USER MOD reduce.3.24.130724 H: found=0, std=0, add=924, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 924 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 116 ASN : amide:sc= 0.589 K(o=2,f=0.83) USER MOD Set 1.2: A 118 SER OG : rot 69:sc= 1.42 USER MOD Set 2.1: A 112 SER OG : rot 180:sc= 0.306 USER MOD Set 2.2: A 115 GLN : amide:sc= 0.237 X(o=0.54,f=0.63) USER MOD Set 3.1: A 56 GLN : amide:sc= -0.477 X(o=-1.3,f=-1.2) USER MOD Set 3.2: A 59 GLN : amide:sc= -0.846 K(o=-1.3,f=-0.6) USER MOD Set 4.1: A 6 THR OG1 : rot 180:sc= 0.596 USER MOD Set 4.2: A 8 GLN : amide:sc= 0.55 K(o=1.1,f=-0.021) USER MOD Single : A 1 MET CE :methyl -164:sc= -0.0966 (180deg=-0.425) USER MOD Single : A 1 MET N :NH3+ 168:sc= -0.0784 (180deg=-0.312) USER MOD Single : A 4 THR OG1 : rot -54:sc= 1.4 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 11 ASN : amide:sc= -0.148 K(o=-0.15,f=-0.66) USER MOD Single : A 13 ASN : amide:sc=-0.00148 K(o=-0.0015,f=-1) USER MOD Single : A 17 ASN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 19 ASN : amide:sc= 0.683 K(o=0.68,f=-6.3!) USER MOD Single : A 20 ASN : amide:sc= 0 X(o=0,f=-0.051) USER MOD Single : A 26 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0.503 K(o=0.5,f=-0.62) USER MOD Single : A 31 GLN : amide:sc= -0.0807 K(o=-0.081,f=-0.84) USER MOD Single : A 32 ASN : amide:sc= 0 X(o=0,f=-0.0013) USER MOD Single : A 33 SER OG : rot -73:sc= 0.883 USER MOD Single : A 34 TYR OH : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ -173:sc= 1.17 (180deg=1.01) USER MOD Single : A 38 SER OG : rot 26:sc= 1.19 USER MOD Single : A 39 TYR OH : rot 180:sc= 0 USER MOD Single : A 40 ASN : amide:sc= -0.049 K(o=-0.049,f=-0.95) USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 GLN : amide:sc= -1.16 K(o=-1.2,f=-0.4) USER MOD Single : A 68 SER OG : rot 180:sc= 0.0923 USER MOD Single : A 69 ASN : amide:sc= 0.745 K(o=0.75,f=0) USER MOD Single : A 71 ASN : amide:sc= -0.938 K(o=-0.94,f=-0.0095) USER MOD Single : A 72 THR OG1 : rot 9:sc= 0.868 USER MOD Single : A 74 LYS NZ :NH3+ 170:sc=-0.00531 (180deg=-0.155) USER MOD Single : A 78 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 80 THR OG1 : rot -148:sc= -0.895 USER MOD Single : A 81 ASN : amide:sc= -0.247 K(o=-0.25,f=-10!) USER MOD Single : A 83 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -0.517 K(o=-0.52,f=-8.8!) USER MOD Single : A 93 GLN : amide:sc= -1.93! K(o=-1.9!,f=0) USER MOD Single : A 95 GLN : amide:sc= -2.47! C(o=-2.5!,f=-8.5!) USER MOD Single : A 97 ASN : amide:sc= -0.655 X(o=-0.65,f=-0.2) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ -134:sc= 1.15 (180deg=-1.29) USER MOD Single : A 103 THR OG1 : rot -5:sc= 0.405 USER MOD Single : A 105 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.0389 USER MOD Single : A 110 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 117 ASN : amide:sc= -0.151 K(o=-0.15,f=-2.4!) USER MOD Single : A 119 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 123 HIS : no HD1:sc= -0.0252 X(o=-0.025,f=0) USER MOD Single : A 124 HIS : no HD1:sc= -0.175 X(o=-0.18,f=0) USER MOD Single : A 125 HIS : no HD1:sc= -0.102 X(o=-0.1,f=0) USER MOD Single : A 126 HIS : no HE2:sc= 0.416 K(o=0.42,f=-2) USER MOD Single : A 127 HIS : no HD1:sc= -0.0897 X(o=-0.09,f=-0.087) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 75.765 56.984 32.497 1.00 0.00 N ATOM 2 CA MET A 1 76.378 56.301 31.331 1.00 52.33 C ATOM 3 C MET A 1 75.301 55.738 30.414 1.00 71.33 C ATOM 4 O MET A 1 74.414 55.012 30.861 1.00 1.24 O ATOM 5 CB MET A 1 77.319 55.179 31.795 1.00 2.44 C ATOM 6 CG MET A 1 76.675 54.189 32.754 1.00 75.50 C ATOM 7 SD MET A 1 77.828 52.941 33.359 1.00 21.34 S ATOM 8 CE MET A 1 78.244 52.092 31.837 1.00 13.04 C ATOM 0 H1 MET A 1 76.498 57.182 33.208 1.00 0.00 H new ATOM 0 H2 MET A 1 75.332 57.878 32.188 1.00 0.00 H new ATOM 0 H3 MET A 1 75.035 56.372 32.913 1.00 0.00 H new ATOM 0 HA MET A 1 76.961 57.035 30.774 1.00 52.33 H new ATOM 0 HB2 MET A 1 77.682 54.639 30.921 1.00 2.44 H new ATOM 0 HB3 MET A 1 78.188 55.625 32.278 1.00 2.44 H new ATOM 0 HG2 MET A 1 76.258 54.732 33.602 1.00 75.50 H new ATOM 0 HG3 MET A 1 75.843 53.694 32.252 1.00 75.50 H new ATOM 0 HE1 MET A 1 78.712 51.135 32.070 1.00 13.04 H new ATOM 0 HE2 MET A 1 77.338 51.921 31.256 1.00 13.04 H new ATOM 0 HE3 MET A 1 78.936 52.702 31.257 1.00 13.04 H new ATOM 20 N ALA A 2 75.387 56.068 29.132 1.00 12.30 N ATOM 21 CA ALA A 2 74.401 55.620 28.156 1.00 21.34 C ATOM 22 C ALA A 2 74.957 55.699 26.740 1.00 14.20 C ATOM 23 O ALA A 2 74.743 54.800 25.925 1.00 72.13 O ATOM 24 CB ALA A 2 73.127 56.447 28.266 1.00 74.23 C ATOM 0 H ALA A 2 76.132 56.646 28.742 1.00 12.30 H new ATOM 0 HA ALA A 2 74.165 54.578 28.373 1.00 21.34 H new ATOM 0 HB1 ALA A 2 72.402 56.099 27.530 1.00 74.23 H new ATOM 0 HB2 ALA A 2 72.708 56.339 29.267 1.00 74.23 H new ATOM 0 HB3 ALA A 2 73.357 57.496 28.080 1.00 74.23 H new ATOM 30 N GLY A 3 75.681 56.769 26.459 1.00 50.23 N ATOM 31 CA GLY A 3 76.190 56.991 25.125 1.00 65.14 C ATOM 32 C GLY A 3 75.592 58.235 24.508 1.00 23.21 C ATOM 33 O GLY A 3 74.919 58.171 23.479 1.00 32.24 O ATOM 0 H GLY A 3 75.926 57.492 27.136 1.00 50.23 H new ATOM 0 HA2 GLY A 3 77.275 57.085 25.159 1.00 65.14 H new ATOM 0 HA3 GLY A 3 75.964 56.128 24.499 1.00 65.14 H new ATOM 37 N THR A 4 75.824 59.368 25.153 1.00 43.32 N ATOM 38 CA THR A 4 75.258 60.634 24.717 1.00 31.21 C ATOM 39 C THR A 4 75.897 61.087 23.400 1.00 2.41 C ATOM 40 O THR A 4 77.086 60.848 23.162 1.00 63.23 O ATOM 41 CB THR A 4 75.428 61.718 25.814 1.00 4.31 C ATOM 42 OG1 THR A 4 74.691 62.904 25.483 1.00 72.25 O ATOM 43 CG2 THR A 4 76.897 62.065 26.023 1.00 71.44 C ATOM 0 H THR A 4 76.406 59.435 25.988 1.00 43.32 H new ATOM 0 HA THR A 4 74.191 60.490 24.545 1.00 31.21 H new ATOM 0 HB THR A 4 75.033 61.306 26.742 1.00 4.31 H new ATOM 0 HG1 THR A 4 74.948 63.210 24.588 1.00 72.25 H new ATOM 0 HG21 THR A 4 76.984 62.827 26.797 1.00 71.44 H new ATOM 0 HG22 THR A 4 77.442 61.172 26.330 1.00 71.44 H new ATOM 0 HG23 THR A 4 77.317 62.444 25.092 1.00 71.44 H new ATOM 51 N MET A 5 75.086 61.713 22.544 1.00 11.31 N ATOM 52 CA MET A 5 75.508 62.185 21.217 1.00 75.43 C ATOM 53 C MET A 5 75.723 61.031 20.240 1.00 15.13 C ATOM 54 O MET A 5 75.105 61.015 19.178 1.00 24.32 O ATOM 55 CB MET A 5 76.766 63.063 21.287 1.00 22.24 C ATOM 56 CG MET A 5 76.493 64.505 21.692 1.00 23.44 C ATOM 57 SD MET A 5 75.812 64.654 23.355 1.00 11.43 S ATOM 58 CE MET A 5 75.502 66.416 23.433 1.00 45.42 C ATOM 0 H MET A 5 74.107 61.910 22.752 1.00 11.31 H new ATOM 0 HA MET A 5 74.689 62.799 20.842 1.00 75.43 H new ATOM 0 HB2 MET A 5 77.465 62.623 21.998 1.00 22.24 H new ATOM 0 HB3 MET A 5 77.256 63.056 20.313 1.00 22.24 H new ATOM 0 HG2 MET A 5 77.420 65.075 21.633 1.00 23.44 H new ATOM 0 HG3 MET A 5 75.799 64.951 20.980 1.00 23.44 H new ATOM 0 HE1 MET A 5 75.078 66.668 24.405 1.00 45.42 H new ATOM 0 HE2 MET A 5 76.438 66.957 23.294 1.00 45.42 H new ATOM 0 HE3 MET A 5 74.801 66.697 22.647 1.00 45.42 H new ATOM 68 N THR A 6 76.584 60.078 20.619 1.00 41.42 N ATOM 69 CA THR A 6 76.946 58.919 19.790 1.00 43.12 C ATOM 70 C THR A 6 77.204 59.302 18.328 1.00 64.43 C ATOM 71 O THR A 6 76.307 59.288 17.481 1.00 60.42 O ATOM 72 CB THR A 6 75.935 57.736 19.904 1.00 74.21 C ATOM 73 OG1 THR A 6 76.296 56.682 19.000 1.00 54.11 O ATOM 74 CG2 THR A 6 74.496 58.154 19.636 1.00 62.12 C ATOM 0 H THR A 6 77.056 60.090 21.523 1.00 41.42 H new ATOM 0 HA THR A 6 77.888 58.556 20.201 1.00 43.12 H new ATOM 0 HB THR A 6 75.989 57.386 20.935 1.00 74.21 H new ATOM 0 HG1 THR A 6 75.654 55.946 19.083 1.00 54.11 H new ATOM 0 HG21 THR A 6 73.842 57.287 19.730 1.00 62.12 H new ATOM 0 HG22 THR A 6 74.198 58.914 20.358 1.00 62.12 H new ATOM 0 HG23 THR A 6 74.417 58.560 18.628 1.00 62.12 H new ATOM 82 N PHE A 7 78.448 59.663 18.043 1.00 42.33 N ATOM 83 CA PHE A 7 78.836 60.064 16.702 1.00 74.33 C ATOM 84 C PHE A 7 79.121 58.840 15.839 1.00 63.13 C ATOM 85 O PHE A 7 80.051 58.075 16.094 1.00 64.35 O ATOM 86 CB PHE A 7 80.040 61.018 16.742 1.00 24.13 C ATOM 87 CG PHE A 7 81.156 60.584 17.656 1.00 71.12 C ATOM 88 CD1 PHE A 7 81.131 60.914 19.001 1.00 75.04 C ATOM 89 CD2 PHE A 7 82.230 59.856 17.168 1.00 54.44 C ATOM 90 CE1 PHE A 7 82.156 60.525 19.843 1.00 24.44 C ATOM 91 CE2 PHE A 7 83.256 59.465 18.005 1.00 13.11 C ATOM 92 CZ PHE A 7 83.219 59.798 19.343 1.00 63.23 C ATOM 0 H PHE A 7 79.205 59.686 18.726 1.00 42.33 H new ATOM 0 HA PHE A 7 78.005 60.605 16.249 1.00 74.33 H new ATOM 0 HB2 PHE A 7 80.436 61.124 15.732 1.00 24.13 H new ATOM 0 HB3 PHE A 7 79.695 62.004 17.054 1.00 24.13 H new ATOM 0 HD1 PHE A 7 80.301 61.482 19.396 1.00 75.04 H new ATOM 0 HD2 PHE A 7 82.265 59.592 16.121 1.00 54.44 H new ATOM 0 HE1 PHE A 7 82.126 60.789 20.890 1.00 24.44 H new ATOM 0 HE2 PHE A 7 84.087 58.899 17.612 1.00 13.11 H new ATOM 0 HZ PHE A 7 84.020 59.491 19.999 1.00 63.23 H new ATOM 102 N GLN A 8 78.295 58.653 14.826 1.00 31.11 N ATOM 103 CA GLN A 8 78.398 57.495 13.955 1.00 22.32 C ATOM 104 C GLN A 8 78.865 57.904 12.567 1.00 73.41 C ATOM 105 O GLN A 8 79.819 57.334 12.034 1.00 70.13 O ATOM 106 CB GLN A 8 77.041 56.795 13.866 1.00 44.31 C ATOM 107 CG GLN A 8 76.502 56.355 15.215 1.00 2.34 C ATOM 108 CD GLN A 8 75.021 56.631 15.367 1.00 35.43 C ATOM 109 OE1 GLN A 8 74.264 56.613 14.394 1.00 50.31 O ATOM 110 NE2 GLN A 8 74.597 56.898 16.587 1.00 14.45 N ATOM 0 H GLN A 8 77.539 59.294 14.584 1.00 31.11 H new ATOM 0 HA GLN A 8 79.133 56.808 14.374 1.00 22.32 H new ATOM 0 HB2 GLN A 8 76.323 57.468 13.398 1.00 44.31 H new ATOM 0 HB3 GLN A 8 77.131 55.924 13.217 1.00 44.31 H new ATOM 0 HG2 GLN A 8 76.684 55.288 15.345 1.00 2.34 H new ATOM 0 HG3 GLN A 8 77.047 56.870 16.006 1.00 2.34 H new ATOM 0 HE21 GLN A 8 75.255 56.903 17.366 1.00 14.45 H new ATOM 0 HE22 GLN A 8 73.611 57.099 16.751 1.00 14.45 H new ATOM 119 N PHE A 9 78.185 58.897 11.991 1.00 73.24 N ATOM 120 CA PHE A 9 78.478 59.369 10.638 1.00 4.13 C ATOM 121 C PHE A 9 78.268 58.229 9.652 1.00 32.53 C ATOM 122 O PHE A 9 79.020 58.059 8.696 1.00 20.24 O ATOM 123 CB PHE A 9 79.909 59.910 10.537 1.00 55.13 C ATOM 124 CG PHE A 9 80.211 61.004 11.520 1.00 3.12 C ATOM 125 CD1 PHE A 9 79.748 62.292 11.305 1.00 54.02 C ATOM 126 CD2 PHE A 9 80.954 60.744 12.661 1.00 53.11 C ATOM 127 CE1 PHE A 9 80.024 63.300 12.209 1.00 4.52 C ATOM 128 CE2 PHE A 9 81.232 61.747 13.565 1.00 31.40 C ATOM 129 CZ PHE A 9 80.765 63.026 13.341 1.00 63.11 C ATOM 0 H PHE A 9 77.420 59.394 12.447 1.00 73.24 H new ATOM 0 HA PHE A 9 77.800 60.188 10.397 1.00 4.13 H new ATOM 0 HB2 PHE A 9 80.610 59.090 10.693 1.00 55.13 H new ATOM 0 HB3 PHE A 9 80.076 60.285 9.527 1.00 55.13 H new ATOM 0 HD1 PHE A 9 79.166 62.510 10.422 1.00 54.02 H new ATOM 0 HD2 PHE A 9 81.319 59.744 12.844 1.00 53.11 H new ATOM 0 HE1 PHE A 9 79.660 64.301 12.030 1.00 4.52 H new ATOM 0 HE2 PHE A 9 81.815 61.532 14.448 1.00 31.40 H new ATOM 0 HZ PHE A 9 80.979 63.812 14.050 1.00 63.11 H new ATOM 139 N ARG A 10 77.217 57.461 9.902 1.00 62.51 N ATOM 140 CA ARG A 10 76.934 56.255 9.138 1.00 44.32 C ATOM 141 C ARG A 10 76.199 56.569 7.832 1.00 21.34 C ATOM 142 O ARG A 10 75.005 56.293 7.685 1.00 35.21 O ATOM 143 CB ARG A 10 76.136 55.265 10.001 1.00 21.20 C ATOM 144 CG ARG A 10 74.894 55.868 10.643 1.00 72.03 C ATOM 145 CD ARG A 10 74.220 54.894 11.600 1.00 53.43 C ATOM 146 NE ARG A 10 73.850 53.639 10.947 1.00 61.25 N ATOM 147 CZ ARG A 10 72.598 53.181 10.867 1.00 52.03 C ATOM 148 NH1 ARG A 10 71.595 53.890 11.366 1.00 11.40 N1+ ATOM 149 NH2 ARG A 10 72.347 52.022 10.273 1.00 60.33 N ATOM 0 H ARG A 10 76.538 57.656 10.638 1.00 62.51 H new ATOM 0 HA ARG A 10 77.883 55.796 8.863 1.00 44.32 H new ATOM 0 HB2 ARG A 10 75.839 54.417 9.383 1.00 21.20 H new ATOM 0 HB3 ARG A 10 76.786 54.876 10.785 1.00 21.20 H new ATOM 0 HG2 ARG A 10 75.168 56.775 11.181 1.00 72.03 H new ATOM 0 HG3 ARG A 10 74.188 56.160 9.865 1.00 72.03 H new ATOM 0 HD2 ARG A 10 74.891 54.683 12.433 1.00 53.43 H new ATOM 0 HD3 ARG A 10 73.328 55.359 12.020 1.00 53.43 H new ATOM 0 HE ARG A 10 74.593 53.080 10.527 1.00 61.25 H new ATOM 0 HH11 ARG A 10 71.778 54.788 11.813 1.00 11.40 H new ATOM 0 HH12 ARG A 10 70.640 53.537 11.303 1.00 11.40 H new ATOM 0 HH21 ARG A 10 73.112 51.477 9.875 1.00 60.33 H new ATOM 0 HH22 ARG A 10 71.389 51.676 10.214 1.00 60.33 H new ATOM 163 N ASN A 11 76.922 57.172 6.898 1.00 4.11 N ATOM 164 CA ASN A 11 76.390 57.446 5.568 1.00 44.33 C ATOM 165 C ASN A 11 77.478 57.296 4.505 1.00 62.55 C ATOM 166 O ASN A 11 78.138 58.265 4.123 1.00 3.33 O ATOM 167 CB ASN A 11 75.734 58.838 5.488 1.00 42.41 C ATOM 168 CG ASN A 11 76.555 59.956 6.123 1.00 62.50 C ATOM 169 OD1 ASN A 11 77.778 59.873 6.245 1.00 63.14 O ATOM 170 ND2 ASN A 11 75.879 61.025 6.519 1.00 43.24 N ATOM 0 H ASN A 11 77.884 57.483 7.037 1.00 4.11 H new ATOM 0 HA ASN A 11 75.612 56.708 5.371 1.00 44.33 H new ATOM 0 HB2 ASN A 11 75.556 59.083 4.441 1.00 42.41 H new ATOM 0 HB3 ASN A 11 74.760 58.796 5.976 1.00 42.41 H new ATOM 0 HD21 ASN A 11 76.371 61.813 6.940 1.00 43.24 H new ATOM 0 HD22 ASN A 11 74.866 61.060 6.403 1.00 43.24 H new ATOM 177 N PRO A 12 77.697 56.060 4.028 1.00 71.33 N ATOM 178 CA PRO A 12 78.705 55.767 3.004 1.00 34.14 C ATOM 179 C PRO A 12 78.354 56.399 1.660 1.00 51.42 C ATOM 180 O PRO A 12 79.241 56.784 0.896 1.00 63.23 O ATOM 181 CB PRO A 12 78.690 54.235 2.894 1.00 5.44 C ATOM 182 CG PRO A 12 77.964 53.756 4.106 1.00 13.40 C ATOM 183 CD PRO A 12 76.991 54.844 4.457 1.00 22.12 C ATOM 0 HA PRO A 12 79.681 56.171 3.272 1.00 34.14 H new ATOM 0 HB2 PRO A 12 78.188 53.912 1.982 1.00 5.44 H new ATOM 0 HB3 PRO A 12 79.703 53.834 2.859 1.00 5.44 H new ATOM 0 HG2 PRO A 12 77.446 52.818 3.906 1.00 13.40 H new ATOM 0 HG3 PRO A 12 78.655 53.570 4.928 1.00 13.40 H new ATOM 0 HD2 PRO A 12 76.042 54.722 3.936 1.00 22.12 H new ATOM 0 HD3 PRO A 12 76.769 54.860 5.524 1.00 22.12 H new ATOM 191 N ASN A 13 77.049 56.505 1.395 1.00 41.30 N ATOM 192 CA ASN A 13 76.536 57.092 0.155 1.00 75.43 C ATOM 193 C ASN A 13 77.163 56.438 -1.071 1.00 53.44 C ATOM 194 O ASN A 13 77.809 57.100 -1.883 1.00 60.03 O ATOM 195 CB ASN A 13 76.773 58.608 0.129 1.00 5.35 C ATOM 196 CG ASN A 13 75.981 59.333 1.200 1.00 