USER MOD reduce.3.24.130724 H: found=0, std=0, add=1027, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1027 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 89 THR OG1 : rot 180:sc= -0.646 USER MOD Set 1.2: A 124 ASN : amide:sc=-0.00416 K(o=-4.1,f=-5.7!) USER MOD Set 1.3: A 126 ASN : amide:sc= -3.41! K(o=-4.1!,f=-1.4) USER MOD Set 2.1: A 119 SER OG : rot 180:sc= 0.401 USER MOD Set 2.2: A 132 SER OG : rot -88:sc= 0.422 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -179:sc= 0 (180deg=-0.00235) USER MOD Single : A 2 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 6 ASN : amide:sc= -0.953 K(o=-0.95,f=-0.021) USER MOD Single : A 7 LYS NZ :NH3+ -138:sc= 0.0437 (180deg=-0.0642) USER MOD Single : A 9 ASN : amide:sc= 0 X(o=0,f=-0.39) USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 12 ASN : amide:sc= 0 K(o=0,f=-0.51) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 18 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 170:sc= 0 USER MOD Single : A 28 ASN : amide:sc= -0.693 K(o=-0.69,f=0) USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.0151 X(o=-0.015,f=0.0084) USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 MET CE :methyl 163:sc= -0.0815 (180deg=-0.477) USER MOD Single : A 52 MET CE :methyl 163:sc= -0.0247 (180deg=-0.308) USER MOD Single : A 54 TYR OH : rot 101:sc= 0.632 USER MOD Single : A 56 HIS : no HE2:sc= 0.0011 X(o=0.0011,f=-0.15) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 58 SER OG : rot 41:sc= 0.0205 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot -140:sc= 0 USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 78 SER OG : rot 43:sc= 0.151 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 SER OG : rot 163:sc= 0.0939 USER MOD Single : A 87 ASN : amide:sc=-0.00746 X(o=-0.0075,f=0) USER MOD Single : A 90 SER OG : rot 180:sc= 0 USER MOD Single : A 94 MET CE :methyl 156:sc= -0.189 (180deg=-0.833) USER MOD Single : A 99 ASN : amide:sc= -0.553 X(o=-0.55,f=-0.78) USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 35:sc= -2.05! USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 72:sc= 0.0601 USER MOD Single : A 108 HIS : no HD1:sc= 0 X(o=0,f=-0.0026) USER MOD Single : A 109 THR OG1 : rot 180:sc= 0 USER MOD Single : A 112 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 TYR OH : rot -145:sc= 0.198 USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 128 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= -0.154 USER MOD Single : A 134 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 HIS : no HD1:sc= 0 X(o=0,f=-0.013) USER MOD Single : A 141 HIS : no HD1:sc= -0.112 X(o=-0.11,f=-0.011) USER MOD Single : A 142 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 143 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 144 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 145 HIS : no HD1:sc= -0.0112 X(o=-0.011,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -34.664 99.529 61.734 1.00 41.35 N ATOM 2 CA MET A 1 -34.593 98.862 60.416 1.00 24.31 C ATOM 3 C MET A 1 -34.732 97.358 60.584 1.00 33.21 C ATOM 4 O MET A 1 -34.019 96.742 61.383 1.00 43.15 O ATOM 5 CB MET A 1 -33.271 99.184 59.707 1.00 71.44 C ATOM 6 CG MET A 1 -33.144 100.627 59.247 1.00 61.23 C ATOM 7 SD MET A 1 -34.431 101.099 58.072 1.00 32.35 S ATOM 8 CE MET A 1 -33.904 102.751 57.627 1.00 10.11 C ATOM 0 H1 MET A 1 -34.585 100.558 61.607 1.00 41.35 H new ATOM 0 H2 MET A 1 -35.572 99.305 62.188 1.00 41.35 H new ATOM 0 H3 MET A 1 -33.884 99.194 62.335 1.00 41.35 H new ATOM 0 HA MET A 1 -35.413 99.235 59.803 1.00 24.31 H new ATOM 0 HB2 MET A 1 -32.446 98.956 60.381 1.00 71.44 H new ATOM 0 HB3 MET A 1 -33.167 98.529 58.842 1.00 71.44 H new ATOM 0 HG2 MET A 1 -33.190 101.286 60.114 1.00 61.23 H new ATOM 0 HG3 MET A 1 -32.167 100.773 58.787 1.00 61.23 H new ATOM 0 HE1 MET A 1 -34.603 103.174 56.905 1.00 10.11 H new ATOM 0 HE2 MET A 1 -33.880 103.378 58.519 1.00 10.11 H new ATOM 0 HE3 MET A 1 -32.908 102.709 57.186 1.00 10.11 H new ATOM 20 N ASN A 2 -35.665 96.769 59.842 1.00 35.14 N ATOM 21 CA ASN A 2 -35.900 95.332 59.908 1.00 30.44 C ATOM 22 C ASN A 2 -36.131 94.766 58.516 1.00 32.21 C ATOM 23 O ASN A 2 -36.770 95.397 57.669 1.00 61.14 O ATOM 24 CB ASN A 2 -37.076 94.985 60.854 1.00 65.52 C ATOM 25 CG ASN A 2 -38.427 95.551 60.431 1.00 13.41 C ATOM 26 OD1 ASN A 2 -39.182 94.909 59.705 1.00 42.34 O ATOM 27 ND2 ASN A 2 -38.753 96.744 60.907 1.00 75.54 N ATOM 0 H ASN A 2 -36.270 97.266 59.188 1.00 35.14 H new ATOM 0 HA ASN A 2 -35.006 94.868 60.325 1.00 30.44 H new ATOM 0 HB2 ASN A 2 -37.159 93.900 60.925 1.00 65.52 H new ATOM 0 HB3 ASN A 2 -36.841 95.353 61.853 1.00 65.52 H new ATOM 0 HD21 ASN A 2 -39.656 97.157 60.673 1.00 75.54 H new ATOM 0 HD22 ASN A 2 -38.101 97.249 61.507 1.00 75.54 H new ATOM 34 N ALA A 3 -35.594 93.582 58.285 1.00 12.02 N ATOM 35 CA ALA A 3 -35.728 92.923 57.004 1.00 1.32 C ATOM 36 C ALA A 3 -36.679 91.744 57.126 1.00 11.44 C ATOM 37 O ALA A 3 -36.483 90.864 57.971 1.00 62.14 O ATOM 38 CB ALA A 3 -34.368 92.464 56.501 1.00 52.03 C ATOM 0 H ALA A 3 -35.058 93.056 58.975 1.00 12.02 H new ATOM 0 HA ALA A 3 -36.138 93.630 56.283 1.00 1.32 H new ATOM 0 HB1 ALA A 3 -34.485 91.970 55.536 1.00 52.03 H new ATOM 0 HB2 ALA A 3 -33.711 93.327 56.390 1.00 52.03 H new ATOM 0 HB3 ALA A 3 -33.932 91.766 57.216 1.00 52.03 H new ATOM 44 N ARG A 4 -37.724 91.748 56.309 1.00 34.20 N ATOM 45 CA ARG A 4 -38.678 90.651 56.282 1.00 51.34 C ATOM 46 C ARG A 4 -38.159 89.540 55.384 1.00 5.44 C ATOM 47 O ARG A 4 -38.254 89.618 54.153 1.00 63.35 O ATOM 48 CB ARG A 4 -40.055 91.126 55.809 1.00 43.24 C ATOM 49 CG ARG A 4 -40.669 92.203 56.686 1.00 12.00 C ATOM 50 CD ARG A 4 -42.084 92.528 56.251 1.00 30.22 C ATOM 51 NE ARG A 4 -42.622 93.664 56.999 1.00 0.42 N ATOM 52 CZ ARG A 4 -43.869 93.749 57.466 1.00 23.25 C ATOM 53 NH1 ARG A 4 -44.742 92.760 57.279 1.00 71.32 N ATOM 54 NH2 ARG A 4 -44.234 94.834 58.132 1.00 5.53 N ATOM 0 H ARG A 4 -37.932 92.502 55.655 1.00 34.20 H new ATOM 0 HA ARG A 4 -38.791 90.267 57.296 1.00 51.34 H new ATOM 0 HB2 ARG A 4 -39.967 91.506 54.791 1.00 43.24 H new ATOM 0 HB3 ARG A 4 -40.731 90.271 55.773 1.00 43.24 H new ATOM 0 HG2 ARG A 4 -40.673 91.871 57.724 1.00 12.00 H new ATOM 0 HG3 ARG A 4 -40.057 93.104 56.642 1.00 12.00 H new ATOM 0 HD2 ARG A 4 -42.096 92.753 55.185 1.00 30.22 H new ATOM 0 HD3 ARG A 4 -42.722 91.657 56.400 1.00 30.22 H new ATOM 0 HE ARG A 4 -41.997 94.450 57.177 1.00 0.42 H new ATOM 0 HH11 ARG A 4 -44.461 91.921 56.772 1.00 71.32 H new ATOM 0 HH12 ARG A 4 -45.691 92.842 57.643 1.00 71.32 H new ATOM 0 HH21 ARG A 4 -43.565 95.590 58.282 1.00 5.53 H new ATOM 0 HH22 ARG A 4 -45.184 94.914 58.495 1.00 5.53 H new ATOM 68 N ASP A 5 -37.547 88.541 56.007 1.00 63.31 N ATOM 69 CA ASP A 5 -37.026 87.401 55.276 1.00 71.34 C ATOM 70 C ASP A 5 -38.147 86.407 55.008 1.00 31.45 C ATOM 71 O ASP A 5 -38.534 85.619 55.875 1.00 72.34 O ATOM 72 CB ASP A 5 -35.869 86.739 56.036 1.00 14.23 C ATOM 73 CG ASP A 5 -35.154 85.691 55.203 1.00 54.00 C ATOM 74 OD1 ASP A 5 -34.501 86.067 54.207 1.00 20.10 O ATOM 75 OD2 ASP A 5 -35.261 84.487 55.521 1.00 63.12 O ATOM 0 H ASP A 5 -37.401 88.500 57.016 1.00 63.31 H new ATOM 0 HA ASP A 5 -36.630 87.748 54.322 1.00 71.34 H new ATOM 0 HB2 ASP A 5 -35.155 87.503 56.344 1.00 14.23 H new ATOM 0 HB3 ASP A 5 -36.253 86.277 56.945 1.00 14.23 H new ATOM 80 N ASN A 6 -38.704 86.502 53.813 1.00 52.12 N ATOM 81 CA ASN A 6 -39.807 85.658 53.414 1.00 41.12 C ATOM 82 C ASN A 6 -39.288 84.554 52.506 1.00 52.10 C ATOM 83 O ASN A 6 -39.075 84.763 51.309 1.00 21.32 O ATOM 84 CB ASN A 6 -40.880 86.493 52.701 1.00 22.25 C ATOM 85 CG ASN A 6 -42.166 85.733 52.443 1.00 61.12 C ATOM 86 OD1 ASN A 6 -42.809 85.925 51.412 1.00 61.23 O ATOM 87 ND2 ASN A 6 -42.577 84.899 53.387 1.00 14.11 N ATOM 0 H ASN A 6 -38.403 87.164 53.098 1.00 52.12 H new ATOM 0 HA ASN A 6 -40.262 85.207 54.296 1.00 41.12 H new ATOM 0 HB2 ASN A 6 -41.103 87.374 53.303 1.00 22.25 H new ATOM 0 HB3 ASN A 6 -40.481 86.848 51.751 1.00 22.25 H new ATOM 0 HD21 ASN A 6 -43.454 84.390 53.272 1.00 14.11 H new ATOM 0 HD22 ASN A 6 -42.017 84.765 54.229 1.00 14.11 H new ATOM 94 N LYS A 7 -39.047 83.390 53.086 1.00 1.34 N ATOM 95 CA LYS A 7 -38.503 82.274 52.337 1.00 40.31 C ATOM 96 C LYS A 7 -39.617 81.337 51.881 1.00 40.11 C ATOM 97 O LYS A 7 -40.738 81.383 52.396 1.00 31.20 O ATOM 98 CB LYS A 7 -37.453 81.517 53.162 1.00 33.23 C ATOM 99 CG LYS A 7 -37.991 80.796 54.398 1.00 24.14 C ATOM 100 CD LYS A 7 -36.890 80.029 55.126 1.00 74.20 C ATOM 101 CE LYS A 7 -36.254 78.951 54.245 1.00 72.14 C ATOM 102 NZ LYS A 7 -37.230 77.906 53.830 1.00 43.25 N ATOM 0 H LYS A 7 -39.220 83.195 54.072 1.00 1.34 H new ATOM 0 HA LYS A 7 -38.008 82.671 51.450 1.00 40.31 H new ATOM 0 HB2 LYS A 7 -36.967 80.785 52.517 1.00 33.23 H new ATOM 0 HB3 LYS A 7 -36.685 82.223 53.479 1.00 33.23 H new ATOM 0 HG2 LYS A 7 -38.439 81.522 55.077 1.00 24.14 H new ATOM 0 HG3 LYS A 7 -38.781 80.106 54.102 1.00 24.14 H new ATOM 0 HD2 LYS A 7 -36.120 80.727 55.455 1.00 74.20 H new ATOM 0 HD3 LYS A 7 -37.304 79.566 56.022 1.00 74.20 H new ATOM 0 HE2 LYS A 7 -35.826 79.417 53.357 1.00 72.14 H new ATOM 0 HE3 LYS A 7 -35.432 78.482 54.786 1.00 72.14 H new ATOM 0 HZ1 LYS A 7 -36.785 76.969 53.898 1.00 43.25 H new ATOM 0 HZ2 LYS A 7 -38.062 77.941 54.453 1.00 43.25 H new ATOM 0 HZ3 LYS A 7 -37.526 78.078 52.848 1.00 43.25 H new ATOM 116 N PHE A 8 -39.305 80.504 50.903 1.00 50.54 N ATOM 117 CA PHE A 8 -40.264 79.558 50.362 1.00 13.02 C ATOM 118 C PHE A 8 -39.785 78.136 50.612 1.00 21.02 C ATOM 119 O PHE A 8 -38.592 77.902 50.843 1.00 52.14 O ATOM 120 CB PHE A 8 -40.477 79.811 48.861 1.00 12.13 C ATOM 121 CG PHE A 8 -41.019 81.186 48.559 1.00 74.44 C ATOM 122 CD1 PHE A 8 -42.313 81.527 48.919 1.00 74.42 C ATOM 123 CD2 PHE A 8 -40.229 82.141 47.939 1.00 1.32 C ATOM 124 CE1 PHE A 8 -42.808 82.790 48.666 1.00 54.33 C ATOM 125 CE2 PHE A 8 -40.720 83.406 47.686 1.00 51.51 C ATOM 126 CZ PHE A 8 -42.011 83.732 48.050 1.00 0.25 C ATOM 0 H PHE A 8 -38.385 80.465 50.464 1.00 50.54 H new ATOM 0 HA PHE A 8 -41.222 79.694 50.865 1.00 13.02 H new ATOM 0 HB2 PHE A 8 -39.529 79.679 48.339 1.00 12.13 H new ATOM 0 HB3 PHE A 8 -41.165 79.062 48.467 1.00 12.13 H new ATOM 0 HD1 PHE A 8 -42.942 80.795 49.404 1.00 74.42 H new ATOM 0 HD2 PHE A 8 -39.218 81.893 47.651 1.00 1.32 H new ATOM 0 HE1 PHE A 8 -43.819 83.041 48.950 1.00 54.33 H new ATOM 0 HE2 PHE A 8 -40.094 84.141 47.203 1.00 51.51 H new ATOM 0 HZ PHE A 8 -42.396 84.722 47.853 1.00 0.25 H new ATOM 136 N ASN A 9 -40.718 77.193 50.591 1.00 72.24 N ATOM 137 CA ASN A 9 -40.413 75.789 50.856 1.00 51.13 C ATOM 138 C ASN A 9 -40.677 74.956 49.611 1.00 54.53 C ATOM 139 O ASN A 9 -41.583 75.266 48.835 1.00 41.33 O ATOM 140 CB ASN A 9 -41.264 75.256 52.024 1.00 52.24 C ATOM 141 CG ASN A 9 -41.041 76.001 53.335 1.00 52.24 C ATOM 142 OD1 ASN A 9 -39.954 76.509 53.610 1.00 23.51 O ATOM 143 ND2 ASN A 9 -42.074 76.072 54.156 1.00 50.14 N ATOM 0 H ASN A 9 -41.702 77.376 50.391 1.00 72.24 H new ATOM 0 HA ASN A 9 -39.360 75.713 51.128 1.00 51.13 H new ATOM 0 HB2 ASN A 9 -42.318 75.322 51.754 1.00 52.24 H new ATOM 0 HB3 ASN A 9 -41.039 74.200 52.174 1.00 52.24 H new ATOM 0 HD21 ASN A 9 -41.984 76.559 55.048 1.00 50.14 H new ATOM 0 HD22 ASN A 9 -42.961 75.640 53.898 1.00 50.14 H new ATOM 150 N THR A 10 -39.890 73.902 49.421 1.00 11.24 N ATOM 151 CA THR A 10 -40.038 73.033 48.260 1.00 44.34 C ATOM 152 C THR A 10 -40.965 71.867 48.589 1.00 71.31 C ATOM 153 O THR A 10 -40.643 71.012 49.417 1.00 64.11 O ATOM 154 CB THR A 10 -38.676 72.488 47.768 1.00 21.21 C ATOM 155 OG1 THR A 10 -37.746 73.563 47.651 1.00 13.34 O ATOM 156 CG2 THR A 10 -38.808 71.806 46.408 1.00 63.13 C ATOM 0 H THR A 10 -39.142 73.629 50.058 1.00 11.24 H new ATOM 0 HA THR A 10 -40.470 73.633 47.459 1.00 44.34 H new ATOM 0 HB THR A 10 -38.326 71.755 48.495 1.00 21.21 H new ATOM 0 HG1 THR A 10 -36.883 73.217 47.341 1.00 13.34 H new ATOM 0 HG21 THR A 10 -37.833 71.434 46.091 1.00 63.13 H new ATOM 0 HG22 THR A 10 -39.507 70.973 46.485 1.00 63.13 H new ATOM 0 HG23 THR A 10 -39.178 72.523 45.676 1.00 63.13 H new ATOM 164 N TRP A 11 -42.125 71.862 47.956 1.00 11.12 N ATOM 165 CA TRP A 11 -43.077 70.782 48.116 1.00 4.54 C ATOM 166 C TRP A 11 -43.080 69.919 46.857 1.00 62.35 C ATOM 167 O TRP A 11 -43.808 70.196 45.903 1.00 24.41 O ATOM 168 CB TRP A 11 -44.483 71.339 48.398 1.00 40.15 C ATOM 169 CG TRP A 11 -44.533 72.285 49.562 1.00 64.10 C ATOM 170 CD1 TRP A 11 -44.781 73.624 49.511 1.00 53.31 C ATOM 171 CD2 TRP A 11 -44.301 71.972 50.939 1.00 71.41 C ATOM 172 NE1 TRP A 11 -44.737 74.160 50.772 1.00 0.32 N ATOM 173 CE2 TRP A 11 -44.443 73.168 51.666 1.00 43.41 C ATOM 174 CE3 TRP A 11 -43.995 70.799 51.626 1.00 2.21 C ATOM 175 CZ2 TRP A 11 -44.286 73.218 53.048 1.00 4.35 C ATOM 176 CZ3 TRP A 11 -43.840 70.852 52.993 1.00 50.22 C ATOM 177 CH2 TRP A 11 -43.984 72.051 53.692 1.00 74.13 C ATOM 0 H TRP A 11 -42.430 72.601 47.322 1.00 11.12 H new ATOM 0 HA TRP A 11 -42.784 70.168 48.968 1.00 4.54 H new ATOM 0 HB2 TRP A 11 -44.846 71.852 47.508 1.00 40.15 H new ATOM 0 HB3 TRP A 11 -45.163 70.508 48.587 1.00 40.15 H new ATOM 0 HD1 TRP A 11 -44.983 74.182 48.608 1.00 53.31 H new ATOM 0 HE1 TRP A 11 -44.898 75.140 51.005 1.00 0.32 H new ATOM 0 HE3 TRP A 11 -43.881 69.865 51.096 1.00 2.21 H new ATOM 0 HZ2 TRP A 11 -44.399 74.145 53.591 1.00 4.35 H new ATOM 0 HZ3 TRP A 11 -43.602 69.948 53.535 1.00 50.22 H new ATOM 0 HH2 TRP A 11 -43.854 72.057 54.764 1.00 74.13 H new ATOM 188 N ASN A 12 -42.226 68.902 46.840 1.00 21.22 N ATOM 189 CA ASN A 12 -42.109 68.026 45.680 1.00 1.24 C ATOM 190 C ASN A 12 -42.907 66.747 45.909 1.00 14.25 C ATOM 191 O ASN A 12 -42.756 66.085 46.939 1.00 52.12 O ATOM 192 CB ASN A 12 -40.632 67.703 45.396 1.00 1.22 C ATOM 193 CG ASN A 12 -40.419 66.907 44.113 1.00 63.43 C ATOM 194 OD1 ASN A 12 -41.165 67.046 43.142 1.00 20.23 O ATOM 195 ND2 ASN A 12 -39.404 66.054 44.100 1.00 34.14 N ATOM 0 H ASN A 12 -41.606 68.664 47.614 1.00 21.22 H new ATOM 0 HA ASN A 12 -42.517 68.539 44.809 1.00 1.24 H new ATOM 0 HB2 ASN A 12 -40.070 68.635 45.333 1.00 1.22 H new ATOM 0 HB3 ASN A 12 -40.224 67.140 46.235 1.00 1.22 H new ATOM 0 HD21 ASN A 12 -39.223 65.490 43.270 1.00 34.14 H new ATOM 0 HD22 ASN A 12 -38.805 65.962 44.920 1.00 34.14 H new ATOM 202 N ASP A 13 -43.768 66.423 44.956 1.00 20.05 N ATOM 203 CA ASP A 13 -44.583 65.221 45.035 1.00 32.11 C ATOM 204 C ASP A 13 -44.263 64.293 43.880 1.00 24.11 C ATOM 205 O ASP A 13 -43.663 64.708 42.887 1.00 33.44 O ATOM 206 CB ASP A 13 -46.074 65.562 45.037 1.00 3.33 C ATOM 207 CG ASP A 13 -46.499 66.286 46.296 1.00 35.22 C ATOM 208 OD1 ASP A 13 -46.786 65.613 47.305 1.00 42.52 O ATOM 209 OD2 ASP A 13 -46.530 67.532 46.288 1.00 24.22 O ATOM 0 H ASP A 13 -43.920 66.979 44.115 1.00 20.05 H new ATOM 0 HA ASP A 13 -44.349 64.718 45.973 1.00 32.11 H new ATOM 0 HB2 ASP A 13 -46.303 66.182 44.170 1.00 3.33 H new ATOM 0 HB3 ASP A 13 -46.654 64.645 44.936 1.00 3.33 H new ATOM 214 N SER A 14 -44.647 63.031 44.022 1.00 73.43 N ATOM 215 CA SER A 14 -44.386 62.028 42.999 1.00 32.31 C ATOM 216 C SER A 14 -45.646 61.753 42.179 1.00 23.12 C ATOM 217 O SER A 14 -46.767 61.957 42.657 1.00 53.13 O ATOM 218 CB SER A 14 -43.895 60.730 43.647 1.00 44.54 C ATOM 219 OG SER A 14 -42.736 60.962 44.430 1.00 2.21 O ATOM 0 H SER A 14 -45.143 62.677 44.840 1.00 73.43 H new ATOM 0 HA SER A 14 -43.613 62.411 42.333 1.00 32.31 H new ATOM 0 HB2 SER A 14 -44.683 60.310 44.272 1.00 44.54 H new ATOM 0 HB3 SER A 14 -43.675 59.994 42.874 1.00 44.54 H new ATOM 0 HG SER A 14 -42.441 60.120 44.835 1.00 2.21 H new ATOM 225 N ARG A 15 -45.447 61.312 40.938 1.00 11.41 N ATOM 226 CA ARG A 15 -46.539 60.890 40.060 1.00 24.24 C ATOM 227 C ARG A 15 -46.521 59.369 39.915 1.00 52.11 C ATOM 228 O ARG A 15 -45.667 