USER MOD reduce.3.24.130724 H: found=0, std=0, add=1051, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1050 hydrogens (6 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 NoAdj-H: A 15 TPO H2 : A 15 TPO N : A 14 THR C :(H bumps) USER MOD NoAdj-H: A 15 TPO H : A 15 TPO N : A 14 THR C :(H bumps) USER MOD Set 1.1: A 5 ASN : amide:sc= 1.11 K(o=1.9,f=-0.25) USER MOD Set 1.2: A 95 ASN : amide:sc= 0.756 K(o=1.9,f=-0.36) USER MOD Set 2.1: A 89 HIS : no HE2:sc= -0.861 K(o=-0.32,f=-5.7) USER MOD Set 2.2: A 110 THR OG1 : rot -0:sc= 0.541 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= 1.29 (180deg=0.995) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 ASN : amide:sc= 0 X(o=0,f=-0.0076) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 11 GLN : amide:sc= -0.596 X(o=-0.6,f=-0.29) USER MOD Single : A 14 THR OG1 : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 MET CE :methyl 146:sc= -0.162 (180deg=-0.795) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 SER OG : rot -77:sc= 0.873 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 SER OG : rot -136:sc= 1.27 USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 ASN : amide:sc= -0.143 K(o=-0.14,f=-1.7!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 ASN : amide:sc= -2.6! C(o=-2.6!,f=-5.1!) USER MOD Single : A 65 GLN : amide:sc= -1.9! C(o=-1.9!,f=-3.7!) USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot -170:sc= 0 USER MOD Single : A 69 THR OG1 : rot -164:sc= -1.42! USER MOD Single : A 73 HIS : no HD1:sc= -3.95! C(o=-3.9!,f=-3.5!) USER MOD Single : A 76 SER OG : rot -69:sc= 0.458 USER MOD Single : A 84 THR OG1 : rot -112:sc= 0.154 USER MOD Single : A 86 SER OG : rot 154:sc= 0.222 USER MOD Single : A 106 SER OG : rot 43:sc= 1.09 USER MOD Single : A 108 ASN : amide:sc= 0.574 X(o=0.57,f=0.15) USER MOD Single : A 111 TYR OH : rot -30:sc= -0.223 USER MOD Single : A 113 ASN : amide:sc= -0.345 K(o=-0.35,f=-5.3!) USER MOD Single : A 118 ASN : amide:sc= -0.561 X(o=-0.56,f=-0.53) USER MOD Single : A 120 GLN : amide:sc= 0.046 K(o=0.046,f=-0.95) USER MOD Single : A 122 MET CE :methyl 170:sc= -1.51 (180deg=-1.6) USER MOD Single : A 123 GLN : amide:sc= 1.01 K(o=1,f=-6.3!) USER MOD Single : A 124 THR OG1 : rot -140:sc= 0 USER MOD Single : A 129 GLN : amide:sc= 0.714 K(o=0.71,f=-0.77) USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 9.983 -21.072 14.324 1.00 11.00 N ATOM 2 CA MET A 1 10.810 -19.913 14.617 1.00 43.05 C ATOM 3 C MET A 1 10.056 -18.872 15.394 1.00 1.01 C ATOM 4 O MET A 1 8.888 -18.588 15.122 1.00 32.44 O ATOM 5 CB MET A 1 11.408 -19.296 13.356 1.00 23.11 C ATOM 6 CG MET A 1 12.597 -20.039 12.792 1.00 65.33 C ATOM 7 SD MET A 1 12.222 -21.717 12.295 1.00 32.55 S ATOM 8 CE MET A 1 13.855 -22.260 11.817 1.00 65.13 C ATOM 0 H1 MET A 1 10.454 -21.663 13.610 1.00 11.00 H new ATOM 0 H2 MET A 1 9.841 -21.626 15.193 1.00 11.00 H new ATOM 0 H3 MET A 1 9.061 -20.757 13.959 1.00 11.00 H new ATOM 0 HA MET A 1 11.631 -20.276 15.235 1.00 43.05 H new ATOM 0 HB2 MET A 1 10.633 -19.244 12.591 1.00 23.11 H new ATOM 0 HB3 MET A 1 11.708 -18.272 13.576 1.00 23.11 H new ATOM 0 HG2 MET A 1 12.983 -19.492 11.932 1.00 65.33 H new ATOM 0 HG3 MET A 1 13.390 -20.059 13.539 1.00 65.33 H new ATOM 0 HE1 MET A 1 13.809 -23.295 11.477 1.00 65.13 H new ATOM 0 HE2 MET A 1 14.227 -21.629 11.010 1.00 65.13 H new ATOM 0 HE3 MET A 1 14.527 -22.188 12.672 1.00 65.13 H new ATOM 20 N SER A 2 10.715 -18.335 16.374 1.00 21.34 N ATOM 21 CA SER A 2 10.209 -17.285 17.186 1.00 13.43 C ATOM 22 C SER A 2 11.359 -16.313 17.447 1.00 2.52 C ATOM 23 O SER A 2 12.115 -16.472 18.400 1.00 64.23 O ATOM 24 CB SER A 2 9.652 -17.840 18.505 1.00 71.44 C ATOM 25 OG SER A 2 8.693 -18.886 18.262 1.00 24.24 O ATOM 0 H SER A 2 11.655 -18.631 16.636 1.00 21.34 H new ATOM 0 HA SER A 2 9.389 -16.774 16.682 1.00 13.43 H new ATOM 0 HB2 SER A 2 10.469 -18.226 19.115 1.00 71.44 H new ATOM 0 HB3 SER A 2 9.183 -17.036 19.072 1.00 71.44 H new ATOM 0 HG SER A 2 8.354 -19.224 19.117 1.00 24.24 H new ATOM 31 N ASP A 3 11.560 -15.401 16.526 1.00 24.54 N ATOM 32 CA ASP A 3 12.607 -14.394 16.650 1.00 24.22 C ATOM 33 C ASP A 3 12.011 -13.131 17.215 1.00 4.11 C ATOM 34 O ASP A 3 10.805 -12.889 17.059 1.00 31.42 O ATOM 35 CB ASP A 3 13.297 -14.108 15.290 1.00 34.41 C ATOM 36 CG ASP A 3 14.293 -15.181 14.852 1.00 34.34 C ATOM 37 OD1 ASP A 3 13.888 -16.210 14.239 1.00 53.12 O ATOM 38 OD2 ASP A 3 15.514 -15.003 15.101 1.00 3.20 O ATOM 0 H ASP A 3 11.010 -15.329 15.670 1.00 24.54 H new ATOM 0 HA ASP A 3 13.375 -14.775 17.323 1.00 24.22 H new ATOM 0 HB2 ASP A 3 12.531 -14.005 14.522 1.00 34.41 H new ATOM 0 HB3 ASP A 3 13.816 -13.151 15.353 1.00 34.41 H new ATOM 43 N ASN A 4 12.802 -12.345 17.893 1.00 55.01 N ATOM 44 CA ASN A 4 12.306 -11.116 18.485 1.00 50.21 C ATOM 45 C ASN A 4 12.887 -9.898 17.814 1.00 51.42 C ATOM 46 O ASN A 4 14.097 -9.807 17.589 1.00 63.13 O ATOM 47 CB ASN A 4 12.562 -11.068 20.008 1.00 24.24 C ATOM 48 CG ASN A 4 12.175 -9.725 20.649 1.00 2.04 C ATOM 49 OD1 ASN A 4 13.008 -8.817 20.774 1.00 33.43 O ATOM 50 ND2 ASN A 4 10.932 -9.583 21.047 1.00 13.02 N ATOM 0 H ASN A 4 13.793 -12.526 18.054 1.00 55.01 H new ATOM 0 HA ASN A 4 11.228 -11.107 18.325 1.00 50.21 H new ATOM 0 HB2 ASN A 4 11.999 -11.868 20.489 1.00 24.24 H new ATOM 0 HB3 ASN A 4 13.618 -11.262 20.198 1.00 24.24 H new ATOM 0 HD21 ASN A 4 10.630 -8.707 21.472 1.00 13.02 H new ATOM 0 HD22 ASN A 4 10.269 -10.349 20.931 1.00 13.02 H new ATOM 57 N ASN A 5 12.022 -8.993 17.469 1.00 64.13 N ATOM 58 CA ASN A 5 12.375 -7.707 16.913 1.00 31.41 C ATOM 59 C ASN A 5 11.276 -6.789 17.357 1.00 43.04 C ATOM 60 O ASN A 5 10.166 -7.271 17.627 1.00 71.33 O ATOM 61 CB ASN A 5 12.472 -7.740 15.361 1.00 14.22 C ATOM 62 CG ASN A 5 11.134 -7.707 14.642 1.00 3.42 C ATOM 63 OD1 ASN A 5 10.638 -6.644 14.286 1.00 30.52 O ATOM 64 ND2 ASN A 5 10.555 -8.848 14.400 1.00 4.01 N ATOM 0 H ASN A 5 11.016 -9.127 17.567 1.00 64.13 H new ATOM 0 HA ASN A 5 13.359 -7.385 17.254 1.00 31.41 H new ATOM 0 HB2 ASN A 5 13.069 -6.890 15.029 1.00 14.22 H new ATOM 0 HB3 ASN A 5 13.008 -8.641 15.063 1.00 14.22 H new ATOM 0 HD21 ASN A 5 9.665 -8.873 13.902 1.00 4.01 H new ATOM 0 HD22 ASN A 5 10.991 -9.717 14.708 1.00 4.01 H new ATOM 71 N GLY A 6 11.535 -5.533 17.466 1.00 43.12 N ATOM 72 CA GLY A 6 10.525 -4.664 17.967 1.00 74.35 C ATOM 73 C GLY A 6 10.370 -3.423 17.159 1.00 71.41 C ATOM 74 O GLY A 6 10.003 -3.475 15.987 1.00 5.33 O ATOM 0 H GLY A 6 12.420 -5.089 17.221 1.00 43.12 H new ATOM 0 HA2 GLY A 6 9.574 -5.197 17.990 1.00 74.35 H new ATOM 0 HA3 GLY A 6 10.764 -4.394 18.996 1.00 74.35 H new ATOM 78 N THR A 7 10.684 -2.327 17.765 1.00 13.30 N ATOM 79 CA THR A 7 10.489 -1.040 17.179 1.00 20.52 C ATOM 80 C THR A 7 11.625 -0.695 16.211 1.00 40.34 C ATOM 81 O THR A 7 12.817 -0.900 16.533 1.00 61.03 O ATOM 82 CB THR A 7 10.452 0.013 18.305 1.00 70.13 C ATOM 83 OG1 THR A 7 9.560 -0.439 19.334 1.00 61.13 O ATOM 84 CG2 THR A 7 9.968 1.361 17.793 1.00 24.34 C ATOM 0 H THR A 7 11.091 -2.299 18.700 1.00 13.30 H new ATOM 0 HA THR A 7 9.553 -1.047 16.621 1.00 20.52 H new ATOM 0 HB THR A 7 11.464 0.136 18.691 1.00 70.13 H new ATOM 0 HG1 THR A 7 9.531 0.223 20.056 1.00 61.13 H new ATOM 0 HG21 THR A 7 9.955 2.078 18.614 1.00 24.34 H new ATOM 0 HG22 THR A 7 10.640 1.716 