12.51 C ATOM 197 OD1 ASN A 13 74.911 58.883 1.603 1.00 74.54 O ATOM 198 ND2 ASN A 13 76.498 60.459 1.668 1.00 31.22 N ATOM 0 H ASN A 13 76.320 56.187 2.033 1.00 41.30 H new ATOM 0 HA ASN A 13 75.462 56.907 0.125 1.00 75.43 H new ATOM 0 HB2 ASN A 13 77.835 58.810 0.267 1.00 5.35 H new ATOM 0 HB3 ASN A 13 76.498 59.000 -0.850 1.00 5.35 H new ATOM 0 HD21 ASN A 13 76.005 60.986 2.389 1.00 31.22 H new ATOM 0 HD22 ASN A 13 77.389 60.800 1.307 1.00 31.22 H new ATOM 205 N PHE A 14 76.976 55.132 -1.193 1.00 62.35 N ATOM 206 CA PHE A 14 77.539 54.375 -2.299 1.00 0.14 C ATOM 207 C PHE A 14 76.627 53.203 -2.644 1.00 75.23 C ATOM 208 O PHE A 14 76.230 52.443 -1.763 1.00 23.43 O ATOM 209 CB PHE A 14 78.941 53.872 -1.932 1.00 41.22 C ATOM 210 CG PHE A 14 79.618 53.089 -3.023 1.00 21.33 C ATOM 211 CD1 PHE A 14 79.760 51.714 -2.925 1.00 5.43 C ATOM 212 CD2 PHE A 14 80.114 53.733 -4.146 1.00 23.12 C ATOM 213 CE1 PHE A 14 80.382 50.996 -3.928 1.00 32.32 C ATOM 214 CE2 PHE A 14 80.737 53.019 -5.151 1.00 54.41 C ATOM 215 CZ PHE A 14 80.871 51.649 -5.043 1.00 3.14 C ATOM 0 H PHE A 14 76.435 54.572 -0.534 1.00 62.35 H new ATOM 0 HA PHE A 14 77.620 55.024 -3.171 1.00 0.14 H new ATOM 0 HB2 PHE A 14 79.565 54.727 -1.672 1.00 41.22 H new ATOM 0 HB3 PHE A 14 78.870 53.247 -1.042 1.00 41.22 H new ATOM 0 HD1 PHE A 14 79.380 51.198 -2.055 1.00 5.43 H new ATOM 0 HD2 PHE A 14 80.012 54.804 -4.236 1.00 23.12 H new ATOM 0 HE1 PHE A 14 80.486 49.925 -3.841 1.00 32.32 H new ATOM 0 HE2 PHE A 14 81.119 53.532 -6.021 1.00 54.41 H new ATOM 0 HZ PHE A 14 81.357 51.089 -5.828 1.00 3.14 H new ATOM 225 N GLY A 15 76.284 53.081 -3.916 1.00 54.15 N ATOM 226 CA GLY A 15 75.456 51.980 -4.370 1.00 71.23 C ATOM 227 C GLY A 15 75.547 51.813 -5.870 1.00 65.22 C ATOM 228 O GLY A 15 76.616 51.500 -6.399 1.00 42.44 O ATOM 0 H GLY A 15 76.566 53.731 -4.650 1.00 54.15 H new ATOM 0 HA2 GLY A 15 75.769 51.059 -3.879 1.00 71.23 H new ATOM 0 HA3 GLY A 15 74.420 52.158 -4.083 1.00 71.23 H new ATOM 232 N GLY A 16 74.438 52.027 -6.558 1.00 14.53 N ATOM 233 CA GLY A 16 74.443 51.976 -8.005 1.00 0.24 C ATOM 234 C GLY A 16 73.500 50.928 -8.555 1.00 22.35 C ATOM 235 O GLY A 16 73.028 50.057 -7.820 1.00 73.33 O ATOM 0 H GLY A 16 73.531 52.236 -6.140 1.00 14.53 H new ATOM 0 HA2 GLY A 16 74.164 52.953 -8.400 1.00 0.24 H new ATOM 0 HA3 GLY A 16 75.454 51.768 -8.354 1.00 0.24 H new ATOM 239 N ASN A 17 73.220 51.019 -9.848 1.00 43.33 N ATOM 240 CA ASN A 17 72.359 50.056 -10.526 1.00 1.12 C ATOM 241 C ASN A 17 73.156 49.341 -11.608 1.00 62.33 C ATOM 242 O ASN A 17 74.023 49.947 -12.241 1.00 61.32 O ATOM 243 CB ASN A 17 71.148 50.761 -11.148 1.00 21.55 C ATOM 244 CG ASN A 17 70.257 51.427 -10.115 1.00 72.14 C ATOM 245 OD1 ASN A 17 70.127 50.956 -8.985 1.00 51.22 O ATOM 246 ND2 ASN A 17 69.649 52.537 -10.492 1.00 0.34 N ATOM 0 H ASN A 17 73.580 51.756 -10.454 1.00 43.33 H new ATOM 0 HA ASN A 17 71.997 49.330 -9.798 1.00 1.12 H new ATOM 0 HB2 ASN A 17 71.496 51.511 -11.858 1.00 21.55 H new ATOM 0 HB3 ASN A 17 70.562 50.036 -11.712 1.00 21.55 H new ATOM 0 HD21 ASN A 17 69.046 53.036 -9.838 1.00 0.34 H new ATOM 0 HD22 ASN A 17 69.782 52.896 -11.438 1.00 0.34 H new ATOM 253 N PRO A 18 72.885 48.045 -11.835 1.00 24.35 N ATOM 254 CA PRO A 18 73.643 47.247 -12.803 1.00 21.23 C ATOM 255 C PRO A 18 73.426 47.701 -14.251 1.00 14.44 C ATOM 256 O PRO A 18 74.382 48.061 -14.938 1.00 61.41 O ATOM 257 CB PRO A 18 73.110 45.826 -12.590 1.00 45.30 C ATOM 258 CG PRO A 18 71.762 46.002 -11.976 1.00 32.23 C ATOM 259 CD PRO A 18 71.835 47.262 -11.162 1.00 15.21 C ATOM 0 HA PRO A 18 74.718 47.340 -12.648 1.00 21.23 H new ATOM 0 HB2 PRO A 18 73.045 45.284 -13.534 1.00 45.30 H new ATOM 0 HB3 PRO A 18 73.768 45.252 -11.937 1.00 45.30 H new ATOM 0 HG2 PRO A 18 70.991 46.078 -12.743 1.00 32.23 H new ATOM 0 HG3 PRO A 18 71.505 45.148 -11.350 1.00 32.23 H new ATOM 0 HD2 PRO A 18 70.882 47.791 -11.155 1.00 15.21 H new ATOM 0 HD3 PRO A 18 72.092 47.055 -10.123 1.00 15.21 H new ATOM 267 N ASN A 19 72.175 47.719 -14.697 1.00 23.42 N ATOM 268 CA ASN A 19 71.852 48.103 -16.069 1.00 64.52 C ATOM 269 C ASN A 19 70.335 48.097 -16.248 1.00 63.24 C ATOM 270 O ASN A 19 69.595 47.981 -15.268 1.00 74.52 O ATOM 271 CB ASN A 19 72.509 47.135 -17.071 1.00 34.52 C ATOM 272 CG ASN A 19 72.812 47.775 -18.420 1.00 65.20 C ATOM 273 OD1 ASN A 19 72.132 48.707 -18.857 1.00 30.24 O ATOM 274 ND2 ASN A 19 73.846 47.285 -19.085 1.00 44.43 N ATOM 0 H ASN A 19 71.365 47.472 -14.128 1.00 23.42 H new ATOM 0 HA ASN A 19 72.238 49.104 -16.261 1.00 64.52 H new ATOM 0 HB2 ASN A 19 73.435 46.753 -16.642 1.00 34.52 H new ATOM 0 HB3 ASN A 19 71.851 46.279 -17.223 1.00 34.52 H new ATOM 0 HD21 ASN A 19 74.103 47.679 -19.990 1.00 44.43 H new ATOM 0 HD22 ASN A 19 74.386 46.514 -18.692 1.00 44.43 H new ATOM 281 N ASN A 20 69.877 48.235 -17.484 1.00 0.34 N ATOM 282 CA ASN A 20 68.453 48.215 -17.784 1.00 2.02 C ATOM 283 C ASN A 20 68.164 47.156 -18.836 1.00 40.34 C ATOM 284 O ASN A 20 69.042 46.792 -19.618 1.00 74.24 O ATOM 285 CB ASN A 20 67.980 49.589 -18.283 1.00 1.51 C ATOM 286 CG ASN A 20 68.441 49.898 -19.698 1.00 51.11 C ATOM 287 OD1 ASN A 20 67.738 49.616 -20.672 1.00 52.43 O ATOM 288 ND2 ASN A 20 69.618 50.488 -19.822 1.00 2.01 N ATOM 0 H ASN A 20 70.476 48.363 -18.300 1.00 0.34 H new ATOM 0 HA ASN A 20 67.911 47.976 -16.869 1.00 2.02 H new ATOM 0 HB2 ASN A 20 66.891 49.628 -18.245 1.00 1.51 H new ATOM 0 HB3 ASN A 20 68.351 50.361 -17.609 1.00 1.51 H new ATOM 0 HD21 ASN A 20 69.974 50.726 -20.748 1.00 2.01 H new ATOM 0 HD22 ASN A 20 70.170 50.705 -18.992 1.00 2.01 H new ATOM 295 N GLY A 21 66.938 46.659 -18.846 1.00 62.44 N ATOM 296 CA GLY A 21 66.551 45.666 -19.824 1.00 13.55 C ATOM 297 C GLY A 21 65.167 45.926 -20.374 1.00 0.45 C ATOM 298 O GLY A 21 64.231 46.185 -19.618 1.00 25.41 O ATOM 0 H GLY A 21 66.202 46.926 -18.192 1.00 62.44 H new ATOM 0 HA2 GLY A 21 67.272 45.662 -20.642 1.00 13.55 H new ATOM 0 HA3 GLY A 21 66.580 44.676 -19.368 1.00 13.55 H new ATOM 302 N ALA A 22 65.044 45.875 -21.691 1.00 11.14 N ATOM 303 CA ALA A 22 63.768 46.085 -22.361 1.00 24.15 C ATOM 304 C ALA A 22 63.849 45.589 -23.797 1.00 21.32 C ATOM 305 O ALA A 22 64.644 46.097 -24.591 1.00 64.10 O ATOM 306 CB ALA A 22 63.381 47.559 -22.331 1.00 21.11 C ATOM 0 H ALA A 22 65.821 45.688 -22.324 1.00 11.14 H new ATOM 0 HA ALA A 22 63.000 45.520 -21.833 1.00 24.15 H new ATOM 0 HB1 ALA A 22 62.425 47.695 -22.837 1.00 21.11 H new ATOM 0 HB2 ALA A 22 63.295 47.892 -21.297 1.00 21.11 H new ATOM 0 HB3 ALA A 22 64.146 48.146 -22.838 1.00 21.11 H new ATOM 312 N PHE A 23 63.040 44.592 -24.124 1.00 32.04 N ATOM 313 CA PHE A 23 63.067 44.000 -25.452 1.00 53.22 C ATOM 314 C PHE A 23 61.735 43.338 -25.786 1.00 65.32 C ATOM 315 O PHE A 23 61.257 42.460 -25.066 1.00 62.34 O ATOM 316 CB PHE A 23 64.225 42.993 -25.577 1.00 65.22 C ATOM 317 CG PHE A 23 64.202 41.873 -24.567 1.00 71.25 C ATOM 318 CD1 PHE A 23 63.750 40.611 -24.923 1.00 53.43 C ATOM 319 CD2 PHE A 23 64.633 42.081 -23.265 1.00 21.43 C ATOM 320 CE1 PHE A 23 63.731 39.580 -24.003 1.00 0.12 C ATOM 321 CE2 PHE A 23 64.615 41.055 -22.340 1.00 3.24 C ATOM 322 CZ PHE A 23 64.163 39.804 -22.710 1.00 64.54 C ATOM 0 H PHE A 23 62.358 44.177 -23.489 1.00 32.04 H new ATOM 0 HA PHE A 23 63.232 44.801 -26.173 1.00 53.22 H new ATOM 0 HB2 PHE A 23 64.206 42.561 -26.578 1.00 65.22 H new ATOM 0 HB3 PHE A 23 65.168 43.531 -25.480 1.00 65.22 H new ATOM 0 HD1 PHE A 23 63.409 40.432 -25.932 1.00 53.43 H new ATOM 0 HD2 PHE A 23 64.987 43.058 -22.971 1.00 21.43 H new ATOM 0 HE1 PHE A 23 63.379 38.601 -24.294 1.00 0.12 H new ATOM 0 HE2 PHE A 23 64.954 41.231 -21.330 1.00 3.24 H new ATOM 0 HZ PHE A 23 64.147 39.000 -21.989 1.00 64.54 H new ATOM 332 N LEU A 24 61.128 43.785 -26.878 1.00 53.34 N ATOM 333 CA LEU A 24 59.886 43.203 -27.360 1.00 51.34 C ATOM 334 C LEU A 24 59.702 43.480 -28.847 1.00 45.44 C ATOM 335 O LEU A 24 59.903 44.601 -29.313 1.00 10.11 O ATOM 336 CB LEU A 24 58.687 43.706 -26.534 1.00 62.32 C ATOM 337 CG LEU A 24 58.598 45.224 -26.301 1.00 3.14 C ATOM 338 CD1 LEU A 24 57.930 45.930 -27.473 1.00 23.03 C ATOM 339 CD2 LEU A 24 57.850 45.518 -25.005 1.00 11.23 C ATOM 0 H LEU A 24 61.480 44.554 -27.448 1.00 53.34 H new ATOM 0 HA LEU A 24 59.939 42.122 -27.231 1.00 51.34 H new ATOM 0 HB2 LEU A 24 57.772 43.384 -27.031 1.00 62.32 H new ATOM 0 HB3 LEU A 24 58.712 43.213 -25.562 1.00 62.32 H new ATOM 0 HG LEU A 24 59.614 45.609 -26.218 1.00 3.14 H new ATOM 0 HD11 LEU A 24 57.884 47.001 -27.274 1.00 23.03 H new ATOM 0 HD12 LEU A 24 58.507 45.754 -28.381 1.00 23.03 H new ATOM 0 HD13 LEU A 24 56.920 45.542 -27.604 1.00 23.03 H new ATOM 0 HD21 LEU A 24 57.795 46.596 -24.853 1.00 11.23 H new ATOM 0 HD22 LEU A 24 56.842 45.108 -25.066 1.00 11.23 H new ATOM 0 HD23 LEU A 24 58.378 45.060 -24.168 1.00 11.23 H new ATOM 351 N LEU A 25 59.382 42.431 -29.587 1.00 14.23 N ATOM 352 CA LEU A 25 59.115 42.534 -31.017 1.00 22.42 C ATOM 353 C LEU A 25 57.878 41.728 -31.401 1.00 42.44 C ATOM 354 O LEU A 25 57.197 42.050 -32.378 1.00 41.32 O ATOM 355 CB LEU A 25 60.316 42.043 -31.830 1.00 52.44 C ATOM 356 CG LEU A 25 61.559 42.936 -31.780 1.00 3.52 C ATOM 357 CD1 LEU A 25 62.695 42.304 -32.569 1.00 35.34 C ATOM 358 CD2 LEU A 25 61.242 44.322 -32.326 1.00 34.05 C ATOM 0 H LEU A 25 59.299 41.484 -29.216 1.00 14.23 H new ATOM 0 HA LEU A 25 58.936 43.585 -31.243 1.00 22.42 H new ATOM 0 HB2 LEU A 25 60.590 41.049 -31.475 1.00 52.44 H new ATOM 0 HB3 LEU A 25 60.009 41.937 -32.870 1.00 52.44 H new ATOM 0 HG LEU A 25 61.871 43.037 -30.740 1.00 3.52 H new ATOM 0 HD11 LEU A 25 63.572 42.950 -32.525 1.00 35.34 H new ATOM 0 HD12 LEU A 25 62.938 41.332 -32.141 1.00 35.34 H new ATOM 0 HD13 LEU A 25 62.390 42.177 -33.608 1.00 35.34 H new ATOM 0 HD21 LEU A 25 62.137 44.943 -32.283 1.00 34.05 H new ATOM 0 HD22 LEU A 25 60.908 44.238 -33.360 1.00 34.05 H new ATOM 0 HD23 LEU A 25 60.454 44.778 -31.726 1.00 34.05 H new ATOM 370 N ASN A 26 57.595 40.677 -30.632 1.00 73.20 N ATOM 371 CA ASN A 26 56.447 39.816 -30.889 1.00 60.40 C ATOM 372 C ASN A 26 55.150 40.600 -30.735 1.00 55.24 C ATOM 373 O ASN A 26 55.009 41.413 -29.819 1.00 70.31 O ATOM 374 CB ASN A 26 56.455 38.619 -29.932 1.00 52.12 C ATOM 375 CG ASN A 26 55.345 37.632 -30.233 1.00 31.52 C ATOM 376 OD1 ASN A 26 54.958 37.442 -31.390 1.00 61.41 O ATOM 377 ND2 ASN A 26 54.821 37.002 -29.197 1.00 0.40 N ATOM 0 H ASN A 26 58.150 40.402 -29.822 1.00 73.20 H new ATOM 0 HA ASN A 26 56.514 39.448 -31.913 1.00 60.40 H new ATOM 0 HB2 ASN A 26 57.417 38.111 -29.998 1.00 52.12 H new ATOM 0 HB3 ASN A 26 56.352 38.976 -28.907 1.00 52.12 H new ATOM 0 HD21 ASN A 26 54.067 36.329 -29.337 1.00 0.40 H new ATOM 0 HD22 ASN A 26 55.170 37.188 -28.257 1.00 0.40 H new ATOM 384 N SER A 27 54.217 40.360 -31.642 1.00 41.42 N ATOM 385 CA SER A 27 52.946 41.065 -31.653 1.00 71.35 C ATOM 386 C SER A 27 52.079 40.670 -30.460 1.00 32.44 C ATOM 387 O SER A 27 51.706 39.502 -30.305 1.00 10.41 O ATOM 388 CB SER A 27 52.215 40.764 -32.957 1.00 30.22 C ATOM 389 OG SER A 27 53.079 40.940 -34.068 1.00 62.34 O ATOM 0 H SER A 27 54.319 39.673 -32.389 1.00 41.42 H new ATOM 0 HA SER A 27 53.142 42.135 -31.578 1.00 71.35 H new ATOM 0 HB2 SER A 27 51.839 39.741 -32.941 1.00 30.22 H new ATOM 0 HB3 SER A 27 51.350 41.420 -33.055 1.00 30.22 H new ATOM 0 HG SER A 27 52.593 40.741 -34.895 1.00 62.34 H new ATOM 395 N ALA A 28 51.764 41.646 -29.624 1.00 11.40 N ATOM 396 CA ALA A 28 50.914 41.424 -28.467 1.00 74.12 C ATOM 397 C ALA A 28 49.675 42.301 -28.552 1.00 32.20 C ATOM 398 O ALA A 28 49.623 43.239 -29.348 1.00 40.33 O ATOM 399 CB ALA A 28 51.678 41.702 -27.183 1.00 11.11 C ATOM 0 H ALA A 28 52.088 42.608 -29.727 1.00 11.40 H new ATOM 0 HA ALA A 28 50.602 40.380 -28.458 1.00 74.12 H new ATOM 0 HB1 ALA A 28 51.025 41.531 -26.327 1.00 11.11 H new ATOM 0 HB2 ALA A 28 52.540 41.037 -27.121 1.00 11.11 H new ATOM 0 HB3 ALA A 28 52.018 42.738 -27.179 1.00 11.11 H new ATOM 405 N GLN A 29 48.683 42.002 -27.730 1.00 51.32 N ATOM 406 CA GLN A 29 47.432 42.741 -27.747 1.00 50.44 C ATOM 407 C GLN A 29 47.413 43.764 -26.616 1.00 51.32 C ATOM 408 O GLN A 29 47.692 43.432 -25.462 1.00 65.31 O ATOM 409 CB GLN A 29 46.244 41.781 -27.616 1.00 25.01 C ATOM 410 CG GLN A 29 44.890 42.457 -27.771 1.00 22.41 C ATOM 411 CD GLN A 29 43.732 41.483 -27.624 1.00 13.34 C ATOM 412 OE1 GLN A 29 43.828 40.491 -26.901 1.00 43.24 O ATOM 413 NE2 GLN A 29 42.627 41.758 -28.300 1.00 45.43 N ATOM 0 H GLN A 29 48.720 41.251 -27.041 1.00 51.32 H new ATOM 0 HA GLN A 29 47.349 43.267 -28.698 1.00 50.44 H new ATOM 0 HB2 GLN A 29 46.337 40.998 -28.368 1.00 25.01 H new ATOM 0 HB3 GLN A 29 46.288 41.294 -26.642 1.00 25.01 H new ATOM 0 HG2 GLN A 29 44.794 43.246 -27.025 1.00 22.41 H new ATOM 0 HG3 GLN A 29 44.836 42.935 -28.749 1.00 22.41 H new ATOM 0 HE21 GLN A 29 42.583 42.589 -28.890 1.00 45.43 H new ATOM 0 HE22 GLN A 29 41.820 41.139 -28.231 1.00 45.43 H new ATOM 422 N ALA A 30 47.102 45.005 -26.959 1.00 32.35 N ATOM 423 CA ALA A 30 47.032 46.076 -25.976 1.00 75.25 C ATOM 424 C ALA A 30 45.674 46.083 -25.286 1.00 2.24 C ATOM 425 O ALA A 30 44.805 45.271 -25.613 1.00 44.53 O ATOM 426 CB ALA A 30 47.299 47.418 -26.642 1.00 53.52 C ATOM 0 H ALA A 30 46.893 45.296 -27.914 1.00 32.35 H new ATOM 0 HA ALA A 30 47.798 45.903 -25.220 1.00 75.25 H new ATOM 0 HB1 ALA A 30 47.244 48.211 -25.897 1.00 53.52 H new ATOM 0 HB2 ALA A 30 48.292 47.410 -27.091 1.00 53.52 H new ATOM 0 HB3 ALA A 30 46.552 47.595 -27.416 1.00 53.52 H new ATOM 432 N GLN A 31 45.504 47.006 -24.334 1.00 62.43 N ATOM 433 CA GLN A 31 44.254 47.152 -23.583 1.00 45.15 C ATOM 434 C GLN A 31 43.981 45.929 -22.710 1.00 11.34 C ATOM 435 O GLN A 31 44.755 44.969 -22.704 1.00 33.30 O ATOM 436 CB GLN A 31 43.061 47.378 -24.522 1.00 15.14 C ATOM 437 CG GLN A 31 43.161 48.628 -25.381 1.00 52.33 C ATOM 438 CD GLN A 31 41.967 48.774 -26.304 1.00 4.22 C ATOM 439 OE1 GLN A 31 41.374 47.781 -26.721 1.00 75.53 O ATOM 440 NE2 GLN A 31 41.610 50.003 -26.635 1.00 5.45 N ATOM 0 H GLN A 31 46.228 47.672 -24.063 1.00 62.43 H new ATOM 0 HA GLN A 31 44.374 48.026 -22.942 1.00 45.15 H new ATOM 0 HB2 GLN A 31 42.960 46.511 -25.175 1.00 15.14 H new ATOM 