58.696 40.502 1.00 12.53 O ATOM 229 CB ARG A 15 -46.423 61.547 38.670 1.00 12.43 C ATOM 230 CG ARG A 15 -46.520 63.073 38.645 1.00 61.01 C ATOM 231 CD ARG A 15 -47.917 63.593 38.989 1.00 42.54 C ATOM 232 NE ARG A 15 -48.194 63.557 40.430 1.00 34.50 N ATOM 233 CZ ARG A 15 -49.415 63.582 40.974 1.00 54.44 C ATOM 234 NH1 ARG A 15 -50.503 63.641 40.217 1.00 11.15 N ATOM 235 NH2 ARG A 15 -49.534 63.525 42.290 1.00 5.14 N ATOM 0 H ARG A 15 -44.523 61.237 40.512 1.00 11.41 H new ATOM 0 HA ARG A 15 -47.481 61.207 40.508 1.00 24.24 H new ATOM 0 HB2 ARG A 15 -45.470 61.255 38.229 1.00 12.43 H new ATOM 0 HB3 ARG A 15 -47.207 61.141 38.031 1.00 12.43 H new ATOM 0 HG2 ARG A 15 -45.801 63.488 39.351 1.00 61.01 H new ATOM 0 HG3 ARG A 15 -46.239 63.432 37.655 1.00 61.01 H new ATOM 0 HD2 ARG A 15 -48.018 64.617 38.629 1.00 42.54 H new ATOM 0 HD3 ARG A 15 -48.662 62.995 38.464 1.00 42.54 H new ATOM 0 HE ARG A 15 -47.396 63.509 41.063 1.00 34.50 H new ATOM 0 HH11 ARG A 15 -50.417 63.668 39.201 1.00 11.15 H new ATOM 0 HH12 ARG A 15 -51.426 63.659 40.651 1.00 11.15 H new ATOM 0 HH21 ARG A 15 -48.701 63.463 42.875 1.00 5.14 H new ATOM 0 HH22 ARG A 15 -50.459 63.543 42.720 1.00 5.14 H new ATOM 249 N GLY A 16 -47.462 58.834 39.142 1.00 50.22 N ATOM 250 CA GLY A 16 -47.495 57.404 38.909 1.00 34.34 C ATOM 251 C GLY A 16 -48.888 56.829 39.004 1.00 54.11 C ATOM 252 O GLY A 16 -49.281 56.315 40.052 1.00 23.00 O ATOM 0 H GLY A 16 -48.198 59.364 38.676 1.00 50.22 H new ATOM 0 HA2 GLY A 16 -47.086 57.192 37.921 1.00 34.34 H new ATOM 0 HA3 GLY A 16 -46.851 56.907 39.635 1.00 34.34 H new ATOM 256 N ASN A 17 -49.639 56.928 37.912 1.00 44.51 N ATOM 257 CA ASN A 17 -50.967 56.322 37.826 1.00 31.02 C ATOM 258 C ASN A 17 -50.841 54.850 37.468 1.00 13.34 C ATOM 259 O ASN A 17 -50.195 54.501 36.475 1.00 22.53 O ATOM 260 CB ASN A 17 -51.836 57.038 36.784 1.00 35.13 C ATOM 261 CG ASN A 17 -52.411 58.358 37.269 1.00 32.54 C ATOM 262 OD1 ASN A 17 -51.823 59.061 38.089 1.00 40.22 O ATOM 263 ND2 ASN A 17 -53.581 58.704 36.759 1.00 52.02 N ATOM 0 H ASN A 17 -49.350 57.424 37.069 1.00 44.51 H new ATOM 0 HA ASN A 17 -51.449 56.421 38.798 1.00 31.02 H new ATOM 0 HB2 ASN A 17 -51.240 57.219 35.890 1.00 35.13 H new ATOM 0 HB3 ASN A 17 -52.655 56.380 36.494 1.00 35.13 H new ATOM 0 HD21 ASN A 17 -54.023 59.578 37.044 1.00 52.02 H new ATOM 0 HD22 ASN A 17 -54.041 58.097 36.081 1.00 52.02 H new ATOM 270 N TYR A 18 -51.449 53.994 38.288 1.00 32.24 N ATOM 271 CA TYR A 18 -51.343 52.544 38.119 1.00 32.11 C ATOM 272 C TYR A 18 -52.355 52.028 37.095 1.00 24.21 C ATOM 273 O TYR A 18 -53.422 52.618 36.894 1.00 14.21 O ATOM 274 CB TYR A 18 -51.520 51.815 39.472 1.00 23.43 C ATOM 275 CG TYR A 18 -52.933 51.812 40.032 1.00 75.11 C ATOM 276 CD1 TYR A 18 -53.428 52.893 40.746 1.00 71.42 C ATOM 277 CD2 TYR A 18 -53.770 50.718 39.837 1.00 31.55 C ATOM 278 CE1 TYR A 18 -54.715 52.886 41.247 1.00 11.03 C ATOM 279 CE2 TYR A 18 -55.056 50.705 40.332 1.00 71.13 C ATOM 280 CZ TYR A 18 -55.523 51.790 41.036 1.00 4.11 C ATOM 281 OH TYR A 18 -56.805 51.780 41.528 1.00 32.32 O ATOM 0 H TYR A 18 -52.023 54.281 39.081 1.00 32.24 H new ATOM 0 HA TYR A 18 -50.343 52.329 37.741 1.00 32.11 H new ATOM 0 HB2 TYR A 18 -51.192 50.782 39.354 1.00 23.43 H new ATOM 0 HB3 TYR A 18 -50.858 52.278 40.204 1.00 23.43 H new ATOM 0 HD1 TYR A 18 -52.797 53.754 40.913 1.00 71.42 H new ATOM 0 HD2 TYR A 18 -53.405 49.863 39.287 1.00 31.55 H new ATOM 0 HE1 TYR A 18 -55.086 53.735 41.801 1.00 11.03 H new ATOM 0 HE2 TYR A 18 -55.693 49.848 40.168 1.00 71.13 H new ATOM 0 HH TYR A 18 -57.240 50.934 41.291 1.00 32.32 H new ATOM 291 N TRP A 19 -51.999 50.939 36.434 1.00 70.52 N ATOM 292 CA TRP A 19 -52.881 50.280 35.483 1.00 53.04 C ATOM 293 C TRP A 19 -52.998 48.809 35.866 1.00 44.44 C ATOM 294 O TRP A 19 -52.025 48.057 35.760 1.00 62.44 O ATOM 295 CB TRP A 19 -52.352 50.416 34.039 1.00 64.14 C ATOM 296 CG TRP A 19 -52.396 51.811 33.465 1.00 54.41 C ATOM 297 CD1 TRP A 19 -51.734 52.912 33.926 1.00 20.12 C ATOM 298 CD2 TRP A 19 -53.112 52.244 32.301 1.00 2.31 C ATOM 299 NE1 TRP A 19 -52.012 54.000 33.144 1.00 73.25 N ATOM 300 CE2 TRP A 19 -52.846 53.617 32.132 1.00 72.34 C ATOM 301 CE3 TRP A 19 -53.952 51.608 31.387 1.00 70.53 C ATOM 302 CZ2 TRP A 19 -53.389 54.360 31.090 1.00 55.13 C ATOM 303 CZ3 TRP A 19 -54.489 52.346 30.351 1.00 4.11 C ATOM 304 CH2 TRP A 19 -54.205 53.708 30.208 1.00 21.52 C ATOM 0 H TRP A 19 -51.091 50.487 36.541 1.00 70.52 H new ATOM 0 HA TRP A 19 -53.861 50.756 35.517 1.00 53.04 H new ATOM 0 HB2 TRP A 19 -51.321 50.062 34.012 1.00 64.14 H new ATOM 0 HB3 TRP A 19 -52.932 49.757 33.393 1.00 64.14 H new ATOM 0 HD1 TRP A 19 -51.082 52.923 34.787 1.00 20.12 H new ATOM 0 HE1 TRP A 19 -51.655 54.944 33.293 1.00 73.25 H new ATOM 0 HE3 TRP A 19 -54.178 50.557 31.488 1.00 70.53 H new ATOM 0 HZ2 TRP A 19 -53.174 55.413 30.981 1.00 55.13 H new ATOM 0 HZ3 TRP A 19 -55.140 51.863 29.638 1.00 4.11 H new ATOM 0 HH2 TRP A 19 -54.639 54.256 29.384 1.00 21.52 H new ATOM 315 N SER A 20 -54.168 48.418 36.364 1.00 33.53 N ATOM 316 CA SER A 20 -54.402 47.044 36.810 1.00 0.32 C ATOM 317 C SER A 20 -55.840 46.618 36.511 1.00 61.12 C ATOM 318 O SER A 20 -56.773 47.026 37.209 1.00 55.33 O ATOM 319 CB SER A 20 -54.121 46.900 38.320 1.00 34.21 C ATOM 320 OG SER A 20 -52.783 47.262 38.629 1.00 74.31 O ATOM 0 H SER A 20 -54.973 49.035 36.470 1.00 33.53 H new ATOM 0 HA SER A 20 -53.718 46.396 36.263 1.00 0.32 H new ATOM 0 HB2 SER A 20 -54.810 47.530 38.883 1.00 34.21 H new ATOM 0 HB3 SER A 20 -54.303 45.871 38.630 1.00 34.21 H new ATOM 0 HG SER A 20 -52.632 47.163 39.592 1.00 74.31 H new ATOM 326 N ASP A 21 -56.015 45.828 35.455 1.00 52.32 N ATOM 327 CA ASP A 21 -57.329 45.314 35.083 1.00 25.44 C ATOM 328 C ASP A 21 -57.189 43.978 34.367 1.00 13.31 C ATOM 329 O ASP A 21 -56.460 43.859 33.382 1.00 13.55 O ATOM 330 CB ASP A 21 -58.082 46.315 34.203 1.00 12.43 C ATOM 331 CG ASP A 21 -59.507 45.896 33.932 1.00 25.32 C ATOM 332 OD1 ASP A 21 -60.266 45.685 34.901 1.00 43.15 O ATOM 333 OD2 ASP A 21 -59.873 45.765 32.754 1.00 31.03 O ATOM 0 H ASP A 21 -55.259 45.529 34.839 1.00 52.32 H new ATOM 0 HA ASP A 21 -57.907 45.166 35.995 1.00 25.44 H new ATOM 0 HB2 ASP A 21 -58.081 47.291 34.688 1.00 12.43 H new ATOM 0 HB3 ASP A 21 -57.555 46.428 33.256 1.00 12.43 H new ATOM 338 N TYR A 22 -57.902 42.983 34.866 1.00 13.32 N ATOM 339 CA TYR A 22 -57.770 41.616 34.376 1.00 74.11 C ATOM 340 C TYR A 22 -59.007 41.184 33.603 1.00 73.12 C ATOM 341 O TYR A 22 -60.136 41.294 34.087 1.00 60.41 O ATOM 342 CB TYR A 22 -57.481 40.646 35.532 1.00 22.40 C ATOM 343 CG TYR A 22 -56.076 40.771 36.093 1.00 70.11 C ATOM 344 CD1 TYR A 22 -55.748 41.771 36.997 1.00 10.10 C ATOM 345 CD2 TYR A 22 -55.074 39.888 35.705 1.00 32.05 C ATOM 346 CE1 TYR A 22 -54.471 41.889 37.496 1.00 23.44 C ATOM 347 CE2 TYR A 22 -53.792 40.000 36.202 1.00 34.21 C ATOM 348 CZ TYR A 22 -53.496 41.002 37.098 1.00 72.13 C ATOM 349 OH TYR A 22 -52.220 41.123 37.597 1.00 43.13 O ATOM 0 H TYR A 22 -58.584 43.095 35.616 1.00 13.32 H new ATOM 0 HA TYR A 22 -56.924 41.590 33.690 1.00 74.11 H new ATOM 0 HB2 TYR A 22 -58.200 40.823 36.332 1.00 22.40 H new ATOM 0 HB3 TYR A 22 -57.635 39.624 35.185 1.00 22.40 H new ATOM 0 HD1 TYR A 22 -56.508 42.469 37.315 1.00 10.10 H new ATOM 0 HD2 TYR A 22 -55.304 39.101 35.002 1.00 32.05 H new ATOM 0 HE1 TYR A 22 -54.234 42.675 38.198 1.00 23.44 H new ATOM 0 HE2 TYR A 22 -53.026 39.306 35.890 1.00 34.21 H new ATOM 0 HH TYR A 22 -51.652 40.420 37.218 1.00 43.13 H new ATOM 359 N GLU A 23 -58.767 40.698 32.395 1.00 45.51 N ATOM 360 CA GLU A 23 -59.824 40.329 31.453 1.00 12.24 C ATOM 361 C GLU A 23 -59.763 38.843 31.066 1.00 71.22 C ATOM 362 O GLU A 23 -60.465 38.408 30.150 1.00 64.24 O ATOM 363 CB GLU A 23 -59.748 41.215 30.186 1.00 43.43 C ATOM 364 CG GLU A 23 -58.351 41.739 29.809 1.00 52.35 C ATOM 365 CD GLU A 23 -57.327 40.661 29.483 1.00 63.43 C ATOM 366 OE1 GLU A 23 -57.269 40.228 28.319 1.00 61.11 O ATOM 367 OE2 GLU A 23 -56.556 40.270 30.390 1.00 53.20 O ATOM 0 H GLU A 23 -57.826 40.545 32.033 1.00 45.51 H new ATOM 0 HA GLU A 23 -60.777 40.496 31.954 1.00 12.24 H new ATOM 0 HB2 GLU A 23 -60.139 40.644 29.344 1.00 43.43 H new ATOM 0 HB3 GLU A 23 -60.409 42.070 30.325 1.00 43.43 H new ATOM 0 HG2 GLU A 23 -58.447 42.400 28.948 1.00 52.35 H new ATOM 0 HG3 GLU A 23 -57.971 42.343 30.633 1.00 52.35 H new ATOM 374 N GLY A 24 -58.953 38.066 31.784 1.00 32.33 N ATOM 375 CA GLY A 24 -58.725 36.674 31.425 1.00 52.22 C ATOM 376 C GLY A 24 -59.651 35.698 32.126 1.00 43.25 C ATOM 377 O GLY A 24 -59.191 34.702 32.688 1.00 1.22 O ATOM 0 H GLY A 24 -58.448 38.378 32.613 1.00 32.33 H new ATOM 0 HA2 GLY A 24 -58.845 36.563 30.347 1.00 52.22 H new ATOM 0 HA3 GLY A 24 -57.693 36.413 31.660 1.00 52.22 H new ATOM 381 N SER A 25 -60.950 35.989 32.093 1.00 63.10 N ATOM 382 CA SER A 25 -61.982 35.131 32.670 1.00 62.31 C ATOM 383 C SER A 25 -63.276 35.274 31.872 1.00 74.13 C ATOM 384 O SER A 25 -64.052 36.208 32.085 1.00 23.02 O ATOM 385 CB SER A 25 -62.232 35.494 34.139 1.00 72.11 C ATOM 386 OG SER A 25 -61.086 35.256 34.942 1.00 71.41 O ATOM 0 H SER A 25 -61.319 36.836 31.660 1.00 63.10 H new ATOM 0 HA SER A 25 -61.640 34.097 32.625 1.00 62.31 H new ATOM 0 HB2 SER A 25 -62.515 36.544 34.211 1.00 72.11 H new ATOM 0 HB3 SER A 25 -63.071 34.911 34.520 1.00 72.11 H new ATOM 0 HG SER A 25 -61.223 35.645 35.831 1.00 71.41 H new ATOM 392 N ASP A 26 -63.475 34.373 30.916 1.00 73.30 N ATOM 393 CA ASP A 26 -64.652 34.429 30.038 1.00 74.13 C ATOM 394 C ASP A 26 -65.128 33.042 29.630 1.00 13.24 C ATOM 395 O ASP A 26 -66.305 32.861 29.315 1.00 1.20 O ATOM 396 CB ASP A 26 -64.376 35.278 28.781 1.00 15.51 C ATOM 397 CG ASP A 26 -63.159 34.825 27.995 1.00 30.10 C ATOM 398 OD1 ASP A 26 -62.037 35.250 28.333 1.00 41.01 O ATOM 399 OD2 ASP A 26 -63.316 34.055 27.029 1.00 20.25 O ATOM 0 H ASP A 26 -62.843 33.596 30.725 1.00 73.30 H new ATOM 0 HA ASP A 26 -65.445 34.903 30.616 1.00 74.13 H new ATOM 0 HB2 ASP A 26 -65.251 35.244 28.131 1.00 15.51 H new ATOM 0 HB3 ASP A 26 -64.239 36.318 29.078 1.00 15.51 H new ATOM 404 N GLU A 27 -64.224 32.062 29.665 1.00 4.33 N ATOM 405 CA GLU A 27 -64.553 30.687 29.284 1.00 0.01 C ATOM 406 C GLU A 27 -64.997 29.865 30.510 1.00 4.03 C ATOM 407 O GLU A 27 -65.179 28.645 30.428 1.00 23.54 O ATOM 408 CB GLU A 27 -63.365 30.018 28.541 1.00 44.43 C ATOM 409 CG GLU A 27 -62.179 29.533 29.401 1.00 43.33 C ATOM 410 CD GLU A 27 -61.450 30.627 30.155 1.00 24.13 C ATOM 411 OE1 GLU A 27 -60.725 31.414 29.523 1.00 11.02 O ATOM 412 OE2 GLU A 27 -61.616 30.707 31.383 1.00 32.15 O ATOM 0 H GLU A 27 -63.255 32.195 29.954 1.00 4.33 H new ATOM 0 HA GLU A 27 -65.395 30.717 28.592 1.00 0.01 H new ATOM 0 HB2 GLU A 27 -63.752 29.163 27.986 1.00 44.43 H new ATOM 0 HB3 GLU A 27 -62.983 30.728 27.807 1.00 44.43 H new ATOM 0 HG2 GLU A 27 -62.545 28.799 30.119 1.00 43.33 H new ATOM 0 HG3 GLU A 27 -61.467 29.020 28.755 1.00 43.33 H new ATOM 419 N ASN A 28 -65.190 30.556 31.639 1.00 43.22 N ATOM 420 CA ASN A 28 -65.633 29.934 32.881 1.00 24.33 C ATOM 421 C ASN A 28 -67.139 29.683 32.855 1.00 65.31 C ATOM 422 O ASN A 28 -67.937 30.564 33.200 1.00 75.34 O ATOM 423 CB ASN A 28 -65.264 30.797 34.092 1.00 45.22 C ATOM 424 CG ASN A 28 -63.771 30.885 34.310 1.00 44.51 C ATOM 425 OD1 ASN A 28 -63.108 31.808 33.835 1.00 34.33 O ATOM 426 ND2 ASN A 28 -63.234 29.919 35.032 1.00 52.22 N ATOM 0 H ASN A 28 -65.042 31.563 31.712 1.00 43.22 H new ATOM 0 HA ASN A 28 -65.121 28.976 32.972 1.00 24.33 H new ATOM 0 HB2 ASN A 28 -65.667 31.800 33.955 1.00 45.22 H new ATOM 0 HB3 ASN A 28 -65.734 30.384 34.985 1.00 45.22 H new ATOM 0 HD21 ASN A 28 -62.231 29.917 35.216 1.00 52.22 H new ATOM 0 HD22 ASN A 28 -63.822 29.174 35.406 1.00 52.22 H new ATOM 433 N GLY A 29 -67.511 28.483 32.410 1.00 33.22 N ATOM 434 CA GLY A 29 -68.909 28.119 32.267 1.00 11.33 C ATOM 435 C GLY A 29 -69.482 28.570 30.937 1.00 32.03 C ATOM 436 O GLY A 29 -68.738 28.930 30.014 1.00 23.12 O ATOM 0 H GLY A 29 -66.856 27.748 32.143 1.00 33.22 H new ATOM 0 HA2 GLY A 29 -69.013 27.038 32.358 1.00 11.33 H new ATOM 0 HA3 GLY A 29 -69.484 28.564 33.079 1.00 11.33 H new ATOM 440 N ASP A 30 -70.809 28.555 30.839 1.00 44.32 N ATOM 441 CA ASP A 30 -71.507 29.097 29.674 1.00 74.43 C ATOM 442 C ASP A 30 -71.888 30.560 29.923 1.00 52.01 C ATOM 443 O ASP A 30 -72.408 31.241 29.036 1.00 3.50 O ATOM 444 CB ASP A 30 -72.746 28.254 29.310 1.00 54.21 C ATOM 445 CG ASP A 30 -73.879 28.351 30.314 1.00 2.31 C ATOM 446 OD1 ASP A 30 -73.791 27.722 31.388 1.00 10.33 O ATOM 447 OD2 ASP A 30 -74.870 29.042 30.025 1.00 35.11 O ATOM 0 H ASP A 30 -71.426 28.172 31.555 1.00 44.32 H new ATOM 0 HA ASP A 30 -70.829 29.053 28.821 1.00 74.43 H new ATOM 0 HB2 ASP A 30 -73.113 28.570 28.333 1.00 54.21 H new ATOM 0 HB3 ASP A 30 -72.447 27.210 29.216 1.00 54.21 H new ATOM 452 N GLY A 31 -71.630 31.019 31.150 1.00 20.11 N ATOM 453 CA GLY A 31 -71.701 32.427 31.473 1.00 61.51 C ATOM 454 C GLY A 31 -70.450 33.137 31.000 1.00 34.33 C ATOM 455 O GLY A 31 -69.459 33.214 31.728 1.00 55.31 O ATOM 0 H GLY A 31 -71.369 30.422 31.935 1.00 20.11 H new ATOM 0 HA2 GLY A 31 -72.579 32.871 31.004 1.00 61.51 H new ATOM 0 HA3 GLY A 31 -71.815 32.555 32.549 1.00 61.51 H new ATOM 459 N ILE A 32 -70.510 33.635 29.766 1.00 54.11 N ATOM 460 CA ILE A 32 -69.365 34.213 29.068 1.00 70.52 C ATOM 461 C ILE A 32 -69.000 35.568 29.672 1.00 11.14 C ATOM 462 O ILE A 32 -69.736 36.545 29.529 1.00 31.22 O ATOM 463 CB ILE A 32 -69.670 34.348 27.541 1.00 34.13 C ATOM 464 CG1 ILE A 32 -70.016 32.973 26.914 1.00 0.42 C ATOM 465 CG2 ILE A 32 -68.514 35.001 26.788 1.00 75.02 C ATOM 466 CD1 ILE A 32 -68.936 31.908 27.056 1.00 3.43 C ATOM 0 H ILE A 32 -71.369 33.648 29.216 1.00 54.11 H new ATOM 0 HA ILE A 32 -68.511 33.547 29.188 1.00 70.52 H new ATOM 0 HB ILE A 32 -70.540 34.998 27.447 1.00 34.13 H new ATOM 0 HG12 ILE A 32 -70.933 32.602 27.373 1.00 0.42 H new ATOM 0 HG13 ILE A 32 -70.226 33.117 25.854 1.00 0.42 H new ATOM 0 HG21 ILE A 32 -68.765 35.077 25.730 1.00 75.02 H new ATOM 0 HG22 ILE A 32 -68.335 35.998 27.190 1.00 75.02 H new ATOM 0 HG23 ILE A 32 -67.615 34.395 26.905 1.00 75.02 H new ATOM 0 HD11 ILE A 32 -69.272 30.984 26.586 1.00 3.43 H new ATOM 0 HD12 ILE A 32 -68.022 32.250 26.571 1.00 3.43 H new ATOM 0 HD13 ILE A 32 -68.740 31.727 28.113 1.00 3.43 H new ATOM 478 N GLY A 33 -67.890 35.576 30.411 1.00 13.33 N ATOM 479 CA GLY A 33 -67.409 36.785 31.054 1.00 51.43 C ATOM 480 C GLY A 33 -67.926 36.958 32.474 1.00 42.25 C ATOM 481 O GLY A 33 -67.479 37.855 33.182 1.00 1.44 O ATOM 0 H GLY A 33 -67.310 34.753 30.575 1.00 13.33 H new ATOM 0 HA2 GLY A 33 -66.319 36.770 31.071 1.00 51.43 H new ATOM 0 HA3 GLY A 33 -67.707 37.648 30.459 1.00 51.43 H new ATOM 485 N ASP A 34 -68.866 36.103 32.886 1.00 53.23 N ATOM 486 CA ASP A 34 -69.507 36.213 34.199 1.00 43.03 C ATOM 487 C ASP A 34 -68.584 35.723 35.308 1.00 23.55 C ATOM 488 O ASP A 34 -68.338 36.434 36.278 1.00 34.13 O ATOM 489 CB ASP A 34 -70.824 35.411 34.227 1.00 71.13 C ATOM 490 CG ASP A 34 -71.517 35.442 35.584 1.00 33.34 C ATOM 491 OD1 ASP A 34 -72.242 36.420 35.866 1.00 22.42 O ATOM 492 OD2 ASP A 34 -71.327 34.498 36.376 1.00 10.25 O ATOM 0 H ASP A 34 -69.202 35.321 32.324 1.00 53.23 H new ATOM 0 HA ASP A 34 -69.725 37.267 34.372 1.00 43.03 H new ATOM 0 HB2 ASP A 34 -71.501 35.810 33.471 1.00 71.13 H new ATOM 0 HB3 ASP A 34 -70.617 34.376 33.955 1.00 71.13 H new ATOM 497 N SER A 35 -68.087 34.509 35.161 1.00 20.52 N ATOM 498 CA SER A 35 -67.321 33.875 36.215 1.00 5.24 C ATOM 499 C SER A 35 -65.817 34.035 35.996 1.00 40.43 C ATOM 500 O SER A 35 -65.355 34.236 34.868 1.00 13.22 O ATOM 501 CB SER A 35 -67.700 32.400 36.298 1.00 15.44 C ATOM 502 OG SER A 35 -69.099 32.253 36.448 1.00 72.05 O ATOM 0 H SER A 35 -68.201 33.942 