17.011 1.00 24.34 H new ATOM 0 HG23 THR A 7 8.962 1.256 17.387 1.00 24.34 H new ATOM 92 N PRO A 8 11.282 -0.227 14.991 1.00 3.42 N ATOM 93 CA PRO A 8 12.263 0.336 14.076 1.00 3.11 C ATOM 94 C PRO A 8 12.931 1.522 14.766 1.00 71.10 C ATOM 95 O PRO A 8 12.278 2.238 15.534 1.00 62.42 O ATOM 96 CB PRO A 8 11.418 0.818 12.888 1.00 23.24 C ATOM 97 CG PRO A 8 10.191 -0.018 12.945 1.00 13.54 C ATOM 98 CD PRO A 8 9.925 -0.245 14.403 1.00 1.44 C ATOM 0 HA PRO A 8 13.043 -0.362 13.771 1.00 3.11 H new ATOM 0 HB2 PRO A 8 11.181 1.878 12.973 1.00 23.24 H new ATOM 0 HB3 PRO A 8 11.947 0.684 11.944 1.00 23.24 H new ATOM 0 HG2 PRO A 8 9.351 0.486 12.467 1.00 13.54 H new ATOM 0 HG3 PRO A 8 10.336 -0.963 12.421 1.00 13.54 H new ATOM 0 HD2 PRO A 8 9.291 0.535 14.825 1.00 1.44 H new ATOM 0 HD3 PRO A 8 9.421 -1.195 14.579 1.00 1.44 H new ATOM 106 N GLU A 9 14.188 1.739 14.507 1.00 13.35 N ATOM 107 CA GLU A 9 14.907 2.750 15.219 1.00 43.50 C ATOM 108 C GLU A 9 14.589 4.132 14.661 1.00 33.52 C ATOM 109 O GLU A 9 14.668 4.353 13.442 1.00 75.15 O ATOM 110 CB GLU A 9 16.414 2.450 15.225 1.00 51.22 C ATOM 111 CG GLU A 9 17.072 2.415 13.861 1.00 50.31 C ATOM 112 CD GLU A 9 18.488 1.927 13.923 1.00 14.14 C ATOM 113 OE1 GLU A 9 19.369 2.668 14.370 1.00 43.52 O ATOM 114 OE2 GLU A 9 18.731 0.769 13.535 1.00 31.14 O ATOM 0 H GLU A 9 14.733 1.231 13.810 1.00 13.35 H new ATOM 0 HA GLU A 9 14.581 2.744 16.259 1.00 43.50 H new ATOM 0 HB2 GLU A 9 16.915 3.203 15.833 1.00 51.22 H new ATOM 0 HB3 GLU A 9 16.574 1.488 15.712 1.00 51.22 H new ATOM 0 HG2 GLU A 9 16.496 1.768 13.199 1.00 50.31 H new ATOM 0 HG3 GLU A 9 17.053 3.414 13.426 1.00 50.31 H new ATOM 121 N PRO A 10 14.124 5.049 15.531 1.00 24.40 N ATOM 122 CA PRO A 10 13.820 6.424 15.152 1.00 60.02 C ATOM 123 C PRO A 10 15.061 7.129 14.634 1.00 44.04 C ATOM 124 O PRO A 10 15.980 7.447 15.395 1.00 54.05 O ATOM 125 CB PRO A 10 13.345 7.087 16.454 1.00 41.41 C ATOM 126 CG PRO A 10 12.992 5.966 17.367 1.00 14.12 C ATOM 127 CD PRO A 10 13.834 4.793 16.954 1.00 50.11 C ATOM 0 HA PRO A 10 13.076 6.473 14.357 1.00 60.02 H new ATOM 0 HB2 PRO A 10 14.128 7.712 16.884 1.00 41.41 H new ATOM 0 HB3 PRO A 10 12.485 7.732 16.274 1.00 41.41 H new ATOM 0 HG2 PRO A 10 13.187 6.236 18.405 1.00 14.12 H new ATOM 0 HG3 PRO A 10 11.931 5.726 17.294 1.00 14.12 H new ATOM 0 HD2 PRO A 10 14.749 4.731 17.543 1.00 50.11 H new ATOM 0 HD3 PRO A 10 13.302 3.851 17.090 1.00 50.11 H new ATOM 135 N GLN A 11 15.129 7.290 13.350 1.00 5.30 N ATOM 136 CA GLN A 11 16.232 7.968 12.736 1.00 1.53 C ATOM 137 C GLN A 11 15.806 9.376 12.424 1.00 31.34 C ATOM 138 O GLN A 11 14.608 9.643 12.254 1.00 11.23 O ATOM 139 CB GLN A 11 16.690 7.219 11.482 1.00 65.53 C ATOM 140 CG GLN A 11 17.189 5.810 11.786 1.00 41.23 C ATOM 141 CD GLN A 11 17.555 5.013 10.555 1.00 31.51 C ATOM 142 OE1 GLN A 11 17.972 5.559 9.533 1.00 23.24 O ATOM 143 NE2 GLN A 11 17.397 3.716 10.634 1.00 13.51 N ATOM 0 H GLN A 11 14.422 6.956 12.695 1.00 5.30 H new ATOM 0 HA GLN A 11 17.086 7.998 13.413 1.00 1.53 H new ATOM 0 HB2 GLN A 11 15.862 7.162 10.775 1.00 65.53 H new ATOM 0 HB3 GLN A 11 17.485 7.785 10.996 1.00 65.53 H new ATOM 0 HG2 GLN A 11 18.061 5.876 12.437 1.00 41.23 H new ATOM 0 HG3 GLN A 11 16.418 5.273 12.339 1.00 41.23 H new ATOM 0 HE21 GLN A 11 17.049 3.296 11.496 1.00 13.51 H new ATOM 0 HE22 GLN A 11 17.622 3.125 9.833 1.00 13.51 H new ATOM 152 N VAL A 12 16.743 10.278 12.353 1.00 33.42 N ATOM 153 CA VAL A 12 16.399 11.653 12.149 1.00 14.51 C ATOM 154 C VAL A 12 16.774 12.089 10.749 1.00 50.35 C ATOM 155 O VAL A 12 17.864 11.792 10.250 1.00 34.00 O ATOM 156 CB VAL A 12 17.063 12.592 13.211 1.00 63.01 C ATOM 157 CG1 VAL A 12 16.646 14.049 13.013 1.00 62.21 C ATOM 158 CG2 VAL A 12 16.721 12.135 14.625 1.00 53.33 C ATOM 0 H VAL A 12 17.742 10.087 12.433 1.00 33.42 H new ATOM 0 HA VAL A 12 15.319 11.739 12.272 1.00 14.51 H new ATOM 0 HB VAL A 12 18.142 12.529 13.071 1.00 63.01 H new ATOM 0 HG11 VAL A 12 17.126 14.671 13.768 1.00 62.21 H new ATOM 0 HG12 VAL A 12 16.950 14.383 12.021 1.00 62.21 H new ATOM 0 HG13 VAL A 12 15.563 14.134 13.108 1.00 62.21 H new ATOM 0 HG21 VAL A 12 17.193 12.802 15.347 1.00 53.33 H new ATOM 0 HG22 VAL A 12 15.640 12.157 14.763 1.00 53.33 H new ATOM 0 HG23 VAL A 12 17.085 11.119 14.777 1.00 53.33 H new ATOM 168 N GLU A 13 15.831 12.717 10.124 1.00 23.53 N ATOM 169 CA GLU A 13 15.935 13.296 8.824 1.00 53.41 C ATOM 170 C GLU A 13 14.915 14.404 8.861 1.00 41.32 C ATOM 171 O GLU A 13 14.134 14.468 9.830 1.00 41.41 O ATOM 172 CB GLU A 13 15.581 12.257 7.737 1.00 64.34 C ATOM 173 CG GLU A 13 16.615 12.126 6.607 1.00 24.50 C ATOM 174 CD GLU A 13 16.709 13.322 5.674 1.00 71.34 C ATOM 175 OE1 GLU A 13 16.819 14.468 6.151 1.00 3.13 O ATOM 176 OE2 GLU A 13 16.716 13.122 4.428 1.00 64.04 O ATOM 0 H GLU A 13 14.907 12.847 10.536 1.00 23.53 H new ATOM 0 HA GLU A 13 16.939 13.648 8.586 1.00 53.41 H new ATOM 0 HB2 GLU A 13 15.458 11.284 8.212 1.00 64.34 H new ATOM 0 HB3 GLU A 13 14.618 12.523 7.300 1.00 64.34 H new ATOM 0 HG2 GLU A 13 17.595 11.954 7.051 1.00 24.50 H new ATOM 0 HG3 GLU A 13 16.374 11.242 6.016 1.00 24.50 H new ATOM 183 N THR A 14 14.906 15.271 7.902 1.00 31.10 N ATOM 184 CA THR A 14 13.954 16.338 7.918 1.00 53.51 C ATOM 185 C THR A 14 12.540 15.783 7.645 1.00 54.12 C ATOM 186 O THR A 14 12.217 15.325 6.557 1.00 4.32 O ATOM 187 CB THR A 14 14.345 17.420 6.905 1.00 0.53 C ATOM 188 OG1 THR A 14 15.699 17.817 7.171 1.00 30.34 O ATOM 189 CG2 THR A 14 13.433 18.642 7.009 1.00 52.20 C ATOM 0 H THR A 14 15.540 15.264 7.103 1.00 31.10 H new ATOM 0 HA THR A 14 13.949 16.802 8.904 1.00 53.51 H new ATOM 0 HB THR A 14 14.245 17.013 5.899 1.00 0.53 H new ATOM 0 HG1 THR A 14 15.969 18.509 6.531 1.00 30.34 H new ATOM 0 HG21 THR A 14 13.740 19.388 6.276 1.00 52.20 H new ATOM 0 HG22 THR A 14 12.403 18.345 6.815 1.00 52.20 H new ATOM 0 HG23 THR A 14 13.505 19.066 8.011 1.00 52.20 H new HETATM 197 N TPO A 15 11.746 15.787 8.659 1.00 32.21 N HETATM 198 CA TPO A 15 10.402 15.301 8.593 1.00 33.10 C HETATM 199 CB TPO A 15 10.219 14.032 9.472 1.00 53.14 C HETATM 200 CG2 TPO A 15 8.810 13.464 9.334 1.00 72.32 C HETATM 201 OG1 TPO A 15 11.130 12.992 9.033 1.00 51.14 O HETATM 202 P TPO A 15 11.798 11.855 9.987 1.00 75.31 P HETATM 203 O1P TPO A 15 12.587 12.493 11.129 1.00 15.31 O HETATM 204 O2P TPO A 15 12.775 11.006 9.185 1.00 72.30 O HETATM 205 O3P TPO A 15 10.700 10.967 10.567 1.00 74.11 O HETATM 206 C TPO A 15 9.489 16.390 9.081 1.00 55.24 C HETATM 207 O TPO A 15 9.615 16.845 10.213 1.00 31.50 O HETATM 0 HG23 TPO A 15 8.083 14.213 9.649 1.00 72.32 H new HETATM 0 HG22 TPO A 15 8.626 13.196 8.294 1.00 72.32 H new HETATM 0 HG21 TPO A 15 8.712 12.577 9.960 1.00 72.32 H new HETATM 0 HB TPO A 15 10.411 14.326 10.504 1.00 53.14 H new HETATM 0 HA TPO A 15 10.167 15.028 7.564 1.00 33.10 H new ATOM 214 N SER A 16 8.625 16.842 8.240 1.00 73.12 N ATOM 215 CA SER A 16 7.696 17.855 8.610 1.00 2.14 C ATOM 216 C SER A 16 6.303 17.298 8.493 1.00 12.23 C ATOM 217 O SER A 16 6.051 16.472 7.627 1.00 53.44 O ATOM 218 CB SER A 16 7.877 19.060 7.711 1.00 71.42 C ATOM 219 OG SER A 16 9.224 19.523 7.770 1.00 32.04 O ATOM 0 H SER A 16 8.541 16.520 7.276 1.00 73.12 H new ATOM 0 HA SER A 16 7.866 18.171 9.639 1.00 2.14 H new ATOM 0 HB2 SER A 16 7.620 18.798 6.685 