0 HB3 GLN A 31 42.151 47.435 -23.925 1.00 15.14 H new ATOM 0 HG2 GLN A 31 43.233 49.506 -24.739 1.00 52.33 H new ATOM 0 HG3 GLN A 31 44.075 48.590 -25.973 1.00 52.33 H new ATOM 0 HE21 GLN A 31 42.128 50.801 -26.268 1.00 5.45 H new ATOM 0 HE22 GLN A 31 40.816 50.153 -27.258 1.00 5.45 H new ATOM 449 N ASN A 32 42.888 46.005 -21.945 1.00 32.35 N ATOM 450 CA ASN A 32 42.376 44.880 -21.147 1.00 60.00 C ATOM 451 C ASN A 32 43.357 44.417 -20.069 1.00 24.31 C ATOM 452 O ASN A 32 43.087 43.451 -19.360 1.00 12.35 O ATOM 453 CB ASN A 32 42.025 43.692 -22.054 1.00 55.23 C ATOM 454 CG ASN A 32 40.962 44.020 -23.087 1.00 52.21 C ATOM 455 OD1 ASN A 32 41.271 44.466 -24.193 1.00 64.01 O ATOM 456 ND2 ASN A 32 39.705 43.797 -22.738 1.00 12.22 N ATOM 0 H ASN A 32 42.328 46.853 -21.859 1.00 32.35 H new ATOM 0 HA ASN A 32 41.481 45.247 -20.644 1.00 60.00 H new ATOM 0 HB2 ASN A 32 42.927 43.355 -22.565 1.00 55.23 H new ATOM 0 HB3 ASN A 32 41.679 42.862 -21.437 1.00 55.23 H new ATOM 0 HD21 ASN A 32 38.950 43.995 -23.395 1.00 12.22 H new ATOM 0 HD22 ASN A 32 39.491 43.427 -21.812 1.00 12.22 H new ATOM 463 N SER A 33 44.479 45.106 -19.930 1.00 43.41 N ATOM 464 CA SER A 33 45.533 44.662 -19.030 1.00 24.32 C ATOM 465 C SER A 33 45.989 45.773 -18.088 1.00 0.13 C ATOM 466 O SER A 33 46.995 45.624 -17.396 1.00 23.01 O ATOM 467 CB SER A 33 46.714 44.161 -19.860 1.00 74.21 C ATOM 468 OG SER A 33 46.980 45.051 -20.934 1.00 5.52 O ATOM 0 H SER A 33 44.683 45.973 -20.427 1.00 43.41 H new ATOM 0 HA SER A 33 45.137 43.858 -18.409 1.00 24.32 H new ATOM 0 HB2 SER A 33 47.597 44.070 -19.228 1.00 74.21 H new ATOM 0 HB3 SER A 33 46.497 43.166 -20.249 1.00 74.21 H new ATOM 0 HG SER A 33 46.282 44.959 -21.616 1.00 5.52 H new ATOM 474 N TYR A 34 45.232 46.870 -18.047 1.00 44.31 N ATOM 475 CA TYR A 34 45.599 48.041 -17.251 1.00 61.24 C ATOM 476 C TYR A 34 46.963 48.577 -17.699 1.00 73.24 C ATOM 477 O TYR A 34 48.002 48.281 -17.105 1.00 62.43 O ATOM 478 CB TYR A 34 45.593 47.711 -15.748 1.00 13.13 C ATOM 479 CG TYR A 34 45.885 48.894 -14.850 1.00 74.24 C ATOM 480 CD1 TYR A 34 44.929 49.876 -14.629 1.00 25.42 C ATOM 481 CD2 TYR A 34 47.116 49.023 -14.222 1.00 64.13 C ATOM 482 CE1 TYR A 34 45.193 50.955 -13.805 1.00 53.30 C ATOM 483 CE2 TYR A 34 47.389 50.096 -13.398 1.00 70.13 C ATOM 484 CZ TYR A 34 46.426 51.061 -13.193 1.00 21.34 C ATOM 485 OH TYR A 34 46.701 52.138 -12.376 1.00 74.43 O ATOM 0 H TYR A 34 44.356 46.972 -18.559 1.00 44.31 H new ATOM 0 HA TYR A 34 44.855 48.820 -17.415 1.00 61.24 H new ATOM 0 HB2 TYR A 34 44.619 47.299 -15.482 1.00 13.13 H new ATOM 0 HB3 TYR A 34 46.331 46.933 -15.556 1.00 13.13 H new ATOM 0 HD1 TYR A 34 43.964 49.796 -15.108 1.00 25.42 H new ATOM 0 HD2 TYR A 34 47.874 48.270 -14.381 1.00 64.13 H new ATOM 0 HE1 TYR A 34 44.439 51.710 -13.641 1.00 53.30 H new ATOM 0 HE2 TYR A 34 48.352 50.179 -12.916 1.00 70.13 H new ATOM 0 HH TYR A 34 47.612 52.058 -12.025 1.00 74.43 H new ATOM 495 N LYS A 35 46.939 49.347 -18.777 1.00 52.32 N ATOM 496 CA LYS A 35 48.143 49.867 -19.410 1.00 32.34 C ATOM 497 C LYS A 35 47.709 50.817 -20.513 1.00 3.52 C ATOM 498 O LYS A 35 46.509 50.932 -20.771 1.00 34.43 O ATOM 499 CB LYS A 35 48.979 48.711 -19.979 1.00 4.45 C ATOM 500 CG LYS A 35 50.430 48.710 -19.517 1.00 64.01 C ATOM 501 CD LYS A 35 51.330 49.504 -20.450 1.00 53.33 C ATOM 502 CE LYS A 35 51.451 48.832 -21.812 1.00 71.43 C ATOM 503 NZ LYS A 35 52.388 49.557 -22.706 1.00 25.44 N1+ ATOM 0 H LYS A 35 46.076 49.631 -19.241 1.00 52.32 H new ATOM 0 HA LYS A 35 48.764 50.396 -18.687 1.00 32.34 H new ATOM 0 HB2 LYS A 35 48.517 47.766 -19.693 1.00 4.45 H new ATOM 0 HB3 LYS A 35 48.955 48.760 -21.068 1.00 4.45 H new ATOM 0 HG2 LYS A 35 50.490 49.130 -18.513 1.00 64.01 H new ATOM 0 HG3 LYS A 35 50.789 47.683 -19.455 1.00 64.01 H new ATOM 0 HD2 LYS A 35 50.931 50.511 -20.574 1.00 53.33 H new ATOM 0 HD3 LYS A 35 52.319 49.606 -20.004 1.00 53.33 H new ATOM 0 HE2 LYS A 35 51.795 47.806 -21.681 1.00 71.43 H new ATOM 0 HE3 LYS A 35 50.468 48.782 -22.280 1.00 71.43 H new ATOM 0 HZ1 LYS A 35 52.353 49.139 -23.658 1.00 25.44 H new ATOM 0 HZ2 LYS A 35 52.114 50.559 -22.757 1.00 25.44 H new ATOM 0 HZ3 LYS A 35 53.355 49.481 -22.330 1.00 25.44 H new ATOM 517 N ASP A 36 48.648 51.493 -21.164 1.00 74.53 N ATOM 518 CA ASP A 36 48.283 52.410 -22.236 1.00 12.22 C ATOM 519 C ASP A 36 47.673 51.631 -23.399 1.00 2.12 C ATOM 520 O ASP A 36 48.070 50.497 -23.683 1.00 1.02 O ATOM 521 CB ASP A 36 49.484 53.253 -22.706 1.00 13.10 C ATOM 522 CG ASP A 36 50.592 52.441 -23.354 1.00 53.20 C ATOM 523 OD1 ASP A 36 51.539 52.048 -22.642 1.00 0.23 O ATOM 524 OD2 ASP A 36 50.533 52.209 -24.577 1.00 61.43 O1- ATOM 0 H ASP A 36 49.648 51.426 -20.974 1.00 74.53 H new ATOM 0 HA ASP A 36 47.541 53.107 -21.846 1.00 12.22 H new ATOM 0 HB2 ASP A 36 49.134 54.002 -23.416 1.00 13.10 H new ATOM 0 HB3 ASP A 36 49.894 53.791 -21.851 1.00 13.10 H new ATOM 529 N PRO A 37 46.669 52.221 -24.060 1.00 13.20 N ATOM 530 CA PRO A 37 45.939 51.577 -25.140 1.00 63.51 C ATOM 531 C PRO A 37 46.552 51.859 -26.512 1.00 54.33 C ATOM 532 O PRO A 37 47.443 52.699 -26.631 1.00 45.11 O ATOM 533 CB PRO A 37 44.554 52.204 -25.000 1.00 21.24 C ATOM 534 CG PRO A 37 44.797 53.581 -24.466 1.00 41.34 C ATOM 535 CD PRO A 37 46.149 53.569 -23.789 1.00 70.22 C ATOM 0 HA PRO A 37 45.943 50.489 -25.074 1.00 63.51 H new ATOM 0 HB2 PRO A 37 44.039 52.239 -25.960 1.00 21.24 H new ATOM 0 HB3 PRO A 37 43.926 51.625 -24.323 1.00 21.24 H new ATOM 0 HG2 PRO A 37 44.777 54.315 -25.272 1.00 41.34 H new ATOM 0 HG3 PRO A 37 44.016 53.863 -23.760 1.00 41.34 H new ATOM 0 HD2 PRO A 37 46.805 54.339 -24.194 1.00 70.22 H new ATOM 0 HD3 PRO A 37 46.061 53.756 -22.719 1.00 70.22 H new ATOM 543 N SER A 38 46.033 51.182 -27.541 1.00 14.04 N ATOM 544 CA SER A 38 46.621 51.175 -28.885 1.00 55.00 C ATOM 545 C SER A 38 45.875 50.199 -29.804 1.00 15.51 C ATOM 546 O SER A 38 46.433 49.742 -30.799 1.00 61.15 O ATOM 547 CB SER A 38 48.104 50.762 -28.846 1.00 62.11 C ATOM 548 OG SER A 38 48.946 51.836 -28.461 1.00 2.22 O ATOM 0 H SER A 38 45.186 50.619 -27.464 1.00 14.04 H new ATOM 0 HA SER A 38 46.535 52.191 -29.272 1.00 55.00 H new ATOM 0 HB2 SER A 38 48.231 49.934 -28.149 1.00 62.11 H new ATOM 0 HB3 SER A 38 48.405 50.400 -29.829 1.00 62.11 H new ATOM 0 HG SER A 38 48.436 52.473 -27.918 1.00 2.22 H new ATOM 554 N TYR A 39 44.615 49.890 -29.499 1.00 43.44 N ATOM 555 CA TYR A 39 43.930 48.813 -30.212 1.00 20.45 C ATOM 556 C TYR A 39 42.418 49.048 -30.284 1.00 62.10 C ATOM 557 O TYR A 39 41.862 49.791 -29.481 1.00 24.30 O ATOM 558 CB TYR A 39 44.235 47.471 -29.524 1.00 32.34 C ATOM 559 CG TYR A 39 43.720 46.253 -30.264 1.00 55.01 C ATOM 560 CD1 TYR A 39 44.273 45.867 -31.481 1.00 1.41 C ATOM 561 CD2 TYR A 39 42.683 45.490 -29.746 1.00 62.40 C ATOM 562 CE1 TYR A 39 43.806 44.754 -32.158 1.00 74.42 C ATOM 563 CE2 TYR A 39 42.211 44.377 -30.415 1.00 23.44 C ATOM 564 CZ TYR A 39 42.774 44.014 -31.622 1.00 40.22 C ATOM 565 OH TYR A 39 42.303 42.907 -32.290 1.00 3.35 O ATOM 0 H TYR A 39 44.060 50.357 -28.782 1.00 43.44 H new ATOM 0 HA TYR A 39 44.300 48.792 -31.237 1.00 20.45 H new ATOM 0 HB2 TYR A 39 45.314 47.377 -29.402 1.00 32.34 H new ATOM 0 HB3 TYR A 39 43.801 47.483 -28.524 1.00 32.34 H new ATOM 0 HD1 TYR A 39 45.080 46.446 -31.905 1.00 1.41 H new ATOM 0 HD2 TYR A 39 42.237 45.771 -28.803 1.00 62.40 H new ATOM 0 HE1 TYR A 39 44.248 44.467 -33.101 1.00 74.42 H new ATOM 0 HE2 TYR A 39 41.405 43.793 -29.995 1.00 23.44 H new ATOM 0 HH TYR A 39 41.576 42.499 -31.775 1.00 3.35 H new ATOM 575 N ASN A 40 41.776 48.410 -31.271 1.00 65.22 N ATOM 576 CA ASN A 40 40.320 48.473 -31.450 1.00 3.22 C ATOM 577 C ASN A 40 39.849 49.918 -31.596 1.00 70.45 C ATOM 578 O ASN A 40 39.035 50.404 -30.809 1.00 15.21 O ATOM 579 CB ASN A 40 39.595 47.780 -30.285 1.00 75.20 C ATOM 580 CG ASN A 40 38.109 47.589 -30.548 1.00 64.02 C ATOM 581 OD1 ASN A 40 37.681 47.448 -31.693 1.00 40.50 O ATOM 582 ND2 ASN A 40 37.316 47.578 -29.490 1.00 70.04 N ATOM 0 H ASN A 40 42.251 47.836 -31.968 1.00 65.22 H new ATOM 0 HA ASN A 40 40.072 47.942 -32.369 1.00 3.22 H new ATOM 0 HB2 ASN A 40 40.055 46.809 -30.102 1.00 75.20 H new ATOM 0 HB3 ASN A 40 39.726 48.370 -29.378 1.00 75.20 H new ATOM 0 HD21 ASN A 40 36.311 47.449 -29.607 1.00 70.04 H new ATOM 0 HD22 ASN A 40 37.709 47.698 -28.557 1.00 70.04 H new ATOM 589 N ASP A 41 40.388 50.587 -32.613 1.00 1.43 N ATOM 590 CA ASP A 41 40.091 51.994 -32.899 1.00 42.41 C ATOM 591 C ASP A 41 40.250 52.854 -31.648 1.00 73.04 C ATOM 592 O ASP A 41 39.273 53.280 -31.028 1.00 20.40 O ATOM 593 CB ASP A 41 38.693 52.165 -33.502 1.00 75.34 C ATOM 594 CG ASP A 41 38.481 53.557 -34.068 1.00 44.10 C ATOM 595 OD1 ASP A 41 37.672 54.321 -33.502 1.00 61.14 O ATOM 596 OD2 ASP A 41 39.133 53.897 -35.078 1.00 31.02 O1- ATOM 0 H ASP A 41 41.048 50.168 -33.268 1.00 1.43 H new ATOM 0 HA ASP A 41 40.814 52.334 -33.640 1.00 42.41 H new ATOM 0 HB2 ASP A 41 38.546 51.427 -34.291 1.00 75.34 H new ATOM 0 HB3 ASP A 41 37.942 51.967 -32.737 1.00 75.34 H new ATOM 601 N ASP A 42 41.499 53.086 -31.284 1.00 64.11 N ATOM 602 CA ASP A 42 41.836 53.819 -30.074 1.00 22.32 C ATOM 603 C ASP A 42 43.246 54.384 -30.181 1.00 12.21 C ATOM 604 O ASP A 42 43.451 55.582 -29.994 1.00 2.23 O ATOM 605 CB ASP A 42 41.663 52.910 -28.851 1.00 70.12 C ATOM 606 CG ASP A 42 42.816 52.969 -27.877 1.00 70.01 C ATOM 607 OD1 ASP A 42 43.541 51.961 -27.778 1.00 24.15 O ATOM 608 OD2 ASP A 42 43.003 54.012 -27.212 1.00 23.10 O1- ATOM 0 H ASP A 42 42.309 52.772 -31.818 1.00 64.11 H new ATOM 0 HA ASP A 42 41.159 54.664 -29.952 1.00 22.32 H new ATOM 0 HB2 ASP A 42 40.746 53.188 -28.331 1.00 70.12 H new ATOM 0 HB3 ASP A 42 41.538 51.881 -29.190 1.00 70.12 H new ATOM 613 N PHE A 43 44.199 53.514 -30.522 1.00 34.33 N ATOM 614 CA PHE A 43 45.598 53.895 -30.779 1.00 42.52 C ATOM 615 C PHE A 43 46.275 54.595 -29.586 1.00 55.15 C ATOM 616 O PHE A 43 47.460 54.939 -29.655 1.00 42.21 O ATOM 617 CB PHE A 43 45.655 54.799 -32.011 1.00 45.40 C ATOM 618 CG PHE A 43 46.977 54.771 -32.721 1.00 60.21 C ATOM 619 CD1 PHE A 43 47.850 55.843 -32.638 1.00 61.42 C ATOM 620 CD2 PHE A 43 47.346 53.668 -33.472 1.00 74.23 C ATOM 621 CE1 PHE A 43 49.067 55.813 -33.287 1.00 3.13 C ATOM 622 CE2 PHE A 43 48.561 53.631 -34.125 1.00 34.35 C ATOM 623 CZ PHE A 43 49.422 54.707 -34.034 1.00 75.22 C ATOM 0 H PHE A 43 44.024 52.515 -30.630 1.00 34.33 H new ATOM 0 HA PHE A 43 46.153 52.972 -30.947 1.00 42.52 H new ATOM 0 HB2 PHE A 43 44.872 54.498 -32.708 1.00 45.40 H new ATOM 0 HB3 PHE A 43 45.437 55.823 -31.709 1.00 45.40 H new ATOM 0 HD1 PHE A 43 47.575 56.712 -32.059 1.00 61.42 H new ATOM 0 HD2 PHE A 43 46.674 52.826 -33.548 1.00 74.23 H new ATOM 0 HE1 PHE A 43 49.741 56.653 -33.211 1.00 3.13 H new ATOM 0 HE2 PHE A 43 48.838 52.763 -34.705 1.00 34.35 H new ATOM 0 HZ PHE A 43 50.372 54.684 -34.547 1.00 75.22 H new ATOM 633 N GLY A 44 45.553 54.782 -28.494 1.00 3.11 N ATOM 634 CA GLY A 44 46.127 55.430 -27.339 1.00 42.15 C ATOM 635 C GLY A 44 45.360 56.663 -26.919 1.00 3.45 C ATOM 636 O GLY A 44 45.930 57.746 -26.812 1.00 74.52 O ATOM 0 H GLY A 44 44.580 54.496 -28.388 1.00 3.11 H new ATOM 0 HA2 GLY A 44 46.155 54.725 -26.509 1.00 42.15 H new ATOM 0 HA3 GLY A 44 47.159 55.706 -27.558 1.00 42.15 H new ATOM 640 N ILE A 45 44.068 56.506 -26.678 1.00 51.24 N ATOM 641 CA ILE A 45 43.243 57.603 -26.174 1.00 71.42 C ATOM 642 C ILE A 45 43.780 58.122 -24.832 1.00 20.41 C ATOM 643 O ILE A 45 43.586 59.284 -24.476 1.00 25.51 O ATOM 644 CB ILE A 45 41.767 57.162 -26.011 1.00 34.42 C ATOM 645 CG1 ILE A 45 41.215 56.642 -27.341 1.00 11.31 C ATOM 646 CG2 ILE A 45 40.907 58.309 -25.496 1.00 54.24 C ATOM 647 CD1 ILE A 45 41.216 57.676 -28.450 1.00 75.24 C ATOM 0 H ILE A 45 43.564 55.631 -26.822 1.00 51.24 H new ATOM 0 HA ILE A 45 43.288 58.408 -26.907 1.00 71.42 H new ATOM 0 HB ILE A 45 41.735 56.357 -25.277 1.00 34.42 H new ATOM 0 HG12 ILE A 45 41.806 55.783 -27.658 1.00 11.31 H new ATOM 0 HG13 ILE A 45 40.195 56.289 -27.187 1.00 11.31 H new ATOM 0 HG21 ILE A 45 39.876 57.972 -25.391 1.00 54.24 H new ATOM 0 HG22 ILE A 45 41.282 58.638 -24.527 1.00 54.24 H new ATOM 0 HG23 ILE A 45 40.947 59.139 -26.201 1.00 54.24 H new ATOM 0 HD11 ILE A 45 40.811 57.234 -29.360 1.00 75.24 H new ATOM 0 HD12 ILE A 45 40.601 58.526 -28.155 1.00 75.24 H new ATOM 0 HD13 ILE A 45 42.237 58.012 -28.633 1.00 75.24 H new ATOM 659 N GLU A 46 44.486 57.261 -24.105 1.00 65.21 N ATOM 660 CA GLU A 46 45.065 57.642 -22.818 1.00 41.54 C ATOM 661 C GLU A 46 46.398 58.372 -22.987 1.00 5.12 C ATOM 662 O GLU A 46 47.070 58.686 -22.004 1.00 43.23 O ATOM 663 CB GLU A 46 45.246 56.414 -21.927 1.00 55.55 C ATOM 664 CG GLU A 46 43.953 55.947 -21.283 1.00 14.53 C ATOM 665 CD GLU A 46 43.334 57.023 -20.418 1.00 0.14 C ATOM 666 OE1 GLU A 46 43.764 57.177 -19.257 1.00 65.32 O ATOM 667 OE2 GLU A 46 42.431 57.736 -20.903 1.00 5.55 O1- ATOM 0 H GLU A 46 44.671 56.297 -24.383 1.00 65.21 H new ATOM 0 HA GLU A 46 44.368 58.330 -22.340 1.00 41.54 H new ATOM 0 HB2 GLU A 46 45.663 55.601 -22.521 1.00 55.55 H new ATOM 0 HB3 GLU A 46 45.971 56.643 -21.146 1.00 55.55 H new ATOM 0 HG2 GLU A 46 43.246 55.653 -22.059 1.00 14.53 H new ATOM 0 HG3 GLU A 46 44.148 55.062 -20.678 1.00 14.53 H new ATOM 674 N THR A 47 46.780 58.627 -24.229 1.00 53.34 N ATOM 675 CA THR A 47 47.946 59.444 -24.519 1.00 11.21 C ATOM 676 C THR A 47 47.632 60.399 -25.675 1.00 2.33 C ATOM 677 O THR A 47 48.045 60.195 -26.819 1.00 31.14 O ATOM 678 CB THR A 47 49.203 58.581 -24.819 1.00 14.13 C ATOM 679 OG1 THR A 47 50.296 59.408 -25.245 1.00 60.32 O ATOM 680 CG2 THR A 47 48.920 57.514 -25.872 1.00 31.14 C ATOM 0 H THR A 47 46.296 58.277 -25.056 1.00 53.34 H new ATOM 0 HA THR A 47 48.182 60.031 -23.631 1.00 11.21 H new ATOM 0 HB THR A 47 49.475 58.076 -23.892 1.00 14.13 H new ATOM 0 HG1 THR A 47 51.079 58.847 -25.428 1.00 60.32 H new ATOM 0 HG21 THR A 47 49.824 56.933 -26.053 1.00 31.14 H new ATOM 0 HG22 THR A 47 48.129 56.854 -25.517 1.00 31.14 H new ATOM 0 HG23 THR A 47 48.605 57.992 -26.799 1.00 31.14 H new ATOM 688 N PRO A 48 46.849 61.449 -25.387 1.00 63.35 N ATOM 689 CA PRO A 48 46.387 62.385 -26.390 1.00 21.13 C ATOM 