34.320 1.00 20.52 H new ATOM 0 HA SER A 35 -67.560 34.366 37.158 1.00 5.24 H new ATOM 0 HB2 SER A 35 -67.369 31.883 35.397 1.00 15.44 H new ATOM 0 HB3 SER A 35 -67.188 31.934 37.140 1.00 15.44 H new ATOM 0 HG SER A 35 -69.324 31.301 36.498 1.00 72.05 H new ATOM 508 N ALA A 36 -65.071 33.944 37.090 1.00 61.10 N ATOM 509 CA ALA A 36 -63.623 34.037 37.054 1.00 34.51 C ATOM 510 C ALA A 36 -63.014 32.746 37.567 1.00 52.11 C ATOM 511 O ALA A 36 -63.644 32.033 38.354 1.00 64.03 O ATOM 512 CB ALA A 36 -63.144 35.218 37.881 1.00 22.01 C ATOM 0 H ALA A 36 -65.455 33.804 38.024 1.00 61.10 H new ATOM 0 HA ALA A 36 -63.304 34.194 36.024 1.00 34.51 H new ATOM 0 HB1 ALA A 36 -62.056 35.272 37.842 1.00 22.01 H new ATOM 0 HB2 ALA A 36 -63.567 36.139 37.480 1.00 22.01 H new ATOM 0 HB3 ALA A 36 -63.464 35.092 38.915 1.00 22.01 H new ATOM 518 N TYR A 37 -61.803 32.445 37.116 1.00 35.12 N ATOM 519 CA TYR A 37 -61.119 31.227 37.538 1.00 21.11 C ATOM 520 C TYR A 37 -60.464 31.426 38.903 1.00 10.33 C ATOM 521 O TYR A 37 -60.022 32.533 39.241 1.00 21.03 O ATOM 522 CB TYR A 37 -60.080 30.760 36.484 1.00 62.05 C ATOM 523 CG TYR A 37 -58.830 31.611 36.358 1.00 74.43 C ATOM 524 CD1 TYR A 37 -58.852 32.834 35.700 1.00 54.22 C ATOM 525 CD2 TYR A 37 -57.623 31.182 36.899 1.00 10.32 C ATOM 526 CE1 TYR A 37 -57.712 33.603 35.586 1.00 73.13 C ATOM 527 CE2 TYR A 37 -56.480 31.945 36.785 1.00 61.34 C ATOM 528 CZ TYR A 37 -56.531 33.154 36.130 1.00 64.03 C ATOM 529 OH TYR A 37 -55.389 33.911 36.007 1.00 55.50 O ATOM 0 H TYR A 37 -61.276 33.023 36.462 1.00 35.12 H new ATOM 0 HA TYR A 37 -61.867 30.439 37.626 1.00 21.11 H new ATOM 0 HB2 TYR A 37 -59.779 29.741 36.727 1.00 62.05 H new ATOM 0 HB3 TYR A 37 -60.570 30.724 35.511 1.00 62.05 H new ATOM 0 HD1 TYR A 37 -59.777 33.189 35.270 1.00 54.22 H new ATOM 0 HD2 TYR A 37 -57.580 30.235 37.417 1.00 10.32 H new ATOM 0 HE1 TYR A 37 -57.747 34.552 35.072 1.00 73.13 H new ATOM 0 HE2 TYR A 37 -55.550 31.595 37.208 1.00 61.34 H new ATOM 0 HH TYR A 37 -54.643 33.452 36.447 1.00 55.50 H new ATOM 539 N ALA A 38 -60.431 30.362 39.689 1.00 41.21 N ATOM 540 CA ALA A 38 -59.752 30.393 40.970 1.00 60.34 C ATOM 541 C ALA A 38 -58.272 30.098 40.772 1.00 22.41 C ATOM 542 O ALA A 38 -57.875 28.955 40.534 1.00 4.33 O ATOM 543 CB ALA A 38 -60.377 29.420 41.948 1.00 34.45 C ATOM 0 H ALA A 38 -60.866 29.468 39.461 1.00 41.21 H new ATOM 0 HA ALA A 38 -59.858 31.390 41.397 1.00 60.34 H new ATOM 0 HB1 ALA A 38 -59.845 29.467 42.898 1.00 34.45 H new ATOM 0 HB2 ALA A 38 -61.423 29.683 42.104 1.00 34.45 H new ATOM 0 HB3 ALA A 38 -60.313 28.409 41.546 1.00 34.45 H new ATOM 549 N VAL A 39 -57.481 31.161 40.834 1.00 35.22 N ATOM 550 CA VAL A 39 -56.040 31.094 40.627 1.00 13.40 C ATOM 551 C VAL A 39 -55.337 30.395 41.808 1.00 70.42 C ATOM 552 O VAL A 39 -55.507 30.769 42.977 1.00 43.22 O ATOM 553 CB VAL A 39 -55.463 32.527 40.355 1.00 12.53 C ATOM 554 CG1 VAL A 39 -55.854 33.518 41.448 1.00 71.01 C ATOM 555 CG2 VAL A 39 -53.947 32.507 40.170 1.00 3.14 C ATOM 0 H VAL A 39 -57.824 32.101 41.031 1.00 35.22 H new ATOM 0 HA VAL A 39 -55.842 30.486 39.744 1.00 13.40 H new ATOM 0 HB VAL A 39 -55.911 32.864 39.420 1.00 12.53 H new ATOM 0 HG11 VAL A 39 -55.433 34.497 41.219 1.00 71.01 H new ATOM 0 HG12 VAL A 39 -56.940 33.593 41.500 1.00 71.01 H new ATOM 0 HG13 VAL A 39 -55.468 33.173 42.407 1.00 71.01 H new ATOM 0 HG21 VAL A 39 -53.590 33.520 39.984 1.00 3.14 H new ATOM 0 HG22 VAL A 39 -53.476 32.116 41.072 1.00 3.14 H new ATOM 0 HG23 VAL A 39 -53.692 31.871 39.322 1.00 3.14 H new ATOM 565 N ASN A 40 -54.593 29.339 41.495 1.00 5.31 N ATOM 566 CA ASN A 40 -53.807 28.638 42.498 1.00 40.22 C ATOM 567 C ASN A 40 -52.364 28.410 42.017 1.00 24.23 C ATOM 568 O ASN A 40 -52.073 27.489 41.252 1.00 43.41 O ATOM 569 CB ASN A 40 -54.508 27.330 42.966 1.00 12.22 C ATOM 570 CG ASN A 40 -54.846 26.335 41.859 1.00 55.33 C ATOM 571 OD1 ASN A 40 -55.858 26.471 41.170 1.00 51.23 O ATOM 572 ND2 ASN A 40 -54.032 25.299 41.721 1.00 72.12 N ATOM 0 H ASN A 40 -54.519 28.952 40.554 1.00 5.31 H new ATOM 0 HA ASN A 40 -53.741 29.275 43.380 1.00 40.22 H new ATOM 0 HB2 ASN A 40 -53.865 26.834 43.693 1.00 12.22 H new ATOM 0 HB3 ASN A 40 -55.429 27.597 43.484 1.00 12.22 H new ATOM 0 HD21 ASN A 40 -54.234 24.580 41.026 1.00 72.12 H new ATOM 0 HD22 ASN A 40 -53.203 25.220 42.310 1.00 72.12 H new ATOM 579 N PRO A 41 -51.430 29.315 42.410 1.00 51.32 N ATOM 580 CA PRO A 41 -49.997 29.142 42.135 1.00 32.21 C ATOM 581 C PRO A 41 -49.279 28.248 43.163 1.00 23.42 C ATOM 582 O PRO A 41 -48.071 28.018 43.052 1.00 43.14 O ATOM 583 CB PRO A 41 -49.470 30.572 42.201 1.00 12.40 C ATOM 584 CG PRO A 41 -50.351 31.258 43.189 1.00 30.13 C ATOM 585 CD PRO A 41 -51.702 30.610 43.079 1.00 52.41 C ATOM 0 HA PRO A 41 -49.824 28.639 41.184 1.00 32.21 H new ATOM 0 HB2 PRO A 41 -48.427 30.595 42.518 1.00 12.40 H new ATOM 0 HB3 PRO A 41 -49.517 31.056 41.226 1.00 12.40 H new ATOM 0 HG2 PRO A 41 -49.953 31.157 44.199 1.00 30.13 H new ATOM 0 HG3 PRO A 41 -50.414 32.325 42.977 1.00 30.13 H new ATOM 0 HD2 PRO A 41 -52.155 30.464 44.060 1.00 52.41 H new ATOM 0 HD3 PRO A 41 -52.391 31.222 42.497 1.00 52.41 H new ATOM 593 N GLU A 42 -50.023 27.752 44.157 1.00 63.42 N ATOM 594 CA GLU A 42 -49.473 26.865 45.170 1.00 33.10 C ATOM 595 C GLU A 42 -49.523 25.432 44.660 1.00 5.02 C ATOM 596 O GLU A 42 -50.561 24.766 44.764 1.00 71.34 O ATOM 597 CB GLU A 42 -50.277 26.995 46.473 1.00 1.25 C ATOM 598 CG GLU A 42 -49.497 26.694 47.755 1.00 74.21 C ATOM 599 CD GLU A 42 -49.270 25.211 48.007 1.00 73.13 C ATOM 600 OE1 GLU A 42 -48.244 24.679 47.551 1.00 61.41 O ATOM 601 OE2 GLU A 42 -50.118 24.581 48.669 1.00 42.44 O ATOM 0 H GLU A 42 -51.015 27.956 44.276 1.00 63.42 H new ATOM 0 HA GLU A 42 -48.438 27.139 45.373 1.00 33.10 H new ATOM 0 HB2 GLU A 42 -50.672 28.009 46.537 1.00 1.25 H new ATOM 0 HB3 GLU A 42 -51.133 26.322 46.421 1.00 1.25 H new ATOM 0 HG2 GLU A 42 -48.531 27.196 47.707 1.00 74.21 H new ATOM 0 HG3 GLU A 42 -50.034 27.118 48.603 1.00 74.21 H new ATOM 608 N ALA A 43 -48.400 24.994 44.086 1.00 12.34 N ATOM 609 CA ALA A 43 -48.232 23.635 43.582 1.00 13.34 C ATOM 610 C ALA A 43 -46.767 23.406 43.222 1.00 1.42 C ATOM 611 O ALA A 43 -46.230 24.078 42.340 1.00 5.13 O ATOM 612 CB ALA A 43 -49.130 23.384 42.373 1.00 71.34 C ATOM 0 H ALA A 43 -47.576 25.581 43.958 1.00 12.34 H new ATOM 0 HA ALA A 43 -48.525 22.931 44.361 1.00 13.34 H new ATOM 0 HB1 ALA A 43 -48.985 22.364 42.017 1.00 71.34 H new ATOM 0 HB2 ALA A 43 -50.173 23.524 42.659 1.00 71.34 H new ATOM 0 HB3 ALA A 43 -48.875 24.085 41.578 1.00 71.34 H new ATOM 618 N GLY A 44 -46.121 22.487 43.934 1.00 41.03 N ATOM 619 CA GLY A 44 -44.714 22.215 43.705 1.00 74.53 C ATOM 620 C GLY A 44 -44.491 20.925 42.946 1.00 61.22 C ATOM 621 O GLY A 44 -45.213 19.946 43.152 1.00 54.13 O ATOM 0 H GLY A 44 -46.550 21.924 44.669 1.00 41.03 H new ATOM 0 HA2 GLY A 44 -44.273 23.042 43.148 1.00 74.53 H new ATOM 0 HA3 GLY A 44 -44.196 22.164 44.663 1.00 74.53 H new ATOM 625 N SER A 45 -43.493 20.928 42.067 1.00 52.11 N ATOM 626 CA SER A 45 -43.146 19.747 41.285 1.00 23.52 C ATOM 627 C SER A 45 -42.128 18.890 42.029 1.00 74.13 C ATOM 628 O SER A 45 -41.104 19.394 42.496 1.00 52.11 O ATOM 629 CB SER A 45 -42.593 20.159 39.917 1.00 43.50 C ATOM 630 OG SER A 45 -43.545 20.913 39.187 1.00 61.44 O ATOM 0 H SER A 45 -42.907 21.741 41.878 1.00 52.11 H new ATOM 0 HA SER A 45 -44.050 19.156 41.135 1.00 23.52 H new ATOM 0 HB2 SER A 45 -41.685 20.746 40.051 1.00 43.50 H new ATOM 0 HB3 SER A 45 -42.317 19.270 39.350 1.00 43.50 H new ATOM 0 HG SER A 45 -43.167 21.165 38.319 1.00 61.44 H new ATOM 636 N MET A 46 -42.430 17.595 42.145 1.00 30.05 N ATOM 637 CA MET A 46 -41.559 16.652 42.842 1.00 33.11 C ATOM 638 C MET A 46 -40.378 16.230 41.962 1.00 43.44 C ATOM 639 O MET A 46 -40.419 16.355 40.733 1.00 11.01 O ATOM 640 CB MET A 46 -42.352 15.412 43.304 1.00 53.42 C ATOM 641 CG MET A 46 -42.954 14.587 42.170 1.00 24.30 C ATOM 642 SD MET A 46 -43.767 13.093 42.758 1.00 40.43 S ATOM 643 CE MET A 46 -44.200 12.315 41.207 1.00 42.31 C ATOM 0 H MET A 46 -43.277 17.176 41.762 1.00 30.05 H new ATOM 0 HA MET A 46 -41.162 17.159 43.721 1.00 33.11 H new ATOM 0 HB2 MET A 46 -41.693 14.773 43.891 1.00 53.42 H new ATOM 0 HB3 MET A 46 -43.155 15.736 43.967 1.00 53.42 H new ATOM 0 HG2 MET A 46 -43.674 15.197 41.624 1.00 24.30 H new ATOM 0 HG3 MET A 46 -42.167 14.315 41.466 1.00 24.30 H new ATOM 0 HE1 MET A 46 -44.713 11.374 41.403 1.00 42.31 H new ATOM 0 HE2 MET A 46 -44.856 12.975 40.640 1.00 42.31 H new ATOM 0 HE3 MET A 46 -43.295 12.122 40.632 1.00 42.31 H new ATOM 653 N ASP A 47 -39.338 15.719 42.608 1.00 33.35 N ATOM 654 CA ASP A 47 -38.129 15.281 41.920 1.00 52.11 C ATOM 655 C ASP A 47 -38.273 13.837 41.443 1.00 32.23 C ATOM 656 O ASP A 47 -39.094 13.070 41.962 1.00 35.21 O ATOM 657 CB ASP A 47 -36.902 15.424 42.840 1.00 70.41 C ATOM 658 CG ASP A 47 -36.937 14.507 44.052 1.00 31.12 C ATOM 659 OD1 ASP A 47 -37.641 14.825 45.027 1.00 55.32 O ATOM 660 OD2 ASP A 47 -36.242 13.475 44.035 1.00 24.52 O ATOM 0 H ASP A 47 -39.308 15.596 43.620 1.00 33.35 H new ATOM 0 HA ASP A 47 -37.983 15.918 41.047 1.00 52.11 H new ATOM 0 HB2 ASP A 47 -36.001 15.216 42.264 1.00 70.41 H new ATOM 0 HB3 ASP A 47 -36.832 16.457 43.179 1.00 70.41 H new ATOM 665 N TYR A 48 -37.472 13.487 40.447 1.00 42.21 N ATOM 666 CA TYR A 48 -37.485 12.154 39.856 1.00 13.52 C ATOM 667 C TYR A 48 -36.053 11.679 39.606 1.00 44.51 C ATOM 668 O TYR A 48 -35.098 12.415 39.859 1.00 53.11 O ATOM 669 CB TYR A 48 -38.321 12.141 38.550 1.00 41.34 C ATOM 670 CG TYR A 48 -37.827 13.047 37.431 1.00 3.14 C ATOM 671 CD1 TYR A 48 -38.133 14.403 37.417 1.00 23.15 C ATOM 672 CD2 TYR A 48 -37.062 12.541 36.386 1.00 63.30 C ATOM 673 CE1 TYR A 48 -37.687 15.225 36.402 1.00 61.22 C ATOM 674 CE2 TYR A 48 -36.613 13.358 35.367 1.00 53.03 C ATOM 675 CZ TYR A 48 -36.927 14.697 35.379 1.00 11.54 C ATOM 676 OH TYR A 48 -36.479 15.511 34.367 1.00 11.43 O ATOM 0 H TYR A 48 -36.793 14.120 40.024 1.00 42.21 H new ATOM 0 HA TYR A 48 -37.957 11.462 40.554 1.00 13.52 H new ATOM 0 HB2 TYR A 48 -38.355 11.118 38.174 1.00 41.34 H new ATOM 0 HB3 TYR A 48 -39.345 12.425 38.795 1.00 41.34 H new ATOM 0 HD1 TYR A 48 -38.730 14.820 38.214 1.00 23.15 H new ATOM 0 HD2 TYR A 48 -36.814 11.490 36.371 1.00 63.30 H new ATOM 0 HE1 TYR A 48 -37.932 16.277 36.409 1.00 61.22 H new ATOM 0 HE2 TYR A 48 -36.018 12.947 34.565 1.00 53.03 H new ATOM 0 HH TYR A 48 -35.958 14.982 33.728 1.00 11.43 H new ATOM 686 N MET A 49 -35.909 10.451 39.129 1.00 52.11 N ATOM 687 CA MET A 49 -34.595 9.898 38.815 1.00 14.04 C ATOM 688 C MET A 49 -34.397 9.824 37.300 1.00 11.02 C ATOM 689 O MET A 49 -35.340 9.493 36.576 1.00 73.23 O ATOM 690 CB MET A 49 -34.419 8.500 39.433 1.00 12.53 C ATOM 691 CG MET A 49 -33.915 8.495 40.875 1.00 73.12 C ATOM 692 SD MET A 49 -35.096 9.152 42.075 1.00 12.33 S ATOM 693 CE MET A 49 -36.436 7.972 41.936 1.00 21.51 C ATOM 0 H MET A 49 -36.687 9.816 38.950 1.00 52.11 H new ATOM 0 HA MET A 49 -33.843 10.561 39.243 1.00 14.04 H new ATOM 0 HB2 MET A 49 -35.376 7.979 39.396 1.00 12.53 H new ATOM 0 HB3 MET A 49 -33.722 7.931 38.817 1.00 12.53 H new ATOM 0 HG2 MET A 49 -33.660 7.473 41.155 1.00 73.12 H new ATOM 0 HG3 MET A 49 -32.996 9.079 40.929 1.00 73.12 H new ATOM 0 HE1 MET A 49 -37.089 8.060 42.804 1.00 21.51 H new ATOM 0 HE2 MET A 49 -37.007 8.175 41.030 1.00 21.51 H new ATOM 0 HE3 MET A 49 -36.028 6.962 41.889 1.00 21.51 H new ATOM 703 N PRO A 50 -33.180 10.169 36.794 1.00 64.12 N ATOM 704 CA PRO A 50 -32.830 10.014 35.368 1.00 73.30 C ATOM 705 C PRO A 50 -32.925 8.560 34.887 1.00 23.44 C ATOM 706 O PRO A 50 -32.491 7.631 35.574 1.00 54.54 O ATOM 707 CB PRO A 50 -31.376 10.505 35.285 1.00 41.03 C ATOM 708 CG PRO A 50 -30.874 10.516 36.689 1.00 65.24 C ATOM 709 CD PRO A 50 -32.070 10.773 37.558 1.00 10.13 C ATOM 0 HA PRO A 50 -33.518 10.570 34.732 1.00 73.30 H new ATOM 0 HB2 PRO A 50 -30.775 9.845 34.659 1.00 41.03 H new ATOM 0 HB3 PRO A 50 -31.323 11.500 34.842 1.00 41.03 H new ATOM 0 HG2 PRO A 50 -30.405 9.565 36.943 1.00 65.24 H new ATOM 0 HG3 PRO A 50 -30.119 11.290 36.827 1.00 65.24 H new ATOM 0 HD2 PRO A 50 -31.960 10.313 38.540 1.00 10.13 H new ATOM 0 HD3 PRO A 50 -32.227 11.839 37.721 1.00 10.13 H new ATOM 717 N LEU A 51 -33.510 8.377 33.712 1.00 12.33 N ATOM 718 CA LEU A 51 -33.712 7.049 33.140 1.00 23.43 C ATOM 719 C LEU A 51 -32.425 6.536 32.507 1.00 1.02 C ATOM 720 O LEU A 51 -31.737 7.268 31.790 1.00 13.43 O ATOM 721 CB LEU A 51 -34.840 7.054 32.085 1.00 43.35 C ATOM 722 CG LEU A 51 -36.295 7.067 32.608 1.00 41.11 C ATOM 723 CD1 LEU A 51 -36.694 8.421 33.186 1.00 34.22 C ATOM 724 CD2 LEU A 51 -37.251 6.671 31.489 1.00 51.10 C ATOM 0 H LEU A 51 -33.857 9.139 33.129 1.00 12.33 H new ATOM 0 HA LEU A 51 -34.003 6.385 33.954 1.00 23.43 H new ATOM 0 HB2 LEU A 51 -34.702 7.927 31.447 1.00 43.35 H new ATOM 0 HB3 LEU A 51 -34.716 6.175 31.453 1.00 43.35 H new ATOM 0 HG LEU A 51 -36.356 6.342 33.420 1.00 41.11 H new ATOM 0 HD11 LEU A 51 -37.724 8.377 33.539 1.00 34.22 H new ATOM 0 HD12 LEU A 51 -36.036 8.670 34.018 1.00 34.22 H new ATOM 0 HD13 LEU A 51 -36.608 9.186 32.414 1.00 34.22 H new ATOM 0 HD21 LEU A 51 -38.274 6.682 31.864 1.00 51.10 H new ATOM 0 HD22 LEU A 51 -37.159 7.378 30.665 1.00 51.10 H new ATOM 0 HD23 LEU A 51 -37.004 5.669 31.137 1.00 51.10 H new ATOM 736 N MET A 52 -32.096 5.282 32.795 1.00 24.41 N ATOM 737 CA MET A 52 -30.925 4.643 32.209 1.00 53.31 C ATOM 738 C MET A 52 -31.247 4.183 30.789 1.00 43.33 C ATOM 739 O MET A 52 -32.325 3.635 30.526 1.00 23.44 O ATOM 740 CB MET A 52 -30.416 3.481 33.092 1.00 24.51 C ATOM 741 CG MET A 52 -31.413 2.345 33.315 1.00 1.40 C ATOM 742 SD MET A 52 -30.826 1.109 34.490 1.00 34.13 S ATOM 743 CE MET A 52 -30.896 2.020 36.030 1.00 13.12 C ATOM 0 H MET A 52 -32.625 4.687 33.432 1.00 24.41 H new ATOM 0 HA MET A 52 -30.114 5.370 32.158 1.00 53.31 H new ATOM 0 HB2 MET A 52 -29.516 3.068 32.637 1.00 24.51 H new ATOM 0 HB3 MET A 52 -30.126 3.884 34.063 1.00 24.51 H new ATOM 0 HG2 MET A 52 -32.354 2.761 33.674 1.00 1.40 H new ATOM 0 HG3 MET A 52 -31.622 1.861 32.361 1.00 1.40 H new ATOM 0 HE1 MET A 52 -30.858 1.323 36.867 1.00 13.12 H new ATOM 0 HE2 MET A 52 -30.048 2.703 36.088 1.00 13.12 H new ATOM 0 HE3 MET A 52 -31.824 2.590 36.074 1.00 13.12 H new ATOM 753 N GLU A 53 -30.333 4.450 29.872 1.00 21.23 N ATOM 754 CA GLU A 53 -30.562 4.168 28.470 1.00 3.11 C ATOM 755 C GLU A 53 -29.753 2.962 28.016 1.00 54.01 C ATOM 756 O GLU A 53 -28.624 2.738 28.466 1.00 10.13 O ATOM 757 CB GLU A 53 -30.253 5.400 27.607 1.00 23.14 C ATOM 758 CG GLU A 53 -28.856 5.976 27.801 1.00 35.25 C ATOM 759 CD GLU A 53 -28.541 7.056 26.802 1.00 31.50 C ATOM 760 OE1 GLU A 53 -28.089 6.725 25.693 1.00 75.31 O ATOM 761 OE2 GLU A 53 -28.730 8.243 27.120 1.00 73.54 O ATOM 0 H GLU A 53 -29.423 4.863 30.077 1.00 21.23 H new ATOM 0 HA GLU A 53 -31.617 3.926 28.343 1.00 3.11 H new ATOM 0 HB2 GLU A 53 -30.379 5.133 26.558 1.00 23.14 H new ATOM 0 HB3 GLU A 53 -30.986 6.176 27.829 1.00 23.14 H new ATOM 0 HG2 GLU A 53 -28.769 6.380 28.810 1.00 35.25 H new ATOM 0 HG3 GLU A 53 -28.120 5.177 27.713 1.00 35.25 H new ATOM 768 N TYR A 54 -30.358 2.172 27.149 1.00 31.25 N ATOM 769 CA TYR A 54 -29.730 0.976 26.625 1.00 15.32 C ATOM 770 C TYR A 54 -29.485 1.142 25.136 1.00 3.33 C ATOM 771 O TYR A 54 -30.305 1.741 24.427 1.00 13.53 O ATOM 772 CB TYR A 54 -30.611 -0.257 26.873 1.00 32.51 C ATOM 773 CG TYR A 54 -30.875 -0.554 28.333 1.00 43.41 C ATOM 774 CD1 TYR A 54 -30.005 -1.348 29.067 1.00 45.40 C ATOM 775 CD2 TYR A 54 -31.993 -0.037 28.975 1.00 25.32 C ATOM 776 CE1 TYR A 54 -30.244 -1.617 30.397 1.00 32.24 C ATOM 777 CE2 TYR A 54 -32.235 -0.301 30.303 1.00 50.14 C ATOM 778 CZ TYR A 54 -31.358 -1.092 31.009 1.00 45.42 C ATOM 779 OH TYR A 54 -31.593 -1.348 32.334 1.00 75.00 O ATOM 0 H TYR A 54 -31.297 2.342 26.789 1.00 31.25 H new ATOM 0 HA TYR A 54 -28.780 0.828 27.139 1.00 15.32 H new ATOM 0 HB2 TYR A 54 -31.565 -0.115 26.366 1.00 32.51 H new ATOM 0 HB3 TYR A 54 -30.135 -1.126 26.418 1.00 32.51 H new ATOM 0 HD1 TYR A 54 -29.129 -1.761 28.589 1.00 45.40 H new ATOM 0 HD2 TYR A 54 -32.684 0.583 28.422 1.00 25.32 H new ATOM 0 HE1 TYR A 54 -29.559 -2.237 30.956 1.00 32.24 H new ATOM 0 HE2 TYR A 54 -33.108 0.110 30.789 1.00 50.14 H new ATOM 0 HH TYR A 54 -31.319 -0.575 32.870 1.00 75.00 H new ATOM 789 N LEU A 55 -28.366 0.620 24.664 1.00 41.52 N ATOM 790 CA LEU A 55 -28.007 0.737 23.260 1.00 63.23 C ATOM 791 C LEU A 55 -27.521 -0.606 22.732 1.00 74.50 C ATOM 792 O LEU A 55 -27.106 -1.473 23.510 1.00 34.41 O ATOM 793 CB LEU A 55 -26.926 1.828 23.035 1.00 11.31 C ATOM 794 CG LEU A 55 -25.471 1.485 23.438 1.00 62.41 C ATOM 795 CD1 LEU A 55 -24.513 2.442 22.758 1.00 74.12 C ATOM 796 CD2 LEU A 55 -25.266 1.550 24.948 1.00 40.31 C ATOM 0 H LEU A 55 -27.689 0.110 25.232 1.00 41.52 H new ATOM 0 HA LEU A 55 -28.899 1.038 22.710 1.00 63.23 H new ATOM 0 HB2 LEU A 55 -26.929 2.092 21.977 1.00 11.31 H new ATOM 0 HB3 LEU A 55 -27.227 2.719 23.586 1.00 11.31 H new ATOM 0 HG LEU A 55 -25.273 0.462 23.117 1.00 62.41 H new ATOM 0 HD11 LEU A 55 -23.490 2.197 23.044 1.00 74.12 H new ATOM 0 HD12 LEU A 55 -24.618 2.355 21.677 1.00 74.12 H new ATOM 0 HD13 LEU A 55 -24.741 3.463 23.063 1.00 74.12 H new ATOM 0 HD21 LEU A 55 -24.231 1.302 25.186 1.00 40.31 H new ATOM 0 HD22 LEU A 55 -25.489 2.556 25.302 1.00 40.31 H new ATOM 0 HD23 LEU A 55 -25.931 0.838 25.436 1.00 40.31 H new ATOM 808 N HIS A 56 -27.581 -0.776 21.419 1.00 52.54 N ATOM 809 CA HIS A 56 -27.019 -1.959 20.779 1.00 14.40 C ATOM 810 C HIS A 56 -25.562 -1.683 20.402 1.00 12.04 C ATOM 811 O HIS A 56 -25.151 -0.524 20.295 1.00 64.03 O ATOM 812 CB HIS A 56 -27.848 -2.412 19.543 1.00 4.23 C ATOM 813 CG HIS A 56 -27.838 -1.475 18.354 1.00 20.43 C ATOM 814 ND1 HIS A 56 -26.854 -1.495 17.379 1.00 73.41 N ATOM 815 CD2 HIS A 56 -28.707 -0.505 17.980 1.00 74.42 C ATOM 816 CE1 HIS A 56 -27.119 -0.577 16.470 1.00 13.10 C ATOM 817 NE2 HIS A 56 -28.236 0.034 16.809 1.00 43.43 N ATOM 0 H HIS A 56 -28.012 -0.112 20.776 1.00 52.54 H new ATOM 0 HA HIS A 56 -27.059 -2.785 21.489 1.00 14.40 H new ATOM 0 HB2 HIS A 56 -27.475 -3.383 19.217 1.00 4.23 H new ATOM 0 HB3 HIS A 56 -28.882 -2.556 19.857 1.00 4.23 H new ATOM 0 HD1 HIS A 56 -26.050 -2.122 17.366 1.00 73.41 H new ATOM 0 HD2 HIS A 56 -29.603 -0.211 18.506 1.00 74.42 H new ATOM 0 HE1 HIS A 56 -26.522 -0.362 15.596 1.00 13.10 H new ATOM 826 N SER A 57 -24.800 -2.739 20.198 1.00 74.30 N ATOM 827 CA SER A 57 -23.416 -2.606 19.792 1.00 33.23 C ATOM 828 C SER A 57 -23.337 -2.358 18.288 1.00 53.33 C ATOM 829 O SER A 57 -23.890 -3.123 17.490 1.00 64.34 O ATOM 830 CB SER A 57 -22.641 -3.863 20.183 1.00 4.55 C ATOM 831 OG SER A 57 -21.243 -3.666 20.076 1.00 72.21 O ATOM 0 H SER A 57 -25.118 -3.702 20.307 1.00 74.30 H new ATOM 0 HA SER A 57 -22.967 -1.753 20.301 1.00 33.23 H new ATOM 0 HB2 SER A 57 -22.893 -4.143 21.206 1.00 4.55 H new ATOM 0 HB3 SER A 57 -22.943 -4.692 19.542 1.00 4.55 H new ATOM 0 HG SER A 57 -20.776 -4.488 20.335 1.00 72.21 H new ATOM 837 N SER A 58 -22.699 -1.258 17.920 1.00 43.21 N ATOM 838 CA SER A 58 -22.454 -0.946 16.523 1.00 1.42 C ATOM 839 C SER A 58 -21.089 -1.494 16.096 1.00 0.42 C ATOM 840 O SER A 58 -20.069 -1.178 16.719 1.00 41.22 O ATOM 841 CB SER A 58 -22.546 0.566 16.299 1.00 20.14 C ATOM 842 OG SER A 58 -21.866 1.287 17.319 1.00 13.12 O ATOM 0 H SER A 58 -22.340 -0.563 18.575 1.00 43.21 H new ATOM 0 HA SER A 58 -23.215 -1.423 15.906 1.00 1.42 H new ATOM 0 HB2 SER A 58 -22.119 0.818 15.328 1.00 20.14 H new ATOM 0 HB3 SER A 58 -23.593 0.868 16.275 1.00 20.14 H new ATOM 0 HG SER A 58 -21.021 0.838 17.529 1.00 13.12 H new ATOM 848 N PRO A 59 -21.054 -2.369 15.059 1.00 12.50 N ATOM 849 CA PRO A 59 -19.808 -3.007 14.584 1.00 0.32 C ATOM 850 C PRO A 59 -18.787 -2.012 13.997 1.00 74.40 C ATOM 851 O PRO A 59 -19.138 -0.895 13.610 1.00 3.51 O ATOM 852 CB PRO A 59 -20.294 -4.001 13.525 1.00 1.41 C ATOM 853 CG PRO A 59 -21.624 -3.498 13.090 1.00 74.00 C ATOM 854 CD PRO A 59 -22.227 -2.817 14.282 1.00 11.03 C ATOM 0 HA PRO A 59 -19.264 -3.475 15.405 1.00 0.32 H new ATOM 0 HB2 PRO A 59 -19.600 -4.052 12.686 1.00 1.41 H new ATOM 0 HB3 PRO A 59 -20.370 -5.007 13.937 1.00 1.41 H new ATOM 0 HG2 PRO A 59 -21.523 -2.804 12.255 1.00 74.00 H new ATOM 0 HG3 PRO A 59 -22.257 -4.317 12.749 1.00 74.00 H new ATOM 0 HD2 PRO A 59 -22.857 -1.977 13.988 1.00 11.03 H new ATOM 0 HD3 PRO A 59 -22.853 -3.498 14.858 1.00 11.03 H new ATOM 862 N VAL A 60 -17.529 -2.439 13.917 1.00 14.21 N ATOM 863 CA VAL A 60 -16.417 -1.527 13.657 1.00 74.01 C ATOM 864 C VAL A 60 -15.900 -1.631 12.203 1.00 14.41 C ATOM 865 O VAL A 60 -15.779 -2.720 11.629 1.00 52.22 O ATOM 866 CB VAL A 60 -15.284 -1.746 14.717 1.00 24.33 C ATOM 867 CG1 VAL A 60 -14.756 -3.172 14.715 1.00 43.43 C ATOM 868 CG2 VAL A 60 -14.141 -0.748 14.561 1.00 12.10 C ATOM 0 H VAL A 60 -17.253 -3.415 14.029 1.00 14.21 H new ATOM 0 HA VAL A 60 -16.782 -0.505 13.762 1.00 74.01 H new ATOM 0 HB VAL A 60 -15.748 -1.567 15.687 1.00 24.33 H new ATOM 0 HG11 VAL A 60 -13.973 -3.271 15.467 1.00 43.43 H new ATOM 0 HG12 VAL A 60 -15.569 -3.861 14.944 1.00 43.43 H new ATOM 0 HG13 VAL A 60 -14.347 -3.407 13.732 1.00 43.43 H new ATOM 0 HG21 VAL A 60 -13.382 -0.942 15.319 1.00 12.10 H new ATOM 0 HG22 VAL A 60 -13.699 -0.853 13.570 1.00 12.10 H new ATOM 0 HG23 VAL A 60 -14.524 0.265 14.682 1.00 12.10 H new ATOM 878 N LEU A 61 -15.642 -0.459 11.619 1.00 21.35 N ATOM 879 CA LEU A 61 -15.131 -0.320 10.255 1.00 23.24 C ATOM 880 C LEU A 61 -13.606 -0.618 10.173 1.00 5.40 C ATOM 881 O LEU A 61 -12.920 -0.572 11.197 1.00 11.40 O ATOM 882 CB LEU A 61 -15.498 1.088 9.651 1.00 35.42 C ATOM 883 CG LEU A 61 -15.390 2.402 10.498 1.00 12.13 C ATOM 884 CD1 LEU A 61 -16.557 2.565 11.465 1.00 3.55 C ATOM 885 CD2 LEU A 61 -14.075 2.520 11.254 1.00 22.22 C ATOM 0 H LEU A 61 -15.785 0.435 12.089 1.00 21.35 H new ATOM 0 HA LEU A 61 -15.624 -1.073 9.640 1.00 23.24 H new ATOM 0 HB2 LEU A 61 -14.870 1.227 8.771 1.00 35.42 H new ATOM 0 HB3 LEU A 61 -16.528 1.022 9.300 1.00 35.42 H new ATOM 0 HG LEU A 61 -15.427 3.210 9.768 1.00 12.13 H new ATOM 0 HD11 LEU A 61 -16.436 3.490 12.029 1.00 3.55 H new ATOM 0 HD12 LEU A 61 -17.491 2.601 10.905 1.00 3.55 H new ATOM 0 HD13 LEU A 61 -16.579 1.721 12.154 1.00 3.55 H new ATOM 0 HD21 LEU A 61 -14.063 3.451 11.820 1.00 22.22 H new ATOM 0 HD22 LEU A 61 -13.972 1.678 11.938 1.00 22.22 H new ATOM 0 HD23 LEU A 61 -13.246 2.516 10.546 1.00 22.22 H new ATOM 897 N PRO A 62 -13.048 -0.950 8.968 1.00 44.11 N ATOM 898 CA PRO A 62 -11.632 -1.308 8.833 1.00 14.11 C ATOM 899 C PRO A 62 -10.706 -0.104 8.685 1.00 33.43 C ATOM 900 O PRO A 62 -11.080 0.926 8.132 1.00 23.32 O ATOM 901 CB PRO A 62 -11.609 -2.131 7.553 1.00 11.42 C ATOM 902 CG PRO A 62 -12.669 -1.527 6.704 1.00 12.13 C ATOM 903 CD PRO A 62 -13.729 -1.016 7.653 1.00 1.42 C ATOM 0 HA PRO A 62 -11.271 -1.825 9.722 1.00 14.11 H new ATOM 0 HB2 PRO A 62 -10.635 -2.082 7.067 1.00 11.42 H new ATOM 0 HB3 PRO A 62 -11.812 -3.183 7.754 1.00 11.42 H new ATOM 0 HG2 PRO A 62 -12.267 -0.716 6.097 1.00 12.13 H new ATOM 0 HG3 PRO A 62 -13.084 -2.264 6.017 1.00 12.13 H new ATOM 0 HD2 PRO A 62 -14.097 -0.037 7.347 1.00 1.42 H new ATOM 0 HD3 PRO A 62 -14.589 -1.684 7.684 1.00 1.42 H new ATOM 911 N THR A 63 -9.496 -0.251 9.180 1.00 40.43 N ATOM 912 CA THR A 63 -8.489 0.765 9.011 1.00 12.22 C ATOM 913 C THR A 63 -7.453 0.275 7.993 1.00 71.21 C ATOM 914 O THR A 63 -7.060 -0.893 8.012 1.00 33.22 O ATOM 915 CB THR A 63 -7.855 1.168 10.387 1.00 63.35 C ATOM 916 OG1 THR A 63 -7.270 2.471 10.299 1.00 1.24 O ATOM 917 CG2 THR A 63 -6.787 0.206 10.884 1.00 71.12 C ATOM 0 H THR A 63 -9.188 -1.070 9.705 1.00 40.43 H new ATOM 0 HA THR A 63 -8.941 1.676 8.618 1.00 12.22 H new ATOM 0 HB THR A 63 -8.678 1.144 11.101 1.00 63.35 H new ATOM 0 HG1 THR A 63 -6.879 2.713 11.164 1.00 1.24 H new ATOM 0 HG21 THR A 63 -6.399 0.556 11.841 1.00 71.12 H new ATOM 0 HG22 THR A 63 -7.221 -0.786 11.009 1.00 71.12 H new ATOM 0 HG23 THR A 63 -5.975 0.158 10.159 1.00 71.12 H new ATOM 925 N ALA A 64 -7.095 1.134 7.052 1.00 53.55 N ATOM 926 CA ALA A 64 -6.066 0.807 6.085 1.00 12.02 C ATOM 927 C ALA A 64 -4.745 1.415 6.498 1.00 61.41 C ATOM 928 O ALA A 64 -4.585 2.636 6.536 1.00 71.40 O ATOM 929 CB ALA A 64 -6.454 1.271 4.697 1.00 12.53 C ATOM 0 H ALA A 64 -7.503 2.062 6.939 1.00 53.55 H new ATOM 0 HA ALA A 64 -5.959 -0.277 6.058 1.00 12.02 H new ATOM 0 HB1 ALA A 64 -5.663 1.012 3.993 1.00 12.53 H new ATOM 0 HB2 ALA A 64 -7.382 0.784 4.396 1.00 12.53 H new ATOM 0 HB3 ALA A 64 -6.597 2.352 4.701 1.00 12.53 H new ATOM 935 N ARG A 65 -3.805 0.549 6.823 1.00 14.44 N ATOM 936 CA ARG A 65 -2.469 0.957 7.220 1.00 72.32 C ATOM 937 C ARG A 65 -1.479 0.000 6.606 1.00 23.33 C ATOM 938 O ARG A 65 -1.789 -1.176 6.429 1.00 32.33 O ATOM 939 CB ARG A 65 -2.304 0.967 8.743 1.00 64.50 C ATOM 940 CG ARG A 65 -2.800 2.230 9.415 1.00 74.35 C ATOM 941 CD ARG A 65 -2.574 2.179 10.912 1.00 4.52 C ATOM 942 NE ARG A 65 -2.949 3.430 11.566 1.00 74.11 N ATOM 943 CZ ARG A 65 -3.664 3.513 12.690 1.00 62.13 C ATOM 944 NH1 ARG A 65 -4.133 2.416 13.282 1.00 31.12 N ATOM 945 NH2 ARG A 65 -3.915 4.710 13.215 1.00 24.21 N ATOM 0 H ARG A 65 -3.946 -0.461 6.820 1.00 14.44 H new ATOM 0 HA ARG A 65 -2.295 1.974 6.869 1.00 72.32 H new ATOM 0 HB2 ARG A 65 -2.838 0.113 9.160 1.00 64.50 H new ATOM 0 HB3 ARG A 65 -1.250 0.831 8.983 1.00 64.50 H new ATOM 0 HG2 ARG A 65 -2.285 3.094 8.996 1.00 74.35 H new ATOM 0 HG3 ARG A 65 -3.862 2.361 9.209 1.00 74.35 H new ATOM 0 HD2 ARG A 65 -3.153 1.360 11.338 1.00 4.52 H new ATOM 0 HD3 ARG A 65 -1.524 1.966 11.113 1.00 4.52 H new ATOM 0 HE ARG A 65 -2.643 4.302 11.133 1.00 74.11 H new ATOM 0 HH11 ARG A 65 -3.947 1.499 12.877 1.00 31.12 H new ATOM 0 HH12 ARG A 65 -4.678 2.493 14.141 1.00 31.12 H new ATOM 0 HH21 ARG A 65 -3.562 5.551 12.759 1.00 24.21 H new ATOM 0 HH22 ARG A 65 -4.460 4.786 14.074 1.00 24.21 H new ATOM 959 N PHE A 66 -0.306 0.502 6.257 1.00 25.33 N ATOM 960 CA PHE A 66 0.729 -0.330 5.676 1.00 21.25 C ATOM 961 C PHE A 66 2.093 0.303 5.841 1.00 2.12 C ATOM 962 O PHE A 66 2.219 1.529 5.891 1.00 44.24 O ATOM 963 CB PHE A 66 0.445 -0.656 4.194 1.00 65.43 C ATOM 964 CG PHE A 66 0.317 0.507 3.248 1.00 34.32 C ATOM 965 CD1 PHE A 66 -0.797 1.332 3.268 1.00 42.35 C ATOM 966 CD2 PHE A 66 1.301 0.748 2.310 1.00 43.11 C ATOM 967 CE1 PHE A 66 -0.918 2.372 2.384 1.00 71.31 C ATOM 968 CE2 PHE A 66 1.177 1.784 1.419 1.00 42.23 C ATOM 969 CZ PHE A 66 0.067 2.598 1.459 1.00 30.53 C ATOM 0 H PHE A 66 -0.049 1.483 6.367 1.00 25.33 H new ATOM 0 HA PHE A 66 0.725 -1.274 6.220 1.00 21.25 H new ATOM 0 HB2 PHE A 66 1.245 -1.301 3.830 1.00 65.43 H new ATOM 0 HB3 PHE A 66 -0.478 -1.234 4.146 1.00 65.43 H new ATOM 0 HD1 PHE A 66 -1.580 1.153 3.990 1.00 42.35 H new ATOM 0 HD2 PHE A 66 2.176 0.116 2.277 1.00 43.11 H new ATOM 0 HE1 PHE A 66 -1.787 3.012 2.416 1.00 71.31 H new ATOM 0 HE2 PHE A 66 1.950 1.961 0.686 1.00 42.23 H new ATOM 0 HZ PHE A 66 -0.027 3.416 0.760 1.00 30.53 H new ATOM 979 N THR A 67 3.107 -0.539 5.936 1.00 61.25 N ATOM 980 CA THR A 67 4.471 -0.086 6.099 1.00 62.31 C ATOM 981 C THR A 67 5.274 -0.488 4.867 1.00 70.40 C ATOM 982 O THR A 67 5.204 -1.628 4.430 1.00 2.12 O ATOM 983 CB THR A 67 5.098 -0.698 7.381 1.00 70.43 C ATOM 984 OG1 THR A 67 4.244 -0.431 8.505 1.00 31.50 O ATOM 985 CG2 THR A 67 6.486 -0.129 7.667 1.00 64.34 C ATOM 0 H THR A 67 3.005 -1.553 5.902 1.00 61.25 H new ATOM 0 HA THR A 67 4.485 0.999 6.205 1.00 62.31 H new ATOM 0 HB THR A 67 5.199 -1.771 7.219 1.00 70.43 H new ATOM 0 HG1 THR A 67 4.638 -0.818 9.314 1.00 31.50 H new ATOM 0 HG21 THR A 67 6.887 -0.585 8.572 1.00 64.34 H new ATOM 0 HG22 THR A 67 7.148 -0.345 6.828 1.00 64.34 H new ATOM 0 HG23 THR A 67 6.416 0.950 7.805 1.00 64.34 H new ATOM 993 N SER A 68 6.000 0.443 4.292 1.00 61.10 N ATOM 994 CA SER A 68 6.865 0.131 3.170 1.00 62.24 C ATOM 995 C SER A 68 8.291 -0.052 3.672 1.00 33.43 C ATOM 996 O SER A 68 8.719 0.666 4.583 1.00 13.33 O ATOM 997 CB SER A 68 6.779 1.241 2.124 1.00 32.41 C ATOM 998 OG SER A 68 5.433 1.455 1.725 1.00 21.11 O ATOM 0 H SER A 68 6.011 1.422 4.579 1.00 61.10 H new ATOM 0 HA SER A 68 6.544 -0.797 2.697 1.00 62.24 H new ATOM 0 HB2 SER A 68 7.193 2.163 2.531 1.00 32.41 H new ATOM 0 HB3 SER A 68 7.383 0.976 1.256 1.00 32.41 H new ATOM 0 HG SER A 68 5.400 1.613 0.758 1.00 21.11 H new ATOM 1004 N ASP A 69 8.997 -1.044 3.106 1.00 73.32 N ATOM 1005 CA ASP A 69 10.376 -1.358 3.505 1.00 43.30 C ATOM 1006 C ASP A 69 11.307 -0.183 3.208 1.00 70.42 C ATOM 1007 O ASP A 69 12.155 0.174 4.030 1.00 51.51 O ATOM 1008 CB ASP A 69 10.866 -2.630 2.802 1.00 32.21 C ATOM 1009 CG ASP A 69 12.139 -3.183 3.418 1.00 20.30 C ATOM 1010 OD1 ASP A 69 12.075 -3.695 4.553 1.00 22.41 O ATOM 1011 OD2 ASP A 69 13.206 -3.101 2.780 1.00 74.23 O ATOM 0 H ASP A 69 8.632 -1.645 2.367 1.00 73.32 H new ATOM 0 HA ASP A 69 10.387 -1.536 4.580 1.00 43.30 H new ATOM 0 HB2 ASP A 69 10.085 -3.389 2.847 1.00 32.21 H new ATOM 0 HB3 ASP A 69 11.041 -2.414 1.748 1.00 32.21 H new ATOM 1016 N ILE A 70 11.124 0.425 2.044 1.00 72.22 N ATOM 1017 CA ILE A 70 11.728 1.714 1.745 1.00 33.34 C ATOM 1018 C ILE A 70 10.639 2.734 1.435 1.00 33.34 C ATOM 1019 O ILE A 70 9.592 2.392 0.888 1.00 34.41 O ATOM 1020 CB ILE A 70 12.775 1.660 0.579 1.00 72.31 C ATOM 1021 CG1 ILE A 70 12.226 0.971 -0.685 1.00 52.23 C ATOM 1022 CG2 ILE A 70 14.062 0.982 1.032 1.00 31.31 C ATOM 1023 CD1 ILE A 70 11.667 1.926 -1.729 1.00 13.03 C ATOM 0 H ILE A 70 10.558 0.042 1.287 1.00 72.22 H new ATOM 0 HA ILE A 70 12.282 2.015 2.634 1.00 33.34 H new ATOM 0 HB ILE A 70 12.991 2.695 0.313 1.00 72.31 H new ATOM 0 HG12 ILE A 70 13.023 0.382 -1.139 1.00 52.23 H new ATOM 0 HG13 ILE A 70 11.442 0.273 -0.392 1.00 52.23 H new ATOM 0 HG21 ILE A 70 14.771 0.958 0.205 1.00 31.31 H new ATOM 0 HG22 ILE A 70 14.494 1.539 1.863 1.00 31.31 H new ATOM 0 HG23 ILE A 70 13.843 -0.037 1.352 1.00 31.31 H new ATOM 0 HD11 ILE A 70 11.303 1.357 -2.584 1.00 13.03 H new ATOM 0 HD12 ILE A 70 10.846 2.497 -1.297 1.00 13.03 H new ATOM 0 HD13 ILE A 70 12.452 2.609 -2.055 1.00 13.03 H new ATOM 1035 N THR A 71 10.880 3.967 1.817 1.00 23.42 N ATOM 1036 CA THR A 71 10.014 5.077 1.436 1.00 41.43 C ATOM 1037 C THR A 71 10.827 6.127 0.693 1.00 61.23 C ATOM 1038 O THR A 71 10.288 6.943 -0.050 1.00 62.22 O ATOM 1039 CB THR A 71 9.336 5.728 2.662 1.00 74.40 C ATOM 1040 OG1 THR A 71 10.296 5.928 3.706 1.00 40.05 O ATOM 1041 CG2 THR A 71 8.175 4.890 3.180 1.00 43.54 C ATOM 0 H THR A 71 11.675 4.236 2.397 1.00 23.42 H new ATOM 0 HA THR A 71 9.230 4.679 0.792 1.00 41.43 H new ATOM 0 HB THR A 71 8.935 6.690 2.343 1.00 74.40 H new ATOM 0 HG1 THR A 71 9.858 6.343 4.478 1.00 40.05 H new ATOM 0 HG21 THR A 71 7.726 5.383 4.042 1.00 43.54 H new ATOM 0 HG22 THR A 71 7.427 4.780 2.395 1.00 43.54 H new ATOM 0 HG23 THR A 71 8.540 3.906 3.474 1.00 43.54 H new ATOM 1049 N GLU A 72 12.141 6.051 0.870 1.00 31.43 N ATOM 1050 CA GLU A 72 13.066 7.058 0.394 1.00 73.14 C ATOM 1051 C GLU A 72 14.400 6.373 0.076 1.00 30.30 C ATOM 1052 O GLU A 72 14.673 5.277 0.587 1.00 55.41 O ATOM 1053 CB GLU A 72 13.235 8.132 1.479 1.00 2.22 C ATOM 1054 CG GLU A 72 13.974 9.385 1.027 1.00 43.20 C ATOM 1055 CD GLU A 72 14.289 10.307 2.174 1.00 41.41 C ATOM 1056 OE1 GLU A 72 15.234 10.012 2.928 1.00 74.32 O ATOM 1057 OE2 GLU A 72 13.603 11.334 2.326 1.00 43.01 O ATOM 0 H GLU A 72 12.594 5.276 1.355 1.00 31.43 H new ATOM 0 HA GLU A 72 12.694 7.542 -0.509 1.00 73.14 H new ATOM 0 HB2 GLU A 72 12.248 8.420 1.842 1.00 2.22 H new ATOM 0 HB3 GLU A 72 13.770 7.696 2.322 1.00 2.22 H new ATOM 0 HG2 GLU A 