1.00 71.42 H new ATOM 0 HB3 SER A 16 7.198 19.856 8.017 1.00 71.42 H new ATOM 0 HG SER A 16 9.328 20.301 7.183 1.00 32.04 H new ATOM 225 N VAL A 17 5.437 17.693 9.385 1.00 33.10 N ATOM 226 CA VAL A 17 4.072 17.238 9.356 1.00 71.40 C ATOM 227 C VAL A 17 3.285 18.107 8.384 1.00 21.55 C ATOM 228 O VAL A 17 3.277 19.343 8.494 1.00 24.54 O ATOM 229 CB VAL A 17 3.420 17.275 10.767 1.00 52.30 C ATOM 230 CG1 VAL A 17 1.993 16.747 10.726 1.00 45.12 C ATOM 231 CG2 VAL A 17 4.254 16.476 11.764 1.00 5.54 C ATOM 0 H VAL A 17 5.654 18.335 10.148 1.00 33.10 H new ATOM 0 HA VAL A 17 4.058 16.199 9.026 1.00 71.40 H new ATOM 0 HB VAL A 17 3.387 18.314 11.094 1.00 52.30 H new ATOM 0 HG11 VAL A 17 1.562 16.785 11.727 1.00 45.12 H new ATOM 0 HG12 VAL A 17 1.397 17.361 10.051 1.00 45.12 H new ATOM 0 HG13 VAL A 17 1.996 15.716 10.371 1.00 45.12 H new ATOM 0 HG21 VAL A 17 3.782 16.514 12.746 1.00 5.54 H new ATOM 0 HG22 VAL A 17 4.322 15.440 11.433 1.00 5.54 H new ATOM 0 HG23 VAL A 17 5.255 16.903 11.826 1.00 5.54 H new ATOM 241 N PHE A 18 2.668 17.472 7.445 1.00 70.22 N ATOM 242 CA PHE A 18 1.904 18.118 6.430 1.00 72.21 C ATOM 243 C PHE A 18 0.540 18.432 7.012 1.00 61.45 C ATOM 244 O PHE A 18 -0.281 17.536 7.252 1.00 12.14 O ATOM 245 CB PHE A 18 1.776 17.147 5.252 1.00 33.14 C ATOM 246 CG PHE A 18 1.254 17.713 3.972 1.00 54.43 C ATOM 247 CD1 PHE A 18 2.120 18.298 3.068 1.00 62.32 C ATOM 248 CD2 PHE A 18 -0.087 17.623 3.651 1.00 41.35 C ATOM 249 CE1 PHE A 18 1.659 18.788 1.871 1.00 61.42 C ATOM 250 CE2 PHE A 18 -0.557 18.117 2.454 1.00 50.25 C ATOM 251 CZ PHE A 18 0.316 18.697 1.564 1.00 54.55 C ATOM 0 H PHE A 18 2.682 16.456 7.360 1.00 70.22 H new ATOM 0 HA PHE A 18 2.373 19.040 6.087 1.00 72.21 H new ATOM 0 HB2 PHE A 18 2.758 16.715 5.058 1.00 33.14 H new ATOM 0 HB3 PHE A 18 1.122 16.329 5.554 1.00 33.14 H new ATOM 0 HD1 PHE A 18 3.171 18.371 3.306 1.00 62.32 H new ATOM 0 HD2 PHE A 18 -0.773 17.161 4.345 1.00 41.35 H new ATOM 0 HE1 PHE A 18 2.345 19.243 1.172 1.00 61.42 H new ATOM 0 HE2 PHE A 18 -1.608 18.049 2.215 1.00 50.25 H new ATOM 0 HZ PHE A 18 -0.049 19.082 0.623 1.00 54.55 H new ATOM 261 N ARG A 19 0.325 19.683 7.300 1.00 40.00 N ATOM 262 CA ARG A 19 -0.909 20.107 7.892 1.00 53.51 C ATOM 263 C ARG A 19 -1.912 20.442 6.820 1.00 61.21 C ATOM 264 O ARG A 19 -1.889 21.534 6.241 1.00 14.44 O ATOM 265 CB ARG A 19 -0.702 21.283 8.835 1.00 65.45 C ATOM 266 CG ARG A 19 0.162 20.970 10.051 1.00 44.42 C ATOM 267 CD ARG A 19 0.341 22.204 10.921 1.00 31.35 C ATOM 268 NE ARG A 19 1.060 23.271 10.211 1.00 11.04 N ATOM 269 CZ ARG A 19 0.528 24.436 9.806 1.00 42.32 C ATOM 270 NH1 ARG A 19 -0.740 24.739 10.080 1.00 51.00 N ATOM 271 NH2 ARG A 19 1.282 25.299 9.148 1.00 12.01 N ATOM 0 H ARG A 19 0.996 20.433 7.132 1.00 40.00 H new ATOM 0 HA ARG A 19 -1.300 19.282 8.488 1.00 53.51 H new ATOM 0 HB2 ARG A 19 -0.244 22.102 8.280 1.00 65.45 H new ATOM 0 HB3 ARG A 19 -1.675 21.635 9.177 1.00 65.45 H new ATOM 0 HG2 ARG A 19 -0.299 20.173 10.634 1.00 44.42 H new ATOM 0 HG3 ARG A 19 1.136 20.605 9.726 1.00 44.42 H new ATOM 0 HD2 ARG A 19 -0.636 22.571 11.237 1.00 31.35 H new ATOM 0 HD3 ARG A 19 0.888 21.936 11.825 1.00 31.35 H new ATOM 0 HE ARG A 19 2.047 23.114 10.008 1.00 11.04 H new ATOM 0 HH11 ARG A 19 -1.320 24.083 10.603 1.00 51.00 H new ATOM 0 HH12 ARG A 19 -1.131 25.627 9.766 1.00 51.00 H new ATOM 0 HH21 ARG A 19 2.258 25.078 8.952 1.00 12.01 H new ATOM 0 HH22 ARG A 19 0.888 26.186 8.836 1.00 12.01 H new ATOM 285 N ALA A 20 -2.734 19.490 6.520 1.00 42.43 N ATOM 286 CA ALA A 20 -3.759 19.640 5.532 1.00 34.25 C ATOM 287 C ALA A 20 -5.100 19.524 6.212 1.00 12.51 C ATOM 288 O ALA A 20 -5.200 18.920 7.267 1.00 65.12 O ATOM 289 CB ALA A 20 -3.603 18.572 4.477 1.00 71.24 C ATOM 0 H ALA A 20 -2.714 18.570 6.960 1.00 42.43 H new ATOM 0 HA ALA A 20 -3.683 20.614 5.048 1.00 34.25 H new ATOM 0 HB1 ALA A 20 -4.384 18.687 3.725 1.00 71.24 H new ATOM 0 HB2 ALA A 20 -2.626 18.668 4.003 1.00 71.24 H new ATOM 0 HB3 ALA A 20 -3.687 17.589 4.940 1.00 71.24 H new ATOM 295 N ASP A 21 -6.132 20.061 5.598 1.00 50.23 N ATOM 296 CA ASP A 21 -7.485 20.079 6.198 1.00 42.03 C ATOM 297 C ASP A 21 -8.202 18.723 6.050 1.00 30.53 C ATOM 298 O ASP A 21 -9.333 18.551 6.498 1.00 32.11 O ATOM 299 CB ASP A 21 -8.348 21.198 5.566 1.00 71.21 C ATOM 300 CG ASP A 21 -8.676 20.965 4.097 1.00 30.21 C ATOM 301 OD1 ASP A 21 -9.698 20.319 3.798 1.00 35.52 O ATOM 302 OD2 ASP A 21 -7.918 21.421 3.206 1.00 4.21 O ATOM 0 H ASP A 21 -6.078 20.498 4.678 1.00 50.23 H new ATOM 0 HA ASP A 21 -7.358 20.277 7.262 1.00 42.03 H new ATOM 0 HB2 ASP A 21 -9.278 21.287 6.127 1.00 71.21 H new ATOM 0 HB3 ASP A 21 -7.824 22.148 5.665 1.00 71.21 H new ATOM 307 N LEU A 22 -7.503 17.756 5.498 1.00 64.23 N ATOM 308 CA LEU A 22 -8.065 16.445 5.172 1.00 5.51 C ATOM 309 C LEU A 22 -8.493 15.614 6.392 1.00 44.21 C ATOM 310 O LEU A 22 -9.358 14.746 6.274 1.00 45.25 O ATOM 311 CB LEU A 22 -7.116 15.676 4.220 1.00 61.41 C ATOM 312 CG LEU A 22 -5.641 15.536 4.644 1.00 33.43 C ATOM 313 CD1 LEU A 22 -5.438 14.464 5.700 1.00 11.35 C ATOM 314 CD2 LEU A 22 -4.759 15.294 3.442 1.00 11.43 C ATOM 0 H LEU A 22 -6.516 17.850 5.256 1.00 64.23 H new ATOM 0 HA LEU A 22 -9.003 16.629 4.648 1.00 5.51 H new ATOM 0 HB2 LEU A 22 -7.521 14.674 4.078 1.00 61.41 H new ATOM 0 HB3 LEU A 22 -7.141 16.170 3.249 1.00 61.41 H new ATOM 0 HG LEU A 22 -5.349 16.481 5.102 1.00 33.43 H new ATOM 0 HD11 LEU A 22 -4.382 14.407 5.962 1.00 11.35 H new ATOM 0 HD12 LEU A 22 -6.020 14.713 6.588 1.00 11.35 H new ATOM 0 HD13 LEU A 22 -5.767 13.501 5.309 1.00 11.35 H new ATOM 0 HD21 LEU A 22 -3.722 15.198 3.765 1.00 11.43 H new ATOM 0 HD22 LEU A 22 -5.069 14.377 2.942 1.00 11.43 H new ATOM 0 HD23 LEU A 22 -4.848 16.132 2.751 1.00 11.43 H new ATOM 326 N LEU A 23 -7.921 15.899 7.557 1.00 62.43 N ATOM 327 CA LEU A 23 -8.243 15.160 8.765 1.00 1.02 C ATOM 328 C LEU A 23 -9.660 15.484 9.242 1.00 24.20 C ATOM 329 O LEU A 23 -10.338 14.647 9.836 1.00 74.11 O ATOM 330 CB LEU A 23 -7.212 15.428 9.893 1.00 32.33 C ATOM 331 CG LEU A 23 -7.252 16.789 10.647 1.00 14.24 C ATOM 332 CD1 LEU A 23 -6.252 16.776 11.789 1.00 3.43 C ATOM 333 CD2 LEU A 23 -6.956 17.968 9.731 1.00 54.10 C ATOM 0 H LEU A 23 -7.231 16.639 7.687 1.00 62.43 H new ATOM 0 HA LEU A 23 -8.195 14.099 8.519 1.00 1.02 H new ATOM 0 HB2 LEU A 23 -7.324 14.638 10.635 1.00 32.33 H new ATOM 0 HB3 LEU A 23 -6.217 15.321 9.461 1.00 32.33 H new ATOM 0 HG LEU A 23 -8.264 16.914 11.032 1.00 14.24 H new ATOM 0 HD11 LEU A 23 -6.285 17.731 12.313 1.00 3.43 H new ATOM 0 HD12 LEU A 23 -6.502 15.973 12.483 1.00 3.43 H new ATOM 0 HD13 LEU A 23 -5.250 16.614 11.393 1.00 3.43 H new ATOM 0 HD21 LEU A 23 -6.996 18.894 10.305 1.00 54.10 H new ATOM 0 HD22 LEU A 23 -5.962 17.852 9.298 1.00 54.10 H new ATOM 0 HD23 LEU A 23 -7.697 18.004 8.933 1.00 54.10 H new ATOM 345 N LYS A 24 -10.122 16.679 8.900 1.00 51.01 N ATOM 346 CA LYS A 24 -11.429 17.158 9.320 1.00 14.34 C ATOM 347 C LYS A 24 -12.537 16.344 8.681 1.00 14.33 C ATOM 348 O LYS A 24 -13.593 16.160 9.277 1.00 14.13 O ATOM 349 CB LYS A 24 -11.618 18.621 8.939 1.00 50.12 C ATOM 350 CG LYS A 24 -10.644 19.594 9.584 1.00 3.22 C ATOM 351 CD LYS A 24 -10.865 21.012 9.063 1.00 74.13 C ATOM 352 CE LYS A 24 -12.252 21.545 9.411 1.00 34.01 C ATOM 353 NZ LYS A 24 -12.520 