690 C PRO A 48 47.342 63.559 -26.587 1.00 23.22 C ATOM 691 O PRO A 48 47.361 64.507 -25.800 1.00 30.10 O ATOM 692 CB PRO A 48 45.047 62.856 -25.826 1.00 72.10 C ATOM 693 CG PRO A 48 45.136 62.664 -24.340 1.00 2.42 C ATOM 694 CD PRO A 48 46.349 61.808 -24.054 1.00 3.12 C ATOM 0 HA PRO A 48 46.315 61.929 -27.377 1.00 21.13 H new ATOM 0 HB2 PRO A 48 44.864 63.901 -26.075 1.00 72.10 H new ATOM 0 HB3 PRO A 48 44.222 62.280 -26.246 1.00 72.10 H new ATOM 0 HG2 PRO A 48 45.221 63.626 -23.835 1.00 2.42 H new ATOM 0 HG3 PRO A 48 44.233 62.184 -23.962 1.00 2.42 H new ATOM 0 HD2 PRO A 48 47.097 62.354 -23.480 1.00 3.12 H new ATOM 0 HD3 PRO A 48 46.086 60.923 -23.474 1.00 3.12 H new ATOM 702 N SER A 49 48.153 63.473 -27.624 1.00 1.52 N ATOM 703 CA SER A 49 49.028 64.570 -28.006 1.00 71.45 C ATOM 704 C SER A 49 48.861 64.869 -29.490 1.00 5.40 C ATOM 705 O SER A 49 48.410 65.949 -29.870 1.00 55.33 O ATOM 706 CB SER A 49 50.485 64.231 -27.680 1.00 4.01 C ATOM 707 OG SER A 49 50.638 63.920 -26.305 1.00 52.25 O ATOM 0 H SER A 49 48.226 62.650 -28.222 1.00 1.52 H new ATOM 0 HA SER A 49 48.754 65.459 -27.437 1.00 71.45 H new ATOM 0 HB2 SER A 49 50.810 63.385 -28.286 1.00 4.01 H new ATOM 0 HB3 SER A 49 51.125 65.074 -27.939 1.00 4.01 H new ATOM 0 HG SER A 49 51.576 63.705 -26.121 1.00 52.25 H new ATOM 713 N ALA A 50 49.195 63.891 -30.327 1.00 4.34 N ATOM 714 CA ALA A 50 49.045 64.036 -31.766 1.00 71.23 C ATOM 715 C ALA A 50 47.626 63.684 -32.182 1.00 52.43 C ATOM 716 O ALA A 50 46.998 64.395 -32.968 1.00 63.35 O ATOM 717 CB ALA A 50 50.050 63.160 -32.498 1.00 52.42 C ATOM 0 H ALA A 50 49.571 62.990 -30.030 1.00 4.34 H new ATOM 0 HA ALA A 50 49.239 65.074 -32.035 1.00 71.23 H new ATOM 0 HB1 ALA A 50 49.923 63.281 -33.574 1.00 52.42 H new ATOM 0 HB2 ALA A 50 51.061 63.453 -32.217 1.00 52.42 H new ATOM 0 HB3 ALA A 50 49.887 62.116 -32.229 1.00 52.42 H new ATOM 723 N LEU A 51 47.110 62.595 -31.620 1.00 14.24 N ATOM 724 CA LEU A 51 45.756 62.155 -31.920 1.00 65.24 C ATOM 725 C LEU A 51 44.734 63.036 -31.206 1.00 54.11 C ATOM 726 O LEU A 51 43.539 62.974 -31.495 1.00 73.42 O ATOM 727 CB LEU A 51 45.572 60.671 -31.554 1.00 34.13 C ATOM 728 CG LEU A 51 45.967 60.263 -30.128 1.00 14.14 C ATOM 729 CD1 LEU A 51 44.872 60.607 -29.128 1.00 42.24 C ATOM 730 CD2 LEU A 51 46.285 58.776 -30.079 1.00 32.32 C ATOM 0 H LEU A 51 47.610 62.004 -30.956 1.00 14.24 H new ATOM 0 HA LEU A 51 45.589 62.254 -32.993 1.00 65.24 H new ATOM 0 HB2 LEU A 51 44.525 60.410 -31.706 1.00 34.13 H new ATOM 0 HB3 LEU A 51 46.155 60.072 -32.254 1.00 34.13 H new ATOM 0 HG LEU A 51 46.858 60.826 -29.850 1.00 14.14 H new ATOM 0 HD11 LEU A 51 45.184 60.305 -28.128 1.00 42.24 H new ATOM 0 HD12 LEU A 51 44.691 61.682 -29.142 1.00 42.24 H new ATOM 0 HD13 LEU A 51 43.956 60.081 -29.396 1.00 42.24 H new ATOM 0 HD21 LEU A 51 46.564 58.497 -29.063 1.00 32.32 H new ATOM 0 HD22 LEU A 51 45.407 58.206 -30.384 1.00 32.32 H new ATOM 0 HD23 LEU A 51 47.112 58.558 -30.755 1.00 32.32 H new ATOM 742 N ASP A 52 45.221 63.866 -30.285 1.00 2.23 N ATOM 743 CA ASP A 52 44.365 64.791 -29.546 1.00 12.25 C ATOM 744 C ASP A 52 43.712 65.780 -30.493 1.00 34.31 C ATOM 745 O ASP A 52 42.499 65.958 -30.478 1.00 33.15 O ATOM 746 CB ASP A 52 45.165 65.549 -28.484 1.00 5.20 C ATOM 747 CG ASP A 52 44.321 66.565 -27.731 1.00 62.52 C ATOM 748 OD1 ASP A 52 44.408 67.772 -28.047 1.00 12.41 O ATOM 749 OD2 ASP A 52 43.574 66.162 -26.818 1.00 63.02 O1- ATOM 0 H ASP A 52 46.208 63.916 -30.032 1.00 2.23 H new ATOM 0 HA ASP A 52 43.592 64.205 -29.049 1.00 12.25 H new ATOM 0 HB2 ASP A 52 45.587 64.837 -27.775 1.00 5.20 H new ATOM 0 HB3 ASP A 52 46.002 66.059 -28.960 1.00 5.20 H new ATOM 754 N ASN A 53 44.525 66.404 -31.335 1.00 61.25 N ATOM 755 CA ASN A 53 44.021 67.357 -32.315 1.00 42.12 C ATOM 756 C ASN A 53 43.092 66.673 -33.311 1.00 63.01 C ATOM 757 O ASN A 53 42.128 67.276 -33.791 1.00 23.25 O ATOM 758 CB ASN A 53 45.179 68.028 -33.055 1.00 44.53 C ATOM 759 CG ASN A 53 45.859 69.098 -32.223 1.00 73.01 C ATOM 760 OD1 ASN A 53 46.775 68.817 -31.452 1.00 72.42 O ATOM 761 ND2 ASN A 53 45.420 70.338 -32.383 1.00 31.23 N ATOM 0 H ASN A 53 45.536 66.268 -31.359 1.00 61.25 H new ATOM 0 HA ASN A 53 43.454 68.120 -31.781 1.00 42.12 H new ATOM 0 HB2 ASN A 53 45.912 67.272 -33.338 1.00 44.53 H new ATOM 0 HB3 ASN A 53 44.807 68.472 -33.978 1.00 44.53 H new ATOM 0 HD21 ASN A 53 45.845 71.101 -31.856 1.00 31.23 H new ATOM 0 HD22 ASN A 53 44.657 70.529 -33.033 1.00 31.23 H new ATOM 768 N PHE A 54 43.375 65.409 -33.598 1.00 22.14 N ATOM 769 CA PHE A 54 42.576 64.635 -34.536 1.00 43.23 C ATOM 770 C PHE A 54 41.186 64.375 -33.957 1.00 0.30 C ATOM 771 O PHE A 54 40.176 64.730 -34.562 1.00 51.31 O ATOM 772 CB PHE A 54 43.279 63.314 -34.863 1.00 64.13 C ATOM 773 CG PHE A 54 42.651 62.554 -35.997 1.00 32.43 C ATOM 774 CD1 PHE A 54 42.880 62.936 -37.309 1.00 20.25 C ATOM 775 CD2 PHE A 54 41.838 61.461 -35.754 1.00 52.44 C ATOM 776 CE1 PHE A 54 42.309 62.241 -38.357 1.00 74.25 C ATOM 777 CE2 PHE A 54 41.263 60.761 -36.798 1.00 41.13 C ATOM 778 CZ PHE A 54 41.499 61.153 -38.102 1.00 1.54 C ATOM 0 H PHE A 54 44.157 64.896 -33.191 1.00 22.14 H new ATOM 0 HA PHE A 54 42.464 65.205 -35.458 1.00 43.23 H new ATOM 0 HB2 PHE A 54 44.321 63.520 -35.109 1.00 64.13 H new ATOM 0 HB3 PHE A 54 43.280 62.684 -33.973 1.00 64.13 H new ATOM 0 HD1 PHE A 54 43.512 63.787 -37.515 1.00 20.25 H new ATOM 0 HD2 PHE A 54 41.650 61.151 -34.737 1.00 52.44 H new ATOM 0 HE1 PHE A 54 42.496 62.549 -39.375 1.00 74.25 H new ATOM 0 HE2 PHE A 54 40.631 59.909 -36.595 1.00 41.13 H new ATOM 0 HZ PHE A 54 41.050 60.609 -38.920 1.00 1.54 H new ATOM 788 N THR A 55 41.140 63.785 -32.762 1.00 75.41 N ATOM 789 CA THR A 55 39.869 63.485 -32.105 1.00 62.12 C ATOM 790 C THR A 55 39.158 64.779 -31.694 1.00 21.25 C ATOM 791 O THR A 55 37.945 64.800 -31.473 1.00 1.24 O ATOM 792 CB THR A 55 40.070 62.567 -30.868 1.00 4.21 C ATOM 793 OG1 THR A 55 38.804 62.138 -30.343 1.00 21.43 O ATOM 794 CG2 THR A 55 40.853 63.276 -29.771 1.00 4.31 C ATOM 0 H THR A 55 41.965 63.507 -32.231 1.00 75.41 H new ATOM 0 HA THR A 55 39.246 62.951 -32.822 1.00 62.12 H new ATOM 0 HB THR A 55 40.639 61.699 -31.200 1.00 4.21 H new ATOM 0 HG1 THR A 55 38.951 61.560 -29.566 1.00 21.43 H new ATOM 0 HG21 THR A 55 40.976 62.606 -28.920 1.00 4.31 H new ATOM 0 HG22 THR A 55 41.833 63.563 -30.151 1.00 4.31 H new ATOM 0 HG23 THR A 55 40.311 64.167 -29.455 1.00 4.31 H new ATOM 802 N GLN A 56 39.924 65.860 -31.619 1.00 32.54 N ATOM 803 CA GLN A 56 39.391 67.170 -31.284 1.00 40.22 C ATOM 804 C GLN A 56 38.485 67.650 -32.409 1.00 42.31 C ATOM 805 O GLN A 56 37.405 68.187 -32.172 1.00 33.50 O ATOM 806 CB GLN A 56 40.538 68.160 -31.069 1.00 24.31 C ATOM 807 CG GLN A 56 40.237 69.251 -30.056 1.00 3.12 C ATOM 808 CD GLN A 56 39.908 68.699 -28.684 1.00 23.51 C ATOM 809 OE1 GLN A 56 38.743 68.488 -28.346 1.00 22.43 O ATOM 810 NE2 GLN A 56 40.937 68.435 -27.897 1.00 51.20 N ATOM 0 H GLN A 56 40.930 65.851 -31.789 1.00 32.54 H new ATOM 0 HA GLN A 56 38.812 67.102 -30.363 1.00 40.22 H new ATOM 0 HB2 GLN A 56 41.421 67.610 -30.743 1.00 24.31 H new ATOM 0 HB3 GLN A 56 40.786 68.624 -32.023 1.00 24.31 H new ATOM 0 HG2 GLN A 56 41.096 69.917 -29.979 1.00 3.12 H new ATOM 0 HG3 GLN A 56 39.400 69.851 -30.412 1.00 3.12 H new ATOM 0 HE21 GLN A 56 41.886 68.626 -28.218 1.00 51.20 H new ATOM 0 HE22 GLN A 56 40.782 68.041 -26.969 1.00 51.20 H new ATOM 819 N ALA A 57 38.926 67.412 -33.640 1.00 43.12 N ATOM 820 CA ALA A 57 38.166 67.801 -34.818 1.00 74.22 C ATOM 821 C ALA A 57 36.968 66.881 -35.017 1.00 13.44 C ATOM 822 O ALA A 57 35.940 67.290 -35.561 1.00 44.41 O ATOM 823 CB ALA A 57 39.058 67.788 -36.048 1.00 32.32 C ATOM 0 H ALA A 57 39.811 66.949 -33.846 1.00 43.12 H new ATOM 0 HA ALA A 57 37.794 68.814 -34.668 1.00 74.22 H new ATOM 0 HB1 ALA A 57 38.477 68.081 -36.922 1.00 32.32 H new ATOM 0 HB2 ALA A 57 39.881 68.489 -35.908 1.00 32.32 H new ATOM 0 HB3 ALA A 57 39.457 66.785 -36.197 1.00 32.32 H new ATOM 829 N ILE A 58 37.103 65.637 -34.573 1.00 52.41 N ATOM 830 CA ILE A 58 36.023 64.664 -34.677 1.00 43.42 C ATOM 831 C ILE A 58 34.824 65.103 -33.841 1.00 42.32 C ATOM 832 O ILE A 58 33.676 64.913 -34.230 1.00 2.22 O ATOM 833 CB ILE A 58 36.470 63.254 -34.231 1.00 4.31 C ATOM 834 CG1 ILE A 58 37.742 62.841 -34.982 1.00 33.32 C ATOM 835 CG2 ILE A 58 35.356 62.244 -34.472 1.00 22.11 C ATOM 836 CD1 ILE A 58 38.172 61.414 -34.715 1.00 75.03 C ATOM 0 H ILE A 58 37.952 65.278 -34.136 1.00 52.41 H new ATOM 0 HA ILE A 58 35.740 64.615 -35.728 1.00 43.42 H new ATOM 0 HB ILE A 58 36.688 63.277 -33.163 1.00 4.31 H new ATOM 0 HG12 ILE A 58 37.578 62.967 -36.052 1.00 33.32 H new ATOM 0 HG13 ILE A 58 38.553 63.514 -34.702 1.00 33.32 H new ATOM 0 HG21 ILE A 58 35.686 61.255 -34.153 1.00 22.11 H new ATOM 0 HG22 ILE A 58 34.473 62.533 -33.902 1.00 22.11 H new ATOM 0 HG23 ILE A 58 35.111 62.219 -35.534 1.00 22.11 H new ATOM 0 HD11 ILE A 58 39.078 61.195 -35.280 1.00 75.03 H new ATOM 0 HD12 ILE A 58 38.369 61.286 -33.651 1.00 75.03 H new ATOM 0 HD13 ILE A 58 37.379 60.732 -35.022 1.00 75.03 H new ATOM 848 N GLN A 59 35.101 65.722 -32.705 1.00 20.32 N ATOM 849 CA GLN A 59 34.048 66.200 -31.818 1.00 43.14 C ATOM 850 C GLN A 59 33.256 67.340 -32.461 1.00 30.01 C ATOM 851 O GLN A 59 32.111 67.599 -32.091 1.00 22.32 O ATOM 852 CB GLN A 59 34.658 66.655 -30.494 1.00 0.24 C ATOM 853 CG GLN A 59 35.191 65.507 -29.652 1.00 33.03 C ATOM 854 CD GLN A 59 36.062 65.980 -28.507 1.00 32.54 C ATOM 855 OE1 GLN A 59 35.577 66.275 -27.418 1.00 24.13 O ATOM 856 NE2 GLN A 59 37.362 66.033 -28.746 1.00 51.23 N ATOM 0 H GLN A 59 36.048 65.906 -32.373 1.00 20.32 H new ATOM 0 HA GLN A 59 33.355 65.380 -31.632 1.00 43.14 H new ATOM 0 HB2 GLN A 59 35.469 67.355 -30.697 1.00 0.24 H new ATOM 0 HB3 GLN A 59 33.905 67.197 -29.922 1.00 0.24 H new ATOM 0 HG2 GLN A 59 34.354 64.934 -29.254 1.00 33.03 H new ATOM 0 HG3 GLN A 59 35.766 64.832 -30.286 1.00 33.03 H new ATOM 0 HE21 GLN A 59 37.722 65.779 -29.666 1.00 51.23 H new ATOM 0 HE22 GLN A 59 38.004 66.328 -28.010 1.00 51.23 H new ATOM 865 N SER A 60 33.873 68.003 -33.429 1.00 51.04 N ATOM 866 CA SER A 60 33.251 69.117 -34.130 1.00 11.41 C ATOM 867 C SER A 60 32.398 68.624 -35.297 1.00 54.31 C ATOM 868 O SER A 60 31.393 69.243 -35.650 1.00 71.15 O ATOM 869 CB SER A 60 34.331 70.067 -34.655 1.00 73.34 C ATOM 870 OG SER A 60 35.344 70.271 -33.686 1.00 3.51 O ATOM 0 H SER A 60 34.816 67.784 -33.750 1.00 51.04 H new ATOM 0 HA SER A 60 32.605 69.643 -33.427 1.00 11.41 H new ATOM 0 HB2 SER A 60 34.770 69.657 -35.564 1.00 73.34 H new ATOM 0 HB3 SER A 60 33.881 71.023 -34.922 1.00 73.34 H new ATOM 0 HG SER A 60 36.023 70.880 -34.045 1.00 3.51 H new ATOM 876 N GLN A 61 32.786 67.497 -35.886 1.00 30.10 N ATOM 877 CA GLN A 61 32.091 66.975 -37.059 1.00 24.42 C ATOM 878 C GLN A 61 30.858 66.174 -36.655 1.00 14.32 C ATOM 879 O GLN A 61 30.102 65.707 -37.508 1.00 1.12 O ATOM 880 CB GLN A 61 33.031 66.111 -37.906 1.00 64.21 C ATOM 881 CG GLN A 61 33.484 64.831 -37.218 1.00 32.32 C ATOM 882 CD GLN A 61 34.438 64.003 -38.064 1.00 64.01 C ATOM 883 OE1 GLN A 61 34.475 62.778 -37.955 1.00 52.54 O ATOM 884 NE2 GLN A 61 35.220 64.664 -38.905 1.00 61.52 N ATOM 0 H GLN A 61 33.574 66.930 -35.573 1.00 30.10 H new ATOM 0 HA GLN A 61 31.765 67.825 -37.658 1.00 24.42 H new ATOM 0 HB2 GLN A 61 32.529 65.852 -38.838 1.00 64.21 H new ATOM 0 HB3 GLN A 61 33.909 66.700 -38.170 1.00 64.21 H new ATOM 0 HG2 GLN A 61 33.970 65.085 -36.276 1.00 32.32 H new ATOM 0 HG3 GLN A 61 32.609 64.229 -36.973 1.00 32.32 H new ATOM 0 HE21 GLN A 61 35.159 65.680 -38.966 1.00 61.52 H new ATOM 0 HE22 GLN A 61 35.883 64.156 -39.491 1.00 61.52 H new ATOM 893 N ILE A 62 30.653 66.020 -35.356 1.00 25.21 N ATOM 894 CA ILE A 62 29.500 65.291 -34.848 1.00 60.23 C ATOM 895 C ILE A 62 28.239 66.132 -34.987 1.00 4.22 C ATOM 896 O ILE A 62 27.171 65.619 -35.318 1.00 73.53 O ATOM 897 CB ILE A 62 29.691 64.886 -33.367 1.00 31.41 C ATOM 898 CG1 ILE A 62 30.909 63.972 -33.213 1.00 75.12 C ATOM 899 CG2 ILE A 62 28.446 64.199 -32.821 1.00 11.33 C ATOM 900 CD1 ILE A 62 30.828 62.695 -34.027 1.00 54.33 C ATOM 0 H ILE A 62 31.270 66.390 -34.633 1.00 25.21 H new ATOM 0 HA ILE A 62 29.400 64.382 -35.441 1.00 60.23 H new ATOM 0 HB ILE A 62 29.859 65.796 -32.791 1.00 31.41 H new ATOM 0 HG12 ILE A 62 31.803 64.522 -33.507 1.00 75.12 H new ATOM 0 HG13 ILE A 62 31.026 63.713 -32.161 1.00 75.12 H new ATOM 0 HG21 ILE A 62 28.609 63.926 -31.779 1.00 11.33 H new ATOM 0 HG22 ILE A 62 27.596 64.878 -32.889 1.00 11.33 H new ATOM 0 HG23 ILE A 62 28.241 63.301 -33.404 1.00 11.33 H new ATOM 0 HD11 ILE A 62 31.728 62.102 -33.864 1.00 54.33 H new ATOM 0 HD12 ILE A 62 29.954 62.121 -33.718 1.00 54.33 H new ATOM 0 HD13 ILE A 62 30.744 62.943 -35.085 1.00 54.33 H new ATOM 912 N LEU A 63 28.379 67.432 -34.762 1.00 64.35 N ATOM 913 CA LEU A 63 27.233 68.334 -34.773 1.00 53.53 C ATOM 914 C LEU A 63 26.620 68.415 -36.170 1.00 34.31 C ATOM 915 O LEU A 63 25.400 68.405 -36.327 1.00 74.53 O ATOM 916 CB LEU A 63 27.633 69.738 -34.297 1.00 24.15 C ATOM 917 CG LEU A 63 28.292 69.833 -32.910 1.00 14.34 C ATOM 918 CD1 LEU A 63 27.716 68.809 -31.942 1.00 52.54 C ATOM 919 CD2 LEU A 63 29.800 69.680 -33.009 1.00 61.01 C ATOM 0 H LEU A 63 29.272 67.885 -34.570 1.00 64.35 H new ATOM 0 HA LEU A 63 26.489 67.932 -34.085 1.00 53.53 H new ATOM 0 HB2 LEU A 63 28.318 70.164 -35.030 1.00 24.15 H new ATOM 0 HB3 LEU A 63 26.741 70.364 -34.294 1.00 24.15 H new ATOM 0 HG LEU A 63 28.071 70.825 -32.517 1.00 14.34 H new ATOM 0 HD11 LEU A 63 28.207 68.907 -30.974 1.00 52.54 H new ATOM 0 HD12 LEU A 63 26.646 68.980 -31.826 1.00 52.54 H new ATOM 0 HD13 LEU A 63 27.883 67.805 -32.333 1.00 52.54 H new ATOM 0 HD21 LEU A 63 30.239 69.751 -32.014 1.00 61.01 H new ATOM 0 HD22 LEU A 63 30.040 68.709 -33.443 1.00 61.01 H new ATOM 0 HD23 LEU A 63 30.205 70.470 -33.642 1.00 61.01 H new ATOM 931 N GLY A 64 27.473 68.486 -37.184 1.00 54.14 N ATOM 932 CA GLY A 64 26.992 68.559 -38.551 1.00 43.53 C ATOM 933 C GLY A 64 26.540 67.210 -39.076 1.00 42.50 C ATOM 934 O GLY A 64 25.733 67.133 -40.002 1.00 45.41 O ATOM 0 H GLY A 64 28.488 68.494 -37.085 