72 14.900 9.098 0.529 1.00 43.20 H new ATOM 0 HG3 GLU A 72 13.369 9.916 0.292 1.00 43.20 H new ATOM 1064 N GLY A 73 15.206 7.003 -0.768 1.00 71.53 N ATOM 1065 CA GLY A 73 16.457 6.413 -1.197 1.00 12.42 C ATOM 1066 C GLY A 73 16.368 5.985 -2.641 1.00 34.41 C ATOM 1067 O GLY A 73 15.432 6.378 -3.328 1.00 13.13 O ATOM 0 H GLY A 73 15.012 7.922 -1.166 1.00 71.53 H new ATOM 0 HA2 GLY A 73 17.267 7.132 -1.073 1.00 12.42 H new ATOM 0 HA3 GLY A 73 16.695 5.554 -0.570 1.00 12.42 H new ATOM 1071 N PHE A 74 17.303 5.161 -3.103 1.00 52.22 N ATOM 1072 CA PHE A 74 17.276 4.710 -4.491 1.00 41.12 C ATOM 1073 C PHE A 74 16.261 3.573 -4.610 1.00 73.41 C ATOM 1074 O PHE A 74 16.077 2.814 -3.652 1.00 13.05 O ATOM 1075 CB PHE A 74 18.684 4.280 -4.986 1.00 61.40 C ATOM 1076 CG PHE A 74 19.160 2.908 -4.541 1.00 53.11 C ATOM 1077 CD1 PHE A 74 19.755 2.721 -3.306 1.00 42.05 C ATOM 1078 CD2 PHE A 74 19.007 1.804 -5.372 1.00 60.44 C ATOM 1079 CE1 PHE A 74 20.181 1.468 -2.908 1.00 55.14 C ATOM 1080 CE2 PHE A 74 19.430 0.555 -4.977 1.00 51.03 C ATOM 1081 CZ PHE A 74 20.016 0.385 -3.745 1.00 61.12 C ATOM 0 H PHE A 74 18.077 4.796 -2.548 1.00 52.22 H new ATOM 0 HA PHE A 74 16.973 5.536 -5.134 1.00 41.12 H new ATOM 0 HB2 PHE A 74 18.687 4.307 -6.076 1.00 61.40 H new ATOM 0 HB3 PHE A 74 19.408 5.021 -4.646 1.00 61.40 H new ATOM 0 HD1 PHE A 74 19.888 3.565 -2.645 1.00 42.05 H new ATOM 0 HD2 PHE A 74 18.549 1.928 -6.342 1.00 60.44 H new ATOM 0 HE1 PHE A 74 20.643 1.337 -1.941 1.00 55.14 H new ATOM 0 HE2 PHE A 74 19.301 -0.292 -5.635 1.00 51.03 H new ATOM 0 HZ PHE A 74 20.346 -0.595 -3.434 1.00 61.12 H new ATOM 1091 N ALA A 75 15.560 3.515 -5.744 1.00 65.13 N ATOM 1092 CA ALA A 75 14.606 2.439 -6.019 1.00 13.13 C ATOM 1093 C ALA A 75 15.293 1.071 -6.126 1.00 55.30 C ATOM 1094 O ALA A 75 16.146 0.863 -6.995 1.00 34.42 O ATOM 1095 CB ALA A 75 13.824 2.742 -7.288 1.00 4.10 C ATOM 0 H ALA A 75 15.636 4.205 -6.491 1.00 65.13 H new ATOM 0 HA ALA A 75 13.917 2.389 -5.176 1.00 13.13 H new ATOM 0 HB1 ALA A 75 13.118 1.935 -7.482 1.00 4.10 H new ATOM 0 HB2 ALA A 75 13.280 3.678 -7.165 1.00 4.10 H new ATOM 0 HB3 ALA A 75 14.513 2.831 -8.128 1.00 4.10 H new ATOM 1101 N PRO A 76 14.951 0.132 -5.211 1.00 21.43 N ATOM 1102 CA PRO A 76 15.478 -1.228 -5.213 1.00 12.13 C ATOM 1103 C PRO A 76 14.676 -2.151 -6.130 1.00 44.55 C ATOM 1104 O PRO A 76 13.747 -1.713 -6.802 1.00 13.01 O ATOM 1105 CB PRO A 76 15.333 -1.672 -3.739 1.00 4.31 C ATOM 1106 CG PRO A 76 14.692 -0.527 -3.020 1.00 65.34 C ATOM 1107 CD PRO A 76 14.044 0.315 -4.078 1.00 53.14 C ATOM 0 HA PRO A 76 16.502 -1.271 -5.584 1.00 12.13 H new ATOM 0 HB2 PRO A 76 14.722 -2.571 -3.662 1.00 4.31 H new ATOM 0 HB3 PRO A 76 16.305 -1.909 -3.306 1.00 4.31 H new ATOM 0 HG2 PRO A 76 13.956 -0.882 -2.299 1.00 65.34 H new ATOM 0 HG3 PRO A 76 15.432 0.048 -2.463 1.00 65.34 H new ATOM 0 HD2 PRO A 76 13.033 -0.023 -4.306 1.00 53.14 H new ATOM 0 HD3 PRO A 76 13.971 1.361 -3.779 1.00 53.14 H new ATOM 1115 N LEU A 77 15.015 -3.431 -6.120 1.00 1.20 N ATOM 1116 CA LEU A 77 14.372 -4.410 -6.994 1.00 45.50 C ATOM 1117 C LEU A 77 12.995 -4.826 -6.460 1.00 2.01 C ATOM 1118 O LEU A 77 11.955 -4.404 -6.981 1.00 44.12 O ATOM 1119 CB LEU A 77 15.285 -5.647 -7.223 1.00 21.31 C ATOM 1120 CG LEU A 77 16.562 -5.780 -6.356 1.00 51.04 C ATOM 1121 CD1 LEU A 77 16.253 -6.253 -4.937 1.00 62.14 C ATOM 1122 CD2 LEU A 77 17.546 -6.725 -7.021 1.00 71.41 C ATOM 0 H LEU A 77 15.736 -3.821 -5.513 1.00 1.20 H new ATOM 0 HA LEU A 77 14.215 -3.930 -7.960 1.00 45.50 H new ATOM 0 HB2 LEU A 77 14.681 -6.541 -7.067 1.00 21.31 H new ATOM 0 HB3 LEU A 77 15.590 -5.647 -8.269 1.00 21.31 H new ATOM 0 HG LEU A 77 17.005 -4.788 -6.275 1.00 51.04 H new ATOM 0 HD11 LEU A 77 17.180 -6.330 -4.369 1.00 62.14 H new ATOM 0 HD12 LEU A 77 15.589 -5.538 -4.452 1.00 62.14 H new ATOM 0 HD13 LEU A 77 15.769 -7.229 -4.976 1.00 62.14 H new ATOM 0 HD21 LEU A 77 18.440 -6.812 -6.404 1.00 71.41 H new ATOM 0 HD22 LEU A 77 17.087 -7.707 -7.135 1.00 71.41 H new ATOM 0 HD23 LEU A 77 17.818 -6.336 -8.002 1.00 71.41 H new ATOM 1134 N SER A 78 13.002 -5.640 -5.427 1.00 4.53 N ATOM 1135 CA SER A 78 11.785 -6.148 -4.839 1.00 50.45 C ATOM 1136 C SER A 78 11.451 -5.387 -3.561 1.00 44.33 C ATOM 1137 O SER A 78 12.061 -5.606 -2.508 1.00 54.11 O ATOM 1138 CB SER A 78 11.927 -7.651 -4.593 1.00 13.24 C ATOM 1139 OG SER A 78 13.135 -7.950 -3.910 1.00 41.03 O ATOM 0 H SER A 78 13.854 -5.968 -4.972 1.00 4.53 H new ATOM 0 HA SER A 78 10.953 -5.995 -5.526 1.00 50.45 H new ATOM 0 HB2 SER A 78 11.079 -8.008 -4.009 1.00 13.24 H new ATOM 0 HB3 SER A 78 11.904 -8.181 -5.545 1.00 13.24 H new ATOM 0 HG SER A 78 13.276 -7.297 -3.193 1.00 41.03 H new ATOM 1145 N VAL A 79 10.509 -4.454 -3.680 1.00 65.11 N ATOM 1146 CA VAL A 79 10.066 -3.651 -2.538 1.00 25.40 C ATOM 1147 C VAL A 79 8.984 -4.401 -1.756 1.00 41.45 C ATOM 1148 O VAL A 79 7.967 -4.818 -2.315 1.00 71.12 O ATOM 1149 CB VAL A 79 9.556 -2.243 -2.974 1.00 53.01 C ATOM 1150 CG1 VAL A 79 9.105 -1.402 -1.779 1.00 51.25 C ATOM 1151 CG2 VAL A 79 10.638 -1.502 -3.749 1.00 1.34 C ATOM 0 H VAL A 79 10.036 -4.234 -4.556 1.00 65.11 H new ATOM 0 HA VAL A 79 10.928 -3.491 -1.891 1.00 25.40 H new ATOM 0 HB VAL A 79 8.690 -2.399 -3.618 1.00 53.01 H new ATOM 0 HG11 VAL A 79 8.758 -0.430 -2.129 1.00 51.25 H new ATOM 0 HG12 VAL A 79 8.293 -1.912 -1.261 1.00 51.25 H new ATOM 0 HG13 VAL A 79 9.942 -1.264 -1.095 1.00 51.25 H new ATOM 0 HG21 VAL A 79 10.266 -0.521 -4.046 1.00 1.34 H new ATOM 0 HG22 VAL A 79 11.519 -1.380 -3.118 1.00 1.34 H new ATOM 0 HG23 VAL A 79 10.905 -2.073 -4.638 1.00 1.34 H new ATOM 1161 N ARG A 80 9.233 -4.586 -0.464 1.00 21.04 N ATOM 1162 CA ARG A 80 8.315 -5.307 0.403 1.00 50.34 C ATOM 1163 C ARG A 80 7.349 -4.373 1.110 1.00 70.32 C ATOM 1164 O ARG A 80 7.669 -3.219 1.411 1.00 40.52 O ATOM 1165 CB ARG A 80 9.078 -6.165 1.414 1.00 43.22 C ATOM 1166 CG ARG A 80 9.591 -7.463 0.814 1.00 50.41 C ATOM 1167 CD ARG A 80 8.429 -8.320 0.323 1.00 12.40 C ATOM 1168 NE ARG A 80 8.854 -9.422 -0.527 1.00 52.20 N ATOM 1169 CZ ARG A 80 8.022 -10.178 -1.246 1.00 3.24 C ATOM 1170 NH1 ARG A 80 6.702 -9.998 -1.178 1.00 61.44 N ATOM 1171 NH2 ARG A 80 8.517 -11.124 -2.025 1.00 32.12 N ATOM 0 H ARG A 80 10.070 -4.243 0.006 1.00 21.04 H new ATOM 0 HA ARG A 80 7.723 -5.966 -0.232 1.00 50.34 H new ATOM 0 HB2 ARG A 80 9.919 -5.594 1.807 1.00 43.22 H new ATOM 0 HB3 ARG A 80 8.425 -6.392 2.257 1.00 43.22 H new ATOM 0 HG2 ARG A 80 10.266 -7.246 -0.014 1.00 50.41 H new ATOM 0 HG3 ARG A 80 10.167 -8.012 1.559 1.00 50.41 H new ATOM 0 HD2 ARG A 80 7.890 -8.719 1.183 1.00 12.40 H new ATOM 0 HD3 ARG A 80 7.729 -7.692 -0.229 1.00 12.40 H new ATOM 0 HE ARG A 80 9.851 -9.630 -0.576 1.00 52.20 H new ATOM 0 HH11 ARG A 80 6.317 -9.275 -0.571 1.00 61.44 H new ATOM 0 HH12 ARG A 80 6.078 -10.583 -1.733 1.00 61.44 H new ATOM 0 HH21 ARG A 80 9.525 -11.270 -2.072 1.00 32.12 H new ATOM 0 HH22 ARG A 80 7.891 -11.708 -2.579 1.00 32.12 H new ATOM 1185 N PHE A 81 6.156 -4.898 1.354 1.00 24.13 N ATOM 1186 CA PHE A 81 5.084 -4.143 1.967 1.00 41.33 C ATOM 1187 C PHE A 81 4.430 -4.936 3.098 1.00 54.12 C ATOM 1188 O PHE A 81 4.080 -6.103 2.942 1.00 61.24 O ATOM 1189 CB PHE A 81 4.051 -3.685 0.909 1.00 21.30 C ATOM 1190 CG PHE A 81 3.751 -4.678 -0.203 1.00 34.24 C ATOM 1191 CD1 PHE A 81 2.859 -5.720 -0.015 1.00 14.23 C ATOM 1192 CD2 PHE A 81 4.357 -4.545 -1.445 1.00 21.32 C ATOM 1193 CE1 PHE A 81 2.578 -6.610 -1.032 1.00 71.51 C ATOM 1194 CE2 PHE A 81 4.083 -5.434 -2.465 1.00 55.10 C ATOM 1195 CZ PHE A 81 3.192 -6.467 -2.257 1.00 72.43 C ATOM 0 H PHE A 81 5.909 -5.862 1.130 1.00 24.13 H new ATOM 0 HA PHE A 81 5.512 -3.244 2.410 1.00 41.33 H new ATOM 0 HB2 PHE A 81 3.118 -3.449 1.420 1.00 21.30 H new ATOM 0 HB3 PHE A 81 4.409 -2.760 0.457 1.00 21.30 H new ATOM 0 HD1 PHE A 81 2.375 -5.838 0.943 1.00 14.23 H new ATOM 0 HD2 PHE A 81 5.052 -3.736 -1.615 1.00 21.32 H new ATOM 0 HE1 PHE A 81 1.879 -7.416 -0.868 1.00 71.51 H new ATOM 0 HE2 PHE A 81 4.565 -5.321 -3.425 1.00 55.10 H new ATOM 0 HZ PHE A 81 2.976 -7.163 -3.054 1.00 72.43 H new ATOM 1205 N LYS A 82 4.317 -4.294 4.248 1.00 42.41 N ATOM 1206 CA LYS A 82 3.728 -4.892 5.436 1.00 5.52 C ATOM 1207 C LYS A 82 2.259 -4.504 5.541 1.00 3.45 C ATOM 1208 O LYS A 82 1.919 -3.330 5.435 1.00 42.42 O ATOM 1209 CB LYS A 82 4.508 -4.426 6.685 1.00 53.21 C ATOM 1210 CG LYS A 82 3.926 -4.869 8.034 1.00 42.01 C ATOM 1211 CD LYS A 82 3.899 -6.388 8.199 1.00 14.03 C ATOM 1212 CE LYS A 82 5.298 -6.981 8.295 1.00 44.24 C ATOM 1213 NZ LYS A 82 5.272 -8.459 8.420 1.00 74.43 N ATOM 0 H LYS A 82 4.634 -3.334 4.386 1.00 42.41 H new ATOM 0 HA LYS A 82 3.789 -5.978 5.368 1.00 5.52 H new ATOM 0 HB2 LYS A 82 5.531 -4.796 6.612 1.00 53.21 H new ATOM 0 HB3 LYS A 82 4.561 -3.337 6.673 1.00 53.21 H new ATOM 0 HG2 LYS A 82 4.515 -4.431 8.840 1.00 42.01 H new ATOM 0 HG3 LYS A 82 2.913 -4.480 8.132 1.00 42.01 H new ATOM 0 HD2 LYS A 82 3.335 -6.644 9.096 1.00 14.03 H new ATOM 0 HD3 LYS A 82 3.374 -6.834 7.354 1.00 14.03 H new ATOM 0 HE2 LYS A 82 5.870 -6.703 7.410 1.00 44.24 H new ATOM 0 HE3 LYS A 82 5.814 -6.554 9.155 1.00 44.24 H new ATOM 0 HZ1 LYS A 82 6.246 -8.819 8.482 1.00 74.43 H new ATOM 0 HZ2 LYS A 82 4.749 -8.726 9.278 1.00 74.43 H new ATOM 0 HZ3 LYS A 82 4.804 -8.870 7.587 1.00 74.43 H new ATOM 1227 N ASP A 83 1.410 -5.501 5.750 1.00 30.51 N ATOM 1228 CA ASP A 83 0.001 -5.273 6.043 1.00 60.12 C ATOM 1229 C ASP A 83 -0.136 -4.862 7.503 1.00 14.15 C ATOM 1230 O ASP A 83 0.230 -5.622 8.404 1.00 72.31 O ATOM 1231 CB ASP A 83 -0.836 -6.540 5.799 1.00 2.21 C ATOM 1232 CG ASP A 83 -0.795 -7.037 4.367 1.00 14.33 C ATOM 1233 OD1 ASP A 83 -1.618 -6.586 3.560 1.00 64.23 O ATOM 1234 OD2 ASP A 83 0.033 -7.924 4.063 1.00 61.14 O ATOM 0 H ASP A 83 1.676 -6.485 5.722 1.00 30.51 H new ATOM 0 HA ASP A 83 -0.367 -4.488 5.382 1.00 60.12 H new ATOM 0 HB2 ASP A 83 -0.480 -7.332 6.458 1.00 2.21 H new ATOM 0 HB3 ASP A 83 -1.871 -6.338 6.074 1.00 2.21 H new ATOM 1239 N PHE A 84 -0.638 -3.659 7.739 1.00 31.41 N ATOM 1240 CA PHE A 84 -0.768 -3.137 9.102 1.00 40.11 C ATOM 1241 C PHE A 84 -2.253 -2.865 9.401 1.00 41.53 C ATOM 1242 O PHE A 84 -2.618 -2.423 10.493 1.00 4.24 O ATOM 1243 CB PHE A 84 0.087 -1.859 9.242 1.00 51.41 C ATOM 1244 CG PHE A 84 0.627 -1.595 10.629 1.00 4.10 C ATOM 1245 CD1 PHE A 84 -0.118 -0.904 11.572 1.00 10.51 C ATOM 1246 CD2 PHE A 84 1.894 -2.039 10.982 1.00 41.13 C ATOM 1247 CE1 PHE A 84 0.383 -0.665 12.836 1.00 71.34 C ATOM 1248 CE2 PHE A 84 2.399 -1.800 12.243 1.00 21.23 C ATOM 1249 CZ PHE A 84 1.642 -1.112 13.172 1.00 41.42 C ATOM 0 H PHE A 84 -0.963 -3.023 7.010 1.00 31.41 H new ATOM 0 HA PHE A 84 -0.406 -3.866 9.827 1.00 40.11 H new ATOM 0 HB2 PHE A 84 0.926 -1.925 8.549 1.00 51.41 H new ATOM 0 HB3 PHE A 84 -0.514 -1.003 8.934 1.00 51.41 H new ATOM 0 HD1 PHE A 84 -1.104 -0.548 11.314 1.00 10.51 H new ATOM 0 HD2 PHE A 84 2.491 -2.578 10.261 1.00 41.13 H new ATOM 0 HE1 PHE A 84 -0.211 -0.128 13.561 1.00 71.34 H new ATOM 0 HE2 PHE A 84 3.386 -2.151 12.504 1.00 21.23 H new ATOM 0 HZ PHE A 84 2.037 -0.925 14.160 1.00 41.42 H new ATOM 1259 N SER A 85 -3.085 -3.129 8.389 1.00 61.13 N ATOM 1260 CA SER A 85 -4.530 -2.945 8.452 1.00 55.52 C ATOM 1261 C SER A 85 -5.196 -3.775 9.548 1.00 12.22 C ATOM 1262 O SER A 85 -4.869 -4.945 9.758 1.00 21.30 O ATOM 1263 CB SER A 85 -5.141 -3.293 7.106 1.00 12.21 C ATOM 1264 OG SER A 85 -4.607 -2.466 6.091 1.00 73.53 O ATOM 0 H SER A 85 -2.763 -3.483 7.488 1.00 61.13 H new ATOM 0 HA SER A 85 -4.708 -1.898 8.699 1.00 55.52 H new ATOM 0 HB2 SER A 85 -4.946 -4.339 6.871 1.00 12.21 H new ATOM 0 HB3 SER A 85 -6.223 -3.173 7.149 1.00 12.21 H new ATOM 0 HG SER A 85 -4.789 -2.865 5.215 1.00 73.53 H new ATOM 1270 N GLU A 86 -6.136 -3.140 10.229 1.00 33.22 N ATOM 1271 CA GLU A 86 -6.836 -3.735 11.353 1.00 12.01 C ATOM 1272 C GLU A 86 -8.341 -3.633 11.104 1.00 42.21 C ATOM 1273 O GLU A 86 -8.781 -2.750 10.368 1.00 50.00 O ATOM 1274 CB GLU A 86 -6.433 -3.001 12.637 1.00 61.12 C ATOM 1275 CG GLU A 86 -6.923 -3.643 13.924 1.00 2.52 C ATOM 1276 CD GLU A 86 -6.639 -2.801 15.141 1.00 34.22 C ATOM 1277 OE1 GLU A 86 -5.471 -2.739 15.570 1.00 32.42 O ATOM 1278 OE2 GLU A 86 -7.588 -2.215 15.693 1.00 74.20 O ATOM 0 H GLU A 86 -6.436 -2.189 10.014 1.00 33.22 H new ATOM 0 HA GLU A 86 -6.573 -4.787 11.463 1.00 12.01 H new ATOM 0 HB2 GLU A 86 -5.346 -2.934 12.673 1.00 61.12 H new ATOM 0 HB3 GLU A 86 -6.814 -1.981 12.589 1.00 61.12 H new ATOM 0 HG2 GLU A 86 -7.996 -3.818 13.852 1.00 2.52 H new ATOM 0 HG3 GLU A 86 -6.448 -4.617 14.043 1.00 2.52 H new ATOM 1285 N ASN A 87 -9.097 -4.563 11.706 1.00 34.41 N ATOM 1286 CA ASN A 87 -10.578 -4.661 11.615 1.00 71.24 C ATOM 1287 C ASN A 87 -11.037 -4.930 10.176 1.00 12.44 C ATOM 1288 O ASN A 87 -12.134 -4.543 9.779 1.00 42.21 O ATOM 1289 CB ASN A 87 -11.290 -3.402 12.166 1.00 40.04 C ATOM 1290 CG ASN A 87 -10.920 -3.068 13.598 1.00 5.51 C ATOM 1291 OD1 ASN A 87 -11.442 -3.654 14.536 1.00 1.54 O ATOM 1292 ND2 ASN A 87 -10.054 -2.081 13.774 1.00 43.32 N ATOM 0 H ASN A 87 -8.691 -5.294 12.290 1.00 34.41 H new ATOM 0 HA ASN A 87 -10.862 -5.507 12.241 1.00 71.24 H new ATOM 0 HB2 ASN A 87 -11.047 -2.551 11.530 1.00 40.04 H new ATOM 0 HB3 ASN A 87 -12.368 -3.549 12.104 1.00 40.04 H new ATOM 0 HD21 ASN A 87 -9.802 -1.786 14.717 1.00 43.32 H new ATOM 0 HD22 ASN A 87 -9.639 -1.616 12.966 1.00 43.32 H new ATOM 1299 N ALA A 88 -10.214 -5.643 9.413 1.00 33.11 N ATOM 1300 CA ALA A 88 -10.464 -5.827 7.997 1.00 12.32 C ATOM 1301 C ALA A 88 -10.855 -7.263 7.689 1.00 31.22 C ATOM 1302 O ALA A 88 -10.263 -8.207 8.214 1.00 75.01 O ATOM 1303 CB ALA A 88 -9.240 -5.422 7.195 1.00 14.04 C ATOM 0 H ALA A 88 -9.370 -6.101 9.756 1.00 33.11 H new ATOM 0 HA ALA A 88 -11.300 -5.188 7.712 1.00 12.32 H new ATOM 0 HB1 ALA A 88 -9.438 -5.564 6.133 1.00 14.04 H new ATOM 0 HB2 ALA A 88 -9.011 -4.373 7.385 1.00 14.04 H new ATOM 0 HB3 ALA A 88 -8.391 -6.038 7.491 1.00 14.04 H new ATOM 1309 N THR A 89 -11.858 -7.404 6.836 1.00 14.51 N ATOM 1310 CA THR A 89 -12.317 -8.706 6.369 1.00 2.02 C ATOM 1311 C THR A 89 -11.503 -9.130 5.142 1.00 35.44 C ATOM 1312 O THR A 89 -11.111 -10.287 5.003 1.00 3.53 O ATOM 1313 CB THR A 89 -13.819 -8.645 5.990 1.00 44.41 C ATOM 1314 OG1 THR A 89 -14.548 -7.946 7.002 1.00 0.42 O ATOM 1315 CG2 THR A 89 -14.421 -10.034 5.819 1.00 15.35 C ATOM 0 H THR A 89 -12.379 -6.618 6.446 1.00 14.51 H new ATOM 0 HA THR A 89 -12.181 -9.432 7.171 1.00 2.02 H new ATOM 0 HB THR A 89 -13.891 -8.121 5.037 1.00 44.41 H new ATOM 0 HG1 THR A 89 -15.496 -7.909 6.756 1.00 0.42 H new ATOM 0 HG21 THR A 89 -15.474 -9.944 5.554 1.00 15.35 H new ATOM 0 HG22 THR A 89 -13.892 -10.565 5.028 1.00 15.35 H new ATOM 0 HG23 THR A 89 -14.328 -10.588 6.753 1.00 15.35 H new ATOM 1323 N SER A 90 -11.250 -8.163 4.261 1.00 61.23 N ATOM 1324 CA SER A 90 -10.519 -8.388 3.022 1.00 62.23 C ATOM 1325 C SER A 90 -9.495 -7.273 2.817 1.00 25.02 C ATOM 1326 O SER A 90 -9.590 -6.220 3.455 1.00 30.24 O ATOM 1327 CB SER A 90 -11.501 -8.412 1.842 1.00 53.31 C ATOM 1328 OG SER A 90 -12.537 -9.357 2.055 1.00 55.14 O ATOM 0 H SER A 90 -11.550 -7.197 4.391 1.00 61.23 H new ATOM 0 HA SER A 90 -10.000 -9.345 3.079 1.00 62.23 H new ATOM 0 HB2 SER A 90 -11.932 -7.421 1.705 1.00 53.31 H new ATOM 0 HB3 SER A 90 -10.965 -8.657 0.925 1.00 53.31 H new ATOM 0 HG SER A 90 -13.149 -9.350 1.289 1.00 55.14 H new ATOM 1334 N ARG A 91 -8.517 -7.514 1.948 1.00 74.45 N ATOM 1335 CA ARG A 91 -7.535 -6.496 1.583 1.00 45.44 C ATOM 1336 C ARG A 91 -7.348 -6.462 0.066 1.00 14.21 C ATOM 1337 O ARG A 91 -7.708 -7.416 -0.635 1.00 10.10 O ATOM 1338 CB ARG A 91 -6.195 -6.756 2.293 1.00 55.22 C ATOM 1339 CG ARG A 91 -5.436 -7.986 1.804 1.00 30.15 C ATOM 1340 CD ARG A 91 -4.334 -8.376 2.770 1.00 20.52 C ATOM 1341 NE ARG A 91 -4.881 -8.839 4.051 1.00 24.03 N ATOM 1342 CZ ARG A 91 -4.171 -9.431 5.012 