22.854 8.778 1.00 14.01 N ATOM 0 H LYS A 24 -9.602 17.341 8.325 1.00 51.01 H new ATOM 0 HA LYS A 24 -11.479 17.052 10.404 1.00 14.34 H new ATOM 0 HB2 LYS A 24 -11.531 18.711 7.856 1.00 50.12 H new ATOM 0 HB3 LYS A 24 -12.632 18.920 9.204 1.00 50.12 H new ATOM 0 HG2 LYS A 24 -10.769 19.576 10.667 1.00 3.22 H new ATOM 0 HG3 LYS A 24 -9.621 19.281 9.377 1.00 3.22 H new ATOM 0 HD2 LYS A 24 -10.108 21.674 9.483 1.00 74.13 H new ATOM 0 HD3 LYS A 24 -10.734 21.024 7.981 1.00 74.13 H new ATOM 0 HE2 LYS A 24 -13.007 20.827 9.091 1.00 34.01 H new ATOM 0 HE3 LYS A 24 -12.342 21.641 10.493 1.00 34.01 H new ATOM 0 HZ1 LYS A 24 -13.472 23.178 9.041 1.00 14.01 H new ATOM 0 HZ2 LYS A 24 -11.816 23.547 9.103 1.00 14.01 H new ATOM 0 HZ3 LYS A 24 -12.460 22.758 7.744 1.00 14.01 H new ATOM 367 N GLU A 25 -12.266 15.822 7.494 1.00 13.24 N ATOM 368 CA GLU A 25 -13.252 15.100 6.710 1.00 32.13 C ATOM 369 C GLU A 25 -13.715 13.825 7.417 1.00 23.23 C ATOM 370 O GLU A 25 -14.922 13.606 7.590 1.00 25.14 O ATOM 371 CB GLU A 25 -12.688 14.793 5.318 1.00 50.21 C ATOM 372 CG GLU A 25 -13.659 14.107 4.371 1.00 11.14 C ATOM 373 CD GLU A 25 -13.093 13.966 2.987 1.00 50.43 C ATOM 374 OE1 GLU A 25 -12.390 12.967 2.706 1.00 43.51 O ATOM 375 OE2 GLU A 25 -13.309 14.868 2.150 1.00 75.24 O ATOM 0 H GLU A 25 -11.351 15.889 7.047 1.00 13.24 H new ATOM 0 HA GLU A 25 -14.132 15.734 6.599 1.00 32.13 H new ATOM 0 HB2 GLU A 25 -12.357 15.726 4.862 1.00 50.21 H new ATOM 0 HB3 GLU A 25 -11.806 14.162 5.430 1.00 50.21 H new ATOM 0 HG2 GLU A 25 -13.910 13.121 4.762 1.00 11.14 H new ATOM 0 HG3 GLU A 25 -14.586 14.678 4.327 1.00 11.14 H new ATOM 382 N MET A 26 -12.768 13.025 7.897 1.00 11.32 N ATOM 383 CA MET A 26 -13.114 11.757 8.552 1.00 43.45 C ATOM 384 C MET A 26 -13.628 11.999 9.966 1.00 20.31 C ATOM 385 O MET A 26 -14.294 11.151 10.558 1.00 70.02 O ATOM 386 CB MET A 26 -11.937 10.738 8.513 1.00 45.30 C ATOM 387 CG MET A 26 -10.672 11.100 9.316 1.00 12.11 C ATOM 388 SD MET A 26 -10.837 10.883 11.116 1.00 73.31 S ATOM 389 CE MET A 26 -11.123 9.108 11.224 1.00 5.34 C ATOM 0 H MET A 26 -11.769 13.223 7.849 1.00 11.32 H new ATOM 0 HA MET A 26 -13.925 11.301 7.985 1.00 43.45 H new ATOM 0 HB2 MET A 26 -12.307 9.779 8.877 1.00 45.30 H new ATOM 0 HB3 MET A 26 -11.648 10.594 7.472 1.00 45.30 H new ATOM 0 HG2 MET A 26 -9.844 10.486 8.963 1.00 12.11 H new ATOM 0 HG3 MET A 26 -10.410 12.138 9.110 1.00 12.11 H new ATOM 0 HE1 MET A 26 -10.667 8.721 12.135 1.00 5.34 H new ATOM 0 HE2 MET A 26 -12.195 8.913 11.244 1.00 5.34 H new ATOM 0 HE3 MET A 26 -10.680 8.615 10.359 1.00 5.34 H new ATOM 399 N GLU A 27 -13.335 13.178 10.483 1.00 43.33 N ATOM 400 CA GLU A 27 -13.774 13.578 11.800 1.00 64.21 C ATOM 401 C GLU A 27 -15.224 14.072 11.691 1.00 22.12 C ATOM 402 O GLU A 27 -16.041 13.832 12.567 1.00 45.44 O ATOM 403 CB GLU A 27 -12.799 14.667 12.326 1.00 53.34 C ATOM 404 CG GLU A 27 -12.869 15.025 13.823 1.00 14.22 C ATOM 405 CD GLU A 27 -14.074 15.835 14.231 1.00 2.15 C ATOM 406 OE1 GLU A 27 -14.256 16.950 13.690 1.00 50.44 O ATOM 407 OE2 GLU A 27 -14.816 15.405 15.154 1.00 30.14 O ATOM 0 H GLU A 27 -12.784 13.885 9.997 1.00 43.33 H new ATOM 0 HA GLU A 27 -13.760 12.753 12.512 1.00 64.21 H new ATOM 0 HB2 GLU A 27 -11.782 14.342 12.106 1.00 53.34 H new ATOM 0 HB3 GLU A 27 -12.973 15.578 11.754 1.00 53.34 H new ATOM 0 HG2 GLU A 27 -12.858 14.102 14.402 1.00 14.22 H new ATOM 0 HG3 GLU A 27 -11.970 15.580 14.090 1.00 14.22 H new ATOM 414 N SER A 28 -15.540 14.699 10.569 1.00 0.42 N ATOM 415 CA SER A 28 -16.865 15.221 10.325 1.00 13.33 C ATOM 416 C SER A 28 -17.842 14.077 10.057 1.00 34.32 C ATOM 417 O SER A 28 -18.934 14.037 10.622 1.00 12.02 O ATOM 418 CB SER A 28 -16.839 16.198 9.125 1.00 2.43 C ATOM 419 OG SER A 28 -18.079 16.879 8.967 1.00 21.02 O ATOM 0 H SER A 28 -14.882 14.858 9.806 1.00 0.42 H new ATOM 0 HA SER A 28 -17.198 15.763 11.210 1.00 13.33 H new ATOM 0 HB2 SER A 28 -16.041 16.926 9.267 1.00 2.43 H new ATOM 0 HB3 SER A 28 -16.609 15.647 8.213 1.00 2.43 H new ATOM 0 HG SER A 28 -18.023 17.487 8.201 1.00 21.02 H new ATOM 425 N SER A 29 -17.428 13.139 9.231 1.00 23.21 N ATOM 426 CA SER A 29 -18.272 12.030 8.846 1.00 33.35 C ATOM 427 C SER A 29 -18.293 10.929 9.910 1.00 53.23 C ATOM 428 O SER A 29 -19.189 10.079 9.919 1.00 73.42 O ATOM 429 CB SER A 29 -17.798 11.496 7.504 1.00 65.34 C ATOM 430 OG SER A 29 -16.382 11.333 7.508 1.00 13.43 O ATOM 0 H SER A 29 -16.499 13.125 8.809 1.00 23.21 H new ATOM 0 HA SER A 29 -19.299 12.383 8.755 1.00 33.35 H new ATOM 0 HB2 SER A 29 -18.280 10.541 7.294 1.00 65.34 H new ATOM 0 HB3 SER A 29 -18.090 12.182 6.709 1.00 65.34 H new ATOM 0 HG SER A 29 -15.952 12.208 7.409 1.00 13.43 H new ATOM 436 N THR A 30 -17.308 10.974 10.799 1.00 62.22 N ATOM 437 CA THR A 30 -17.136 10.007 11.863 1.00 53.24 C ATOM 438 C THR A 30 -16.776 8.636 11.280 1.00 25.40 C ATOM 439 O THR A 30 -17.619 7.720 11.168 1.00 23.24 O ATOM 440 CB THR A 30 -18.365 9.952 12.810 1.00 32.45 C ATOM 441 OG1 THR A 30 -18.707 11.306 13.190 1.00 34.32 O ATOM 442 CG2 THR A 30 -18.048 9.158 14.072 1.00 73.31 C ATOM 0 H THR A 30 -16.594 11.702 10.795 1.00 62.22 H new ATOM 0 HA THR A 30 -16.302 10.330 12.486 1.00 53.24 H new ATOM 0 HB THR A 30 -19.190 9.465 12.290 1.00 32.45 H new ATOM 0 HG1 THR A 30 -19.483 11.292 13.788 1.00 34.32 H new ATOM 0 HG21 THR A 30 -18.926 9.135 14.718 1.00 73.31 H new ATOM 0 HG22 THR A 30 -17.770 8.139 13.801 1.00 73.31 H new ATOM 0 HG23 THR A 30 -17.221 9.631 14.601 1.00 73.31 H new ATOM 450 N GLY A 31 -15.534 8.559 10.830 1.00 71.25 N ATOM 451 CA GLY A 31 -14.998 7.385 10.181 1.00 55.53 C ATOM 452 C GLY A 31 -15.115 6.125 11.002 1.00 64.44 C ATOM 453 O GLY A 31 -14.657 6.072 12.158 1.00 64.25 O ATOM 0 H GLY A 31 -14.864 9.324 10.909 1.00 71.25 H new ATOM 0 HA2 GLY A 31 -15.515 7.238 9.233 1.00 55.53 H new ATOM 0 HA3 GLY A 31 -13.948 7.559 9.948 1.00 55.53 H new ATOM 457 N THR A 32 -15.732 5.127 10.420 1.00 73.41 N ATOM 458 CA THR A 32 -15.919 3.867 11.069 1.00 35.53 C ATOM 459 C THR A 32 -14.794 2.922 10.670 1.00 30.10 C ATOM 460 O THR A 32 -14.369 2.894 9.501 1.00 43.15 O ATOM 461 CB THR A 32 -17.319 3.239 10.734 1.00 70.33 C ATOM 462 OG1 THR A 32 -17.482 1.987 11.401 1.00 31.43 O ATOM 463 CG2 THR A 32 -17.516 3.035 9.234 1.00 24.53 C ATOM 0 H THR A 32 -16.118 5.173 9.477 1.00 73.41 H new ATOM 0 HA THR A 32 -15.894 4.028 12.147 1.00 35.53 H new ATOM 0 HB THR A 32 -18.070 3.947 11.084 1.00 70.33 H new ATOM 0 HG1 THR A 32 -18.360 1.612 11.182 1.00 31.43 H new ATOM 0 HG21 THR A 32 -18.498 2.599 9.052 1.00 24.53 H new ATOM 0 HG22 THR A 32 -17.446 3.996 8.724 1.00 24.53 H new ATOM 0 HG23 THR A 32 -16.745 2.365 8.854 1.00 24.53 H new ATOM 471 N ALA A 33 -14.288 2.199 11.620 1.00 61.22 N ATOM 472 CA ALA A 33 -13.241 1.248 11.370 1.00 1.43 C ATOM 473 C ALA A 33 -13.775 -0.160 11.560 1.00 22.34 C ATOM 474 O ALA A 33 -13.948 -0.619 12.698 1.00 33.40 O ATOM 475 CB ALA A 33 -12.057 1.493 12.285 1.00 43.41 C ATOM 0 H ALA A 33 -14.587 2.249 12.594 1.00 61.22 H new ATOM 0 HA ALA A 33 -12.899 1.366 10.342 1.00 1.43 H new ATOM 0 HB1 ALA A 33 -11.278 0.760 12.076 1.00 43.41 H new ATOM 0 HB2 ALA A 33 -11.667 2.496 12.114 1.00 43.41 H new ATOM 0 HB3 ALA A 33 -12.374 1.399 13.324 1.00 43.41 H new ATOM 481 N PRO A 34 -14.131 -0.844 10.474 1.00 