1.00 54.14 H new ATOM 0 HA2 GLY A 64 26.162 69.264 -38.604 1.00 43.53 H new ATOM 0 HA3 GLY A 64 27.783 68.949 -39.192 1.00 43.53 H new ATOM 938 N GLY A 65 27.047 66.142 -38.467 1.00 25.24 N ATOM 939 CA GLY A 65 26.708 64.798 -38.907 1.00 5.50 C ATOM 940 C GLY A 65 25.330 64.368 -38.444 1.00 33.53 C ATOM 941 O GLY A 65 24.834 63.313 -38.832 1.00 11.34 O ATOM 0 H GLY A 65 27.688 66.183 -37.675 1.00 25.24 H new ATOM 0 HA2 GLY A 65 26.753 64.753 -39.995 1.00 5.50 H new ATOM 0 HA3 GLY A 65 27.451 64.096 -38.528 1.00 5.50 H new ATOM 945 N LEU A 66 24.708 65.191 -37.611 1.00 53.33 N ATOM 946 CA LEU A 66 23.384 64.887 -37.090 1.00 72.23 C ATOM 947 C LEU A 66 22.328 64.992 -38.185 1.00 34.12 C ATOM 948 O LEU A 66 21.336 64.274 -38.160 1.00 33.03 O ATOM 949 CB LEU A 66 23.037 65.826 -35.932 1.00 31.31 C ATOM 950 CG LEU A 66 23.952 65.721 -34.709 1.00 64.21 C ATOM 951 CD1 LEU A 66 23.540 66.732 -33.651 1.00 22.03 C ATOM 952 CD2 LEU A 66 23.922 64.311 -34.137 1.00 65.03 C ATOM 0 H LEU A 66 25.099 66.074 -37.282 1.00 53.33 H new ATOM 0 HA LEU A 66 23.395 63.861 -36.722 1.00 72.23 H new ATOM 0 HB2 LEU A 66 23.063 66.852 -36.298 1.00 31.31 H new ATOM 0 HB3 LEU A 66 22.013 65.625 -35.617 1.00 31.31 H new ATOM 0 HG LEU A 66 24.972 65.942 -35.022 1.00 64.21 H new ATOM 0 HD11 LEU A 66 24.200 66.645 -32.788 1.00 22.03 H new ATOM 0 HD12 LEU A 66 23.612 67.739 -34.062 1.00 22.03 H new ATOM 0 HD13 LEU A 66 22.513 66.538 -33.343 1.00 22.03 H new ATOM 0 HD21 LEU A 66 24.579 64.257 -33.269 1.00 65.03 H new ATOM 0 HD22 LEU A 66 22.904 64.061 -33.838 1.00 65.03 H new ATOM 0 HD23 LEU A 66 24.262 63.604 -34.894 1.00 65.03 H new ATOM 964 N LEU A 67 22.575 65.862 -39.161 1.00 53.21 N ATOM 965 CA LEU A 67 21.607 66.143 -40.225 1.00 64.45 C ATOM 966 C LEU A 67 21.156 64.870 -40.939 1.00 60.43 C ATOM 967 O LEU A 67 19.959 64.649 -41.146 1.00 44.24 O ATOM 968 CB LEU A 67 22.214 67.112 -41.239 1.00 51.43 C ATOM 969 CG LEU A 67 22.645 68.462 -40.667 1.00 3.00 C ATOM 970 CD1 LEU A 67 23.287 69.310 -41.751 1.00 70.32 C ATOM 971 CD2 LEU A 67 21.451 69.184 -40.060 1.00 22.21 C ATOM 0 H LEU A 67 23.444 66.390 -39.239 1.00 53.21 H new ATOM 0 HA LEU A 67 20.730 66.593 -39.759 1.00 64.45 H new ATOM 0 HB2 LEU A 67 23.080 66.637 -41.699 1.00 51.43 H new ATOM 0 HB3 LEU A 67 21.487 67.286 -42.032 1.00 51.43 H new ATOM 0 HG LEU A 67 23.380 68.291 -39.880 1.00 3.00 H new ATOM 0 HD11 LEU A 67 23.590 70.269 -41.331 1.00 70.32 H new ATOM 0 HD12 LEU A 67 24.162 68.794 -42.146 1.00 70.32 H new ATOM 0 HD13 LEU A 67 22.570 69.476 -42.555 1.00 70.32 H new ATOM 0 HD21 LEU A 67 21.773 70.144 -39.656 1.00 22.21 H new ATOM 0 HD22 LEU A 67 20.696 69.348 -40.829 1.00 22.21 H new ATOM 0 HD23 LEU A 67 21.028 68.578 -39.259 1.00 22.21 H new ATOM 983 N SER A 68 22.115 64.029 -41.298 1.00 40.32 N ATOM 984 CA SER A 68 21.831 62.797 -42.017 1.00 11.31 C ATOM 985 C SER A 68 21.133 61.780 -41.118 1.00 75.02 C ATOM 986 O SER A 68 20.437 60.888 -41.598 1.00 75.11 O ATOM 987 CB SER A 68 23.135 62.228 -42.584 1.00 0.14 C ATOM 988 OG SER A 68 24.234 62.557 -41.745 1.00 4.11 O ATOM 0 H SER A 68 23.104 64.180 -41.101 1.00 40.32 H new ATOM 0 HA SER A 68 21.151 63.017 -42.840 1.00 11.31 H new ATOM 0 HB2 SER A 68 23.054 61.145 -42.678 1.00 0.14 H new ATOM 0 HB3 SER A 68 23.305 62.623 -43.586 1.00 0.14 H new ATOM 0 HG SER A 68 25.057 62.183 -42.123 1.00 4.11 H new ATOM 994 N ASN A 69 21.294 61.942 -39.812 1.00 22.22 N ATOM 995 CA ASN A 69 20.705 61.019 -38.852 1.00 3.21 C ATOM 996 C ASN A 69 19.350 61.523 -38.369 1.00 33.23 C ATOM 997 O ASN A 69 18.631 60.819 -37.666 1.00 41.32 O ATOM 998 CB ASN A 69 21.642 60.802 -37.661 1.00 53.44 C ATOM 999 CG ASN A 69 22.863 59.978 -38.022 1.00 25.14 C ATOM 1000 OD1 ASN A 69 22.847 58.751 -37.929 1.00 41.35 O ATOM 1001 ND2 ASN A 69 23.934 60.641 -38.431 1.00 2.13 N ATOM 0 H ASN A 69 21.827 62.704 -39.393 1.00 22.22 H new ATOM 0 HA ASN A 69 20.557 60.065 -39.357 1.00 3.21 H new ATOM 0 HB2 ASN A 69 21.962 61.770 -37.275 1.00 53.44 H new ATOM 0 HB3 ASN A 69 21.096 60.304 -36.860 1.00 53.44 H new ATOM 0 HD21 ASN A 69 24.783 60.134 -38.681 1.00 2.13 H new ATOM 0 HD22 ASN A 69 23.910 61.659 -38.496 1.00 2.13 H new ATOM 1008 N ILE A 70 19.007 62.746 -38.747 1.00 71.41 N ATOM 1009 CA ILE A 70 17.713 63.323 -38.400 1.00 54.25 C ATOM 1010 C ILE A 70 16.634 62.823 -39.358 1.00 15.54 C ATOM 1011 O ILE A 70 15.460 62.744 -38.997 1.00 23.53 O ATOM 1012 CB ILE A 70 17.759 64.875 -38.423 1.00 3.10 C ATOM 1013 CG1 ILE A 70 18.669 65.403 -37.306 1.00 23.53 C ATOM 1014 CG2 ILE A 70 16.364 65.477 -38.297 1.00 12.32 C ATOM 1015 CD1 ILE A 70 18.252 64.958 -35.920 1.00 42.43 C ATOM 0 H ILE A 70 19.608 63.361 -39.296 1.00 71.41 H new ATOM 0 HA ILE A 70 17.471 63.004 -37.386 1.00 54.25 H new ATOM 0 HB ILE A 70 18.169 65.179 -39.386 1.00 3.10 H new ATOM 0 HG12 ILE A 70 19.690 65.070 -37.493 1.00 23.53 H new ATOM 0 HG13 ILE A 70 18.678 66.492 -37.341 1.00 23.53 H new ATOM 0 HG21 ILE A 70 16.434 66.565 -38.317 1.00 12.32 H new ATOM 0 HG22 ILE A 70 15.745 65.138 -39.128 1.00 12.32 H new ATOM 0 HG23 ILE A 70 15.914 65.159 -37.356 1.00 12.32 H new ATOM 0 HD11 ILE A 70 18.941 65.370 -35.183 1.00 42.43 H new ATOM 0 HD12 ILE A 70 17.243 65.314 -35.712 1.00 42.43 H new ATOM 0 HD13 ILE A 70 18.271 63.869 -35.866 1.00 42.43 H new ATOM 1027 N ASN A 71 17.050 62.460 -40.570 1.00 10.14 N ATOM 1028 CA ASN A 71 16.122 62.019 -41.613 1.00 44.34 C ATOM 1029 C ASN A 71 15.245 60.870 -41.118 1.00 55.34 C ATOM 1030 O ASN A 71 14.029 61.024 -40.998 1.00 20.43 O ATOM 1031 CB ASN A 71 16.891 61.587 -42.866 1.00 33.10 C ATOM 1032 CG ASN A 71 15.983 61.315 -44.055 1.00 24.15 C ATOM 1033 OD1 ASN A 71 16.249 60.424 -44.862 1.00 2.11 O ATOM 1034 ND2 ASN A 71 14.920 62.097 -44.191 1.00 61.43 N ATOM 0 H ASN A 71 18.029 62.462 -40.856 1.00 10.14 H new ATOM 0 HA ASN A 71 15.477 62.861 -41.864 1.00 44.34 H new ATOM 0 HB2 ASN A 71 17.607 62.365 -43.133 1.00 33.10 H new ATOM 0 HB3 ASN A 71 17.466 60.688 -42.641 1.00 33.10 H new ATOM 0 HD21 ASN A 71 14.292 61.970 -44.984 1.00 61.43 H new ATOM 0 HD22 ASN A 71 14.731 62.825 -43.502 1.00 61.43 H new ATOM 1041 N THR A 72 15.880 59.730 -40.820 1.00 12.11 N ATOM 1042 CA THR A 72 15.203 58.534 -40.293 1.00 23.30 C ATOM 1043 C THR A 72 14.005 58.108 -41.150 1.00 44.31 C ATOM 1044 O THR A 72 13.832 58.578 -42.276 1.00 44.23 O ATOM 1045 CB THR A 72 14.751 58.725 -38.820 1.00 2.13 C ATOM 1046 OG1 THR A 72 13.849 59.832 -38.693 1.00 14.23 O ATOM 1047 CG2 THR A 72 15.951 58.943 -37.911 1.00 53.31 C ATOM 0 H THR A 72 16.886 59.608 -40.938 1.00 12.11 H new ATOM 0 HA THR A 72 15.945 57.737 -40.332 1.00 23.30 H new ATOM 0 HB THR A 72 14.233 57.815 -38.518 1.00 2.13 H new ATOM 0 HG1 THR A 72 13.588 60.145 -39.584 1.00 14.23 H new ATOM 0 HG21 THR A 72 15.610 59.074 -36.884 1.00 53.31 H new ATOM 0 HG22 THR A 72 16.611 58.078 -37.966 1.00 53.31 H new ATOM 0 HG23 THR A 72 16.492 59.833 -38.230 1.00 53.31 H new ATOM 1055 N GLY A 73 13.206 57.187 -40.629 1.00 3.13 N ATOM 1056 CA GLY A 73 11.993 56.790 -41.315 1.00 42.41 C ATOM 1057 C GLY A 73 12.109 55.438 -41.991 1.00 24.53 C ATOM 1058 O GLY A 73 11.174 54.995 -42.659 1.00 71.02 O ATOM 0 H GLY A 73 13.376 56.708 -39.745 1.00 3.13 H new ATOM 0 HA2 GLY A 73 11.170 56.763 -40.600 1.00 42.41 H new ATOM 0 HA3 GLY A 73 11.742 57.543 -42.062 1.00 42.41 H new ATOM 1062 N LYS A 74 13.261 54.791 -41.832 1.00 31.51 N ATOM 1063 CA LYS A 74 13.492 53.477 -42.428 1.00 51.44 C ATOM 1064 C LYS A 74 12.430 52.466 -41.979 1.00 44.43 C ATOM 1065 O LYS A 74 11.955 52.517 -40.843 1.00 24.01 O ATOM 1066 CB LYS A 74 14.916 52.974 -42.111 1.00 23.21 C ATOM 1067 CG LYS A 74 15.297 52.981 -40.632 1.00 4.23 C ATOM 1068 CD LYS A 74 14.787 51.750 -39.897 1.00 20.20 C ATOM 1069 CE LYS A 74 15.223 51.746 -38.440 1.00 35.24 C ATOM 1070 NZ LYS A 74 14.703 52.921 -37.691 1.00 22.45 N1+ ATOM 0 H LYS A 74 14.049 55.155 -41.296 1.00 31.51 H new ATOM 0 HA LYS A 74 13.406 53.580 -43.510 1.00 51.44 H new ATOM 0 HB2 LYS A 74 15.017 51.957 -42.490 1.00 23.21 H new ATOM 0 HB3 LYS A 74 15.631 53.590 -42.656 1.00 23.21 H new ATOM 0 HG2 LYS A 74 16.382 53.033 -40.539 1.00 4.23 H new ATOM 0 HG3 LYS A 74 14.893 53.876 -40.160 1.00 4.23 H new ATOM 0 HD2 LYS A 74 13.699 51.718 -39.952 1.00 20.20 H new ATOM 0 HD3 LYS A 74 15.158 50.852 -40.391 1.00 20.20 H new ATOM 0 HE2 LYS A 74 14.875 50.830 -37.962 1.00 35.24 H new ATOM 0 HE3 LYS A 74 16.312 51.739 -38.389 1.00 35.24 H new ATOM 0 HZ1 LYS A 74 14.880 52.791 -36.674 1.00 22.45 H new ATOM 0 HZ2 LYS A 74 15.185 53.783 -38.019 1.00 22.45 H new ATOM 0 HZ3 LYS A 74 13.680 53.012 -37.855 1.00 22.45 H new ATOM 1084 N PRO A 75 12.036 51.548 -42.875 1.00 62.34 N ATOM 1085 CA PRO A 75 11.023 50.530 -42.580 1.00 2.31 C ATOM 1086 C PRO A 75 11.538 49.462 -41.620 1.00 25.45 C ATOM 1087 O PRO A 75 10.776 48.891 -40.837 1.00 34.43 O ATOM 1088 CB PRO A 75 10.715 49.903 -43.948 1.00 60.25 C ATOM 1089 CG PRO A 75 11.375 50.784 -44.957 1.00 23.21 C ATOM 1090 CD PRO A 75 12.526 51.439 -44.253 1.00 65.03 C ATOM 0 HA PRO A 75 10.151 50.966 -42.093 1.00 2.31 H new ATOM 0 HB2 PRO A 75 11.099 48.885 -44.007 1.00 60.25 H new ATOM 0 HB3 PRO A 75 9.640 49.848 -44.120 1.00 60.25 H new ATOM 0 HG2 PRO A 75 11.721 50.204 -45.813 1.00 23.21 H new ATOM 0 HG3 PRO A 75 10.677 51.529 -45.338 1.00 23.21 H new ATOM 0 HD2 PRO A 75 13.434 50.839 -44.314 1.00 65.03 H new ATOM 0 HD3 PRO A 75 12.760 52.415 -44.679 1.00 65.03 H new ATOM 1098 N GLY A 76 12.835 49.203 -41.684 1.00 12.10 N ATOM 1099 CA GLY A 76 13.436 48.198 -40.836 1.00 14.01 C ATOM 1100 C GLY A 76 14.851 47.875 -41.260 1.00 13.34 C ATOM 1101 O GLY A 76 15.473 48.645 -41.993 1.00 72.12 O ATOM 0 H GLY A 76 13.485 49.675 -42.313 1.00 12.10 H new ATOM 0 HA2 GLY A 76 13.437 48.548 -39.804 1.00 14.01 H new ATOM 0 HA3 GLY A 76 12.832 47.291 -40.865 1.00 14.01 H new ATOM 1105 N ARG A 77 15.358 46.740 -40.799 1.00 2.44 N ATOM 1106 CA ARG A 77 16.719 46.317 -41.104 1.00 13.33 C ATOM 1107 C ARG A 77 16.813 44.796 -41.099 1.00 22.11 C ATOM 1108 O ARG A 77 15.866 44.113 -40.711 1.00 0.25 O ATOM 1109 CB ARG A 77 17.702 46.925 -40.096 1.00 21.41 C ATOM 1110 CG ARG A 77 17.279 46.738 -38.649 1.00 30.43 C ATOM 1111 CD ARG A 77 18.186 47.499 -37.698 1.00 20.32 C ATOM 1112 NE ARG A 77 17.658 47.498 -36.337 1.00 45.02 N ATOM 1113 CZ ARG A 77 18.255 48.087 -35.300 1.00 1.11 C ATOM 1114 NH1 ARG A 77 19.404 48.734 -35.460 1.00 21.40 N1+ ATOM 1115 NH2 ARG A 77 17.696 48.025 -34.098 1.00 14.15 N ATOM 0 H ARG A 77 14.842 46.090 -40.207 1.00 2.44 H new ATOM 0 HA ARG A 77 16.984 46.673 -42.100 1.00 13.33 H new ATOM 0 HB2 ARG A 77 18.684 46.474 -40.240 1.00 21.41 H new ATOM 0 HB3 ARG A 77 17.807 47.990 -40.301 1.00 21.41 H new ATOM 0 HG2 ARG A 77 16.251 47.079 -38.523 1.00 30.43 H new ATOM 0 HG3 ARG A 77 17.296 45.677 -38.399 1.00 30.43 H new ATOM 0 HD2 ARG A 77 19.179 47.050 -37.704 1.00 20.32 H new ATOM 0 HD3 ARG A 77 18.298 48.526 -38.045 1.00 20.32 H new ATOM 0 HE ARG A 77 16.775 47.016 -36.168 1.00 45.02 H new ATOM 0 HH11 ARG A 77 19.837 48.784 -36.382 1.00 21.40 H new ATOM 0 HH12 ARG A 77 19.853 49.181 -34.661 1.00 21.40 H new ATOM 0 HH21 ARG A 77 16.814 47.529 -33.971 1.00 14.15 H new ATOM 0 HH22 ARG A 77 18.148 48.474 -33.301 1.00 14.15 H new ATOM 1129 N MET A 78 17.952 44.270 -41.525 1.00 12.00 N ATOM 1130 CA MET A 78 18.133 42.827 -41.624 1.00 2.03 C ATOM 1131 C MET A 78 18.930 42.293 -40.440 1.00 70.13 C ATOM 1132 O MET A 78 20.080 42.673 -40.228 1.00 44.34 O ATOM 1133 CB MET A 78 18.836 42.463 -42.935 1.00 63.14 C ATOM 1134 CG MET A 78 19.066 40.970 -43.110 1.00 52.15 C ATOM 1135 SD MET A 78 19.915 40.569 -44.650 1.00 73.31 S ATOM 1136 CE MET A 78 20.070 38.792 -44.488 1.00 35.54 C ATOM 0 H MET A 78 18.764 44.819 -41.807 1.00 12.00 H new ATOM 0 HA MET A 78 17.146 42.365 -41.611 1.00 2.03 H new ATOM 0 HB2 MET A 78 18.241 42.831 -43.771 1.00 63.14 H new ATOM 0 HB3 MET A 78 19.796 42.977 -42.977 1.00 63.14 H new ATOM 0 HG2 MET A 78 19.651 40.596 -42.270 1.00 52.15 H new ATOM 0 HG3 MET A 78 18.106 40.454 -43.084 1.00 52.15 H new ATOM 0 HE1 MET A 78 20.577 38.390 -45.365 1.00 35.54 H new ATOM 0 HE2 MET A 78 20.649 38.557 -43.595 1.00 35.54 H new ATOM 0 HE3 MET A 78 19.079 38.346 -44.406 1.00 35.54 H new ATOM 1146 N VAL A 79 18.312 41.408 -39.674 1.00 63.22 N ATOM 1147 CA VAL A 79 18.964 40.805 -38.523 1.00 53.31 C ATOM 1148 C VAL A 79 19.849 39.646 -38.968 1.00 34.33 C ATOM 1149 O VAL A 79 19.354 38.591 -39.364 1.00 23.05 O ATOM 1150 CB VAL A 79 17.935 40.303 -37.489 1.00 51.15 C ATOM 1151 CG1 VAL A 79 18.635 39.754 -36.255 1.00 62.34 C ATOM 1152 CG2 VAL A 79 16.960 41.413 -37.114 1.00 20.14 C ATOM 0 H VAL A 79 17.355 41.090 -39.830 1.00 63.22 H new ATOM 0 HA VAL A 79 19.576 41.573 -38.050 1.00 53.31 H new ATOM 0 HB VAL A 79 17.364 39.492 -37.942 1.00 51.15 H new ATOM 0 HG11 VAL A 79 17.891 39.406 -35.539 1.00 62.34 H new ATOM 0 HG12 VAL A 79 19.279 38.923 -36.542 1.00 62.34 H new ATOM 0 HG13 VAL A 79 19.237 40.540 -35.799 1.00 62.34 H new ATOM 0 HG21 VAL A 79 16.244 41.037 -36.384 1.00 20.14 H new ATOM 0 HG22 VAL A 79 17.510 42.250 -36.685 1.00 20.14 H new ATOM 0 HG23 VAL A 79 16.428 41.747 -38.005 1.00 20.14 H new ATOM 1162 N THR A 80 21.155 39.857 -38.922 1.00 24.24 N ATOM 1163 CA THR A 80 22.101 38.839 -39.344 1.00 43.31 C ATOM 1164 C THR A 80 22.817 38.245 -38.124 1.00 22.22 C ATOM 1165 O THR A 80 22.703 38.774 -37.015 1.00 20.53 O ATOM 1166 CB THR A 80 23.119 39.435 -40.339 1.00 4.42 C ATOM 1167 OG1 THR A 80 22.457 40.386 -41.179 1.00 23.43 O ATOM 1168 CG2 THR A 80 23.748 38.360 -41.213 1.00 23.11 C ATOM 0 H THR A 80 21.583 40.724 -38.597 1.00 24.24 H new ATOM 0 HA THR A 80 21.558 38.039 -39.848 1.00 43.31 H new ATOM 0 HB THR A 80 23.911 39.913 -39.762 1.00 4.42 H new ATOM 0 HG1 THR A 80 22.876 40.388 -42.065 1.00 23.43 H new ATOM 0 HG21 THR A 80 24.459 38.819 -41.900 1.00 23.11 H new ATOM 0 HG22 THR A 80 24.267 37.637 -40.584 1.00 23.11 H new ATOM 0 HG23 THR A 80 22.969 37.852 -41.782 1.00 23.11 H new ATOM 1176 N ASN A 81 23.534 37.146 -38.321 1.00 12.13 N ATOM 1177 CA ASN A 81 24.174 36.430 -37.223 1.00 13.33 C ATOM 1178 C ASN A 81 25.589 36.954 -36.936 1.00 53.52 C ATOM 1179 O ASN A 81 