1.00 31.11 C ATOM 1343 NH1 ARG A 91 -2.858 -9.566 4.899 1.00 24.35 N ATOM 1344 NH2 ARG A 91 -4.789 -9.879 6.097 1.00 21.02 N ATOM 0 H ARG A 91 -8.383 -8.411 1.481 1.00 74.45 H new ATOM 0 HA ARG A 91 -7.905 -5.523 1.907 1.00 45.44 H new ATOM 0 HB2 ARG A 91 -5.558 -5.880 2.167 1.00 55.22 H new ATOM 0 HB3 ARG A 91 -6.382 -6.863 3.362 1.00 55.22 H new ATOM 0 HG2 ARG A 91 -6.129 -8.819 1.684 1.00 30.15 H new ATOM 0 HG3 ARG A 91 -5.007 -7.784 0.822 1.00 30.15 H new ATOM 0 HD2 ARG A 91 -3.723 -9.163 2.328 1.00 20.52 H new ATOM 0 HD3 ARG A 91 -3.679 -7.522 2.940 1.00 20.52 H new ATOM 0 HE ARG A 91 -5.877 -8.698 4.218 1.00 24.03 H new ATOM 0 HH11 ARG A 91 -2.379 -9.215 4.070 1.00 24.35 H new ATOM 0 HH12 ARG A 91 -2.326 -10.021 5.641 1.00 24.35 H new ATOM 0 HH21 ARG A 91 -5.799 -9.769 6.191 1.00 21.02 H new ATOM 0 HH22 ARG A 91 -4.254 -10.333 6.837 1.00 21.02 H new ATOM 1358 N LEU A 92 -6.804 -5.358 -0.428 1.00 22.12 N ATOM 1359 CA LEU A 92 -6.555 -5.178 -1.847 1.00 72.52 C ATOM 1360 C LEU A 92 -5.402 -4.201 -2.050 1.00 41.20 C ATOM 1361 O LEU A 92 -5.500 -3.020 -1.715 1.00 60.14 O ATOM 1362 CB LEU A 92 -7.825 -4.674 -2.556 1.00 60.14 C ATOM 1363 CG LEU A 92 -7.776 -4.659 -4.091 1.00 44.03 C ATOM 1364 CD1 LEU A 92 -7.688 -6.074 -4.641 1.00 50.34 C ATOM 1365 CD2 LEU A 92 -8.997 -3.951 -4.653 1.00 41.41 C ATOM 0 H LEU A 92 -6.524 -4.563 0.146 1.00 22.12 H new ATOM 0 HA LEU A 92 -6.281 -6.139 -2.284 1.00 72.52 H new ATOM 0 HB2 LEU A 92 -8.663 -5.298 -2.245 1.00 60.14 H new ATOM 0 HB3 LEU A 92 -8.034 -3.662 -2.209 1.00 60.14 H new ATOM 0 HG LEU A 92 -6.883 -4.115 -4.398 1.00 44.03 H new ATOM 0 HD11 LEU A 92 -7.654 -6.040 -5.730 1.00 50.34 H new ATOM 0 HD12 LEU A 92 -6.785 -6.555 -4.265 1.00 50.34 H new ATOM 0 HD13 LEU A 92 -8.561 -6.643 -4.323 1.00 50.34 H new ATOM 0 HD21 LEU A 92 -8.947 -3.949 -5.742 1.00 41.41 H new ATOM 0 HD22 LEU A 92 -9.899 -4.472 -4.332 1.00 41.41 H new ATOM 0 HD23 LEU A 92 -9.022 -2.924 -4.289 1.00 41.41 H new ATOM 1377 N TRP A 93 -4.308 -4.706 -2.590 1.00 43.54 N ATOM 1378 CA TRP A 93 -3.140 -3.889 -2.886 1.00 52.24 C ATOM 1379 C TRP A 93 -3.241 -3.356 -4.301 1.00 31.44 C ATOM 1380 O TRP A 93 -3.355 -4.125 -5.249 1.00 52.34 O ATOM 1381 CB TRP A 93 -1.852 -4.705 -2.747 1.00 61.04 C ATOM 1382 CG TRP A 93 -1.439 -5.002 -1.337 1.00 42.34 C ATOM 1383 CD1 TRP A 93 -1.640 -6.160 -0.638 1.00 41.15 C ATOM 1384 CD2 TRP A 93 -0.724 -4.128 -0.463 1.00 30.33 C ATOM 1385 NE1 TRP A 93 -1.082 -6.056 0.611 1.00 73.15 N ATOM 1386 CE2 TRP A 93 -0.518 -4.819 0.744 1.00 25.25 C ATOM 1387 CE3 TRP A 93 -0.227 -2.828 -0.588 1.00 40.44 C ATOM 1388 CZ2 TRP A 93 0.163 -4.255 1.817 1.00 4.04 C ATOM 1389 CZ3 TRP A 93 0.438 -2.270 0.478 1.00 60.05 C ATOM 1390 CH2 TRP A 93 0.627 -2.984 1.666 1.00 34.25 C ATOM 0 H TRP A 93 -4.202 -5.690 -2.836 1.00 43.54 H new ATOM 0 HA TRP A 93 -3.109 -3.064 -2.175 1.00 52.24 H new ATOM 0 HB2 TRP A 93 -1.978 -5.648 -3.279 1.00 61.04 H new ATOM 0 HB3 TRP A 93 -1.043 -4.166 -3.241 1.00 61.04 H new ATOM 0 HD1 TRP A 93 -2.161 -7.028 -1.014 1.00 41.15 H new ATOM 0 HE1 TRP A 93 -1.087 -6.785 1.325 1.00 73.15 H new ATOM 0 HE3 TRP A 93 -0.363 -2.272 -1.504 1.00 40.44 H new ATOM 0 HZ2 TRP A 93 0.318 -4.804 2.734 1.00 4.04 H new ATOM 0 HZ3 TRP A 93 0.821 -1.263 0.397 1.00 60.05 H new ATOM 0 HH2 TRP A 93 1.154 -2.515 2.484 1.00 34.25 H new ATOM 1401 N MET A 94 -3.230 -2.041 -4.437 1.00 55.31 N ATOM 1402 CA MET A 94 -3.393 -1.414 -5.739 1.00 62.40 C ATOM 1403 C MET A 94 -2.248 -0.465 -6.051 1.00 54.52 C ATOM 1404 O MET A 94 -1.985 0.480 -5.310 1.00 20.50 O ATOM 1405 CB MET A 94 -4.721 -0.652 -5.832 1.00 21.42 C ATOM 1406 CG MET A 94 -5.958 -1.533 -5.747 1.00 63.15 C ATOM 1407 SD MET A 94 -7.472 -0.646 -6.150 1.00 63.13 S ATOM 1408 CE MET A 94 -7.200 -0.268 -7.883 1.00 35.23 C ATOM 0 H MET A 94 -3.110 -1.387 -3.664 1.00 55.31 H new ATOM 0 HA MET A 94 -3.393 -2.219 -6.473 1.00 62.40 H new ATOM 0 HB2 MET A 94 -4.759 0.086 -5.031 1.00 21.42 H new ATOM 0 HB3 MET A 94 -4.745 -0.102 -6.773 1.00 21.42 H new ATOM 0 HG2 MET A 94 -5.845 -2.378 -6.427 1.00 63.15 H new ATOM 0 HG3 MET A 94 -6.039 -1.943 -4.740 1.00 63.15 H new ATOM 0 HE1 MET A 94 -8.160 -0.119 -8.378 1.00 35.23 H new ATOM 0 HE2 MET A 94 -6.603 0.640 -7.968 1.00 35.23 H new ATOM 0 HE3 MET A 94 -6.672 -1.095 -8.357 1.00 35.23 H new ATOM 1418 N PHE A 95 -1.551 -0.748 -7.140 1.00 54.14 N ATOM 1419 CA PHE A 95 -0.616 0.207 -7.723 1.00 53.01 C ATOM 1420 C PHE A 95 -1.347 1.033 -8.791 1.00 71.34 C ATOM 1421 O PHE A 95 -1.101 2.230 -8.958 1.00 1.11 O ATOM 1422 CB PHE A 95 0.594 -0.532 -8.328 1.00 55.25 C ATOM 1423 CG PHE A 95 1.677 0.378 -8.843 1.00 44.31 C ATOM 1424 CD1 PHE A 95 2.503 1.063 -7.963 1.00 10.01 C ATOM 1425 CD2 PHE A 95 1.866 0.550 -10.207 1.00 61.03 C ATOM 1426 CE1 PHE A 95 3.493 1.901 -8.434 1.00 21.52 C ATOM 1427 CE2 PHE A 95 2.856 1.387 -10.682 1.00 42.24 C ATOM 1428 CZ PHE A 95 3.668 2.062 -9.793 1.00 4.03 C ATOM 0 H PHE A 95 -1.614 -1.634 -7.641 1.00 54.14 H new ATOM 0 HA PHE A 95 -0.242 0.878 -6.949 1.00 53.01 H new ATOM 0 HB2 PHE A 95 1.018 -1.192 -7.571 1.00 55.25 H new ATOM 0 HB3 PHE A 95 0.248 -1.165 -9.145 1.00 55.25 H new ATOM 0 HD1 PHE A 95 2.370 0.939 -6.898 1.00 10.01 H new ATOM 0 HD2 PHE A 95 1.232 0.023 -10.905 1.00 61.03 H new ATOM 0 HE1 PHE A 95 4.130 2.430 -7.740 1.00 21.52 H new ATOM 0 HE2 PHE A 95 2.995 1.513 -11.746 1.00 42.24 H new ATOM 0 HZ PHE A 95 4.442 2.718 -10.162 1.00 4.03 H new ATOM 1438 N GLY A 96 -2.255 0.361 -9.495 1.00 15.45 N ATOM 1439 CA GLY A 96 -3.032 0.979 -10.556 1.00 53.04 C ATOM 1440 C GLY A 96 -2.606 0.481 -11.921 1.00 21.43 C ATOM 1441 O GLY A 96 -3.378 0.534 -12.878 1.00 44.21 O ATOM 0 H GLY A 96 -2.469 -0.625 -9.343 1.00 15.45 H new ATOM 0 HA2 GLY A 96 -4.090 0.766 -10.404 1.00 53.04 H new ATOM 0 HA3 GLY A 96 -2.915 2.062 -10.510 1.00 53.04 H new ATOM 1445 N ASP A 97 -1.371 -0.002 -11.997 1.00 22.30 N ATOM 1446 CA ASP A 97 -0.871 -0.704 -13.167 1.00 2.23 C ATOM 1447 C ASP A 97 -0.421 -2.110 -12.778 1.00 20.31 C ATOM 1448 O ASP A 97 0.211 -2.308 -11.732 1.00 40.02 O ATOM 1449 CB ASP A 97 0.286 0.095 -13.796 1.00 21.23 C ATOM 1450 CG ASP A 97 1.025 -0.661 -14.890 1.00 4.13 C ATOM 1451 OD1 ASP A 97 0.459 -0.855 -15.979 1.00 4.43 O ATOM 1452 OD2 ASP A 97 2.188 -1.052 -14.655 1.00 62.22 O ATOM 0 H ASP A 97 -0.688 0.084 -11.244 1.00 22.30 H new ATOM 0 HA ASP A 97 -1.667 -0.796 -13.906 1.00 2.23 H new ATOM 0 HB2 ASP A 97 -0.108 1.023 -14.210 1.00 21.23 H new ATOM 0 HB3 ASP A 97 0.994 0.370 -13.014 1.00 21.23 H new ATOM 1457 N GLY A 98 -0.755 -3.081 -13.623 1.00 52.35 N ATOM 1458 CA GLY A 98 -0.387 -4.455 -13.372 1.00 44.10 C ATOM 1459 C GLY A 98 -1.499 -5.218 -12.695 1.00 61.14 C ATOM 1460 O GLY A 98 -2.649 -5.170 -13.134 1.00 34.41 O ATOM 0 H GLY A 98 -1.280 -2.933 -14.485 1.00 52.35 H new ATOM 0 HA2 GLY A 98 -0.134 -4.941 -14.314 1.00 44.10 H new ATOM 0 HA3 GLY A 98 0.506 -4.484 -12.748 1.00 44.10 H new ATOM 1464 N ASN A 99 -1.164 -5.913 -11.617 1.00 62.24 N ATOM 1465 CA ASN A 99 -2.146 -6.705 -10.893 1.00 72.20 C ATOM 1466 C ASN A 99 -2.355 -6.162 -9.483 1.00 70.32 C ATOM 1467 O ASN A 99 -1.757 -5.155 -9.088 1.00 74.40 O ATOM 1468 CB ASN A 99 -1.727 -8.185 -10.850 1.00 32.33 C ATOM 1469 CG ASN A 99 -1.791 -8.864 -12.209 1.00 0.05 C ATOM 1470 OD1 ASN A 99 -2.614 -8.524 -13.058 1.00 42.41 O ATOM 1471 ND2 ASN A 99 -0.929 -9.844 -12.421 1.00 41.14 N ATOM 0 H ASN A 99 -0.222 -5.944 -11.226 1.00 62.24 H new ATOM 0 HA ASN A 99 -3.095 -6.633 -11.425 1.00 72.20 H new ATOM 0 HB2 ASN A 99 -0.711 -8.257 -10.462 1.00 32.33 H new ATOM 0 HB3 ASN A 99 -2.373 -8.719 -10.153 1.00 32.33 H new ATOM 0 HD21 ASN A 99 -0.933 -10.344 -13.310 1.00 41.14 H new ATOM 0 HD22 ASN A 99 -0.260 -10.100 -11.695 1.00 41.14 H new ATOM 1478 N THR A 100 -3.212 -6.840 -8.736 1.00 40.32 N ATOM 1479 CA THR A 100 -3.575 -6.434 -7.388 1.00 31.01 C ATOM 1480 C THR A 100 -3.034 -7.440 -6.368 1.00 11.13 C ATOM 1481 O THR A 100 -2.114 -8.199 -6.692 1.00 63.10 O ATOM 1482 CB THR A 100 -5.108 -6.306 -7.249 1.00 23.30 C ATOM 1483 OG1 THR A 100 -5.751 -7.459 -7.806 1.00 63.42 O ATOM 1484 CG2 THR A 100 -5.618 -5.045 -7.935 1.00 1.13 C ATOM 0 H THR A 100 -3.677 -7.692 -9.050 1.00 40.32 H new ATOM 0 HA THR A 100 -3.130 -5.459 -7.192 1.00 31.01 H new ATOM 0 HB THR A 100 -5.347 -6.238 -6.188 1.00 23.30 H new ATOM 0 HG1 THR A 100 -6.722 -7.369 -7.712 1.00 63.42 H new ATOM 0 HG21 THR A 100 -6.700 -4.981 -7.821 1.00 1.13 H new ATOM 0 HG22 THR A 100 -5.153 -4.170 -7.481 1.00 1.13 H new ATOM 0 HG23 THR A 100 -5.366 -5.080 -8.995 1.00 1.13 H new ATOM 1492 N SER A 101 -3.559 -7.393 -5.128 1.00 20.43 N ATOM 1493 CA SER A 101 -3.242 -8.392 -4.091 1.00 2.11 C ATOM 1494 C SER A 101 -3.582 -9.804 -4.565 1.00 10.10 C ATOM 1495 O SER A 101 -4.746 -10.138 -4.814 1.00 75.13 O ATOM 1496 CB SER A 101 -3.976 -8.073 -2.785 1.00 55.24 C ATOM 1497 OG SER A 101 -5.361 -7.906 -2.995 1.00 53.35 O ATOM 0 H SER A 101 -4.208 -6.669 -4.820 1.00 20.43 H new ATOM 0 HA SER A 101 -2.169 -8.347 -3.903 1.00 2.11 H new ATOM 0 HB2 SER A 101 -3.811 -8.877 -2.068 1.00 55.24 H new ATOM 0 HB3 SER A 101 -3.562 -7.165 -2.347 1.00 55.24 H new ATOM 0 HG SER A 101 -5.660 -8.515 -3.702 1.00 53.35 H new ATOM 1503 N ASP A 102 -2.538 -10.602 -4.702 1.00 64.32 N ATOM 1504 CA ASP A 102 -2.615 -11.913 -5.325 1.00 3.22 C ATOM 1505 C ASP A 102 -1.471 -12.767 -4.757 1.00 34.34 C ATOM 1506 O ASP A 102 -0.822 -12.338 -3.793 1.00 5.20 O ATOM 1507 CB ASP A 102 -2.500 -11.754 -6.854 1.00 21.32 C ATOM 1508 CG ASP A 102 -3.143 -12.888 -7.625 1.00 73.35 C ATOM 1509 OD1 ASP A 102 -4.382 -12.910 -7.741 1.00 50.13 O ATOM 1510 OD2 ASP A 102 -2.413 -13.772 -8.103 1.00 53.13 O ATOM 0 H ASP A 102 -1.602 -10.356 -4.380 1.00 64.32 H new ATOM 0 HA ASP A 102 -3.566 -12.403 -5.114 1.00 3.22 H new ATOM 0 HB2 ASP A 102 -2.964 -10.813 -7.150 1.00 21.32 H new ATOM 0 HB3 ASP A 102 -1.447 -11.690 -7.127 1.00 21.32 H new ATOM 1515 N SER A 103 -1.268 -13.972 -5.305 1.00 64.25 N ATOM 1516 CA SER A 103 -0.133 -14.831 -4.953 1.00 12.21 C ATOM 1517 C SER A 103 1.192 -14.082 -5.144 1.00 53.03 C ATOM 1518 O SER A 103 1.442 -13.580 -6.239 1.00 60.00 O ATOM 1519 CB SER A 103 -0.149 -16.091 -5.817 1.00 14.33 C ATOM 1520 OG SER A 103 -1.347 -16.829 -5.633 1.00 23.52 O ATOM 0 H SER A 103 -1.888 -14.378 -6.006 1.00 64.25 H new ATOM 0 HA SER A 103 -0.222 -15.112 -3.904 1.00 12.21 H new ATOM 0 HB2 SER A 103 -0.047 -15.816 -6.867 1.00 14.33 H new ATOM 0 HB3 SER A 103 0.708 -16.717 -5.567 1.00 14.33 H new ATOM 0 HG SER A 103 -1.329 -17.628 -6.200 1.00 23.52 H new ATOM 1526 N PRO A 104 2.024 -13.980 -4.062 1.00 5.32 N ATOM 1527 CA PRO A 104 3.218 -13.110 -4.020 1.00 21.43 C ATOM 1528 C PRO A 104 4.228 -13.386 -5.134 1.00 70.23 C ATOM 1529 O PRO A 104 4.987 -14.360 -5.104 1.00 44.32 O ATOM 1530 CB PRO A 104 3.834 -13.374 -2.640 1.00 3.35 C ATOM 1531 CG PRO A 104 3.198 -14.630 -2.146 1.00 54.32 C ATOM 1532 CD PRO A 104 1.849 -14.706 -2.789 1.00 74.43 C ATOM 0 HA PRO A 104 2.937 -12.069 -4.178 1.00 21.43 H new ATOM 0 HB2 PRO A 104 4.916 -13.484 -2.709 1.00 3.35 H new ATOM 0 HB3 PRO A 104 3.641 -12.544 -1.960 1.00 3.35 H new ATOM 0 HG2 PRO A 104 3.802 -15.499 -2.408 1.00 54.32 H new ATOM 0 HG3 PRO A 104 3.110 -14.619 -1.060 1.00 54.32 H new ATOM 0 HD2 PRO A 104 1.543 -15.739 -2.956 1.00 74.43 H new ATOM 0 HD3 PRO A 104 1.083 -14.244 -2.167 1.00 74.43 H new ATOM 1540 N SER A 105 4.172 -12.523 -6.136 1.00 41.20 N ATOM 1541 CA SER A 105 5.026 -12.582 -7.307 1.00 22.34 C ATOM 1542 C SER A 105 5.326 -11.140 -7.716 1.00 14.11 C ATOM 1543 O SER A 105 4.495 -10.259 -7.472 1.00 65.53 O ATOM 1544 CB SER A 105 4.317 -13.312 -8.464 1.00 1.43 C ATOM 1545 OG SER A 105 3.863 -14.602 -8.079 1.00 75.02 O ATOM 0 H SER A 105 3.514 -11.744 -6.156 1.00 41.20 H new ATOM 0 HA SER A 105 5.941 -13.130 -7.080 1.00 22.34 H new ATOM 0 HB2 SER A 105 3.470 -12.716 -8.804 1.00 1.43 H new ATOM 0 HB3 SER A 105 5.001 -13.405 -9.308 1.00 1.43 H new ATOM 0 HG SER A 105 3.100 -14.512 -7.471 1.00 75.02 H new ATOM 1551 N PRO A 106 6.516 -10.847 -8.283 1.00 12.10 N ATOM 1552 CA PRO A 106 6.813 -9.513 -8.816 1.00 11.03 C ATOM 1553 C PRO A 106 5.996 -9.207 -10.075 1.00 1.52 C ATOM 1554 O PRO A 106 6.216 -9.803 -11.133 1.00 14.42 O ATOM 1555 CB PRO A 106 8.315 -9.564 -9.138 1.00 23.22 C ATOM 1556 CG PRO A 106 8.828 -10.796 -8.473 1.00 2.51 C ATOM 1557 CD PRO A 106 7.670 -11.750 -8.422 1.00 61.45 C ATOM 0 HA PRO A 106 6.557 -8.725 -8.107 1.00 11.03 H new ATOM 0 HB2 PRO A 106 8.484 -9.601 -10.214 1.00 23.22 H new ATOM 0 HB3 PRO A 106 8.826 -8.676 -8.765 1.00 23.22 H new ATOM 0 HG2 PRO A 106 9.661 -11.223 -9.031 1.00 2.51 H new ATOM 0 HG3 PRO A 106 9.196 -10.575 -7.471 1.00 2.51 H new ATOM 0 HD2 PRO A 106 7.604 -12.356 -9.326 1.00 61.45 H new ATOM 0 HD3 PRO A 106 7.749 -12.439 -7.581 1.00 61.45 H new ATOM 1565 N LEU A 107 5.013 -8.312 -9.929 1.00 5.31 N ATOM 1566 CA LEU A 107 4.197 -7.860 -11.063 1.00 50.32 C ATOM 1567 C LEU A 107 5.027 -6.927 -11.929 1.00 71.03 C ATOM 1568 O LEU A 107 4.973 -6.978 -13.157 1.00 55.13 O ATOM 1569 CB LEU A 107 2.902 -7.141 -10.609 1.00 2.41 C ATOM 1570 CG LEU A 107 1.884 -7.941 -9.753 1.00 24.04 C ATOM 1571 CD1 LEU A 107 1.790 -9.406 -10.183 1.00 55.23 C ATOM 1572 CD2 LEU A 107 2.187 -7.823 -8.265 1.00 73.41 C ATOM 0 H LEU A 107 4.763 -7.886 -9.037 1.00 5.31 H new ATOM 0 HA LEU A 107 3.893 -8.740 -11.629 1.00 50.32 H new ATOM 0 HB2 LEU A 107 3.193 -6.257 -10.042 1.00 2.41 H new ATOM 0 HB3 LEU A 107 2.384 -6.791 -11.502 1.00 2.41 H new ATOM 0 HG LEU A 107 0.907 -7.492 -9.931 1.00 24.04 H new ATOM 0 HD11 LEU A 107 1.065 -9.924 -9.555 1.00 55.23 H new ATOM 0 HD12 LEU A 107 1.472 -9.460 -11.224 1.00 55.23 H new ATOM 0 HD13 LEU A 107 2.766 -9.880 -10.077 1.00 55.23 H new ATOM 0 HD21 LEU A 107 1.453 -8.396 -7.698 1.00 73.41 H new ATOM 0 HD22 LEU A 107 3.185 -8.212 -8.065 1.00 73.41 H new ATOM 0 HD23 LEU A 107 2.139 -6.776 -7.966 1.00 73.41 H new ATOM 1584 N HIS A 108 5.802 -6.081 -11.254 1.00 4.40 N ATOM 1585 CA HIS A 108 6.858 -5.314 -11.880 1.00 43.22 C ATOM 1586 C HIS A 108 7.972 -5.081 -10.855 1.00 53.35 C ATOM 1587 O HIS A 108 7.710 -4.750 -9.692 1.00 75.34 O ATOM 1588 CB HIS A 108 6.342 -3.981 -12.503 1.00 71.54 C ATOM 1589 CG HIS A 108 5.942 -2.881 -11.549 1.00 63.43 C ATOM 1590 ND1 HIS A 108 6.568 -1.655 -11.524 1.00 32.34 N ATOM 1591 CD2 HIS A 108 4.961 -2.817 -10.614 1.00 74.14 C ATOM 1592 CE1 HIS A 108 5.995 -0.891 -10.620 1.00 23.33 C ATOM 1593 NE2 HIS A 108 5.021 -1.564 -10.050 1.00 34.30 N ATOM 0 H HIS A 108 5.709 -5.913 -10.252 1.00 4.40 H new ATOM 0 HA HIS A 108 7.256 -5.884 -12.719 1.00 43.22 H new ATOM 0 HB2 HIS A 108 7.120 -3.592 -13.160 1.00 71.54 H new ATOM 0 HB3 HIS A 108 5.482 -4.213 -13.131 1.00 71.54 H new ATOM 0 HD2 HIS A 108 4.264 -3.602 -10.360 1.00 74.14 H new ATOM 0 HE1 HIS A 108 6.279 0.124 -10.384 1.00 23.33 H new ATOM 0 HE2 HIS A 108 4.410 -1.215 -9.311 1.00 34.30 H new ATOM 1602 N THR A 109 9.196 -5.314 -11.279 1.00 42.32 N ATOM 1603 CA THR A 109 10.371 -4.983 -10.492 1.00 31.22 C ATOM 1604 C THR A 109 10.691 -3.508 -10.730 1.00 50.33 C ATOM 1605 O THR A 109 10.480 -3.015 -11.840 1.00 34.11 O ATOM 1606 CB THR A 109 11.546 -5.891 -10.915 1.00 21.11 C ATOM 1607 OG1 THR A 109 11.144 -7.260 -10.804 1.00 23.25 O ATOM 1608 CG2 THR A 109 12.793 -5.671 -10.071 1.00 10.31 C ATOM 0 H THR A 109 9.408 -5.739 -12.182 1.00 42.32 H new ATOM 0 HA THR A 109 10.194 -5.146 -9.429 1.00 31.22 H new ATOM 0 HB THR A 109 11.799 -5.637 -11.944 1.00 21.11 H new ATOM 0 HG1 THR A 109 11.886 -7.842 -11.073 1.00 23.25 H new ATOM 0 HG21 THR A 109 13.586 -6.336 -10.413 1.00 10.31 H new ATOM 0 HG22 THR A 109 13.120 -4.636 -10.168 1.00 10.31 H new ATOM 0 HG23 THR A 109 12.567 -5.884 -9.026 1.00 10.31 H new ATOM 1616 N PHE A 110 11.153 -2.799 -9.701 1.00 52.54 N ATOM 1617 CA PHE A 110 11.405 -1.369 -9.821 1.00 20.21 C ATOM 1618 C PHE