61.51 N ATOM 482 CA PRO A 34 -14.614 -2.206 10.549 1.00 63.13 C ATOM 483 C PRO A 34 -13.468 -3.177 10.801 1.00 72.13 C ATOM 484 O PRO A 34 -12.348 -2.986 10.302 1.00 73.45 O ATOM 485 CB PRO A 34 -15.233 -2.448 9.170 1.00 63.53 C ATOM 486 CG PRO A 34 -14.498 -1.533 8.256 1.00 31.23 C ATOM 487 CD PRO A 34 -14.085 -0.347 9.085 1.00 3.33 C ATOM 0 HA PRO A 34 -15.321 -2.357 11.365 1.00 63.13 H new ATOM 0 HB2 PRO A 34 -15.120 -3.488 8.863 1.00 63.53 H new ATOM 0 HB3 PRO A 34 -16.301 -2.230 9.172 1.00 63.53 H new ATOM 0 HG2 PRO A 34 -13.627 -2.029 7.827 1.00 31.23 H new ATOM 0 HG3 PRO A 34 -15.131 -1.224 7.424 1.00 31.23 H new ATOM 0 HD2 PRO A 34 -13.086 -0.003 8.818 1.00 3.33 H new ATOM 0 HD3 PRO A 34 -14.762 0.495 8.941 1.00 3.33 H new ATOM 495 N ALA A 35 -13.731 -4.186 11.581 1.00 62.43 N ATOM 496 CA ALA A 35 -12.745 -5.186 11.866 1.00 5.33 C ATOM 497 C ALA A 35 -12.859 -6.263 10.817 1.00 71.35 C ATOM 498 O ALA A 35 -13.946 -6.800 10.592 1.00 21.44 O ATOM 499 CB ALA A 35 -12.965 -5.760 13.257 1.00 14.12 C ATOM 0 H ALA A 35 -14.632 -4.338 12.035 1.00 62.43 H new ATOM 0 HA ALA A 35 -11.745 -4.752 11.844 1.00 5.33 H new ATOM 0 HB1 ALA A 35 -12.209 -6.519 13.461 1.00 14.12 H new ATOM 0 HB2 ALA A 35 -12.888 -4.963 13.996 1.00 14.12 H new ATOM 0 HB3 ALA A 35 -13.956 -6.211 13.312 1.00 14.12 H new ATOM 505 N SER A 36 -11.783 -6.566 10.172 1.00 13.24 N ATOM 506 CA SER A 36 -11.785 -7.536 9.122 1.00 13.52 C ATOM 507 C SER A 36 -10.984 -8.768 9.568 1.00 71.32 C ATOM 508 O SER A 36 -10.134 -8.677 10.467 1.00 75.12 O ATOM 509 CB SER A 36 -11.199 -6.891 7.858 1.00 33.12 C ATOM 510 OG SER A 36 -11.387 -7.696 6.702 1.00 15.13 O ATOM 0 H SER A 36 -10.871 -6.147 10.357 1.00 13.24 H new ATOM 0 HA SER A 36 -12.798 -7.868 8.896 1.00 13.52 H new ATOM 0 HB2 SER A 36 -11.665 -5.919 7.700 1.00 33.12 H new ATOM 0 HB3 SER A 36 -10.134 -6.714 8.004 1.00 33.12 H new ATOM 0 HG SER A 36 -10.561 -7.708 6.174 1.00 15.13 H new ATOM 516 N THR A 37 -11.258 -9.892 8.968 1.00 50.03 N ATOM 517 CA THR A 37 -10.622 -11.129 9.324 1.00 72.11 C ATOM 518 C THR A 37 -10.100 -11.799 8.052 1.00 23.03 C ATOM 519 O THR A 37 -10.508 -11.432 6.938 1.00 11.42 O ATOM 520 CB THR A 37 -11.614 -12.071 10.099 1.00 63.44 C ATOM 521 OG1 THR A 37 -10.969 -13.302 10.485 1.00 0.44 O ATOM 522 CG2 THR A 37 -12.855 -12.387 9.266 1.00 22.41 C ATOM 0 H THR A 37 -11.936 -9.976 8.210 1.00 50.03 H new ATOM 0 HA THR A 37 -9.786 -10.929 9.994 1.00 72.11 H new ATOM 0 HB THR A 37 -11.923 -11.534 10.996 1.00 63.44 H new ATOM 0 HG1 THR A 37 -11.607 -13.869 10.967 1.00 0.44 H new ATOM 0 HG21 THR A 37 -13.518 -13.040 9.834 1.00 22.41 H new ATOM 0 HG22 THR A 37 -13.377 -11.461 9.025 1.00 22.41 H new ATOM 0 HG23 THR A 37 -12.557 -12.886 8.344 1.00 22.41 H new ATOM 530 N GLY A 38 -9.171 -12.718 8.209 1.00 14.03 N ATOM 531 CA GLY A 38 -8.622 -13.424 7.089 1.00 51.13 C ATOM 532 C GLY A 38 -7.186 -13.060 6.922 1.00 14.14 C ATOM 533 O GLY A 38 -6.456 -13.665 6.145 1.00 42.10 O ATOM 0 H GLY A 38 -8.783 -12.990 9.112 1.00 14.03 H new ATOM 0 HA2 GLY A 38 -8.720 -14.499 7.241 1.00 51.13 H new ATOM 0 HA3 GLY A 38 -9.177 -13.178 6.184 1.00 51.13 H new ATOM 537 N ALA A 39 -6.769 -12.090 7.708 1.00 23.43 N ATOM 538 CA ALA A 39 -5.433 -11.569 7.657 1.00 63.33 C ATOM 539 C ALA A 39 -4.474 -12.552 8.272 1.00 33.01 C ATOM 540 O ALA A 39 -3.400 -12.814 7.741 1.00 64.04 O ATOM 541 CB ALA A 39 -5.360 -10.243 8.389 1.00 0.21 C ATOM 0 H ALA A 39 -7.361 -11.640 8.406 1.00 23.43 H new ATOM 0 HA ALA A 39 -5.157 -11.409 6.615 1.00 63.33 H new ATOM 0 HB1 ALA A 39 -4.341 -9.858 8.343 1.00 0.21 H new ATOM 0 HB2 ALA A 39 -6.039 -9.531 7.920 1.00 0.21 H new ATOM 0 HB3 ALA A 39 -5.647 -10.386 9.431 1.00 0.21 H new ATOM 547 N GLU A 40 -4.924 -13.149 9.343 1.00 13.14 N ATOM 548 CA GLU A 40 -4.146 -14.080 10.119 1.00 43.33 C ATOM 549 C GLU A 40 -4.276 -15.482 9.551 1.00 30.24 C ATOM 550 O GLU A 40 -3.614 -16.411 9.996 1.00 10.45 O ATOM 551 CB GLU A 40 -4.591 -14.065 11.596 1.00 51.30 C ATOM 552 CG GLU A 40 -6.070 -14.411 11.846 1.00 75.12 C ATOM 553 CD GLU A 40 -7.051 -13.314 11.455 1.00 32.25 C ATOM 554 OE1 GLU A 40 -7.452 -13.240 10.278 1.00 74.23 O ATOM 555 OE2 GLU A 40 -7.430 -12.521 12.326 1.00 41.43 O ATOM 0 H GLU A 40 -5.864 -12.999 9.710 1.00 13.14 H new ATOM 0 HA GLU A 40 -3.101 -13.774 10.068 1.00 43.33 H new ATOM 0 HB2 GLU A 40 -3.972 -14.770 12.151 1.00 51.30 H new ATOM 0 HB3 GLU A 40 -4.393 -13.075 12.007 1.00 51.30 H new ATOM 0 HG2 GLU A 40 -6.317 -15.316 11.291 1.00 75.12 H new ATOM 0 HG3 GLU A 40 -6.203 -14.639 12.904 1.00 75.12 H new ATOM 562 N ASN A 41 -5.118 -15.622 8.564 1.00 2.11 N ATOM 563 CA ASN A 41 -5.344 -16.902 7.939 1.00 72.04 C ATOM 564 C ASN A 41 -4.342 -17.128 6.853 1.00 53.24 C ATOM 565 O ASN A 41 -3.950 -18.260 6.602 1.00 54.41 O ATOM 566 CB ASN A 41 -6.769 -17.024 7.377 1.00 34.43 C ATOM 567 CG ASN A 41 -7.831 -17.182 8.451 1.00 21.15 C ATOM 568 OD1 ASN A 41 -8.389 -16.200 8.962 1.00 65.45 O ATOM 569 ND2 ASN A 41 -8.131 -18.407 8.794 1.00 21.33 N ATOM 0 H ASN A 41 -5.666 -14.857 8.170 1.00 2.11 H new ATOM 0 HA ASN A 41 -5.227 -17.667 8.706 1.00 72.04 H new ATOM 0 HB2 ASN A 41 -6.994 -16.139 6.782 1.00 34.43 H new ATOM 0 HB3 ASN A 41 -6.814 -17.880 6.704 1.00 34.43 H new ATOM 0 HD21 ASN A 41 -8.844 -18.578 9.503 1.00 21.33 H new ATOM 0 HD22 ASN A 41 -7.652 -19.192 8.353 1.00 21.33 H new ATOM 576 N LEU A 42 -3.894 -16.024 6.241 1.00 24.22 N ATOM 577 CA LEU A 42 -2.955 -16.057 5.113 1.00 40.01 C ATOM 578 C LEU A 42 -3.488 -16.979 3.997 1.00 41.04 C ATOM 579 O LEU A 42 -2.933 -18.055 3.760 1.00 53.42 O ATOM 580 CB LEU A 42 -1.525 -16.495 5.542 1.00 52.14 C ATOM 581 CG LEU A 42 -0.658 -15.522 6.382 1.00 72.42 C ATOM 582 CD1 LEU A 42 -0.511 -14.172 5.712 1.00 65.41 C ATOM 583 CD2 LEU A 42 -1.158 -15.380 7.809 1.00 73.40 C ATOM 0 H LEU A 42 -4.173 -15.082 6.515 1.00 24.22 H new ATOM 0 HA LEU A 42 -2.877 -15.039 4.732 1.00 40.01 H new ATOM 0 HB2 LEU A 42 -1.621 -17.421 6.108 1.00 52.14 H new ATOM 0 HB3 LEU A 42 -0.968 -16.732 4.635 1.00 52.14 H new ATOM 0 HG LEU A 42 0.334 -15.970 6.438 1.00 72.42 H new ATOM 0 HD11 LEU A 42 0.104 -13.522 6.335 1.00 65.41 H new ATOM 0 HD12 LEU A 42 -0.036 -14.298 4.739 1.00 65.41 H new ATOM 0 HD13 LEU A 42 -1.495 -13.723 5.579 1.00 65.41 H new ATOM 0 HD21 LEU A 42 -0.515 -14.688 8.353 1.00 73.40 H new ATOM 0 HD22 LEU A 42 -2.178 -14.997 7.801 1.00 73.40 H new ATOM 0 HD23 LEU A 42 -1.140 -16.353 8.299 1.00 73.40 H new ATOM 595 N PRO A 43 -4.586 -16.565 3.307 1.00 43.33 N ATOM 596 CA PRO A 43 -5.276 -17.403 2.313 1.00 25.15 C ATOM 597 C PRO A 43 -4.352 -17.962 1.227 1.00 42.12 C ATOM 598 O PRO A 43 -4.121 -19.169 1.159 1.00 15.21 O ATOM 599 CB PRO A 43 -6.338 -16.469 1.700 1.00 21.23 C ATOM 600 CG PRO A 43 -5.964 -15.096 2.144 1.00 65.20 C ATOM 601 CD PRO A 43 -5.248 -15.254 3.448 1.00 53.13 C ATOM 0 HA PRO A 43 -5.696 -18.291 2.786 1.00 25.15 H new ATOM 0 HB2 PRO A 43 -6.344 -16.542 0.612 1.00 21.23 H new ATOM 0 HB3 PRO A 43 -7.338 -16.734 2.043 1.00 21.23 H new ATOM 0 HG2 PRO A 43 -5.325 -14.610 1.407 1.00 65.20 H new ATOM 0 HG3 PRO A 43 -6.849 -14.471 2.260 1.00 65.20 H new ATOM 0 HD2 PRO A 43 -4.527 -14.453 3.612 1.00 53.13 H new ATOM 0 HD3 PRO A 43 -5.938 -15.239 4.292 1.00 53.13 H new ATOM 609 N ALA A 44 -3.805 -17.096 0.406 1.00 34.43 N