25.845 37.517 -35.870 1.00 72.31 O ATOM 1180 CB ASN A 81 24.191 34.917 -37.519 1.00 31.34 C ATOM 1181 CG ASN A 81 24.899 34.548 -38.819 1.00 23.22 C ATOM 1182 OD1 ASN A 81 24.971 35.344 -39.761 1.00 55.05 O ATOM 1183 ND2 ASN A 81 25.411 33.331 -38.882 1.00 51.02 N ATOM 0 H ASN A 81 23.688 36.728 -39.238 1.00 12.13 H new ATOM 0 HA ASN A 81 23.587 36.608 -36.322 1.00 13.33 H new ATOM 0 HB2 ASN A 81 24.679 34.401 -36.692 1.00 31.34 H new ATOM 0 HB3 ASN A 81 23.164 34.554 -37.560 1.00 31.34 H new ATOM 0 HD21 ASN A 81 25.886 33.021 -39.730 1.00 51.02 H new ATOM 0 HD22 ASN A 81 25.331 32.702 -38.083 1.00 51.02 H new ATOM 1190 N ASP A 82 26.500 36.780 -37.886 1.00 32.11 N ATOM 1191 CA ASP A 82 27.900 37.172 -37.696 1.00 24.13 C ATOM 1192 C ASP A 82 28.160 38.568 -38.245 1.00 61.51 C ATOM 1193 O ASP A 82 29.268 39.097 -38.145 1.00 75.51 O ATOM 1194 CB ASP A 82 28.840 36.167 -38.370 1.00 23.52 C ATOM 1195 CG ASP A 82 28.991 34.879 -37.588 1.00 72.21 C ATOM 1196 OD1 ASP A 82 29.985 34.746 -36.849 1.00 63.25 O ATOM 1197 OD2 ASP A 82 28.122 33.993 -37.708 1.00 30.43 O1- ATOM 0 H ASP A 82 26.299 36.370 -38.798 1.00 32.11 H new ATOM 0 HA ASP A 82 28.097 37.179 -36.624 1.00 24.13 H new ATOM 0 HB2 ASP A 82 28.463 35.938 -39.367 1.00 23.52 H new ATOM 0 HB3 ASP A 82 29.821 36.625 -38.498 1.00 23.52 H new ATOM 1202 N TYR A 83 27.133 39.153 -38.833 1.00 2.10 N ATOM 1203 CA TYR A 83 27.213 40.505 -39.355 1.00 61.22 C ATOM 1204 C TYR A 83 26.021 41.299 -38.853 1.00 25.13 C ATOM 1205 O TYR A 83 24.965 40.732 -38.587 1.00 35.42 O ATOM 1206 CB TYR A 83 27.217 40.503 -40.892 1.00 22.35 C ATOM 1207 CG TYR A 83 28.466 39.921 -41.526 1.00 63.34 C ATOM 1208 CD1 TYR A 83 29.388 40.741 -42.165 1.00 54.31 C ATOM 1209 CD2 TYR A 83 28.719 38.555 -41.491 1.00 61.31 C ATOM 1210 CE1 TYR A 83 30.526 40.215 -42.750 1.00 54.50 C ATOM 1211 CE2 TYR A 83 29.853 38.025 -42.070 1.00 43.02 C ATOM 1212 CZ TYR A 83 30.753 38.855 -42.698 1.00 0.23 C ATOM 1213 OH TYR A 83 31.881 38.319 -43.282 1.00 35.22 O ATOM 0 H TYR A 83 26.225 38.708 -38.962 1.00 2.10 H new ATOM 0 HA TYR A 83 28.142 40.959 -39.012 1.00 61.22 H new ATOM 0 HB2 TYR A 83 26.353 39.939 -41.242 1.00 22.35 H new ATOM 0 HB3 TYR A 83 27.093 41.528 -41.243 1.00 22.35 H new ATOM 0 HD1 TYR A 83 29.213 41.806 -42.206 1.00 54.31 H new ATOM 0 HD2 TYR A 83 28.016 37.897 -41.002 1.00 61.31 H new ATOM 0 HE1 TYR A 83 31.233 40.865 -43.244 1.00 54.50 H new ATOM 0 HE2 TYR A 83 30.034 36.961 -42.031 1.00 43.02 H new ATOM 0 HH TYR A 83 31.886 37.348 -43.152 1.00 35.22 H new ATOM 1223 N ILE A 84 26.195 42.594 -38.685 1.00 71.04 N ATOM 1224 CA ILE A 84 25.077 43.461 -38.368 1.00 33.43 C ATOM 1225 C ILE A 84 24.900 44.467 -39.492 1.00 24.33 C ATOM 1226 O ILE A 84 25.579 45.496 -39.532 1.00 13.30 O ATOM 1227 CB ILE A 84 25.246 44.209 -37.019 1.00 35.11 C ATOM 1228 CG1 ILE A 84 25.416 43.226 -35.848 1.00 70.51 C ATOM 1229 CG2 ILE A 84 24.051 45.121 -36.764 1.00 63.41 C ATOM 1230 CD1 ILE A 84 26.829 42.712 -35.669 1.00 21.15 C ATOM 0 H ILE A 84 27.095 43.068 -38.762 1.00 71.04 H new ATOM 0 HA ILE A 84 24.195 42.829 -38.265 1.00 33.43 H new ATOM 0 HB ILE A 84 26.150 44.814 -37.087 1.00 35.11 H new ATOM 0 HG12 ILE A 84 25.101 43.717 -34.927 1.00 70.51 H new ATOM 0 HG13 ILE A 84 24.749 42.377 -36.001 1.00 70.51 H new ATOM 0 HG21 ILE A 84 24.184 45.639 -35.814 1.00 63.41 H new ATOM 0 HG22 ILE A 84 23.974 45.853 -37.568 1.00 63.41 H new ATOM 0 HG23 ILE A 84 23.139 44.525 -36.727 1.00 63.41 H new ATOM 0 HD11 ILE A 84 26.862 42.025 -34.823 1.00 21.15 H new ATOM 0 HD12 ILE A 84 27.143 42.190 -36.573 1.00 21.15 H new ATOM 0 HD13 ILE A 84 27.500 43.550 -35.482 1.00 21.15 H new ATOM 1242 N VAL A 85 24.034 44.141 -40.437 1.00 45.21 N ATOM 1243 CA VAL A 85 23.758 45.032 -41.546 1.00 41.00 C ATOM 1244 C VAL A 85 22.577 45.944 -41.210 1.00 52.13 C ATOM 1245 O VAL A 85 21.411 45.540 -41.238 1.00 43.50 O ATOM 1246 CB VAL A 85 23.514 44.253 -42.864 1.00 62.43 C ATOM 1247 CG1 VAL A 85 22.426 43.201 -42.704 1.00 1.04 C ATOM 1248 CG2 VAL A 85 23.179 45.210 -43.993 1.00 64.33 C ATOM 0 H VAL A 85 23.511 43.265 -40.456 1.00 45.21 H new ATOM 0 HA VAL A 85 24.639 45.653 -41.707 1.00 41.00 H new ATOM 0 HB VAL A 85 24.437 43.729 -43.114 1.00 62.43 H new ATOM 0 HG11 VAL A 85 22.285 42.677 -43.649 1.00 1.04 H new ATOM 0 HG12 VAL A 85 22.720 42.488 -41.934 1.00 1.04 H new ATOM 0 HG13 VAL A 85 21.493 43.684 -42.414 1.00 1.04 H new ATOM 0 HG21 VAL A 85 23.011 44.646 -44.910 1.00 64.33 H new ATOM 0 HG22 VAL A 85 22.278 45.769 -43.741 1.00 64.33 H new ATOM 0 HG23 VAL A 85 24.007 45.903 -44.140 1.00 64.33 H new ATOM 1258 N ASP A 86 22.897 47.171 -40.845 1.00 31.13 N ATOM 1259 CA ASP A 86 21.886 48.133 -40.452 1.00 20.21 C ATOM 1260 C ASP A 86 21.477 48.975 -41.650 1.00 24.31 C ATOM 1261 O ASP A 86 22.326 49.534 -42.347 1.00 74.51 O ATOM 1262 CB ASP A 86 22.409 49.021 -39.324 1.00 4.42 C ATOM 1263 CG ASP A 86 21.299 49.786 -38.633 1.00 33.31 C ATOM 1264 OD1 ASP A 86 20.927 50.876 -39.115 1.00 21.44 O ATOM 1265 OD2 ASP A 86 20.790 49.296 -37.604 1.00 45.22 O1- ATOM 0 H ASP A 86 23.853 47.526 -40.813 1.00 31.13 H new ATOM 0 HA ASP A 86 21.010 47.597 -40.087 1.00 20.21 H new ATOM 0 HB2 ASP A 86 22.933 48.405 -38.593 1.00 4.42 H new ATOM 0 HB3 ASP A 86 23.137 49.726 -39.727 1.00 4.42 H new ATOM 1270 N ILE A 87 20.182 49.035 -41.905 1.00 70.13 N ATOM 1271 CA ILE A 87 19.662 49.778 -43.039 1.00 11.31 C ATOM 1272 C ILE A 87 19.287 51.195 -42.621 1.00 5.45 C ATOM 1273 O ILE A 87 18.323 51.405 -41.877 1.00 31.44 O ATOM 1274 CB ILE A 87 18.432 49.076 -43.654 1.00 73.15 C ATOM 1275 CG1 ILE A 87 18.799 47.651 -44.087 1.00 41.53 C ATOM 1276 CG2 ILE A 87 17.893 49.878 -44.835 1.00 33.35 C ATOM 1277 CD1 ILE A 87 17.637 46.876 -44.673 1.00 31.30 C ATOM 0 H ILE A 87 19.468 48.576 -41.339 1.00 70.13 H new ATOM 0 HA ILE A 87 20.448 49.820 -43.793 1.00 11.31 H new ATOM 0 HB ILE A 87 17.648 49.017 -42.899 1.00 73.15 H new ATOM 0 HG12 ILE A 87 19.601 47.699 -44.824 1.00 41.53 H new ATOM 0 HG13 ILE A 87 19.190 47.108 -43.226 1.00 41.53 H new ATOM 0 HG21 ILE A 87 17.026 49.368 -45.256 1.00 33.35 H new ATOM 0 HG22 ILE A 87 17.600 50.872 -44.497 1.00 33.35 H new ATOM 0 HG23 ILE A 87 18.667 49.968 -45.597 1.00 33.35 H new ATOM 0 HD11 ILE A 87 17.971 45.878 -44.956 1.00 31.30 H new ATOM 0 HD12 ILE A 87 16.842 46.796 -43.931 1.00 31.30 H new ATOM 0 HD13 ILE A 87 17.260 47.396 -45.554 1.00 31.30 H new ATOM 1289 N ALA A 88 20.066 52.158 -43.081 1.00 34.53 N ATOM 1290 CA ALA A 88 19.817 53.559 -42.778 1.00 21.21 C ATOM 1291 C ALA A 88 19.607 54.353 -44.062 1.00 23.43 C ATOM 1292 O ALA A 88 19.727 53.812 -45.162 1.00 54.14 O ATOM 1293 CB ALA A 88 20.975 54.142 -41.983 1.00 40.44 C ATOM 0 H ALA A 88 20.883 51.995 -43.670 1.00 34.53 H new ATOM 0 HA ALA A 88 18.911 53.626 -42.176 1.00 21.21 H new ATOM 0 HB1 ALA A 88 20.774 55.191 -41.764 1.00 40.44 H new ATOM 0 HB2 ALA A 88 21.089 53.591 -41.049 1.00 40.44 H new ATOM 0 HB3 ALA A 88 21.893 54.062 -42.565 1.00 40.44 H new ATOM 1299 N ASN A 89 19.294 55.632 -43.926 1.00 52.24 N ATOM 1300 CA ASN A 89 19.152 56.502 -45.081 1.00 21.13 C ATOM 1301 C ASN A 89 19.776 57.854 -44.783 1.00 22.12 C ATOM 1302 O ASN A 89 19.427 58.508 -43.801 1.00 62.21 O ATOM 1303 CB ASN A 89 17.680 56.671 -45.470 1.00 44.43 C ATOM 1304 CG ASN A 89 17.500 57.404 -46.794 1.00 51.24 C ATOM 1305 OD1 ASN A 89 18.288 58.275 -47.161 1.00 34.21 O ATOM 1306 ND2 ASN A 89 16.464 57.043 -47.529 1.00 52.10 N ATOM 0 H ASN A 89 19.134 56.089 -43.028 1.00 52.24 H new ATOM 0 HA ASN A 89 19.669 56.043 -45.924 1.00 21.13 H new ATOM 0 HB2 ASN A 89 17.211 55.689 -45.537 1.00 44.43 H new ATOM 0 HB3 ASN A 89 17.161 57.219 -44.683 1.00 44.43 H new ATOM 0 HD21 ASN A 89 16.298 57.490 -48.431 1.00 52.10 H new ATOM 0 HD22 ASN A 89 15.830 56.317 -47.195 1.00 52.10 H new ATOM 1313 N ARG A 90 20.711 58.251 -45.625 1.00 34.23 N ATOM 1314 CA ARG A 90 21.386 59.529 -45.477 1.00 61.53 C ATOM 1315 C ARG A 90 20.888 60.509 -46.534 1.00 14.51 C ATOM 1316 O ARG A 90 21.289 60.433 -47.700 1.00 31.12 O ATOM 1317 CB ARG A 90 22.909 59.336 -45.572 1.00 1.00 C ATOM 1318 CG ARG A 90 23.351 58.532 -46.786 1.00 75.44 C ATOM 1319 CD ARG A 90 24.816 58.137 -46.705 1.00 14.21 C ATOM 1320 NE ARG A 90 25.727 59.275 -46.822 1.00 45.22 N ATOM 1321 CZ ARG A 90 27.058 59.164 -46.754 1.00 45.51 C ATOM 1322 NH1 ARG A 90 27.617 57.980 -46.519 1.00 34.45 N1+ ATOM 1323 NH2 ARG A 90 27.826 60.235 -46.915 1.00 21.12 N ATOM 0 H ARG A 90 21.023 57.702 -46.426 1.00 34.23 H new ATOM 0 HA ARG A 90 21.158 59.944 -44.495 1.00 61.53 H new ATOM 0 HB2 ARG A 90 23.389 60.314 -45.601 1.00 1.00 H new ATOM 0 HB3 ARG A 90 23.260 58.836 -44.669 1.00 1.00 H new ATOM 0 HG2 ARG A 90 22.738 57.635 -46.869 1.00 75.44 H new ATOM 0 HG3 ARG A 90 23.183 59.118 -47.690 1.00 75.44 H new ATOM 0 HD2 ARG A 90 24.997 57.631 -45.757 1.00 14.21 H new ATOM 0 HD3 ARG A 90 25.037 57.420 -47.496 1.00 14.21 H new ATOM 0 HE ARG A 90 25.326 60.202 -46.963 1.00 45.22 H new ATOM 0 HH11 ARG A 90 27.030 57.156 -46.390 1.00 34.45 H new ATOM 0 HH12 ARG A 90 28.632 57.897 -46.467 1.00 34.45 H new ATOM 0 HH21 ARG A 90 27.401 61.145 -47.091 1.00 21.12 H new ATOM 0 HH22 ARG A 90 28.841 60.147 -46.863 1.00 21.12 H new ATOM 1337 N ASP A 91 19.968 61.390 -46.126 1.00 14.33 N ATOM 1338 CA ASP A 91 19.399 62.423 -47.004 1.00 71.02 C ATOM 1339 C ASP A 91 18.420 61.825 -48.023 1.00 43.52 C ATOM 1340 O ASP A 91 17.248 62.205 -48.069 1.00 61.51 O ATOM 1341 CB ASP A 91 20.514 63.213 -47.708 1.00 34.34 C ATOM 1342 CG ASP A 91 20.026 63.992 -48.913 1.00 2.00 C ATOM 1343 OD1 ASP A 91 20.261 63.528 -50.053 1.00 21.24 O ATOM 1344 OD2 ASP A 91 19.417 65.065 -48.729 1.00 32.31 O1- ATOM 0 H ASP A 91 19.595 61.408 -45.177 1.00 14.33 H new ATOM 0 HA ASP A 91 18.833 63.113 -46.378 1.00 71.02 H new ATOM 0 HB2 ASP A 91 20.966 63.904 -46.996 1.00 34.34 H new ATOM 0 HB3 ASP A 91 21.296 62.522 -48.023 1.00 34.34 H new ATOM 1349 N GLY A 92 18.904 60.891 -48.821 1.00 75.32 N ATOM 1350 CA GLY A 92 18.082 60.242 -49.821 1.00 62.34 C ATOM 1351 C GLY A 92 18.818 59.089 -50.465 1.00 52.21 C ATOM 1352 O GLY A 92 18.626 58.786 -51.642 1.00 23.30 O ATOM 0 H GLY A 92 19.870 60.564 -48.794 1.00 75.32 H new ATOM 0 HA2 GLY A 92 17.163 59.879 -49.361 1.00 62.34 H new ATOM 0 HA3 GLY A 92 17.793 60.965 -50.584 1.00 62.34 H new ATOM 1356 N GLN A 93 19.672 58.450 -49.685 1.00 55.42 N ATOM 1357 CA GLN A 93 20.469 57.332 -50.159 1.00 43.03 C ATOM 1358 C GLN A 93 20.455 56.221 -49.124 1.00 53.23 C ATOM 1359 O GLN A 93 20.794 56.449 -47.962 1.00 62.41 O ATOM 1360 CB GLN A 93 21.920 57.767 -50.419 1.00 32.14 C ATOM 1361 CG GLN A 93 22.097 58.736 -51.582 1.00 62.32 C ATOM 1362 CD GLN A 93 22.243 58.050 -52.934 1.00 5.43 C ATOM 1363 OE1 GLN A 93 22.913 58.565 -53.827 1.00 25.23 O ATOM 1364 NE2 GLN A 93 21.627 56.888 -53.104 1.00 33.20 N ATOM 0 H GLN A 93 19.832 58.691 -48.707 1.00 55.42 H new ATOM 0 HA GLN A 93 20.038 56.974 -51.094 1.00 43.03 H new ATOM 0 HB2 GLN A 93 22.313 58.231 -49.514 1.00 32.14 H new ATOM 0 HB3 GLN A 93 22.522 56.879 -50.609 1.00 32.14 H new ATOM 0 HG2 GLN A 93 21.240 59.409 -51.617 1.00 62.32 H new ATOM 0 HG3 GLN A 93 22.978 59.351 -51.400 1.00 62.32 H new ATOM 0 HE21 GLN A 93 21.078 56.486 -52.344 1.00 33.20 H new ATOM 0 HE22 GLN A 93 21.702 56.396 -53.995 1.00 33.20 H new ATOM 1373 N LEU A 94 20.051 55.029 -49.542 1.00 22.14 N ATOM 1374 CA LEU A 94 20.061 53.870 -48.661 1.00 50.31 C ATOM 1375 C LEU A 94 21.487 53.522 -48.258 1.00 43.43 C ATOM 1376 O LEU A 94 22.341 53.247 -49.106 1.00 52.24 O ATOM 1377 CB LEU A 94 19.387 52.668 -49.335 1.00 41.23 C ATOM 1378 CG LEU A 94 17.865 52.570 -49.148 1.00 41.02 C ATOM 1379 CD1 LEU A 94 17.521 52.403 -47.678 1.00 1.43 C ATOM 1380 CD2 LEU A 94 17.159 53.791 -49.718 1.00 42.11 C ATOM 0 H LEU A 94 19.712 54.840 -50.485 1.00 22.14 H new ATOM 0 HA LEU A 94 19.496 54.119 -47.763 1.00 50.31 H new ATOM 0 HB2 LEU A 94 19.602 52.705 -50.403 1.00 41.23 H new ATOM 0 HB3 LEU A 94 19.842 51.756 -48.950 1.00 41.23 H new ATOM 0 HG LEU A 94 17.517 51.693 -49.694 1.00 41.02 H new ATOM 0 HD11 LEU A 94 16.439 52.335 -47.563 1.00 1.43 H new ATOM 0 HD12 LEU A 94 17.984 51.493 -47.297 1.00 1.43 H new ATOM 0 HD13 LEU A 94 17.892 53.261 -47.118 1.00 1.43 H new ATOM 0 HD21 LEU A 94 16.084 53.692 -49.570 1.00 42.11 H new ATOM 0 HD22 LEU A 94 17.514 54.687 -49.209 1.00 42.11 H new ATOM 0 HD23 LEU A 94 17.373 53.870 -50.784 1.00 42.11 H new ATOM 1392 N GLN A 95 21.736 53.557 -46.962 1.00 22.34 N ATOM 1393 CA GLN A 95 23.048 53.265 -46.423 1.00 52.10 C ATOM 1394 C GLN A 95 23.071 51.855 -45.848 1.00 55.53 C ATOM 1395 O GLN A 95 22.358 51.553 -44.890 1.00 20.22 O ATOM 1396 CB GLN A 95 23.407 54.283 -45.335 1.00 54.30 C ATOM 1397 CG GLN A 95 24.814 54.124 -44.783 1.00 4.25 C ATOM 1398 CD GLN A 95 25.890 54.535 -45.766 1.00 5.40 C ATOM 1399 OE1 GLN A 95 26.295 55.694 -45.807 1.00 14.41 O ATOM 1400 NE2 GLN A 95 26.369 53.593 -46.558 1.00 5.31 N ATOM 0 H GLN A 95 21.036 53.788 -46.257 1.00 22.34 H new ATOM 0 HA GLN A 95 23.784 53.332 -47.224 1.00 52.10 H new ATOM 0 HB2 GLN A 95 23.298 55.288 -45.742 1.00 54.30 H new ATOM 0 HB3 GLN A 95 22.693 54.192 -44.516 1.00 54.30 H new ATOM 0 HG2 GLN A 95 24.911 54.722 -43.877 1.00 4.25 H new ATOM 0 HG3 GLN A 95 24.970 53.084 -44.497 1.00 4.25 H new ATOM 0 HE21 GLN A 95 26.008 52.641 -46.495 1.00 5.31 H new ATOM 0 HE22 GLN A 95 27.100 53.817 -47.233 1.00 5.31 H new ATOM 1409 N LEU A 96 23.879 50.998 -46.445 1.00 75.11 N ATOM 1410 CA LEU A 96 24.017 49.629 -45.986 1.00 53.33 C ATOM 1411 C LEU A 96 25.179 49.542 -45.001 1.00 12.32 C ATOM 1412 O LEU A 96 26.335 49.368 -45.399 1.00 51.50 O ATOM 1413 CB LEU A 96 24.264 48.704 -47.181 1.00 11.23 C ATOM 1414 CG LEU A 96 24.000 47.221 -46.939 1.00 54.15 C ATOM 1415 CD1 LEU A 96 22.504 46.954 -46.869 1.00 12.31 C ATOM 1416 CD2 LEU A 96 24.650 46.382 -48.031 1.00 11.35 C ATOM 0 H LEU A 96 24.454 51.229 -47.255 1.00 75.11 H new ATOM 0 HA LEU A 96 23.100 49.316 -45.486 1.00 53.33 H new ATOM 0 HB2 LEU A 96 23.636 49.035 -48.008 1.00 11.23 H new ATOM 0 HB3 LEU A 96 25.300 48.822 -47.500 1.00 11.23 H new ATOM 0 HG LEU A 96 24.442 46.938 -45.983 1.00 54.15 H new ATOM 0 HD11 LEU A 96 