 1.00 13.33 C ATOM 1639 CD1 TYR A 140 5.824 16.610 5.732 1.00 74.24 C ATOM 1640 CD2 TYR A 140 7.084 17.195 7.668 1.00 25.35 C ATOM 1641 CE1 TYR A 140 4.756 17.353 6.196 1.00 43.24 C ATOM 1642 CE2 TYR A 140 6.021 17.940 8.142 1.00 64.22 C ATOM 1643 CZ TYR A 140 4.859 18.016 7.401 1.00 4.42 C ATOM 1644 OH TYR A 140 3.799 18.758 7.868 1.00 34.41 O ATOM 0 H TYR A 140 7.184 13.891 7.292 1.00 2.34 H new ATOM 0 HA TYR A 140 6.973 14.532 4.596 1.00 75.31 H new ATOM 0 HB2 TYR A 140 8.863 15.518 6.767 1.00 62.24 H new ATOM 0 HB3 TYR A 140 8.709 16.284 5.199 1.00 62.24 H new ATOM 0 HD1 TYR A 140 5.740 16.092 4.788 1.00 74.24 H new ATOM 0 HD2 TYR A 140 7.993 17.139 8.249 1.00 25.35 H new ATOM 0 HE1 TYR A 140 3.845 17.414 5.618 1.00 43.24 H new ATOM 0 HE2 TYR A 140 6.099 18.459 9.086 1.00 64.22 H new ATOM 0 HH TYR A 140 4.035 19.159 8.730 1.00 34.41 H new ATOM 1654 N ALA A 141 9.640 12.833 5.329 1.00 50.41 N ATOM 1655 CA ALA A 141 10.800 12.149 4.769 1.00 2.52 C ATOM 1656 C ALA A 141 11.920 13.136 4.457 1.00 20.01 C ATOM 1657 O ALA A 141 12.200 13.448 3.300 1.00 15.12 O ATOM 1658 CB ALA A 141 10.406 11.381 3.518 1.00 53.02 C ATOM 0 H ALA A 141 9.415 12.566 6.287 1.00 50.41 H new ATOM 0 HA ALA A 141 11.170 11.443 5.513 1.00 2.52 H new ATOM 0 HB1 ALA A 141 11.281 10.875 3.111 1.00 53.02 H new ATOM 0 HB2 ALA A 141 9.645 10.643 3.769 1.00 53.02 H new ATOM 0 HB3 ALA A 141 10.009 12.074 2.776 1.00 53.02 H new