ATOM 610 CA ALA A 44 -2.950 -17.542 -0.673 1.00 31.11 C ATOM 611 C ALA A 44 -1.482 -17.335 -0.341 1.00 2.51 C ATOM 612 O ALA A 44 -0.606 -17.636 -1.144 1.00 74.24 O ATOM 613 CB ALA A 44 -3.320 -16.848 -1.960 1.00 50.21 C ATOM 0 H ALA A 44 -3.934 -16.086 0.462 1.00 34.43 H new ATOM 0 HA ALA A 44 -3.104 -18.613 -0.804 1.00 31.11 H new ATOM 0 HB1 ALA A 44 -2.667 -17.195 -2.761 1.00 50.21 H new ATOM 0 HB2 ALA A 44 -4.356 -17.076 -2.212 1.00 50.21 H new ATOM 0 HB3 ALA A 44 -3.205 -15.771 -1.839 1.00 50.21 H new ATOM 619 N GLY A 45 -1.224 -16.793 0.834 1.00 53.12 N ATOM 620 CA GLY A 45 0.145 -16.583 1.280 1.00 42.23 C ATOM 621 C GLY A 45 0.772 -15.307 0.741 1.00 2.52 C ATOM 622 O GLY A 45 1.883 -14.950 1.124 1.00 13.34 O ATOM 0 H GLY A 45 -1.939 -16.491 1.496 1.00 53.12 H new ATOM 0 HA2 GLY A 45 0.163 -16.555 2.369 1.00 42.23 H new ATOM 0 HA3 GLY A 45 0.753 -17.434 0.973 1.00 42.23 H new ATOM 626 N SER A 46 0.065 -14.617 -0.124 1.00 43.32 N ATOM 627 CA SER A 46 0.567 -13.394 -0.703 1.00 61.44 C ATOM 628 C SER A 46 -0.296 -12.215 -0.262 1.00 42.34 C ATOM 629 O SER A 46 -1.472 -12.392 0.119 1.00 31.30 O ATOM 630 CB SER A 46 0.575 -13.501 -2.228 1.00 42.15 C ATOM 631 OG SER A 46 1.345 -14.623 -2.677 1.00 60.33 O ATOM 0 H SER A 46 -0.866 -14.885 -0.443 1.00 43.32 H new ATOM 0 HA SER A 46 1.588 -13.231 -0.357 1.00 61.44 H new ATOM 0 HB2 SER A 46 -0.448 -13.593 -2.592 1.00 42.15 H new ATOM 0 HB3 SER A 46 0.984 -12.585 -2.655 1.00 42.15 H new ATOM 0 HG SER A 46 1.327 -14.662 -3.656 1.00 60.33 H new ATOM 637 N ALA A 47 0.264 -11.034 -0.317 1.00 42.42 N ATOM 638 CA ALA A 47 -0.414 -9.838 0.107 1.00 14.25 C ATOM 639 C ALA A 47 -0.055 -8.677 -0.812 1.00 45.25 C ATOM 640 O ALA A 47 1.112 -8.540 -1.220 1.00 3.33 O ATOM 641 CB ALA A 47 -0.011 -9.528 1.530 1.00 42.53 C ATOM 0 H ALA A 47 1.211 -10.875 -0.660 1.00 42.42 H new ATOM 0 HA ALA A 47 -1.492 -9.988 0.058 1.00 14.25 H new ATOM 0 HB1 ALA A 47 -0.519 -8.623 1.863 1.00 42.53 H new ATOM 0 HB2 ALA A 47 -0.291 -10.360 2.177 1.00 42.53 H new ATOM 0 HB3 ALA A 47 1.067 -9.378 1.578 1.00 42.53 H new ATOM 647 N LEU A 48 -1.034 -7.844 -1.141 1.00 51.35 N ATOM 648 CA LEU A 48 -0.800 -6.725 -2.031 1.00 50.02 C ATOM 649 C LEU A 48 -1.713 -5.553 -1.715 1.00 40.20 C ATOM 650 O LEU A 48 -2.824 -5.733 -1.214 1.00 54.53 O ATOM 651 CB LEU A 48 -0.896 -7.170 -3.525 1.00 23.14 C ATOM 652 CG LEU A 48 -2.181 -7.900 -4.004 1.00 30.24 C ATOM 653 CD1 LEU A 48 -3.375 -6.961 -4.161 1.00 5.21 C ATOM 654 CD2 LEU A 48 -1.914 -8.643 -5.299 1.00 12.12 C ATOM 0 H LEU A 48 -1.993 -7.925 -0.804 1.00 51.35 H new ATOM 0 HA LEU A 48 0.218 -6.372 -1.865 1.00 50.02 H new ATOM 0 HB2 LEU A 48 -0.771 -6.281 -4.143 1.00 23.14 H new ATOM 0 HB3 LEU A 48 -0.048 -7.824 -3.731 1.00 23.14 H new ATOM 0 HG LEU A 48 -2.447 -8.615 -3.225 1.00 30.24 H new ATOM 0 HD11 LEU A 48 -4.242 -7.529 -4.498 1.00 5.21 H new ATOM 0 HD12 LEU A 48 -3.598 -6.492 -3.202 1.00 5.21 H new ATOM 0 HD13 LEU A 48 -3.138 -6.191 -4.895 1.00 5.21 H new ATOM 0 HD21 LEU A 48 -2.824 -9.149 -5.622 1.00 12.12 H new ATOM 0 HD22 LEU A 48 -1.601 -7.935 -6.067 1.00 12.12 H new ATOM 0 HD23 LEU A 48 -1.126 -9.379 -5.140 1.00 12.12 H new ATOM 666 N LEU A 49 -1.247 -4.370 -1.989 1.00 25.23 N ATOM 667 CA LEU A 49 -2.041 -3.190 -1.783 1.00 22.51 C ATOM 668 C LEU A 49 -2.127 -2.415 -3.077 1.00 24.32 C ATOM 669 O LEU A 49 -1.125 -2.250 -3.785 1.00 5.45 O ATOM 670 CB LEU A 49 -1.543 -2.293 -0.604 1.00 21.15 C ATOM 671 CG LEU A 49 -0.170 -1.580 -0.711 1.00 34.23 C ATOM 672 CD1 LEU A 49 -0.005 -0.625 0.455 1.00 13.24 C ATOM 673 CD2 LEU A 49 0.991 -2.562 -0.708 1.00 74.12 C ATOM 0 H LEU A 49 -0.313 -4.194 -2.359 1.00 25.23 H new ATOM 0 HA LEU A 49 -3.037 -3.515 -1.483 1.00 22.51 H new ATOM 0 HB2 LEU A 49 -2.298 -1.524 -0.438 1.00 21.15 H new ATOM 0 HB3 LEU A 49 -1.519 -2.915 0.291 1.00 21.15 H new ATOM 0 HG LEU A 49 -0.155 -1.043 -1.659 1.00 34.23 H new ATOM 0 HD11 LEU A 49 0.960 -0.123 0.381 1.00 13.24 H new ATOM 0 HD12 LEU A 49 -0.803 0.117 0.433 1.00 13.24 H new ATOM 0 HD13 LEU A 49 -0.053 -1.182 1.391 1.00 13.24 H new ATOM 0 HD21 LEU A 49 1.931 -2.015 -0.785 1.00 74.12 H new ATOM 0 HD22 LEU A 49 0.980 -3.136 0.219 1.00 74.12 H new ATOM 0 HD23 LEU A 49 0.896 -3.240 -1.556 1.00 74.12 H new ATOM 685 N VAL A 50 -3.309 -1.986 -3.408 1.00 62.40 N ATOM 686 CA VAL A 50 -3.536 -1.266 -4.631 1.00 40.20 C ATOM 687 C VAL A 50 -3.875 0.181 -4.332 1.00 42.35 C ATOM 688 O VAL A 50 -4.665 0.475 -3.427 1.00 53.20 O ATOM 689 CB VAL A 50 -4.649 -1.938 -5.517 1.00 33.33 C ATOM 690 CG1 VAL A 50 -5.993 -2.010 -4.797 1.00 52.12 C ATOM 691 CG2 VAL A 50 -4.796 -1.229 -6.864 1.00 40.11 C ATOM 0 H VAL A 50 -4.144 -2.124 -2.839 1.00 62.40 H new ATOM 0 HA VAL A 50 -2.613 -1.298 -5.210 1.00 40.20 H new ATOM 0 HB VAL A 50 -4.323 -2.961 -5.704 1.00 33.33 H new ATOM 0 HG11 VAL A 50 -6.730 -2.481 -5.448 1.00 52.12 H new ATOM 0 HG12 VAL A 50 -5.886 -2.597 -3.885 1.00 52.12 H new ATOM 0 HG13 VAL A 50 -6.324 -1.003 -4.544 1.00 52.12 H new ATOM 0 HG21 VAL A 50 -5.573 -1.719 -7.450 1.00 40.11 H new ATOM 0 HG22 VAL A 50 -5.069 -0.187 -6.699 1.00 40.11 H new ATOM 0 HG23 VAL A 50 -3.851 -1.275 -7.404 1.00 40.11 H new ATOM 701 N VAL A 51 -3.248 1.076 -5.039 1.00 60.24 N ATOM 702 CA VAL A 51 -3.536 2.473 -4.886 1.00 21.43 C ATOM 703 C VAL A 51 -4.843 2.729 -5.602 1.00 72.44 C ATOM 704 O VAL A 51 -4.939 2.539 -6.816 1.00 12.11 O ATOM 705 CB VAL A 51 -2.409 3.327 -5.504 1.00 21.55 C ATOM 706 CG1 VAL A 51 -2.608 4.803 -5.207 1.00 3.12 C ATOM 707 CG2 VAL A 51 -1.052 2.851 -5.007 1.00 72.50 C ATOM 0 H VAL A 51 -2.530 0.862 -5.731 1.00 60.24 H new ATOM 0 HA VAL A 51 -3.608 2.743 -3.832 1.00 21.43 H new ATOM 0 HB VAL A 51 -2.445 3.203 -6.586 1.00 21.55 H new ATOM 0 HG11 VAL A 51 -1.797 5.377 -5.656 1.00 3.12 H new ATOM 0 HG12 VAL A 51 -3.560 5.133 -5.623 1.00 3.12 H new ATOM 0 HG13 VAL A 51 -2.610 4.960 -4.128 1.00 3.12 H new ATOM 0 HG21 VAL A 51 -0.267 3.463 -5.451 1.00 72.50 H new ATOM 0 HG22 VAL A 51 -1.011 2.940 -3.921 1.00 72.50 H new ATOM 0 HG23 VAL A 51 -0.905 1.809 -5.292 1.00 72.50 H new ATOM 717 N LYS A 52 -5.834 3.147 -4.860 1.00 20.50 N ATOM 718 CA LYS A 52 -7.168 3.296 -5.395 1.00 43.54 C ATOM 719 C LYS A 52 -7.357 4.691 -5.941 1.00 5.43 C ATOM 720 O LYS A 52 -8.070 4.903 -6.919 1.00 21.42 O ATOM 721 CB LYS A 52 -8.198 3.015 -4.292 1.00 34.21 C ATOM 722 CG LYS A 52 -9.648 2.936 -4.760 1.00 50.23 C ATOM 723 CD LYS A 52 -9.879 1.731 -5.662 1.00 34.45 C ATOM 724 CE LYS A 52 -11.336 1.615 -6.061 1.00 0.21 C ATOM 725 NZ LYS A 52 -11.611 0.374 -6.817 1.00 13.23 N ATOM 0 H LYS A 52 -5.744 3.393 -3.874 1.00 20.50 H new ATOM 0 HA LYS A 52 -7.310 2.583 -6.208 1.00 43.54 H new ATOM 0 HB2 LYS A 52 -7.938 2.074 -3.806 1.00 34.21 H new ATOM 0 HB3 LYS A 52 -8.119 3.797 -3.536 1.00 34.21 H new ATOM 0 HG2 LYS A 52 -10.308 2.876 -3.895 1.00 50.23 H new ATOM 0 HG3 LYS A 52 -9.908 3.848 -5.296 1.00 50.23 H new ATOM 0 HD2 LYS A 52 -9.261 1.819 -6.555 1.00 34.45 H new ATOM 0 HD3 LYS A 52 -9.567 0.823 -5.146 1.00 34.45 H new ATOM 0 HE2 LYS A 52 -11.959 1.639 -5.167 1.00 0.21 H new ATOM 0 HE3 LYS A 52 -11.615 2.477 -6.667 1.00 0.21 H new ATOM 0 HZ1 LYS A 52 -12.619 0.337 -7.069 1.00 13.23 H new ATOM 0 HZ2 LYS A 52 -11.037 0.361 -7.684 1.00 13.23 H new ATOM 0 HZ3 LYS A 52 -11.370 -0.450 -6.230 1.00 13.23 H new