22.332 45.892 -46.696 1.00 12.31 H new ATOM 0 HD12 LEU A 96 22.069 47.530 -46.052 1.00 12.31 H new ATOM 0 HD13 LEU A 96 22.037 47.249 -47.809 1.00 12.31 H new ATOM 0 HD21 LEU A 96 24.453 45.326 -47.845 1.00 11.35 H new ATOM 0 HD22 LEU A 96 24.237 46.663 -49.000 1.00 11.35 H new ATOM 0 HD23 LEU A 96 25.726 46.556 -48.031 1.00 11.35 H new ATOM 1428 N ASN A 97 24.880 49.713 -43.722 1.00 24.34 N ATOM 1429 CA ASN A 97 25.909 49.700 -42.690 1.00 24.31 C ATOM 1430 C ASN A 97 26.235 48.274 -42.271 1.00 43.41 C ATOM 1431 O ASN A 97 25.539 47.690 -41.445 1.00 33.42 O ATOM 1432 CB ASN A 97 25.467 50.497 -41.456 1.00 32.34 C ATOM 1433 CG ASN A 97 25.302 51.981 -41.718 1.00 4.11 C ATOM 1434 OD1 ASN A 97 24.218 52.452 -42.061 1.00 11.22 O ATOM 1435 ND2 ASN A 97 26.377 52.734 -41.538 1.00 2.51 N ATOM 0 H ASN A 97 23.933 49.863 -43.373 1.00 24.34 H new ATOM 0 HA ASN A 97 26.798 50.166 -43.114 1.00 24.31 H new ATOM 0 HB2 ASN A 97 24.522 50.094 -41.093 1.00 32.34 H new ATOM 0 HB3 ASN A 97 26.200 50.356 -40.661 1.00 32.34 H new ATOM 0 HD21 ASN A 97 26.324 53.742 -41.684 1.00 2.51 H new ATOM 0 HD22 ASN A 97 27.258 52.306 -41.253 1.00 2.51 H new ATOM 1442 N VAL A 98 27.280 47.706 -42.852 1.00 45.14 N ATOM 1443 CA VAL A 98 27.721 46.371 -42.471 1.00 72.02 C ATOM 1444 C VAL A 98 28.718 46.443 -41.327 1.00 15.31 C ATOM 1445 O VAL A 98 29.875 46.830 -41.508 1.00 42.35 O ATOM 1446 CB VAL A 98 28.339 45.594 -43.656 1.00 44.14 C ATOM 1447 CG1 VAL A 98 29.050 44.332 -43.180 1.00 50.42 C ATOM 1448 CG2 VAL A 98 27.257 45.228 -44.655 1.00 24.02 C ATOM 0 H VAL A 98 27.837 48.145 -43.585 1.00 45.14 H new ATOM 0 HA VAL A 98 26.833 45.828 -42.147 1.00 72.02 H new ATOM 0 HB VAL A 98 29.076 46.239 -44.135 1.00 44.14 H new ATOM 0 HG11 VAL A 98 29.474 43.808 -44.037 1.00 50.42 H new ATOM 0 HG12 VAL A 98 29.848 44.603 -42.489 1.00 50.42 H new ATOM 0 HG13 VAL A 98 28.337 43.682 -42.673 1.00 50.42 H new ATOM 0 HG21 VAL A 98 27.700 44.681 -45.487 1.00 24.02 H new ATOM 0 HG22 VAL A 98 26.508 44.604 -44.168 1.00 24.02 H new ATOM 0 HG23 VAL A 98 26.785 46.136 -45.029 1.00 24.02 H new ATOM 1458 N THR A 99 28.243 46.095 -40.149 1.00 13.53 N ATOM 1459 CA THR A 99 29.079 46.041 -38.972 1.00 63.52 C ATOM 1460 C THR A 99 29.553 44.610 -38.738 1.00 34.14 C ATOM 1461 O THR A 99 28.748 43.718 -38.459 1.00 52.04 O ATOM 1462 CB THR A 99 28.302 46.538 -37.744 1.00 15.12 C ATOM 1463 OG1 THR A 99 27.741 47.829 -38.017 1.00 32.14 O ATOM 1464 CG2 THR A 99 29.202 46.618 -36.518 1.00 64.32 C ATOM 0 H THR A 99 27.269 45.843 -39.983 1.00 13.53 H new ATOM 0 HA THR A 99 29.944 46.686 -39.127 1.00 63.52 H new ATOM 0 HB THR A 99 27.504 45.826 -37.535 1.00 15.12 H new ATOM 0 HG1 THR A 99 27.245 48.143 -37.232 1.00 32.14 H new ATOM 0 HG21 THR A 99 28.624 46.973 -35.665 1.00 64.32 H new ATOM 0 HG22 THR A 99 29.605 45.630 -36.297 1.00 64.32 H new ATOM 0 HG23 THR A 99 30.022 47.309 -36.713 1.00 64.32 H new ATOM 1472 N ASP A 100 30.847 44.390 -38.900 1.00 61.11 N ATOM 1473 CA ASP A 100 31.439 43.076 -38.671 1.00 23.41 C ATOM 1474 C ASP A 100 31.467 42.737 -37.183 1.00 63.40 C ATOM 1475 O ASP A 100 31.911 43.537 -36.357 1.00 62.23 O ATOM 1476 CB ASP A 100 32.852 43.030 -39.246 1.00 14.41 C ATOM 1477 CG ASP A 100 33.593 41.763 -38.887 1.00 53.52 C ATOM 1478 OD1 ASP A 100 34.754 41.863 -38.455 1.00 4.12 O ATOM 1479 OD2 ASP A 100 33.026 40.664 -39.028 1.00 11.31 O1- ATOM 0 H ASP A 100 31.513 45.106 -39.190 1.00 61.11 H new ATOM 0 HA ASP A 100 30.822 42.333 -39.177 1.00 23.41 H new ATOM 0 HB2 ASP A 100 32.800 43.119 -40.331 1.00 14.41 H new ATOM 0 HB3 ASP A 100 33.415 43.889 -38.882 1.00 14.41 H new ATOM 1484 N ARG A 101 30.999 41.544 -36.848 1.00 1.22 N ATOM 1485 CA ARG A 101 30.894 41.121 -35.459 1.00 70.42 C ATOM 1486 C ARG A 101 32.134 40.332 -35.046 1.00 41.44 C ATOM 1487 O ARG A 101 32.359 40.070 -33.863 1.00 3.54 O ATOM 1488 CB ARG A 101 29.641 40.264 -35.285 1.00 70.04 C ATOM 1489 CG ARG A 101 29.105 40.212 -33.866 1.00 12.41 C ATOM 1490 CD ARG A 101 27.817 39.405 -33.807 1.00 13.24 C ATOM 1491 NE ARG A 101 27.061 39.655 -32.582 1.00 14.53 N ATOM 1492 CZ ARG A 101 25.809 39.245 -32.385 1.00 32.32 C ATOM 1493 NH1 ARG A 101 25.181 38.536 -33.316 1.00 20.33 N1+ ATOM 1494 NH2 ARG A 101 25.185 39.553 -31.255 1.00 52.25 N ATOM 0 H ARG A 101 30.684 40.848 -37.524 1.00 1.22 H new ATOM 0 HA ARG A 101 30.822 42.002 -34.821 1.00 70.42 H new ATOM 0 HB2 ARG A 101 28.860 40.648 -35.941 1.00 70.04 H new ATOM 0 HB3 ARG A 101 29.862 39.249 -35.614 1.00 70.04 H new ATOM 0 HG2 ARG A 101 29.850 39.766 -33.207 1.00 12.41 H new ATOM 0 HG3 ARG A 101 28.923 41.224 -33.503 1.00 12.41 H new ATOM 0 HD2 ARG A 101 27.198 39.650 -34.670 1.00 13.24 H new ATOM 0 HD3 ARG A 101 28.053 38.343 -33.875 1.00 13.24 H new ATOM 0 HE ARG A 101 27.519 40.174 -31.833 1.00 14.53 H new ATOM 0 HH11 ARG A 101 25.657 38.303 -34.187 1.00 20.33 H new ATOM 0 HH12 ARG A 101 24.222 38.225 -33.160 1.00 20.33 H new ATOM 0 HH21 ARG A 101 25.664 40.102 -30.541 1.00 52.25 H new ATOM 0 HH22 ARG A 101 24.226 39.241 -31.100 1.00 52.25 H new ATOM 1508 N LYS A 102 32.948 39.966 -36.029 1.00 25.22 N ATOM 1509 CA LYS A 102 34.122 39.144 -35.778 1.00 51.24 C ATOM 1510 C LYS A 102 35.328 39.995 -35.386 1.00 24.03 C ATOM 1511 O LYS A 102 35.849 39.872 -34.279 1.00 61.52 O ATOM 1512 CB LYS A 102 34.448 38.295 -37.007 1.00 63.24 C ATOM 1513 CG LYS A 102 33.336 37.330 -37.380 1.00 64.00 C ATOM 1514 CD LYS A 102 33.716 36.469 -38.576 1.00 42.35 C ATOM 1515 CE LYS A 102 32.632 35.455 -38.897 1.00 32.33 C ATOM 1516 NZ LYS A 102 32.390 34.522 -37.766 1.00 73.14 N1+ ATOM 0 H LYS A 102 32.815 40.226 -37.006 1.00 25.22 H new ATOM 0 HA LYS A 102 33.894 38.484 -34.941 1.00 51.24 H new ATOM 0 HB2 LYS A 102 34.648 38.953 -37.853 1.00 63.24 H new ATOM 0 HB3 LYS A 102 35.362 37.731 -36.819 1.00 63.24 H new ATOM 0 HG2 LYS A 102 33.109 36.689 -36.528 1.00 64.00 H new ATOM 0 HG3 LYS A 102 32.429 37.890 -37.608 1.00 64.00 H new ATOM 0 HD2 LYS A 102 33.889 37.105 -39.444 1.00 42.35 H new ATOM 0 HD3 LYS A 102 34.652 35.950 -38.370 1.00 42.35 H new ATOM 0 HE2 LYS A 102 31.707 35.978 -39.140 1.00 32.33 H new ATOM 0 HE3 LYS A 102 32.918 34.886 -39.782 1.00 32.33 H new ATOM 0 HZ1 LYS A 102 32.342 33.547 -38.125 1.00 73.14 H new ATOM 0 HZ2 LYS A 102 33.167 34.600 -37.079 1.00 73.14 H new ATOM 0 HZ3 LYS A 102 31.492 34.765 -37.302 1.00 73.14 H new ATOM 1530 N THR A 103 35.764 40.857 -36.290 1.00 32.11 N ATOM 1531 CA THR A 103 36.953 41.668 -36.058 1.00 65.25 C ATOM 1532 C THR A 103 36.597 43.145 -35.894 1.00 51.12 C ATOM 1533 O THR A 103 37.305 43.899 -35.220 1.00 72.12 O ATOM 1534 CB THR A 103 37.965 41.508 -37.212 1.00 3.51 C ATOM 1535 OG1 THR A 103 37.357 41.851 -38.467 1.00 71.14 O ATOM 1536 CG2 THR A 103 38.483 40.083 -37.283 1.00 15.44 C ATOM 0 H THR A 103 35.314 41.015 -37.192 1.00 32.11 H new ATOM 0 HA THR A 103 37.407 41.313 -35.133 1.00 65.25 H new ATOM 0 HB THR A 103 38.799 42.182 -37.017 1.00 3.51 H new ATOM 0 HG1 THR A 103 36.404 42.034 -38.330 1.00 71.14 H new ATOM 0 HG21 THR A 103 39.195 39.995 -38.104 1.00 15.44 H new ATOM 0 HG22 THR A 103 38.977 39.828 -36.345 1.00 15.44 H new ATOM 0 HG23 THR A 103 37.650 39.401 -37.451 1.00 15.44 H new ATOM 1544 N GLY A 104 35.499 43.546 -36.518 1.00 65.24 N ATOM 1545 CA GLY A 104 35.030 44.911 -36.409 1.00 42.41 C ATOM 1546 C GLY A 104 35.342 45.732 -37.642 1.00 24.42 C ATOM 1547 O GLY A 104 35.630 46.925 -37.548 1.00 13.23 O ATOM 0 H GLY A 104 34.920 42.943 -37.103 1.00 65.24 H new ATOM 0 HA2 GLY A 104 33.953 44.909 -36.241 1.00 42.41 H new ATOM 0 HA3 GLY A 104 35.488 45.381 -35.538 1.00 42.41 H new ATOM 1551 N GLN A 105 35.301 45.084 -38.796 1.00 51.35 N ATOM 1552 CA GLN A 105 35.457 45.772 -40.068 1.00 72.04 C ATOM 1553 C GLN A 105 34.211 46.601 -40.369 1.00 12.40 C ATOM 1554 O GLN A 105 33.118 46.056 -40.534 1.00 64.30 O ATOM 1555 CB GLN A 105 35.693 44.758 -41.188 1.00 71.44 C ATOM 1556 CG GLN A 105 36.957 43.935 -41.012 1.00 11.23 C ATOM 1557 CD GLN A 105 37.083 42.829 -42.043 1.00 44.43 C ATOM 1558 OE1 GLN A 105 36.624 41.707 -41.828 1.00 42.45 O ATOM 1559 NE2 GLN A 105 37.699 43.136 -43.173 1.00 23.32 N ATOM 0 H GLN A 105 35.160 44.077 -38.878 1.00 51.35 H new ATOM 0 HA GLN A 105 36.319 46.437 -40.006 1.00 72.04 H new ATOM 0 HB2 GLN A 105 34.837 44.085 -41.243 1.00 71.44 H new ATOM 0 HB3 GLN A 105 35.744 45.287 -42.140 1.00 71.44 H new ATOM 0 HG2 GLN A 105 37.825 44.591 -41.080 1.00 11.23 H new ATOM 0 HG3 GLN A 105 36.965 43.498 -40.013 1.00 11.23 H new ATOM 0 HE21 GLN A 105 38.066 44.077 -43.314 1.00 23.32 H new ATOM 0 HE22 GLN A 105 37.807 42.432 -43.903 1.00 23.32 H new ATOM 1568 N THR A 106 34.374 47.913 -40.426 1.00 25.35 N ATOM 1569 CA THR A 106 33.259 48.801 -40.703 1.00 43.25 C ATOM 1570 C THR A 106 33.070 48.964 -42.209 1.00 44.11 C ATOM 1571 O THR A 106 33.696 49.819 -42.840 1.00 33.22 O ATOM 1572 CB THR A 106 33.468 50.183 -40.051 1.00 61.32 C ATOM 1573 OG1 THR A 106 33.821 50.023 -38.671 1.00 1.35 O ATOM 1574 CG2 THR A 106 32.206 51.025 -40.152 1.00 5.13 C ATOM 0 H THR A 106 35.267 48.385 -40.284 1.00 25.35 H new ATOM 0 HA THR A 106 32.363 48.351 -40.274 1.00 43.25 H new ATOM 0 HB THR A 106 34.273 50.691 -40.581 1.00 61.32 H new ATOM 0 HG1 THR A 106 33.954 50.904 -38.263 1.00 1.35 H new ATOM 0 HG21 THR A 106 32.378 51.995 -39.685 1.00 5.13 H new ATOM 0 HG22 THR A 106 31.947 51.168 -41.201 1.00 5.13 H new ATOM 0 HG23 THR A 106 31.388 50.517 -39.642 1.00 5.13 H new ATOM 1582 N SER A 107 32.225 48.124 -42.784 1.00 30.10 N ATOM 1583 CA SER A 107 31.965 48.163 -44.211 1.00 71.15 C ATOM 1584 C SER A 107 30.691 48.954 -44.491 1.00 42.21 C ATOM 1585 O SER A 107 29.595 48.395 -44.564 1.00 53.14 O ATOM 1586 CB SER A 107 31.850 46.737 -44.768 1.00 62.32 C ATOM 1587 OG SER A 107 31.745 46.732 -46.183 1.00 35.01 O ATOM 0 H SER A 107 31.706 47.404 -42.281 1.00 30.10 H new ATOM 0 HA SER A 107 32.797 48.661 -44.709 1.00 71.15 H new ATOM 0 HB2 SER A 107 32.722 46.157 -44.466 1.00 62.32 H new ATOM 0 HB3 SER A 107 30.977 46.247 -44.337 1.00 62.32 H new ATOM 0 HG SER A 107 31.675 45.808 -46.503 1.00 35.01 H new ATOM 1593 N THR A 108 30.836 50.260 -44.621 1.00 61.34 N ATOM 1594 CA THR A 108 29.699 51.124 -44.862 1.00 45.01 C ATOM 1595 C THR A 108 29.482 51.308 -46.364 1.00 51.14 C ATOM 1596 O THR A 108 30.119 52.149 -46.999 1.00 24.12 O ATOM 1597 CB THR A 108 29.900 52.488 -44.181 1.00 51.54 C ATOM 1598 OG1 THR A 108 30.447 52.299 -42.866 1.00 42.23 O ATOM 1599 CG2 THR A 108 28.582 53.231 -44.065 1.00 12.31 C ATOM 0 H THR A 108 31.732 50.744 -44.563 1.00 61.34 H new ATOM 0 HA THR A 108 28.813 50.654 -44.435 1.00 45.01 H new ATOM 0 HB THR A 108 30.587 53.075 -44.790 1.00 51.54 H new ATOM 0 HG1 THR A 108 30.575 53.171 -42.437 1.00 42.23 H new ATOM 0 HG21 THR A 108 28.748 54.193 -43.580 1.00 12.31 H new ATOM 0 HG22 THR A 108 28.167 53.393 -45.060 1.00 12.31 H new ATOM 0 HG23 THR A 108 27.883 52.642 -43.471 1.00 12.31 H new ATOM 1607 N ILE A 109 28.592 50.498 -46.923 1.00 13.34 N ATOM 1608 CA ILE A 109 28.356 50.482 -48.360 1.00 55.11 C ATOM 1609 C ILE A 109 27.067 51.224 -48.700 1.00 14.15 C ATOM 1610 O ILE A 109 26.062 51.077 -48.012 1.00 1.14 O ATOM 1611 CB ILE A 109 28.250 49.029 -48.885 1.00 61.20 C ATOM 1612 CG1 ILE A 109 29.476 48.214 -48.464 1.00 73.01 C ATOM 1613 CG2 ILE A 109 28.107 49.015 -50.400 1.00 4.42 C ATOM 1614 CD1 ILE A 109 29.383 46.747 -48.831 1.00 12.41 C ATOM 0 H ILE A 109 28.018 49.839 -46.398 1.00 13.34 H new ATOM 0 HA ILE A 109 29.201 50.978 -48.838 1.00 55.11 H new ATOM 0 HB ILE A 109 27.361 48.574 -48.448 1.00 61.20 H new ATOM 0 HG12 ILE A 109 30.364 48.641 -48.930 1.00 73.01 H new ATOM 0 HG13 ILE A 109 29.608 48.303 -47.386 1.00 73.01 H new ATOM 0 HG21 ILE A 109 28.034 47.985 -50.749 1.00 4.42 H new ATOM 0 HG22 ILE A 109 27.207 49.560 -50.686 1.00 4.42 H new ATOM 0 HG23 ILE A 109 28.977 49.490 -50.852 1.00 4.42 H new ATOM 0 HD11 ILE A 109 30.286 46.232 -48.502 1.00 12.41 H new ATOM 0 HD12 ILE A 109 28.515 46.304 -48.343 1.00 12.41 H new ATOM 0 HD13 ILE A 109 29.282 46.648 -49.912 1.00 12.41 H new ATOM 1626 N GLN A 110 27.104 52.042 -49.735 1.00 42.43 N ATOM 1627 CA GLN A 110 25.898 52.680 -50.233 1.00 3.53 C ATOM 1628 C GLN A 110 25.310 51.883 -51.388 1.00 10.22 C ATOM 1629 O GLN A 110 25.979 51.027 -51.971 1.00 61.10 O ATOM 1630 CB GLN A 110 26.186 54.112 -50.676 1.00 51.25 C ATOM 1631 CG GLN A 110 26.171 55.108 -49.535 1.00 2.41 C ATOM 1632 CD GLN A 110 26.771 56.440 -49.926 1.00 4.14 C ATOM 1633 OE1 GLN A 110 26.073 57.333 -50.409 1.00 23.33 O ATOM 1634 NE2 GLN A 110 28.069 56.583 -49.714 1.00 32.10 N ATOM 0 H GLN A 110 27.953 52.281 -50.247 1.00 42.43 H new ATOM 0 HA GLN A 110 25.171 52.709 -49.421 1.00 3.53 H new ATOM 0 HB2 GLN A 110 27.160 54.145 -51.164 1.00 51.25 H new ATOM 0 HB3 GLN A 110 25.447 54.410 -51.419 1.00 51.25 H new ATOM 0 HG2 GLN A 110 25.144 55.259 -49.201 1.00 2.41 H new ATOM 0 HG3 GLN A 110 26.724 54.697 -48.690 1.00 2.41 H new ATOM 0 HE21 GLN A 110 28.608 55.816 -49.312 1.00 32.10 H new ATOM 0 HE22 GLN A 110 28.531 57.460 -49.953 1.00 32.10 H new ATOM 1643 N VAL A 111 24.053 52.156 -51.701 1.00 22.34 N ATOM 1644 CA VAL A 111 23.391 51.530 -52.834 1.00 74.24 C ATOM 1645 C VAL A 111 24.032 51.985 -54.149 1.00 21.00 C ATOM 1646 O VAL A 111 24.058 53.175 -54.468 1.00 75.11 O ATOM 1647 CB VAL A 111 21.871 51.836 -52.832 1.00 73.33 C ATOM 1648 CG1 VAL A 111 21.609 53.332 -52.726 1.00 13.23 C ATOM 1649 CG2 VAL A 111 21.208 51.266 -54.073 1.00 44.35 C ATOM 0 H VAL A 111 23.468 52.811 -51.182 1.00 22.34 H new ATOM 0 HA VAL A 111 23.515 50.451 -52.743 1.00 74.24 H new ATOM 0 HB VAL A 111 21.436 51.356 -51.955 1.00 73.33 H new ATOM 0 HG11 VAL A 111 20.534 53.514 -52.727 1.00 13.23 H new ATOM 0 HG12 VAL A 111 22.041 53.712 -51.800 1.00 13.23 H new ATOM 0 HG13 VAL A 111 22.064 53.842 -53.575 1.00 13.23 H new ATOM 0 HG21 VAL A 111 20.142 51.492 -54.052 1.00 44.35 H new ATOM 0 HG22 VAL A 111 21.656 51.711 -54.962 1.00 44.35 H new ATOM 0 HG23 VAL A 111 21.350 50.186 -54.098 1.00 44.35 H new ATOM 1659 N SER A 112 24.579 51.034 -54.892 1.00 13.43 N ATOM 1660 CA SER A 112 25.248 51.343 -56.143 1.00 25.44 C ATOM 1661 C SER A 112 24.281 51.206 -57.312 1.00 