A 110 12.791 -1.126 -10.416 1.00 44.11 C ATOM 1619 O PHE A 110 13.783 -0.968 -9.702 1.00 55.33 O ATOM 1620 CB PHE A 110 11.241 -0.653 -8.471 1.00 44.52 C ATOM 1621 CG PHE A 110 9.829 -0.635 -7.940 1.00 13.40 C ATOM 1622 CD1 PHE A 110 9.329 -1.699 -7.202 1.00 63.34 C ATOM 1623 CD2 PHE A 110 9.007 0.454 -8.171 1.00 64.24 C ATOM 1624 CE1 PHE A 110 8.039 -1.674 -6.708 1.00 33.54 C ATOM 1625 CE2 PHE A 110 7.716 0.483 -7.679 1.00 3.20 C ATOM 1626 CZ PHE A 110 7.232 -0.581 -6.947 1.00 20.13 C ATOM 0 H PHE A 110 11.358 -3.191 -8.782 1.00 52.54 H new ATOM 0 HA PHE A 110 10.662 -0.947 -10.497 1.00 20.21 H new ATOM 0 HB2 PHE A 110 11.886 -1.136 -7.737 1.00 44.52 H new ATOM 0 HB3 PHE A 110 11.590 0.374 -8.574 1.00 44.52 H new ATOM 0 HD1 PHE A 110 9.956 -2.557 -7.012 1.00 63.34 H new ATOM 0 HD2 PHE A 110 9.379 1.291 -8.743 1.00 64.24 H new ATOM 0 HE1 PHE A 110 7.663 -2.509 -6.136 1.00 33.54 H new ATOM 0 HE2 PHE A 110 7.086 1.339 -7.868 1.00 3.20 H new ATOM 0 HZ PHE A 110 6.223 -0.559 -6.562 1.00 20.13 H new ATOM 1636 N PHE A 111 12.838 -1.158 -11.746 1.00 62.22 N ATOM 1637 CA PHE A 111 14.064 -0.920 -12.502 1.00 25.43 C ATOM 1638 C PHE A 111 14.312 0.573 -12.666 1.00 24.25 C ATOM 1639 O PHE A 111 15.436 1.003 -12.908 1.00 50.13 O ATOM 1640 CB PHE A 111 13.975 -1.553 -13.898 1.00 32.20 C ATOM 1641 CG PHE A 111 13.818 -3.047 -13.907 1.00 14.13 C ATOM 1642 CD1 PHE A 111 14.838 -3.871 -13.459 1.00 53.00 C ATOM 1643 CD2 PHE A 111 12.656 -3.625 -14.384 1.00 31.33 C ATOM 1644 CE1 PHE A 111 14.697 -5.243 -13.484 1.00 33.32 C ATOM 1645 CE2 PHE A 111 12.510 -4.996 -14.410 1.00 21.24 C ATOM 1646 CZ PHE A 111 13.530 -5.806 -13.959 1.00 13.22 C ATOM 0 H PHE A 111 12.025 -1.350 -12.331 1.00 62.22 H new ATOM 0 HA PHE A 111 14.884 -1.373 -11.945 1.00 25.43 H new ATOM 0 HB2 PHE A 111 13.132 -1.111 -14.428 1.00 32.20 H new ATOM 0 HB3 PHE A 111 14.874 -1.294 -14.456 1.00 32.20 H new ATOM 0 HD1 PHE A 111 15.753 -3.435 -13.086 1.00 53.00 H new ATOM 0 HD2 PHE A 111 11.854 -2.996 -14.740 1.00 31.33 H new ATOM 0 HE1 PHE A 111 15.499 -5.876 -13.132 1.00 33.32 H new ATOM 0 HE2 PHE A 111 11.597 -5.435 -14.784 1.00 21.24 H new ATOM 0 HZ PHE A 111 13.416 -6.880 -13.977 1.00 13.22 H new ATOM 1656 N ASN A 112 13.253 1.348 -12.525 1.00 50.34 N ATOM 1657 CA ASN A 112 13.293 2.772 -12.782 1.00 54.01 C ATOM 1658 C ASN A 112 13.132 3.517 -11.473 1.00 5.04 C ATOM 1659 O ASN A 112 12.475 3.021 -10.551 1.00 65.51 O ATOM 1660 CB ASN A 112 12.166 3.179 -13.745 1.00 14.44 C ATOM 1661 CG ASN A 112 12.063 2.292 -14.971 1.00 23.13 C ATOM 1662 OD1 ASN A 112 11.351 1.287 -14.960 1.00 54.13 O ATOM 1663 ND2 ASN A 112 12.751 2.654 -16.035 1.00 35.15 N ATOM 0 H ASN A 112 12.339 1.005 -12.228 1.00 50.34 H new ATOM 0 HA ASN A 112 14.250 3.023 -13.240 1.00 54.01 H new ATOM 0 HB2 ASN A 112 11.217 3.156 -13.210 1.00 14.44 H new ATOM 0 HB3 ASN A 112 12.327 4.209 -14.065 1.00 14.44 H new ATOM 0 HD21 ASN A 112 12.704 2.095 -16.887 1.00 35.15 H new ATOM 0 HD22 ASN A 112 13.330 3.493 -16.007 1.00 35.15 H new ATOM 1670 N GLU A 113 13.739 4.688 -11.384 1.00 72.41 N ATOM 1671 CA GLU A 113 13.566 5.555 -10.230 1.00 13.01 C ATOM 1672 C GLU A 113 12.547 6.646 -10.556 1.00 54.34 C ATOM 1673 O GLU A 113 12.383 7.027 -11.719 1.00 51.25 O ATOM 1674 CB GLU A 113 14.901 6.182 -9.783 1.00 43.12 C ATOM 1675 CG GLU A 113 15.943 5.179 -9.280 1.00 43.45 C ATOM 1676 CD GLU A 113 16.878 4.660 -10.361 1.00 14.31 C ATOM 1677 OE1 GLU A 113 16.544 3.674 -11.042 1.00 35.15 O ATOM 1678 OE2 GLU A 113 17.974 5.229 -10.515 1.00 51.13 O ATOM 0 H GLU A 113 14.360 5.062 -12.102 1.00 72.41 H new ATOM 0 HA GLU A 113 13.198 4.949 -9.402 1.00 13.01 H new ATOM 0 HB2 GLU A 113 15.325 6.736 -10.621 1.00 43.12 H new ATOM 0 HB3 GLU A 113 14.700 6.904 -8.992 1.00 43.12 H new ATOM 0 HG2 GLU A 113 16.537 5.650 -8.497 1.00 43.45 H new ATOM 0 HG3 GLU A 113 15.427 4.334 -8.824 1.00 43.45 H new ATOM 1685 N GLY A 114 11.877 7.143 -9.528 1.00 51.22 N ATOM 1686 CA GLY A 114 10.827 8.120 -9.725 1.00 3.54 C ATOM 1687 C GLY A 114 9.893 8.187 -8.543 1.00 34.22 C ATOM 1688 O GLY A 114 10.309 7.971 -7.411 1.00 35.43 O ATOM 0 H GLY A 114 12.043 6.885 -8.555 1.00 51.22 H new ATOM 0 HA2 GLY A 114 11.271 9.101 -9.893 1.00 3.54 H new ATOM 0 HA3 GLY A 114 10.261 7.869 -10.622 1.00 3.54 H new ATOM 1692 N GLU A 115 8.630 8.472 -8.797 1.00 3.42 N ATOM 1693 CA GLU A 115 7.662 8.620 -7.726 1.00 23.41 C ATOM 1694 C GLU A 115 6.529 7.613 -7.900 1.00 50.14 C ATOM 1695 O GLU A 115 5.785 7.648 -8.882 1.00 63.11 O ATOM 1696 CB GLU A 115 7.152 10.056 -7.703 1.00 53.42 C ATOM 1697 CG GLU A 115 6.318 10.401 -6.483 1.00 45.40 C ATOM 1698 CD GLU A 115 6.087 11.884 -6.354 1.00 13.42 C ATOM 1699 OE1 GLU A 115 5.293 12.431 -7.138 1.00 32.11 O ATOM 1700 OE2 GLU A 115 6.731 12.512 -5.496 1.00 20.50 O ATOM 0 H GLU A 115 8.250 8.606 -9.734 1.00 3.42 H new ATOM 0 HA GLU A 115 8.133 8.413 -6.765 1.00 23.41 H new ATOM 0 HB2 GLU A 115 8.005 10.733 -7.749 1.00 53.42 H new ATOM 0 HB3 GLU A 115 6.556 10.232 -8.598 1.00 53.42 H new ATOM 0 HG2 GLU A 115 5.358 9.889 -6.545 1.00 45.40 H new ATOM 0 HG3 GLU A 115 6.818 10.033 -5.587 1.00 45.40 H new ATOM 1707 N TYR A 116 6.439 6.692 -6.952 1.00 41.24 N ATOM 1708 CA TYR A 116 5.498 5.582 -7.023 1.00 74.53 C ATOM 1709 C TYR A 116 4.593 5.602 -5.809 1.00 72.05 C ATOM 1710 O TYR A 116 5.065 5.537 -4.685 1.00 41.22 O ATOM 1711 CB TYR A 116 6.253 4.244 -7.071 1.00 4.53 C ATOM 1712 CG TYR A 116 7.226 4.137 -8.219 1.00 50.12 C ATOM 1713 CD1 TYR A 116 6.777 3.850 -9.496 1.00 52.13 C ATOM 1714 CD2 TYR A 116 8.587 4.345 -8.028 1.00 2.22 C ATOM 1715 CE1 TYR A 116 7.653 3.769 -10.554 1.00 65.00 C ATOM 1716 CE2 TYR A 116 9.472 4.263 -9.082 1.00 22.12 C ATOM 1717 CZ TYR A 116 8.996 3.977 -10.344 1.00 64.01 C ATOM 1718 OH TYR A 116 9.863 3.906 -11.400 1.00 3.31 O ATOM 0 H TYR A 116 7.016 6.692 -6.111 1.00 41.24 H new ATOM 0 HA TYR A 116 4.901 5.688 -7.929 1.00 74.53 H new ATOM 0 HB2 TYR A 116 6.794 4.108 -6.134 1.00 4.53 H new ATOM 0 HB3 TYR A 116 5.530 3.431 -7.142 1.00 4.53 H new ATOM 0 HD1 TYR A 116 5.723 3.687 -9.665 1.00 52.13 H new ATOM 0 HD2 TYR A 116 8.957 4.574 -7.039 1.00 2.22 H new ATOM 0 HE1 TYR A 116 7.287 3.543 -11.545 1.00 65.00 H new ATOM 0 HE2 TYR A 116 10.528 4.421 -8.921 1.00 22.12 H new ATOM 0 HH TYR A 116 10.715 3.526 -11.099 1.00 3.31 H new ATOM 1728 N ILE A 117 3.298 5.700 -6.027 1.00 64.14 N ATOM 1729 CA ILE A 117 2.364 5.754 -4.915 1.00 70.12 C ATOM 1730 C ILE A 117 1.697 4.390 -4.740 1.00 20.31 C ATOM 1731 O ILE A 117 0.995 3.898 -5.632 1.00 14.21 O ATOM 1732 CB ILE A 117 1.306 6.909 -5.045 1.00 3.42 C ATOM 1733 CG1 ILE A 117 1.964 8.307 -4.987 1.00 22.24 C ATOM 1734 CG2 ILE A 117 0.264 6.818 -3.932 1.00 44.22 C ATOM 1735 CD1 ILE A 117 2.564 8.807 -6.290 1.00 22.14 C ATOM 0 H ILE A 117 2.869 5.744 -6.951 1.00 64.14 H new ATOM 0 HA ILE A 117 2.935 5.992 -4.018 1.00 70.12 H new ATOM 0 HB ILE A 117 0.829 6.783 -6.017 1.00 3.42 H new ATOM 0 HG12 ILE A 117 1.217 9.027 -4.653 1.00 22.24 H new ATOM 0 HG13 ILE A 117 2.749 8.288 -4.231 1.00 22.24 H new ATOM 0 HG21 ILE A 117 -0.458 7.627 -4.042 1.00 44.22 H new ATOM 0 HG22 ILE A 117 -0.252 5.860 -3.995 1.00 44.22 H new ATOM 0 HG23 ILE A 117 0.758 6.901 -2.964 1.00 44.22 H new ATOM 0 HD11 ILE A 117 2.998 9.795 -6.135 1.00 22.14 H new ATOM 0 HD12 ILE A 117 3.341 8.118 -6.621 1.00 22.14 H new ATOM 0 HD13 ILE A 117 1.785 8.868 -7.050 1.00 22.14 H new ATOM 1747 N VAL A 118 1.970 3.777 -3.594 1.00 44.05 N ATOM 1748 CA VAL A 118 1.405 2.482 -3.239 1.00 71.01 C ATOM 1749 C VAL A 118 0.113 2.705 -2.455 1.00 2.33 C ATOM 1750 O VAL A 118 0.061 3.573 -1.582 1.00 12.22 O ATOM 1751 CB VAL A 118 2.407 1.632 -2.397 1.00 52.20 C ATOM 1752 CG1 VAL A 118 1.871 0.229 -2.128 1.00 21.41 C ATOM 1753 CG2 VAL A 118 3.766 1.544 -3.084 1.00 51.44 C ATOM 0 H VAL A 118 2.591 4.165 -2.884 1.00 44.05 H new ATOM 0 HA VAL A 118 1.197 1.928 -4.154 1.00 71.01 H new ATOM 0 HB VAL A 118 2.527 2.141 -1.440 1.00 52.20 H new ATOM 0 HG11 VAL A 118 2.597 -0.331 -1.539 1.00 21.41 H new ATOM 0 HG12 VAL A 118 0.933 0.297 -1.577 1.00 21.41 H new ATOM 0 HG13 VAL A 118 1.699 -0.283 -3.075 1.00 21.41 H new ATOM 0 HG21 VAL A 118 4.444 0.946 -2.475 1.00 51.44 H new ATOM 0 HG22 VAL A 118 3.650 1.077 -4.062 1.00 51.44 H new ATOM 0 HG23 VAL A 118 4.177 2.546 -3.207 1.00 51.44 H new ATOM 1763 N SER A 119 -0.930 1.961 -2.802 1.00 14.31 N ATOM 1764 CA SER A 119 -2.203 2.054 -2.103 1.00 71.43 C ATOM 1765 C SER A 119 -2.627 0.697 -1.542 1.00 73.13 C ATOM 1766 O SER A 119 -2.366 -0.351 -2.139 1.00 3.04 O ATOM 1767 CB SER A 119 -3.284 2.600 -3.042 1.00 60.34 C ATOM 1768 OG SER A 119 -2.887 3.839 -3.608 1.00 71.14 O ATOM 0 H SER A 119 -0.918 1.285 -3.566 1.00 14.31 H new ATOM 0 HA SER A 119 -2.078 2.741 -1.266 1.00 71.43 H new ATOM 0 HB2 SER A 119 -3.479 1.879 -3.836 1.00 60.34 H new ATOM 0 HB3 SER A 119 -4.217 2.729 -2.493 1.00 60.34 H new ATOM 0 HG SER A 119 -3.592 4.167 -4.205 1.00 71.14 H new ATOM 1774 N LEU A 120 -3.269 0.737 -0.384 1.00 2.52 N ATOM 1775 CA LEU A 120 -3.877 -0.434 0.226 1.00 54.22 C ATOM 1776 C LEU A 120 -5.292 -0.078 0.645 1.00 73.05 C ATOM 1777 O LEU A 120 -5.500 0.790 1.489 1.00 72.43 O ATOM 1778 CB LEU A 120 -3.041 -0.930 1.432 1.00 61.44 C ATOM 1779 CG LEU A 120 -3.633 -2.082 2.285 1.00 54.33 C ATOM 1780 CD1 LEU A 120 -3.985 -3.298 1.437 1.00 52.33 C ATOM 1781 CD2 LEU A 120 -2.653 -2.487 3.364 1.00 71.31 C ATOM 0 H LEU A 120 -3.383 1.591 0.163 1.00 2.52 H new ATOM 0 HA LEU A 120 -3.906 -1.251 -0.495 1.00 54.22 H new ATOM 0 HB2 LEU A 120 -2.069 -1.253 1.058 1.00 61.44 H new ATOM 0 HB3 LEU A 120 -2.863 -0.080 2.091 1.00 61.44 H new ATOM 0 HG LEU A 120 -4.552 -1.710 2.738 1.00 54.33 H new ATOM 0 HD11 LEU A 120 -4.396 -4.080 2.075 1.00 52.33 H new ATOM 0 HD12 LEU A 120 -4.724 -3.017 0.686 1.00 52.33 H new ATOM 0 HD13 LEU A 120 -3.087 -3.668 0.942 1.00 52.33 H new ATOM 0 HD21 LEU A 120 -3.079 -3.296 3.957 1.00 71.31 H new ATOM 0 HD22 LEU A 120 -1.724 -2.824 2.904 1.00 71.31 H new ATOM 0 HD23 LEU A 120 -2.449 -1.633 4.010 1.00 71.31 H new ATOM 1793 N ILE A 121 -6.258 -0.743 0.034 1.00 3.44 N ATOM 1794 CA ILE A 121 -7.652 -0.564 0.379 1.00 44.33 C ATOM 1795 C ILE A 121 -8.178 -1.856 0.989 1.00 2.43 C ATOM 1796 O ILE A 121 -8.027 -2.934 0.433 1.00 35.14 O ATOM 1797 CB ILE A 121 -8.528 -0.093 -0.832 1.00 65.11 C ATOM 1798 CG1 ILE A 121 -10.026 -0.081 -0.449 1.00 15.32 C ATOM 1799 CG2 ILE A 121 -8.280 -0.935 -2.087 1.00 52.00 C ATOM 1800 CD1 ILE A 121 -10.936 0.551 -1.477 1.00 14.10 C ATOM 0 H ILE A 121 -6.096 -1.419 -0.712 1.00 3.44 H new ATOM 0 HA ILE A 121 -7.722 0.241 1.111 1.00 44.33 H new ATOM 0 HB ILE A 121 -8.228 0.926 -1.075 1.00 65.11 H new ATOM 0 HG12 ILE A 121 -10.351 -1.107 -0.278 1.00 15.32 H new ATOM 0 HG13 ILE A 121 -10.141 0.452 0.495 1.00 15.32 H new ATOM 0 HG21 ILE A 121 -8.909 -0.571 -2.899 1.00 52.00 H new ATOM 0 HG22 ILE A 121 -7.232 -0.857 -2.377 1.00 52.00 H new ATOM 0 HG23 ILE A 121 -8.522 -1.977 -1.879 1.00 52.00 H new ATOM 0 HD11 ILE A 121 -11.966 0.514 -1.123 1.00 14.10 H new ATOM 0 HD12 ILE A 121 -10.643 1.589 -1.633 1.00 14.10 H new ATOM 0 HD13 ILE A 121 -10.856 0.006 -2.418 1.00 14.10 H new ATOM 1812 N VAL A 122 -8.767 -1.742 2.153 1.00 2.15 N ATOM 1813 CA VAL A 122 -9.299 -2.891 2.853 1.00 72.23 C ATOM 1814 C VAL A 122 -10.809 -2.805 2.923 1.00 51.41 C ATOM 1815 O VAL A 122 -11.384 -1.718 2.906 1.00 10.12 O ATOM 1816 CB VAL A 122 -8.696 -3.062 4.268 1.00 12.24 C ATOM 1817 CG1 VAL A 122 -7.241 -3.482 4.165 1.00 12.03 C ATOM 1818 CG2 VAL A 122 -8.821 -1.787 5.096 1.00 23.31 C ATOM 0 H VAL A 122 -8.892 -0.856 2.643 1.00 2.15 H new ATOM 0 HA VAL A 122 -9.012 -3.775 2.284 1.00 72.23 H new ATOM 0 HB VAL A 122 -9.262 -3.841 4.779 1.00 12.24 H new ATOM 0 HG11 VAL A 122 -6.825 -3.600 5.165 1.00 12.03 H new ATOM 0 HG12 VAL A 122 -7.173 -4.429 3.630 1.00 12.03 H new ATOM 0 HG13 VAL A 122 -6.679 -2.719 3.626 1.00 12.03 H new ATOM 0 HG21 VAL A 122 -8.386 -1.949 6.082 1.00 23.31 H new ATOM 0 HG22 VAL A 122 -8.293 -0.975 4.596 1.00 23.31 H new ATOM 0 HG23 VAL A 122 -9.873 -1.524 5.203 1.00 23.31 H new ATOM 1828 N SER A 123 -11.449 -3.953 3.001 1.00 74.42 N ATOM 1829 CA SER A 123 -12.890 -4.016 2.938 1.00 72.33 C ATOM 1830 C SER A 123 -13.431 -4.740 4.157 1.00 70.15 C ATOM 1831 O SER A 123 -12.745 -5.572 4.745 1.00 65.30 O ATOM 1832 CB SER A 123 -13.327 -4.732 1.660 1.00 74.14 C ATOM 1833 OG SER A 123 -12.686 -4.173 0.521 1.00 41.42 O ATOM 0 H SER A 123 -10.990 -4.857 3.109 1.00 74.42 H new ATOM 0 HA SER A 123 -13.290 -3.002 2.926 1.00 72.33 H new ATOM 0 HB2 SER A 123 -13.088 -5.793 1.733 1.00 74.14 H new ATOM 0 HB3 SER A 123 -14.409 -4.656 1.547 1.00 74.14 H new ATOM 0 HG SER A 123 -12.979 -4.647 -0.285 1.00 41.42 H new ATOM 1839 N ASN A 124 -14.642 -4.386 4.534 1.00 53.23 N ATOM 1840 CA ASN A 124 -15.352 -4.996 5.646 1.00 43.43 C ATOM 1841 C ASN A 124 -16.837 -4.989 5.275 1.00 54.51 C ATOM 1842 O ASN A 124 -17.208 -4.399 4.253 1.00 0.44 O ATOM 1843 CB ASN A 124 -15.057 -4.183 6.932 1.00 44.41 C ATOM 1844 CG ASN A 124 -15.618 -4.738 8.234 1.00 5.31 C ATOM 1845 OD1 ASN A 124 -16.717 -4.393 8.638 1.00 64.31 O ATOM 1846 ND2 ASN A 124 -14.849 -5.564 8.913 1.00 62.13 N ATOM 0 H ASN A 124 -15.174 -3.651 4.068 1.00 53.23 H new ATOM 0 HA ASN A 124 -15.037 -6.022 5.838 1.00 43.43 H new ATOM 0 HB2 ASN A 124 -13.976 -4.094 7.038 1.00 44.41 H new ATOM 0 HB3 ASN A 124 -15.448 -3.175 6.795 1.00 44.41 H new ATOM 0 HD21 ASN A 124 -15.166 -5.937 9.808 1.00 62.13 H new ATOM 0 HD22 ASN A 124 -13.936 -5.830 8.544 1.00 62.13 H new ATOM 1853 N GLU A 125 -17.679 -5.619 6.092 1.00 43.12 N ATOM 1854 CA GLU A 125 -19.123 -5.663 5.859 1.00 24.13 C ATOM 1855 C GLU A 125 -19.787 -4.303 6.154 1.00 72.22 C ATOM 1856 O GLU A 125 -20.868 -4.006 5.643 1.00 43.11 O ATOM 1857 CB GLU A 125 -19.746 -6.764 6.728 1.00 61.45 C ATOM 1858 CG GLU A 125 -19.353 -6.684 8.199 1.00 43.30 C ATOM 1859 CD GLU A 125 -20.064 -7.706 9.046 1.00 71.02 C ATOM 1860 OE1 GLU A 125 -21.216 -7.450 9.445 1.00 72.32 O ATOM 1861 OE2 GLU A 125 -19.479 -8.770 9.318 1.00 60.43 O ATOM 0 H GLU A 125 -17.381 -6.113 6.933 1.00 43.12 H new ATOM 0 HA GLU A 125 -19.296 -5.887 4.806 1.00 24.13 H new ATOM 0 HB2 GLU A 125 -20.832 -6.706 6.648 1.00 61.45 H new ATOM 0 HB3 GLU A 125 -19.449 -7.736 6.335 1.00 61.45 H new ATOM 0 HG2 GLU A 125 -18.276 -6.827 8.292 1.00 43.30 H new ATOM 0 HG3 GLU A 125 -19.576 -5.686 8.577 1.00 43.30 H new ATOM 1868 N ASN A 126 -19.114 -3.489 6.965 1.00 34.32 N ATOM 1869 CA ASN A 126 -19.615 -2.184 7.377 1.00 13.40 C ATOM 1870 C ASN A 126 -19.185 -1.106 6.397 1.00 31.14 C ATOM 1871 O ASN A 126 -20.020 -0.428 5.809 1.00 41.43 O ATOM 1872 CB ASN A 126 -19.078 -1.840 8.769 1.00 32.13 C ATOM 1873 CG ASN A 126 -19.534 -2.816 9.830 1.00 31.12 C ATOM 1874 OD1 ASN A 126 -20.671 -3.282 9.821 1.00 33.42 O ATOM 1875 ND2 ASN A 126 -18.638 -3.169 10.726 1.00 53.22 N ATOM 0 H ASN A 126 -18.201 -3.720 7.356 1.00 34.32 H new ATOM 0 HA ASN A 126 -20.704 -2.227 7.398 1.00 13.40 H new ATOM 0 HB2 ASN A 126 -17.988 -1.825 8.740 1.00 32.13 H new ATOM 0 HB3 ASN A 126 -19.404 -0.836 9.041 1.00 32.13 H new ATOM 0 HD21 ASN A 126 -18.877 -3.851 11.445 1.00 53.22 H new ATOM 0 HD22 ASN A 126 -17.704 -2.760 10.702 1.00 53.22 H new ATOM 1882 N ASP A 127 -17.877 -0.973 6.216 1.00 13.40 N ATOM 1883 CA ASP A 127 -17.309 0.111 5.426 1.00 33.53 C ATOM 1884 C ASP A 127 -16.036 -0.388 4.738 1.00 23.30 C ATOM 1885 O ASP A 127 -15.618 -1.525 4.961 1.00 0.22 O ATOM 1886 CB ASP A 127 -17.012 1.296 6.366 1.00 22.44 C ATOM 1887 CG ASP A 127 -16.930 2.640 5.672 1.00 33.24 C ATOM 1888 OD1 ASP A 127 -17.982 3.276 5.481 1.00 40.34 O ATOM 1889 OD2 ASP A 127 -15.815 3.062 5.321 1.00 62.34 O ATOM 0 H ASP A 127 -17.184 -1.609 6.610 1.00 13.40 H new ATOM 0 HA ASP A 127 -18.005 0.442 4.655 1.00 33.53 H new ATOM 0 HB2 ASP A 127 -17.789 1.342 7.130 1.00 22.44 H