ATOM 739 N ARG A 53 -6.696 5.626 -5.327 1.00 13.44 N ATOM 740 CA ARG A 53 -6.826 7.009 -5.693 1.00 61.11 C ATOM 741 C ARG A 53 -5.452 7.603 -5.554 1.00 43.21 C ATOM 742 O ARG A 53 -4.704 7.197 -4.678 1.00 2.11 O ATOM 743 CB ARG A 53 -7.839 7.690 -4.740 1.00 12.34 C ATOM 744 CG ARG A 53 -8.470 9.025 -5.208 1.00 42.54 C ATOM 745 CD ARG A 53 -7.497 10.193 -5.300 1.00 32.54 C ATOM 746 NE ARG A 53 -8.200 11.468 -5.489 1.00 61.24 N ATOM 747 CZ ARG A 53 -7.987 12.356 -6.477 1.00 25.53 C ATOM 748 NH1 ARG A 53 -7.215 12.047 -7.512 1.00 42.53 N ATOM 749 NH2 ARG A 53 -8.607 13.530 -6.448 1.00 43.32 N ATOM 0 H ARG A 53 -6.050 5.454 -4.557 1.00 13.44 H new ATOM 0 HA ARG A 53 -7.196 7.144 -6.709 1.00 61.11 H new ATOM 0 HB2 ARG A 53 -8.647 6.984 -4.547 1.00 12.34 H new ATOM 0 HB3 ARG A 53 -7.339 7.869 -3.788 1.00 12.34 H new ATOM 0 HG2 ARG A 53 -8.926 8.872 -6.186 1.00 42.54 H new ATOM 0 HG3 ARG A 53 -9.273 9.292 -4.521 1.00 42.54 H new ATOM 0 HD2 ARG A 53 -6.896 10.239 -4.392 1.00 32.54 H new ATOM 0 HD3 ARG A 53 -6.809 10.030 -6.129 1.00 32.54 H new ATOM 0 HE ARG A 53 -8.919 11.703 -4.805 1.00 61.24 H new ATOM 0 HH11 ARG A 53 -6.776 11.128 -7.564 1.00 42.53 H new ATOM 0 HH12 ARG A 53 -7.061 12.729 -8.255 1.00 42.53 H new ATOM 0 HH21 ARG A 53 -9.240 13.754 -5.680 1.00 43.32 H new ATOM 0 HH22 ARG A 53 -8.450 14.208 -7.194 1.00 43.32 H new ATOM 763 N GLY A 54 -5.125 8.506 -6.416 1.00 72.10 N ATOM 764 CA GLY A 54 -3.830 9.140 -6.401 1.00 3.44 C ATOM 765 C GLY A 54 -3.259 9.192 -7.799 1.00 20.30 C ATOM 766 O GLY A 54 -3.810 8.559 -8.699 1.00 61.32 O ATOM 0 H GLY A 54 -5.744 8.833 -7.158 1.00 72.10 H new ATOM 0 HA2 GLY A 54 -3.915 10.149 -5.997 1.00 3.44 H new ATOM 0 HA3 GLY A 54 -3.155 8.590 -5.745 1.00 3.44 H new ATOM 770 N PRO A 55 -2.169 9.923 -8.034 1.00 25.11 N ATOM 771 CA PRO A 55 -1.557 10.017 -9.371 1.00 2.34 C ATOM 772 C PRO A 55 -1.076 8.653 -9.881 1.00 34.22 C ATOM 773 O PRO A 55 -1.116 8.373 -11.076 1.00 11.31 O ATOM 774 CB PRO A 55 -0.369 10.966 -9.157 1.00 64.34 C ATOM 775 CG PRO A 55 -0.731 11.738 -7.936 1.00 73.21 C ATOM 776 CD PRO A 55 -1.459 10.769 -7.053 1.00 41.21 C ATOM 0 HA PRO A 55 -2.264 10.370 -10.122 1.00 2.34 H new ATOM 0 HB2 PRO A 55 0.561 10.414 -9.018 1.00 64.34 H new ATOM 0 HB3 PRO A 55 -0.225 11.623 -10.015 1.00 64.34 H new ATOM 0 HG2 PRO A 55 0.158 12.129 -7.441 1.00 73.21 H new ATOM 0 HG3 PRO A 55 -1.360 12.593 -8.184 1.00 73.21 H new ATOM 0 HD2 PRO A 55 -0.774 10.188 -6.435 1.00 41.21 H new ATOM 0 HD3 PRO A 55 -2.149 11.274 -6.377 1.00 41.21 H new ATOM 784 N ASN A 56 -0.659 7.803 -8.962 1.00 22.13 N ATOM 785 CA ASN A 56 -0.177 6.470 -9.287 1.00 62.30 C ATOM 786 C ASN A 56 -1.257 5.397 -9.010 1.00 35.40 C ATOM 787 O ASN A 56 -0.948 4.219 -8.823 1.00 73.31 O ATOM 788 CB ASN A 56 1.122 6.186 -8.505 1.00 65.23 C ATOM 789 CG ASN A 56 0.950 6.261 -6.998 1.00 14.25 C ATOM 790 OD1 ASN A 56 1.048 7.334 -6.398 1.00 52.10 O ATOM 791 ND2 ASN A 56 0.719 5.151 -6.384 1.00 14.21 N ATOM 0 H ASN A 56 -0.644 8.016 -7.965 1.00 22.13 H new ATOM 0 HA ASN A 56 0.043 6.424 -10.354 1.00 62.30 H new ATOM 0 HB2 ASN A 56 1.488 5.195 -8.772 1.00 65.23 H new ATOM 0 HB3 ASN A 56 1.885 6.901 -8.812 1.00 65.23 H new ATOM 0 HD21 ASN A 56 0.611 5.142 -5.370 1.00 14.21 H new ATOM 0 HD22 ASN A 56 0.644 4.282 -6.913 1.00 14.21 H new ATOM 798 N ALA A 57 -2.524 5.819 -8.992 1.00 71.54 N ATOM 799 CA ALA A 57 -3.659 4.916 -8.765 1.00 72.14 C ATOM 800 C ALA A 57 -3.752 3.860 -9.853 1.00 3.33 C ATOM 801 O ALA A 57 -3.452 4.123 -11.022 1.00 33.31 O ATOM 802 CB ALA A 57 -4.961 5.687 -8.692 1.00 31.25 C ATOM 0 H ALA A 57 -2.793 6.793 -9.134 1.00 71.54 H new ATOM 0 HA ALA A 57 -3.488 4.418 -7.810 1.00 72.14 H new ATOM 0 HB1 ALA A 57 -5.785 4.994 -8.523 1.00 31.25 H new ATOM 0 HB2 ALA A 57 -4.915 6.402 -7.871 1.00 31.25 H new ATOM 0 HB3 ALA A 57 -5.121 6.220 -9.629 1.00 31.25 H new ATOM 808 N GLY A 58 -4.144 2.675 -9.474 1.00 13.15 N ATOM 809 CA GLY A 58 -4.241 1.592 -10.422 1.00 33.15 C ATOM 810 C GLY A 58 -3.045 0.687 -10.330 1.00 50.45 C ATOM 811 O GLY A 58 -3.033 -0.416 -10.885 1.00 4.54 O ATOM 0 H GLY A 58 -4.402 2.432 -8.518 1.00 13.15 H new ATOM 0 HA2 GLY A 58 -5.150 1.020 -10.234 1.00 33.15 H new ATOM 0 HA3 GLY A 58 -4.320 1.994 -11.432 1.00 33.15 H new ATOM 815 N ALA A 59 -2.027 1.153 -9.651 1.00 35.11 N ATOM 816 CA ALA A 59 -0.848 0.367 -9.445 1.00 43.40 C ATOM 817 C ALA A 59 -0.994 -0.429 -8.166 1.00 31.30 C ATOM 818 O ALA A 59 -1.363 0.124 -7.115 1.00 42.53 O ATOM 819 CB ALA A 59 0.385 1.255 -9.385 1.00 13.11 C ATOM 0 H ALA A 59 -1.997 2.082 -9.230 1.00 35.11 H new ATOM 0 HA ALA A 59 -0.725 -0.319 -10.283 1.00 43.40 H new ATOM 0 HB1 ALA A 59 1.270 0.639 -9.228 1.00 13.11 H new ATOM 0 HB2 ALA A 59 0.485 1.802 -10.322 1.00 13.11 H new ATOM 0 HB3 ALA A 59 0.284 1.962 -8.561 1.00 13.11 H new ATOM 825 N ARG A 60 -0.763 -1.712 -8.253 1.00 35.25 N ATOM 826 CA ARG A 60 -0.798 -2.556 -7.092 1.00 74.20 C ATOM 827 C ARG A 60 0.592 -3.021 -6.784 1.00 74.22 C ATOM 828 O ARG A 60 1.343 -3.406 -7.684 1.00 54.44 O ATOM 829 CB ARG A 60 -1.764 -3.753 -7.249 1.00 3.11 C ATOM 830 CG ARG A 60 -1.494 -4.652 -8.448 1.00 60.42 C ATOM 831 CD ARG A 60 -2.418 -5.858 -8.450 1.00 22.23 C ATOM 832 NE ARG A 60 -2.302 -6.637 -9.687 1.00 14.04 N ATOM 833 CZ ARG A 60 -2.505 -7.959 -9.808 1.00 45.22 C ATOM 834 NH1 ARG A 60 -2.682 -8.721 -8.735 1.00 10.44 N ATOM 835 NH2 ARG A 60 -2.492 -8.519 -11.014 1.00 53.23 N ATOM 0 H ARG A 60 -0.547 -2.197 -9.124 1.00 35.25 H new ATOM 0 HA ARG A 60 -1.185 -1.969 -6.259 1.00 74.20 H new ATOM 0 HB2 ARG A 60 -1.717 -4.358 -6.344 1.00 3.11 H new ATOM 0 HB3 ARG A 60 -2.782 -3.370 -7.324 1.00 3.11 H new ATOM 0 HG2 ARG A 60 -1.630 -4.085 -9.369 1.00 60.42 H new ATOM 0 HG3 ARG A 60 -0.456 -4.986 -8.429 1.00 60.42 H new ATOM 0 HD2 ARG A 60 -2.184 -6.495 -7.597 1.00 22.23 H new ATOM 0 HD3 ARG A 60 -3.449 -5.525 -8.326 1.00 22.23 H new ATOM 0 HE ARG A 60 -2.044 -6.128 -10.533 1.00 14.04 H new ATOM 0 HH11 ARG A 60 -2.665 -8.303 -7.805 1.00 10.44 H new ATOM 0 HH12 ARG A 60 -2.835 -9.724 -8.841 1.00 10.44 H new ATOM 0 HH21 ARG A 60 -2.328 -7.945 -11.841 1.00 53.23 H new ATOM 0 HH22 ARG A 60 -2.646 -9.523 -11.112 1.00 53.23 H new ATOM 849 N PHE A 61 0.941 -2.969 -5.550 1.00 34.04 N ATOM 850 CA PHE A 61 2.238 -3.368 -5.121 1.00 41.44 C ATOM 851 C PHE A 61 2.088 -4.531 -4.190 1.00 71.12 C ATOM 852 O PHE A 61 1.261 -4.494 -3.278 1.00 53.35 O ATOM 853 CB PHE A 61 2.956 -2.215 -4.407 1.00 50.41 C ATOM 854 CG PHE A 61 3.162 -0.983 -5.256 1.00 22.14 C ATOM 855 CD1 PHE A 61 4.229 -0.905 -6.138 1.00 14.43 C ATOM 856 CD2 PHE A 61 2.294 0.097 -5.164 1.00 50.21 C ATOM 857 CE1 PHE A 61 4.427 0.223 -6.911 1.00 52.12 C ATOM 858 CE2 PHE A 61 2.487 1.227 -5.936 1.00 22.24 C ATOM 859 CZ PHE A 61 3.553 1.290 -6.811 1.00 13.43 C ATOM 0 H PHE A 61 0.331 -2.646 -4.799 1.00 34.04 H new ATOM 0 HA PHE A 61 2.837 -3.649 -5.987 1.00 41.44 H new ATOM 0 HB2 PHE A 61 2.382 -1.939 -3.522 1.00 50.41 H new ATOM 0 HB3 PHE A 61 3.927 -2.568 -4.060 1.00 50.41 H new ATOM 0 HD1 PHE A 61 4.914 -1.736 -6.222 1.00 14.43 H new ATOM 0 HD2 PHE A 61 1.458 0.053 -4.481 1.00 50.21 H new ATOM 0 HE1 PHE A 61 5.263 0.271 -7.593 1.00 52.12 H new ATOM 0 HE2 PHE A 61 1.804 2.060 -5.855 1.00 22.24 H new ATOM 0 HZ PHE A 61 3.704 2.171 -7.417 1.00 13.43 H new ATOM 869 