41.43 C ATOM 1662 O SER A 112 24.121 50.121 -57.883 1.00 54.32 O ATOM 1663 CB SER A 112 26.466 50.432 -56.340 1.00 73.52 C ATOM 1664 OG SER A 112 27.252 50.856 -57.444 1.00 50.04 O ATOM 0 H SER A 112 24.572 50.043 -54.649 1.00 13.43 H new ATOM 0 HA SER A 112 25.595 52.376 -56.104 1.00 25.44 H new ATOM 0 HB2 SER A 112 27.074 50.433 -55.436 1.00 73.52 H new ATOM 0 HB3 SER A 112 26.134 49.406 -56.499 1.00 73.52 H new ATOM 0 HG SER A 112 28.022 50.259 -57.546 1.00 50.04 H new ATOM 1670 N GLY A 113 23.616 52.307 -57.637 1.00 3.12 N ATOM 1671 CA GLY A 113 22.691 52.325 -58.751 1.00 51.54 C ATOM 1672 C GLY A 113 21.558 51.332 -58.590 1.00 51.43 C ATOM 1673 O GLY A 113 20.921 51.272 -57.537 1.00 53.21 O ATOM 0 H GLY A 113 23.703 53.195 -57.143 1.00 3.12 H new ATOM 0 HA2 GLY A 113 22.277 53.328 -58.857 1.00 51.54 H new ATOM 0 HA3 GLY A 113 23.233 52.105 -59.671 1.00 51.54 H new ATOM 1677 N LEU A 114 21.321 50.542 -59.626 1.00 24.32 N ATOM 1678 CA LEU A 114 20.235 49.573 -59.623 1.00 41.32 C ATOM 1679 C LEU A 114 20.750 48.190 -59.999 1.00 21.34 C ATOM 1680 O LEU A 114 19.976 47.306 -60.363 1.00 34.33 O ATOM 1681 CB LEU A 114 19.132 49.999 -60.599 1.00 64.43 C ATOM 1682 CG LEU A 114 18.405 51.300 -60.250 1.00 3.52 C ATOM 1683 CD1 LEU A 114 17.404 51.660 -61.339 1.00 71.24 C ATOM 1684 CD2 LEU A 114 17.705 51.174 -58.906 1.00 25.04 C ATOM 0 H LEU A 114 21.870 50.553 -60.485 1.00 24.32 H new ATOM 0 HA LEU A 114 19.820 49.533 -58.616 1.00 41.32 H new ATOM 0 HB2 LEU A 114 19.571 50.104 -61.591 1.00 64.43 H new ATOM 0 HB3 LEU A 114 18.396 49.197 -60.659 1.00 64.43 H new ATOM 0 HG LEU A 114 19.143 52.099 -60.182 1.00 3.52 H new ATOM 0 HD11 LEU A 114 16.896 52.588 -61.074 1.00 71.24 H new ATOM 0 HD12 LEU A 114 17.928 51.790 -62.286 1.00 71.24 H new ATOM 0 HD13 LEU A 114 16.670 50.860 -61.437 1.00 71.24 H new ATOM 0 HD21 LEU A 114 17.193 52.108 -58.673 1.00 25.04 H new ATOM 0 HD22 LEU A 114 16.978 50.363 -58.949 1.00 25.04 H new ATOM 0 HD23 LEU A 114 18.441 50.961 -58.131 1.00 25.04 H new ATOM 1696 N GLN A 115 22.061 48.008 -59.915 1.00 45.34 N ATOM 1697 CA GLN A 115 22.661 46.716 -60.217 1.00 40.42 C ATOM 1698 C GLN A 115 22.465 45.755 -59.048 1.00 4.04 C ATOM 1699 O GLN A 115 22.219 44.565 -59.253 1.00 53.53 O ATOM 1700 CB GLN A 115 24.151 46.864 -60.542 1.00 34.14 C ATOM 1701 CG GLN A 115 24.964 47.502 -59.427 1.00 25.34 C ATOM 1702 CD GLN A 115 26.442 47.564 -59.748 1.00 62.34 C ATOM 1703 OE1 GLN A 115 26.976 46.711 -60.460 1.00 30.31 O ATOM 1704 NE2 GLN A 115 27.116 48.573 -59.222 1.00 61.02 N ATOM 0 H GLN A 115 22.725 48.733 -59.642 1.00 45.34 H new ATOM 0 HA GLN A 115 22.162 46.307 -61.096 1.00 40.42 H new ATOM 0 HB2 GLN A 115 24.564 45.880 -60.762 1.00 34.14 H new ATOM 0 HB3 GLN A 115 24.258 47.464 -61.446 1.00 34.14 H new ATOM 0 HG2 GLN A 115 24.593 48.510 -59.243 1.00 25.34 H new ATOM 0 HG3 GLN A 115 24.819 46.936 -58.507 1.00 25.34 H new ATOM 0 HE21 GLN A 115 26.636 49.258 -58.638 1.00 61.02 H new ATOM 0 HE22 GLN A 115 28.116 48.666 -59.400 1.00 61.02 H new ATOM 1713 N ASN A 116 22.577 46.296 -57.827 1.00 43.54 N ATOM 1714 CA ASN A 116 22.379 45.534 -56.588 1.00 10.42 C ATOM 1715 C ASN A 116 23.478 44.492 -56.371 1.00 30.14 C ATOM 1716 O ASN A 116 23.864 43.771 -57.293 1.00 42.14 O ATOM 1717 CB ASN A 116 20.996 44.867 -56.573 1.00 13.45 C ATOM 1718 CG ASN A 116 20.773 43.997 -55.347 1.00 41.32 C ATOM 1719 OD1 ASN A 116 20.385 44.489 -54.287 1.00 22.52 O ATOM 1720 ND2 ASN A 116 20.990 42.698 -55.486 1.00 63.44 N ATOM 0 H ASN A 116 22.808 47.277 -57.671 1.00 43.54 H new ATOM 0 HA ASN A 116 22.436 46.244 -55.763 1.00 10.42 H new ATOM 0 HB2 ASN A 116 20.226 45.638 -56.611 1.00 13.45 H new ATOM 0 HB3 ASN A 116 20.882 44.258 -57.470 1.00 13.45 H new ATOM 0 HD21 ASN A 116 20.836 42.068 -54.699 1.00 63.44 H new ATOM 0 HD22 ASN A 116 21.311 42.327 -56.380 1.00 63.44 H new ATOM 1727 N ASN A 117 23.993 44.434 -55.148 1.00 33.24 N ATOM 1728 CA ASN A 117 24.983 43.425 -54.774 1.00 2.33 C ATOM 1729 C ASN A 117 24.375 42.033 -54.907 1.00 51.41 C ATOM 1730 O ASN A 117 23.548 41.630 -54.089 1.00 1.42 O ATOM 1731 CB ASN A 117 25.470 43.646 -53.335 1.00 61.13 C ATOM 1732 CG ASN A 117 26.238 44.945 -53.153 1.00 30.42 C ATOM 1733 OD1 ASN A 117 25.993 45.937 -53.842 1.00 34.24 O ATOM 1734 ND2 ASN A 117 27.169 44.951 -52.214 1.00 5.04 N ATOM 0 H ASN A 117 23.742 45.075 -54.395 1.00 33.24 H new ATOM 0 HA ASN A 117 25.838 43.514 -55.444 1.00 2.33 H new ATOM 0 HB2 ASN A 117 24.611 43.643 -52.664 1.00 61.13 H new ATOM 0 HB3 ASN A 117 26.107 42.811 -53.042 1.00 61.13 H new ATOM 0 HD21 ASN A 117 27.713 45.796 -52.040 1.00 5.04 H new ATOM 0 HD22 ASN A 117 27.344 44.110 -51.663 1.00 5.04 H new ATOM 1741 N SER A 118 24.766 41.313 -55.945 1.00 14.15 N ATOM 1742 CA SER A 118 24.150 40.035 -56.253 1.00 75.22 C ATOM 1743 C SER A 118 25.196 38.925 -56.349 1.00 42.11 C ATOM 1744 O SER A 118 26.397 39.177 -56.243 1.00 3.43 O ATOM 1745 CB SER A 118 23.372 40.150 -57.565 1.00 22.31 C ATOM 1746 OG SER A 118 22.519 41.283 -57.548 1.00 43.44 O ATOM 0 H SER A 118 25.507 41.592 -56.588 1.00 14.15 H new ATOM 0 HA SER A 118 23.466 39.774 -55.446 1.00 75.22 H new ATOM 0 HB2 SER A 118 24.068 40.226 -58.400 1.00 22.31 H new ATOM 0 HB3 SER A 118 22.782 39.247 -57.723 1.00 22.31 H new ATOM 0 HG SER A 118 23.060 42.100 -57.569 1.00 43.44 H new ATOM 1752 N THR A 119 24.724 37.700 -56.533 1.00 1.13 N ATOM 1753 CA THR A 119 25.592 36.545 -56.686 1.00 11.34 C ATOM 1754 C THR A 119 25.290 35.868 -58.029 1.00 73.20 C ATOM 1755 O THR A 119 24.318 36.235 -58.693 1.00 53.00 O ATOM 1756 CB THR A 119 25.379 35.556 -55.515 1.00 14.15 C ATOM 1757 OG1 THR A 119 25.236 36.291 -54.290 1.00 61.21 O ATOM 1758 CG2 THR A 119 26.548 34.589 -55.379 1.00 31.13 C ATOM 0 H THR A 119 23.729 37.481 -56.580 1.00 1.13 H new ATOM 0 HA THR A 119 26.634 36.864 -56.671 1.00 11.34 H new ATOM 0 HB THR A 119 24.478 34.979 -55.723 1.00 14.15 H new ATOM 0 HG1 THR A 119 25.099 35.666 -53.548 1.00 61.21 H new ATOM 0 HG21 THR A 119 26.363 33.910 -54.547 1.00 31.13 H new ATOM 0 HG22 THR A 119 26.654 34.015 -56.299 1.00 31.13 H new ATOM 0 HG23 THR A 119 27.464 35.150 -55.193 1.00 31.13 H new ATOM 1766 N ASP A 120 26.113 34.905 -58.438 1.00 14.24 N ATOM 1767 CA ASP A 120 25.922 34.238 -59.725 1.00 62.41 C ATOM 1768 C ASP A 120 24.709 33.306 -59.693 1.00 11.22 C ATOM 1769 O ASP A 120 23.946 33.250 -60.661 1.00 34.13 O ATOM 1770 CB ASP A 120 27.182 33.455 -60.135 1.00 21.11 C ATOM 1771 CG ASP A 120 27.343 32.138 -59.396 1.00 5.01 C ATOM 1772 OD1 ASP A 120 27.787 32.155 -58.228 1.00 42.22 O ATOM 1773 OD2 ASP A 120 27.025 31.081 -59.980 1.00 22.14 O1- ATOM 0 H ASP A 120 26.913 34.570 -57.902 1.00 14.24 H new ATOM 0 HA ASP A 120 25.739 35.013 -60.469 1.00 62.41 H new ATOM 0 HB2 ASP A 120 27.146 33.259 -61.207 1.00 21.11 H new ATOM 0 HB3 ASP A 120 28.060 34.074 -59.953 1.00 21.11 H new ATOM 1778 N PHE A 121 24.528 32.602 -58.568 1.00 13.21 N ATOM 1779 CA PHE A 121 23.428 31.647 -58.389 1.00 25.12 C ATOM 1780 C PHE A 121 23.543 30.471 -59.362 1.00 43.12 C ATOM 1781 O PHE A 121 23.250 30.595 -60.553 1.00 24.43 O ATOM 1782 CB PHE A 121 22.061 32.330 -58.531 1.00 11.52 C ATOM 1783 CG PHE A 121 21.784 33.348 -57.462 1.00 23.13 C ATOM 1784 CD1 PHE A 121 21.714 34.696 -57.771 1.00 75.24 C ATOM 1785 CD2 PHE A 121 21.595 32.955 -56.146 1.00 41.35 C ATOM 1786 CE1 PHE A 121 21.458 35.634 -56.790 1.00 60.15 C ATOM 1787 CE2 PHE A 121 21.338 33.889 -55.159 1.00 43.42 C ATOM 1788 CZ PHE A 121 21.271 35.230 -55.483 1.00 30.42 C ATOM 0 H PHE A 121 25.141 32.679 -57.756 1.00 13.21 H new ATOM 0 HA PHE A 121 23.507 31.256 -57.374 1.00 25.12 H new ATOM 0 HB2 PHE A 121 22.006 32.815 -59.506 1.00 11.52 H new ATOM 0 HB3 PHE A 121 21.280 31.570 -58.508 1.00 11.52 H new ATOM 0 HD1 PHE A 121 21.861 35.018 -58.791 1.00 75.24 H new ATOM 0 HD2 PHE A 121 21.649 31.908 -55.889 1.00 41.35 H new ATOM 0 HE1 PHE A 121 21.404 36.682 -57.045 1.00 60.15 H new ATOM 0 HE2 PHE A 121 21.190 33.571 -54.138 1.00 43.42 H new ATOM 0 HZ PHE A 121 21.072 35.962 -54.714 1.00 30.42 H new ATOM 1798 N HIS A 122 23.962 29.328 -58.840 1.00 74.33 N ATOM 1799 CA HIS A 122 24.165 28.140 -59.658 1.00 33.51 C ATOM 1800 C HIS A 122 22.854 27.378 -59.820 1.00 61.51 C ATOM 1801 O HIS A 122 22.222 27.005 -58.834 1.00 44.21 O ATOM 1802 CB HIS A 122 25.225 27.220 -59.036 1.00 14.54 C ATOM 1803 CG HIS A 122 26.584 27.838 -58.923 1.00 14.41 C ATOM 1804 ND1 HIS A 122 27.581 27.645 -59.853 1.00 72.31 N ATOM 1805 CD2 HIS A 122 27.113 28.645 -57.975 1.00 55.51 C ATOM 1806 CE1 HIS A 122 28.658 28.310 -59.486 1.00 74.34 C ATOM 1807 NE2 HIS A 122 28.404 28.928 -58.348 1.00 72.12 N ATOM 0 H HIS A 122 24.169 29.197 -57.850 1.00 74.33 H new ATOM 0 HA HIS A 122 24.516 28.463 -60.638 1.00 33.51 H new ATOM 0 HB2 HIS A 122 24.891 26.919 -58.043 1.00 14.54 H new ATOM 0 HB3 HIS A 122 25.299 26.313 -59.636 1.00 14.54 H new ATOM 0 HD2 HIS A 122 26.612 29.002 -57.087 1.00 55.51 H new ATOM 0 HE1 HIS A 122 29.592 28.344 -60.026 1.00 74.34 H new ATOM 0 HE2 HIS A 122 29.057 29.517 -57.832 1.00 72.12 H new ATOM 1816 N HIS A 123 22.443 27.157 -61.063 1.00 41.22 N ATOM 1817 CA HIS A 123 21.206 26.433 -61.337 1.00 40.20 C ATOM 1818 C HIS A 123 21.459 24.932 -61.368 1.00 14.21 C ATOM 1819 O HIS A 123 20.720 24.153 -60.762 1.00 55.44 O ATOM 1820 CB HIS A 123 20.601 26.888 -62.674 1.00 64.15 C ATOM 1821 CG HIS A 123 19.246 26.295 -62.974 1.00 33.35 C ATOM 1822 ND1 HIS A 123 18.069 26.983 -62.771 1.00 51.31 N ATOM 1823 CD2 HIS A 123 18.888 25.085 -63.473 1.00 23.32 C ATOM 1824 CE1 HIS A 123 17.048 26.224 -63.128 1.00 62.03 C ATOM 1825 NE2 HIS A 123 17.517 25.071 -63.559 1.00 11.12 N ATOM 0 H HIS A 123 22.945 27.467 -61.895 1.00 41.22 H new ATOM 0 HA HIS A 123 20.500 26.653 -60.537 1.00 40.20 H new ATOM 0 HB2 HIS A 123 20.517 27.975 -62.671 1.00 64.15 H new ATOM 0 HB3 HIS A 123 21.287 26.624 -63.479 1.00 64.15 H new ATOM 0 HD2 HIS A 123 19.556 24.283 -63.751 1.00 23.32 H new ATOM 0 HE1 HIS A 123 16.006 26.502 -63.075 1.00 62.03 H new ATOM 0 HE2 HIS A 123 16.953 24.293 -63.901 1.00 11.12 H new ATOM 1834 N HIS A 124 22.499 24.534 -62.082 1.00 75.21 N ATOM 1835 CA HIS A 124 22.808 23.124 -62.260 1.00 61.31 C ATOM 1836 C HIS A 124 24.055 22.743 -61.477 1.00 45.43 C ATOM 1837 O HIS A 124 25.169 23.096 -61.860 1.00 72.22 O ATOM 1838 CB HIS A 124 23.002 22.815 -63.748 1.00 55.11 C ATOM 1839 CG HIS A 124 23.200 21.359 -64.054 1.00 30.43 C ATOM 1840 ND1 HIS A 124 22.155 20.474 -64.167 1.00 72.32 N ATOM 1841 CD2 HIS A 124 24.325 20.640 -64.282 1.00 11.23 C ATOM 1842 CE1 HIS A 124 22.622 19.276 -64.455 1.00 60.11 C ATOM 1843 NE2 HIS A 124 23.938 19.346 -64.533 1.00 42.31 N ATOM 0 H HIS A 124 23.146 25.169 -62.549 1.00 75.21 H new ATOM 0 HA HIS A 124 21.973 22.536 -61.880 1.00 61.31 H new ATOM 0 HB2 HIS A 124 22.133 23.175 -64.299 1.00 55.11 H new ATOM 0 HB3 HIS A 124 23.865 23.372 -64.114 1.00 55.11 H new ATOM 0 HD2 HIS A 124 25.338 21.014 -64.269 1.00 11.23 H new ATOM 0 HE1 HIS A 124 22.028 18.386 -64.602 1.00 60.11 H new ATOM 0 HE2 HIS A 124 24.563 18.569 -64.744 1.00 42.31 H new ATOM 1852 N HIS A 125 23.863 22.033 -60.376 1.00 33.11 N ATOM 1853 CA HIS A 125 24.983 21.532 -59.594 1.00 42.42 C ATOM 1854 C HIS A 125 25.393 20.158 -60.111 1.00 12.25 C ATOM 1855 O HIS A 125 26.569 19.890 -60.332 1.00 65.23 O ATOM 1856 CB HIS A 125 24.613 21.458 -58.107 1.00 11.44 C ATOM 1857 CG HIS A 125 25.736 21.013 -57.213 1.00 60.43 C ATOM 1858 ND1 HIS A 125 26.478 21.884 -56.447 1.00 71.41 N ATOM 1859 CD2 HIS A 125 26.235 19.779 -56.961 1.00 3.32 C ATOM 1860 CE1 HIS A 125 27.385 21.207 -55.766 1.00 54.41 C ATOM 1861 NE2 HIS A 125 27.256 19.928 -56.062 1.00 54.24 N ATOM 0 H HIS A 125 22.944 21.791 -60.004 1.00 33.11 H new ATOM 0 HA HIS A 125 25.824 22.218 -59.699 1.00 42.42 H new ATOM 0 HB2 HIS A 125 24.271 22.440 -57.780 1.00 11.44 H new ATOM 0 HB3 HIS A 125 23.774 20.772 -57.987 1.00 11.44 H new ATOM 0 HD2 HIS A 125 25.891 18.850 -57.390 1.00 3.32 H new ATOM 0 HE1 HIS A 125 28.108 21.628 -55.084 1.00 54.41 H new ATOM 0 HE2 HIS A 125 27.825 19.172 -55.682 1.00 54.24 H new ATOM 1870 N HIS A 126 24.408 19.293 -60.298 1.00 22.41 N ATOM 1871 CA HIS A 126 24.636 17.957 -60.827 1.00 73.13 C ATOM 1872 C HIS A 126 23.307 17.366 -61.262 1.00 14.44 C ATOM 1873 O HIS A 126 22.298 17.570 -60.593 1.00 61.23 O ATOM 1874 CB HIS A 126 25.283 17.059 -59.764 1.00 23.41 C ATOM 1875 CG HIS A 126 25.825 15.765 -60.295 1.00 43.53 C ATOM 1876 ND1 HIS A 126 25.034 14.678 -60.607 1.00 63.22 N ATOM 1877 CD2 HIS A 126 27.096 15.388 -60.568 1.00 54.42 C ATOM 1878 CE1 HIS A 126 25.795 13.693 -61.040 1.00 42.22 C ATOM 1879 NE2 HIS A 126 27.049 14.096 -61.027 1.00 15.42 N ATOM 0 H HIS A 126 23.431 19.496 -60.088 1.00 22.41 H new ATOM 0 HA HIS A 126 25.312 18.019 -61.680 1.00 73.13 H new ATOM 0 HB2 HIS A 126 26.093 17.609 -59.285 1.00 23.41 H new ATOM 0 HB3 HIS A 126 24.545 16.841 -58.992 1.00 23.41 H new ATOM 0 HD1 HIS A 126 24.019 14.642 -60.517 1.00 63.22 H new ATOM 0 HD2 HIS A 126 27.983 15.992 -60.447 1.00 54.42 H new ATOM 0 HE1 HIS A 126 25.449 12.719 -61.353 1.00 42.22 H new ATOM 1888 N HIS A 127 23.297 16.648 -62.374 1.00 12.35 N ATOM 1889 CA HIS A 127 22.063 16.038 -62.848 1.00 31.34 C ATOM 1890 C HIS A 127 21.678 14.880 -61.940 1.00 12.31 C ATOM 1891 O HIS A 127 20.561 14.905 -61.395 1.00 54.42 O ATOM 1892 CB HIS A 127 22.154 15.591 -64.320 1.00 12.42 C ATOM 1893 CG HIS A 127 23.082 14.439 -64.601 1.00 22.42 C ATOM 1894 ND1 HIS A 127 24.405 14.604 -64.938 1.00 5.05 N ATOM 1895 CD2 HIS A 127 22.852 13.104 -64.653 1.00 4.12 C ATOM 1896 CE1 HIS A 127 24.947 13.426 -65.180 1.00 42.13 C ATOM 1897 NE2 HIS A 127 24.028 12.495 -65.019 1.00 54.43 N ATOM 1898 OXT HIS A 127 22.525 13.990 -61.725 1.00 0.00 O1- ATOM 0 H HIS A 127 24.115 16.474 -62.958 1.00 12.35 H new ATOM 0 HA HIS A 127 21.280 16.795 -62.809 1.00 31.34 H new ATOM 0 HB2 HIS A 127 21.155 15.318 -64.659 1.00 12.42 H new ATOM 0 HB3 HIS A 127 22.473 16.444 -64.920 1.00 12.42 H new ATOM 0 HD2 HIS A 127 21.915 12.609 -64.445 1.00 4.12 H new ATOM 0 HE1 HIS A 127 25.975 13.253 -65.463 1.00 42.13 H new ATOM 0 HE2 HIS A 127 24.166 11.492 -65.145 1.00 54.43 H new TER 1907 HIS A 127