new ATOM 0 HB3 ASP A 127 -16.070 1.108 6.881 1.00 22.44 H new ATOM 1894 N SER A 128 -15.445 0.428 3.873 1.00 31.13 N ATOM 1895 CA SER A 128 -14.153 0.124 3.269 1.00 73.42 C ATOM 1896 C SER A 128 -13.273 1.370 3.298 1.00 62.42 C ATOM 1897 O SER A 128 -13.751 2.473 3.045 1.00 21.11 O ATOM 1898 CB SER A 128 -14.334 -0.386 1.834 1.00 71.23 C ATOM 1899 OG SER A 128 -15.153 -1.546 1.806 1.00 74.33 O ATOM 0 H SER A 128 -15.846 1.316 3.571 1.00 31.13 H new ATOM 0 HA SER A 128 -13.666 -0.665 3.842 1.00 73.42 H new ATOM 0 HB2 SER A 128 -14.783 0.395 1.220 1.00 71.23 H new ATOM 0 HB3 SER A 128 -13.361 -0.613 1.399 1.00 71.23 H new ATOM 0 HG SER A 128 -15.255 -1.852 0.881 1.00 74.33 H new ATOM 1905 N ASP A 129 -11.997 1.192 3.615 1.00 62.30 N ATOM 1906 CA ASP A 129 -11.077 2.320 3.778 1.00 2.42 C ATOM 1907 C ASP A 129 -9.810 2.092 2.968 1.00 4.25 C ATOM 1908 O ASP A 129 -9.309 0.977 2.904 1.00 13.24 O ATOM 1909 CB ASP A 129 -10.739 2.509 5.266 1.00 72.42 C ATOM 1910 CG ASP A 129 -9.792 3.668 5.530 1.00 70.42 C ATOM 1911 OD1 ASP A 129 -10.124 4.814 5.167 1.00 12.22 O ATOM 1912 OD2 ASP A 129 -8.727 3.438 6.125 1.00 11.42 O ATOM 0 H ASP A 129 -11.571 0.277 3.765 1.00 62.30 H new ATOM 0 HA ASP A 129 -11.559 3.225 3.410 1.00 2.42 H new ATOM 0 HB2 ASP A 129 -11.662 2.671 5.822 1.00 72.42 H new ATOM 0 HB3 ASP A 129 -10.293 1.591 5.649 1.00 72.42 H new ATOM 1917 N SER A 130 -9.305 3.151 2.356 1.00 3.41 N ATOM 1918 CA SER A 130 -8.079 3.085 1.583 1.00 74.53 C ATOM 1919 C SER A 130 -7.076 4.116 2.095 1.00 1.54 C ATOM 1920 O SER A 130 -7.458 5.185 2.576 1.00 33.24 O ATOM 1921 CB SER A 130 -8.385 3.337 0.102 1.00 13.23 C ATOM 1922 OG SER A 130 -7.244 3.124 -0.715 1.00 4.14 O ATOM 0 H SER A 130 -9.733 4.077 2.382 1.00 3.41 H new ATOM 0 HA SER A 130 -7.644 2.092 1.693 1.00 74.53 H new ATOM 0 HB2 SER A 130 -9.191 2.678 -0.220 1.00 13.23 H new ATOM 0 HB3 SER A 130 -8.739 4.360 -0.027 1.00 13.23 H new ATOM 0 HG SER A 130 -7.477 3.292 -1.652 1.00 4.14 H new ATOM 1928 N ALA A 131 -5.797 3.779 2.000 1.00 0.21 N ATOM 1929 CA ALA A 131 -4.718 4.699 2.323 1.00 72.11 C ATOM 1930 C ALA A 131 -3.614 4.563 1.310 1.00 15.12 C ATOM 1931 O ALA A 131 -3.436 3.504 0.702 1.00 41.13 O ATOM 1932 CB ALA A 131 -4.190 4.464 3.732 1.00 13.03 C ATOM 0 H ALA A 131 -5.479 2.859 1.696 1.00 0.21 H new ATOM 0 HA ALA A 131 -5.110 5.715 2.289 1.00 72.11 H new ATOM 0 HB1 ALA A 131 -3.385 5.168 3.941 1.00 13.03 H new ATOM 0 HB2 ALA A 131 -4.996 4.610 4.452 1.00 13.03 H new ATOM 0 HB3 ALA A 131 -3.811 3.445 3.813 1.00 13.03 H new ATOM 1938 N SER A 132 -2.892 5.649 1.114 1.00 74.41 N ATOM 1939 CA SER A 132 -1.842 5.704 0.123 1.00 23.44 C ATOM 1940 C SER A 132 -0.598 6.359 0.719 1.00 72.25 C ATOM 1941 O SER A 132 -0.699 7.160 1.653 1.00 64.44 O ATOM 1942 CB SER A 132 -2.329 6.507 -1.086 1.00 52.05 C ATOM 1943 OG SER A 132 -3.546 5.998 -1.603 1.00 10.23 O ATOM 0 H SER A 132 -3.019 6.515 1.638 1.00 74.41 H new ATOM 0 HA SER A 132 -1.588 4.692 -0.194 1.00 23.44 H new ATOM 0 HB2 SER A 132 -2.465 7.550 -0.799 1.00 52.05 H new ATOM 0 HB3 SER A 132 -1.567 6.488 -1.865 1.00 52.05 H new ATOM 0 HG SER A 132 -3.354 5.295 -2.258 1.00 10.23 H new ATOM 1949 N VAL A 133 0.573 6.015 0.194 1.00 55.31 N ATOM 1950 CA VAL A 133 1.809 6.667 0.602 1.00 15.22 C ATOM 1951 C VAL A 133 2.676 6.941 -0.632 1.00 61.25 C ATOM 1952 O VAL A 133 2.733 6.132 -1.568 1.00 51.45 O ATOM 1953 CB VAL A 133 2.588 5.855 1.696 1.00 45.01 C ATOM 1954 CG1 VAL A 133 3.189 4.565 1.161 1.00 55.02 C ATOM 1955 CG2 VAL A 133 3.663 6.708 2.360 1.00 50.04 C ATOM 0 H VAL A 133 0.691 5.290 -0.513 1.00 55.31 H new ATOM 0 HA VAL A 133 1.552 7.617 1.071 1.00 15.22 H new ATOM 0 HB VAL A 133 1.849 5.575 2.447 1.00 45.01 H new ATOM 0 HG11 VAL A 133 3.715 4.048 1.964 1.00 55.02 H new ATOM 0 HG12 VAL A 133 2.394 3.925 0.777 1.00 55.02 H new ATOM 0 HG13 VAL A 133 3.889 4.795 0.358 1.00 55.02 H new ATOM 0 HG21 VAL A 133 4.184 6.116 3.113 1.00 50.04 H new ATOM 0 HG22 VAL A 133 4.375 7.046 1.608 1.00 50.04 H new ATOM 0 HG23 VAL A 133 3.199 7.572 2.835 1.00 50.04 H new ATOM 1965 N THR A 134 3.297 8.107 -0.647 1.00 61.02 N ATOM 1966 CA THR A 134 4.154 8.509 -1.739 1.00 64.22 C ATOM 1967 C THR A 134 5.568 7.982 -1.519 1.00 3.33 C ATOM 1968 O THR A 134 6.271 8.429 -0.613 1.00 13.55 O ATOM 1969 CB THR A 134 4.188 10.043 -1.862 1.00 11.44 C ATOM 1970 OG1 THR A 134 2.865 10.570 -1.716 1.00 22.25 O ATOM 1971 CG2 THR A 134 4.745 10.467 -3.204 1.00 35.23 C ATOM 0 H THR A 134 3.219 8.799 0.099 1.00 61.02 H new ATOM 0 HA THR A 134 3.753 8.089 -2.662 1.00 64.22 H new ATOM 0 HB THR A 134 4.834 10.432 -1.075 1.00 11.44 H new ATOM 0 HG1 THR A 134 2.892 11.547 -1.793 1.00 22.25 H new ATOM 0 HG21 THR A 134 4.758 11.555 -3.265 1.00 35.23 H new ATOM 0 HG22 THR A 134 5.760 10.085 -3.314 1.00 35.23 H new ATOM 0 HG23 THR A 134 4.119 10.066 -4.001 1.00 35.23 H new ATOM 1979 N ILE A 135 5.958 7.012 -2.332 1.00 71.44 N ATOM 1980 CA ILE A 135 7.303 6.453 -2.279 1.00 1.53 C ATOM 1981 C ILE A 135 8.182 7.237 -3.239 1.00 2.23 C ATOM 1982 O ILE A 135 7.937 7.261 -4.447 1.00 35.24 O ATOM 1983 CB ILE A 135 7.331 4.931 -2.637 1.00 32.05 C ATOM 1984 CG1 ILE A 135 6.341 4.130 -1.765 1.00 4.43 C ATOM 1985 CG2 ILE A 135 8.739 4.348 -2.514 1.00 11.22 C ATOM 1986 CD1 ILE A 135 6.517 4.311 -0.270 1.00 42.31 C ATOM 0 H ILE A 135 5.358 6.592 -3.042 1.00 71.44 H new ATOM 0 HA ILE A 135 7.675 6.537 -1.258 1.00 1.53 H new ATOM 0 HB ILE A 135 7.020 4.844 -3.678 1.00 32.05 H new ATOM 0 HG12 ILE A 135 5.325 4.420 -2.034 1.00 4.43 H new ATOM 0 HG13 ILE A 135 6.444 3.071 -2.003 1.00 4.43 H new ATOM 0 HG21 ILE A 135 8.718 3.289 -2.771 1.00 11.22 H new ATOM 0 HG22 ILE A 135 9.411 4.873 -3.193 1.00 11.22 H new ATOM 0 HG23 ILE A 135 9.094 4.466 -1.490 1.00 11.22 H new ATOM 0 HD11 ILE A 135 5.777 3.710 0.259 1.00 42.31 H new ATOM 0 HD12 ILE A 135 7.518 3.992 0.020 1.00 42.31 H new ATOM 0 HD13 ILE A 135 6.382 5.361 -0.012 1.00 42.31 H new ATOM 1998 N ARG A 136 9.186 7.889 -2.696 1.00 52.54 N ATOM 1999 CA ARG A 136 10.024 8.763 -3.480 1.00 61.24 C ATOM 2000 C ARG A 136 11.405 8.155 -3.650 1.00 2.42 C ATOM 2001 O ARG A 136 12.171 8.021 -2.693 1.00 63.13 O ATOM 2002 CB ARG A 136 10.104 10.144 -2.831 1.00 74.32 C ATOM 2003 CG ARG A 136 8.824 10.959 -2.967 1.00 5.54 C ATOM 2004 CD ARG A 136 8.888 12.240 -2.152 1.00 51.44 C ATOM 2005 NE ARG A 136 8.807 11.979 -0.708 1.00 42.13 N ATOM 2006 CZ ARG A 136 9.707 12.388 0.198 1.00 54.44 C ATOM 2007 NH1 ARG A 136 10.836 12.988 -0.182 1.00 73.04 N ATOM 2008 NH2 ARG A 136 9.494 12.151 1.487 1.00 65.33 N ATOM 0 H ARG A 136 9.441 7.829 -1.710 1.00 52.54 H new ATOM 0 HA ARG A 136 9.584 8.882 -4.470 1.00 61.24 H new ATOM 0 HB2 ARG A 136 10.338 10.026 -1.773 1.00 74.32 H new ATOM 0 HB3 ARG A 136 10.928 10.700 -3.280 1.00 74.32 H new ATOM 0 HG2 ARG A 136 8.657 11.202 -4.016 1.00 5.54 H new ATOM 0 HG3 ARG A 136 7.974 10.360 -2.639 1.00 5.54 H new ATOM 0 HD2 ARG A 136 9.817 12.765 -2.374 1.00 51.44 H new ATOM 0 HD3 ARG A 136 8.072 12.899 -2.448 1.00 51.44 H new ATOM 0 HE ARG A 136 8.006 11.447 -0.369 1.00 42.13 H new ATOM 0 HH11 ARG A 136 11.024 13.141 -1.173 1.00 73.04 H new ATOM 0 HH12 ARG A 136 11.512 13.294 0.518 1.00 73.04 H new ATOM 0 HH21 ARG A 136 8.650 11.661 1.783 1.00 65.33 H new ATOM 0 HH22 ARG A 136 10.174 12.459 2.181 1.00 65.33 H new ATOM 2022 N ALA A 137 11.695 7.779 -4.883 1.00 44.34 N ATOM 2023 CA ALA A 137 12.975 7.212 -5.231 1.00 75.35 C ATOM 2024 C ALA A 137 13.856 8.311 -5.784 1.00 2.44 C ATOM 2025 O ALA A 137 13.444 9.057 -6.673 1.00 55.31 O ATOM 2026 CB ALA A 137 12.816 6.087 -6.234 1.00 5.25 C ATOM 0 H ALA A 137 11.047 7.860 -5.667 1.00 44.34 H new ATOM 0 HA ALA A 137 13.439 6.785 -4.342 1.00 75.35 H new ATOM 0 HB1 ALA A 137 13.796 5.677 -6.479 1.00 5.25 H new ATOM 0 HB2 ALA A 137 12.192 5.303 -5.805 1.00 5.25 H new ATOM 0 HB3 ALA A 137 12.346 6.471 -7.140 1.00 5.25 H new ATOM 2032 N LEU A 138 15.057 8.395 -5.254 1.00 60.32 N ATOM 2033 CA LEU A 138 15.926 9.532 -5.481 1.00 50.21 C ATOM 2034 C LEU A 138 16.643 9.428 -6.811 1.00 41.42 C ATOM 2035 O LEU A 138 17.097 8.350 -7.213 1.00 43.32 O ATOM 2036 CB LEU A 138 16.937 9.676 -4.337 1.00 53.22 C ATOM 2037 CG LEU A 138 16.331 9.983 -2.959 1.00 54.12 C ATOM 2038 CD1 LEU A 138 17.417 10.048 -1.902 1.00 2.14 C ATOM 2039 CD2 LEU A 138 15.555 11.291 -2.995 1.00 45.34 C ATOM 0 H LEU A 138 15.460 7.677 -4.653 1.00 60.32 H new ATOM 0 HA LEU A 138 15.300 10.424 -5.510 1.00 50.21 H new ATOM 0 HB2 LEU A 138 17.513 8.753 -4.265 1.00 53.22 H new ATOM 0 HB3 LEU A 138 17.639 10.470 -4.592 1.00 53.22 H new ATOM 0 HG LEU A 138 15.643 9.177 -2.703 1.00 54.12 H new ATOM 0 HD11 LEU A 138 16.969 10.266 -0.933 1.00 2.14 H new ATOM 0 HD12 LEU A 138 17.936 9.091 -1.854 1.00 2.14 H new ATOM 0 HD13 LEU A 138 18.128 10.834 -2.158 1.00 2.14 H new ATOM 0 HD21 LEU A 138 15.133 11.491 -2.010 1.00 45.34 H new ATOM 0 HD22 LEU A 138 16.225 12.104 -3.275 1.00 45.34 H new ATOM 0 HD23 LEU A 138 14.750 11.216 -3.726 1.00 45.34 H new ATOM 2051 N GLU A 139 16.707 10.558 -7.492 1.00 14.14 N ATOM 2052 CA GLU A 139 17.436 10.668 -8.739 1.00 10.31 C ATOM 2053 C GLU A 139 18.911 10.914 -8.463 1.00 42.45 C ATOM 2054 O GLU A 139 19.271 11.548 -7.463 1.00 1.12 O ATOM 2055 CB GLU A 139 16.867 11.761 -9.679 1.00 11.40 C ATOM 2056 CG GLU A 139 15.940 12.806 -9.046 1.00 73.13 C ATOM 2057 CD GLU A 139 16.605 13.709 -8.015 1.00 22.52 C ATOM 2058 OE1 GLU A 139 17.362 14.620 -8.404 1.00 4.23 O ATOM 2059 OE2 GLU A 139 16.334 13.531 -6.811 1.00 13.11 O ATOM 0 H GLU A 139 16.255 11.423 -7.195 1.00 14.14 H new ATOM 0 HA GLU A 139 17.316 9.719 -9.262 1.00 10.31 H new ATOM 0 HB2 GLU A 139 17.706 12.285 -10.137 1.00 11.40 H new ATOM 0 HB3 GLU A 139 16.322 11.267 -10.483 1.00 11.40 H new ATOM 0 HG2 GLU A 139 15.523 13.428 -9.838 1.00 73.13 H new ATOM 0 HG3 GLU A 139 15.105 12.291 -8.572 1.00 73.13 H new ATOM 2066 N HIS A 140 19.748 10.381 -9.343 1.00 73.02 N ATOM 2067 CA HIS A 140 21.187 10.541 -9.234 1.00 20.12 C ATOM 2068 C HIS A 140 21.571 11.941 -9.701 1.00 75.34 C ATOM 2069 O HIS A 140 21.525 12.255 -10.894 1.00 74.40 O ATOM 2070 CB HIS A 140 21.924 9.458 -10.046 1.00 62.30 C ATOM 2071 CG HIS A 140 23.421 9.463 -9.862 1.00 20.13 C ATOM 2072 ND1 HIS A 140 24.317 9.552 -10.905 1.00 53.53 N ATOM 2073 CD2 HIS A 140 24.168 9.397 -8.738 1.00 10.54 C ATOM 2074 CE1 HIS A 140 25.547 9.541 -10.429 1.00 34.14 C ATOM 2075 NE2 HIS A 140 25.482 9.450 -9.117 1.00 54.14 N ATOM 0 H HIS A 140 19.448 9.829 -10.147 1.00 73.02 H new ATOM 0 HA HIS A 140 21.486 10.420 -8.193 1.00 20.12 H new ATOM 0 HB2 HIS A 140 21.537 8.479 -9.762 1.00 62.30 H new ATOM 0 HB3 HIS A 140 21.698 9.595 -11.103 1.00 62.30 H new ATOM 0 HD2 HIS A 140 23.797 9.317 -7.727 1.00 10.54 H new ATOM 0 HE1 HIS A 140 26.452 9.597 -11.015 1.00 34.14 H new ATOM 0 HE2 HIS A 140 26.282 9.423 -8.485 1.00 54.14 H new ATOM 2084 N HIS A 141 21.930 12.769 -8.741 1.00 42.11 N ATOM 2085 CA HIS A 141 22.215 14.164 -9.005 1.00 33.22 C ATOM 2086 C HIS A 141 23.692 14.461 -8.780 1.00 11.34 C ATOM 2087 O HIS A 141 24.237 14.223 -7.696 1.00 35.43 O ATOM 2088 CB HIS A 141 21.278 15.097 -8.182 1.00 63.34 C ATOM 2089 CG HIS A 141 21.373 15.037 -6.675 1.00 43.55 C ATOM 2090 ND1 HIS A 141 21.570 16.158 -5.895 1.00 3.43 N ATOM 2091 CD2 HIS A 141 21.249 14.003 -5.806 1.00 74.22 C ATOM 2092 CE1 HIS A 141 21.576 15.815 -4.622 1.00 62.44 C ATOM 2093 NE2 HIS A 141 21.380 14.518 -4.539 1.00 1.43 N ATOM 0 H HIS A 141 22.032 12.497 -7.763 1.00 42.11 H new ATOM 0 HA HIS A 141 22.006 14.371 -10.054 1.00 33.22 H new ATOM 0 HB2 HIS A 141 21.474 16.124 -8.490 1.00 63.34 H new ATOM 0 HB3 HIS A 141 20.249 14.871 -8.462 1.00 63.34 H new ATOM 0 HD2 HIS A 141 21.079 12.968 -6.062 1.00 74.22 H new ATOM 0 HE1 HIS A 141 21.718 16.486 -3.788 1.00 62.44 H new ATOM 0 HE2 HIS A 141 21.333 13.980 -3.673 1.00 1.43 H new ATOM 2102 N HIS A 142 24.347 14.939 -9.828 1.00 71.41 N ATOM 2103 CA HIS A 142 25.738 15.333 -9.733 1.00 14.13 C ATOM 2104 C HIS A 142 25.815 16.742 -9.157 1.00 11.04 C ATOM 2105 O HIS A 142 26.442 16.958 -8.126 1.00 41.31 O ATOM 2106 CB HIS A 142 26.414 15.233 -11.106 1.00 32.11 C ATOM 2107 CG HIS A 142 27.906 15.403 -11.081 1.00 51.11 C ATOM 2108 ND1 HIS A 142 28.777 14.400 -10.723 1.00 21.22 N ATOM 2109 CD2 HIS A 142 28.675 16.473 -11.378 1.00 3.22 C ATOM 2110 CE1 HIS A 142 30.017 14.850 -10.801 1.00 14.14 C ATOM 2111 NE2 HIS A 142 29.984 16.106 -11.198 1.00 35.32 N ATOM 0 H HIS A 142 23.934 15.062 -10.753 1.00 71.41 H new ATOM 0 HA HIS A 142 26.275 14.660 -9.065 1.00 14.13 H new ATOM 0 HB2 HIS A 142 26.179 14.262 -11.542 1.00 32.11 H new ATOM 0 HB3 HIS A 142 25.986 15.990 -11.763 1.00 32.11 H new ATOM 0 HD2 HIS A 142 28.323 17.442 -11.699 1.00 3.22 H new ATOM 0 HE1 HIS A 142 30.908 14.283 -10.577 1.00 14.14 H new ATOM 0 HE2 HIS A 142 30.796 16.705 -11.347 1.00 35.32 H new ATOM 2120 N HIS A 143 25.146 17.676 -9.820 1.00 33.14 N ATOM 2121 CA HIS A 143 25.051 19.039 -9.334 1.00 64.42 C ATOM 2122 C HIS A 143 23.759 19.671 -9.837 1.00 41.42 C ATOM 2123 O HIS A 143 23.499 19.701 -11.043 1.00 23.22 O ATOM 2124 CB HIS A 143 26.272 19.865 -9.775 1.00 33.15 C ATOM 2125 CG HIS A 143 26.412 21.174 -9.056 1.00 61.02 C ATOM 2126 ND1 HIS A 143 26.206 22.394 -9.663 1.00 30.22 N ATOM 2127 CD2 HIS A 143 26.734 21.445 -7.771 1.00 70.21 C ATOM 2128 CE1 HIS A 143 26.394 23.357 -8.782 1.00 63.12 C ATOM 2129 NE2 HIS A 143 26.715 22.809 -7.629 1.00 33.41 N ATOM 0 H HIS A 143 24.660 17.509 -10.701 1.00 33.14 H new ATOM 0 HA HIS A 143 25.038 19.026 -8.244 1.00 64.42 H new ATOM 0 HB2 HIS A 143 27.174 19.275 -9.615 1.00 33.15 H new ATOM 0 HB3 HIS A 143 26.202 20.056 -10.846 1.00 33.15 H new ATOM 0 HD2 HIS A 143 26.963 20.723 -7.001 1.00 70.21 H new ATOM 0 HE1 HIS A 143 26.300 24.416 -8.974 1.00 63.12 H new ATOM 0 HE2 HIS A 143 26.917 23.317 -6.768 1.00 33.41 H new ATOM 2138 N HIS A 144 22.963 20.161 -8.899 1.00 12.33 N ATOM 2139 CA HIS A 144 21.732 20.877 -9.205 1.00 35.11 C ATOM 2140 C HIS A 144 22.074 22.274 -9.727 1.00 51.13 C ATOM 2141 O HIS A 144 22.635 23.095 -8.996 1.00 23.15 O ATOM 2142 CB HIS A 144 20.861 20.950 -7.933 1.00 51.43 C ATOM 2143 CG HIS A 144 19.517 21.607 -8.095 1.00 52.45 C ATOM 2144 ND1 HIS A 144 19.309 22.951 -7.877 1.00 10.31 N ATOM 2145 CD2 HIS A 144 18.310 21.091 -8.419 1.00 3.33 C ATOM 2146 CE1 HIS A 144 18.036 23.236 -8.062 1.00 22.13 C ATOM 2147 NE2 HIS A 144 17.409 22.128 -8.395 1.00 63.14 N ATOM 0 H HIS A 144 23.152 20.073 -7.901 1.00 12.33 H new ATOM 0 HA HIS A 144 21.169 20.354 -9.978 1.00 35.11 H new ATOM 0 HB2 HIS A 144 20.706 19.936 -7.563 1.00 51.43 H new ATOM 0 HB3 HIS A 144 21.417 21.488 -7.165 1.00 51.43 H new ATOM 0 HD2 HIS A 144 18.095 20.059 -8.653 1.00 3.33 H new ATOM 0 HE1 HIS A 144 17.585 24.212 -7.958 1.00 22.13 H new ATOM 0 HE2 HIS A 144 16.413 22.051 -8.602 1.00 63.14 H new ATOM 2156 N HIS A 145 21.757 22.523 -10.992 1.00 43.21 N ATOM 2157 CA HIS A 145 21.977 23.833 -11.598 1.00 0.10 C ATOM 2158 C HIS A 145 20.932 24.087 -12.679 1.00 22.25 C ATOM 2159 O HIS A 145 20.419 23.150 -13.292 1.00 72.23 O ATOM 2160 CB HIS A 145 23.397 23.932 -12.180 1.00 24.00 C ATOM 2161 CG HIS A 145 23.831 25.331 -12.511 1.00 43.50 C ATOM 2162 ND1 HIS A 145 24.436 25.668 -13.700 1.00 31.22 N ATOM 2163 CD2 HIS A 145 23.771 26.472 -11.783 1.00 42.10 C ATOM 2164 CE1 HIS A 145 24.733 26.954 -13.689 1.00 3.22 C ATOM 2165 NE2 HIS A 145 24.339 27.462 -12.541 1.00 23.30 N ATOM 0 H HIS A 145 21.345 21.833 -11.621 1.00 43.21 H new ATOM 0 HA HIS A 145 21.877 24.597 -10.827 1.00 0.10 H new ATOM 0 HB2 HIS A 145 24.101 23.505 -11.466 1.00 24.00 H new ATOM 0 HB3 HIS A 145 23.451 23.324 -13.083 1.00 24.00 H new ATOM 0 HD2 HIS A 145 23.354 26.581 -10.793 1.00 42.10 H new ATOM 0 HE1 HIS A 145 25.217 27.497 -14.487 1.00 3.22 H new ATOM 0 HE2 HIS A 145 24.440 28.437 -12.260 1.00 23.30 H new TER 2174 HIS A 145