N LEU A 62 2.815 -5.567 -4.439 1.00 72.11 N ATOM 870 CA LEU A 62 2.782 -6.703 -3.575 1.00 73.34 C ATOM 871 C LEU A 62 3.916 -6.627 -2.587 1.00 5.13 C ATOM 872 O LEU A 62 4.990 -6.107 -2.908 1.00 2.51 O ATOM 873 CB LEU A 62 2.710 -8.046 -4.361 1.00 63.12 C ATOM 874 CG LEU A 62 3.743 -8.317 -5.478 1.00 44.31 C ATOM 875 CD1 LEU A 62 5.138 -8.609 -4.930 1.00 24.42 C ATOM 876 CD2 LEU A 62 3.262 -9.455 -6.359 1.00 31.23 C ATOM 0 H LEU A 62 3.443 -5.653 -5.238 1.00 72.11 H new ATOM 0 HA LEU A 62 1.856 -6.683 -3.000 1.00 73.34 H new ATOM 0 HB2 LEU A 62 2.789 -8.856 -3.636 1.00 63.12 H new ATOM 0 HB3 LEU A 62 1.718 -8.113 -4.807 1.00 63.12 H new ATOM 0 HG LEU A 62 3.828 -7.408 -6.073 1.00 44.31 H new ATOM 0 HD11 LEU A 62 5.823 -8.792 -5.758 1.00 24.42 H new ATOM 0 HD12 LEU A 62 5.488 -7.754 -4.351 1.00 24.42 H new ATOM 0 HD13 LEU A 62 5.100 -9.490 -4.289 1.00 24.42 H new ATOM 0 HD21 LEU A 62 3.994 -9.641 -7.145 1.00 31.23 H new ATOM 0 HD22 LEU A 62 3.139 -10.355 -5.756 1.00 31.23 H new ATOM 0 HD23 LEU A 62 2.306 -9.187 -6.810 1.00 31.23 H new ATOM 888 N LEU A 63 3.672 -7.077 -1.397 1.00 24.05 N ATOM 889 CA LEU A 63 4.675 -7.038 -0.362 1.00 12.20 C ATOM 890 C LEU A 63 5.703 -8.119 -0.633 1.00 12.23 C ATOM 891 O LEU A 63 5.361 -9.307 -0.680 1.00 12.42 O ATOM 892 CB LEU A 63 4.043 -7.220 1.029 1.00 40.41 C ATOM 893 CG LEU A 63 3.179 -6.061 1.603 1.00 62.34 C ATOM 894 CD1 LEU A 63 3.936 -4.741 1.608 1.00 43.55 C ATOM 895 CD2 LEU A 63 1.841 -5.923 0.889 1.00 30.03 C ATOM 0 H LEU A 63 2.781 -7.481 -1.109 1.00 24.05 H new ATOM 0 HA LEU A 63 5.162 -6.063 -0.370 1.00 12.20 H new ATOM 0 HB2 LEU A 63 3.421 -8.114 0.997 1.00 40.41 H new ATOM 0 HB3 LEU A 63 4.848 -7.417 1.737 1.00 40.41 H new ATOM 0 HG LEU A 63 2.963 -6.325 2.638 1.00 62.34 H new ATOM 0 HD11 LEU A 63 3.298 -3.957 2.016 1.00 43.55 H new ATOM 0 HD12 LEU A 63 4.831 -4.837 2.223 1.00 43.55 H new ATOM 0 HD13 LEU A 63 4.222 -4.482 0.589 1.00 43.55 H new ATOM 0 HD21 LEU A 63 1.277 -5.100 1.328 1.00 30.03 H new ATOM 0 HD22 LEU A 63 2.012 -5.722 -0.169 1.00 30.03 H new ATOM 0 HD23 LEU A 63 1.275 -6.848 0.996 1.00 30.03 H new ATOM 907 N ASP A 64 6.939 -7.716 -0.842 1.00 25.22 N ATOM 908 CA ASP A 64 7.967 -8.644 -1.231 1.00 42.12 C ATOM 909 C ASP A 64 9.131 -8.647 -0.245 1.00 61.43 C ATOM 910 O ASP A 64 9.784 -9.676 -0.050 1.00 71.52 O ATOM 911 CB ASP A 64 8.459 -8.308 -2.649 1.00 33.33 C ATOM 912 CG ASP A 64 9.496 -9.277 -3.161 1.00 34.30 C ATOM 913 OD1 ASP A 64 9.123 -10.315 -3.759 1.00 15.12 O ATOM 914 OD2 ASP A 64 10.697 -9.032 -2.976 1.00 42.02 O ATOM 0 H ASP A 64 7.251 -6.750 -0.748 1.00 25.22 H new ATOM 0 HA ASP A 64 7.539 -9.646 -1.225 1.00 42.12 H new ATOM 0 HB2 ASP A 64 7.608 -8.302 -3.330 1.00 33.33 H new ATOM 0 HB3 ASP A 64 8.878 -7.302 -2.653 1.00 33.33 H new ATOM 919 N GLN A 65 9.376 -7.530 0.411 1.00 53.12 N ATOM 920 CA GLN A 65 10.503 -7.454 1.314 1.00 24.24 C ATOM 921 C GLN A 65 10.094 -7.171 2.751 1.00 61.00 C ATOM 922 O GLN A 65 9.073 -6.527 2.985 1.00 71.14 O ATOM 923 CB GLN A 65 11.557 -6.455 0.843 1.00 71.51 C ATOM 924 CG GLN A 65 11.105 -5.022 0.668 1.00 21.31 C ATOM 925 CD GLN A 65 12.279 -4.070 0.467 1.00 61.12 C ATOM 926 OE1 GLN A 65 12.175 -3.066 -0.222 1.00 32.24 O ATOM 927 NE2 GLN A 65 13.394 -4.353 1.099 1.00 10.42 N ATOM 0 H GLN A 65 8.820 -6.678 0.337 1.00 53.12 H new ATOM 0 HA GLN A 65 10.954 -8.446 1.299 1.00 24.24 H new ATOM 0 HB2 GLN A 65 12.380 -6.467 1.557 1.00 71.51 H new ATOM 0 HB3 GLN A 65 11.956 -6.805 -0.109 1.00 71.51 H new ATOM 0 HG2 GLN A 65 10.435 -4.956 -0.189 1.00 21.31 H new ATOM 0 HG3 GLN A 65 10.534 -4.713 1.544 1.00 21.31 H new ATOM 0 HE21 GLN A 65 13.457 -5.197 1.668 1.00 10.42 H new ATOM 0 HE22 GLN A 65 14.197 -3.729 1.021 1.00 10.42 H new ATOM 936 N PRO A 66 10.923 -7.644 3.741 1.00 41.32 N ATOM 937 CA PRO A 66 10.670 -7.479 5.192 1.00 71.40 C ATOM 938 C PRO A 66 10.409 -6.034 5.623 1.00 24.43 C ATOM 939 O PRO A 66 9.756 -5.795 6.635 1.00 0.31 O ATOM 940 CB PRO A 66 11.955 -7.991 5.837 1.00 13.42 C ATOM 941 CG PRO A 66 12.484 -8.976 4.870 1.00 60.21 C ATOM 942 CD PRO A 66 12.161 -8.430 3.515 1.00 50.05 C ATOM 0 HA PRO A 66 9.766 -8.013 5.487 1.00 71.40 H new ATOM 0 HB2 PRO A 66 12.664 -7.181 6.007 1.00 13.42 H new ATOM 0 HB3 PRO A 66 11.758 -8.451 6.805 1.00 13.42 H new ATOM 0 HG2 PRO A 66 13.559 -9.106 4.993 1.00 60.21 H new ATOM 0 HG3 PRO A 66 12.025 -9.954 5.017 1.00 60.21 H new ATOM 0 HD2 PRO A 66 12.968 -7.805 3.132 1.00 50.05 H new ATOM 0 HD3 PRO A 66 12.003 -9.227 2.789 1.00 50.05 H new ATOM 950 N THR A 67 10.912 -5.086 4.883 1.00 3.43 N ATOM 951 CA THR A 67 10.626 -3.713 5.188 1.00 41.40 C ATOM 952 C THR A 67 10.290 -3.014 3.891 1.00 4.45 C ATOM 953 O THR A 67 11.098 -2.958 3.000 1.00 3.53 O ATOM 954 CB THR A 67 11.852 -3.019 5.858 1.00 32.21 C ATOM 955 OG1 THR A 67 12.239 -3.732 7.056 1.00 34.24 O ATOM 956 CG2 THR A 67 11.533 -1.571 6.220 1.00 13.31 C ATOM 0 H THR A 67 11.515 -5.236 4.074 1.00 3.43 H new ATOM 0 HA THR A 67 9.793 -3.659 5.889 1.00 41.40 H new ATOM 0 HB THR A 67 12.673 -3.031 5.141 1.00 32.21 H new ATOM 0 HG1 THR A 67 13.010 -3.288 7.466 1.00 34.24 H new ATOM 0 HG21 THR A 67 12.405 -1.112 6.685 1.00 13.31 H new ATOM 0 HG22 THR A 67 11.271 -1.020 5.317 1.00 13.31 H new ATOM 0 HG23 THR A 67 10.695 -1.546 6.916 1.00 13.31 H new ATOM 964 N THR A 68 9.118 -2.485 3.805 1.00 11.44 N ATOM 965 CA THR A 68 8.685 -1.808 2.615 1.00 52.24 C ATOM 966 C THR A 68 8.462 -0.340 2.943 1.00 3.43 C ATOM 967 O THR A 68 7.587 -0.010 3.709 1.00 64.24 O ATOM 968 CB THR A 68 7.371 -2.442 2.108 1.00 2.11 C ATOM 969 OG1 THR A 68 7.563 -3.859 1.934 1.00 24.21 O ATOM 970 CG2 THR A 68 6.930 -1.827 0.786 1.00 73.35 C ATOM 0 H THR A 68 8.426 -2.506 4.555 1.00 11.44 H new ATOM 0 HA THR A 68 9.442 -1.899 1.836 1.00 52.24 H new ATOM 0 HB THR A 68 6.593 -2.252 2.848 1.00 2.11 H new ATOM 0 HG1 THR A 68 6.790 -4.239 1.467 1.00 24.21 H new ATOM 0 HG21 THR A 68 6.002 -2.296 0.458 1.00 73.35 H new ATOM 0 HG22 THR A 68 6.769 -0.757 0.918 1.00 73.35 H new ATOM 0 HG23 THR A 68 7.703 -1.987 0.034 1.00 73.35 H new ATOM 978 N THR A 69 9.241 0.519 2.381 1.00 20.14 N ATOM 979 CA THR A 69 9.145 1.918 2.687 1.00 63.44 C ATOM 980 C THR A 69 8.101 2.610 1.808 1.00 30.34 C ATOM 981 O THR A 69 8.028 2.359 0.588 1.00 32.41 O ATOM 982 CB THR A 69 10.518 2.557 2.516 1.00 71.41 C ATOM 983 OG1 THR A 69 11.118 2.008 1.331 1.00 20.14 O ATOM 984 CG2 THR A 69 11.404 2.261 3.720 1.00 21.55 C ATOM 0 H THR A 69 9.961 0.281 1.699 1.00 20.14 H new ATOM 0 HA THR A 69 8.817 2.036 3.720 1.00 63.44 H new ATOM 0 HB THR A 69 10.412 3.638 2.431 1.00 71.41 H new ATOM 0 HG1 THR A 69 12.079 2.200 1.332 1.00 20.14 H new ATOM 0 HG21 THR A 69 12.379 2.726 3.577 1.00 21.55 H new ATOM 0 HG22 THR A 69 10.939 2.661 4.621 1.00 21.55 H new ATOM 0 HG23 THR A 69 11.528 1.183 3.824 1.00 21.55 H new ATOM 992 N ALA A 70 7.283 3.450 2.428 1.00 14.23 N ATOM 993 CA ALA A 70 6.219 4.137 1.739 1.00 13.21 C ATOM 994 C ALA A 70 6.394 5.648 1.808 1.00 1.50 C ATOM 995 O ALA A 70 6.696 6.224 2.903 1.00 12.44 O ATOM 996 CB ALA A 70 4.877 3.741 2.336 1.00 23.44 C ATOM 0 H ALA A 70 7.345 3.669 3.422 1.00 14.23 H new ATOM 0 HA ALA A 70 6.253 3.844 0.690 1.00 13.21 H new ATOM 0 HB1 ALA A 70 4.077 4.263 1.811 1.00 23.44 H new ATOM 0 HB2 ALA A 70 4.736 2.665 2.233 1.00 23.44 H new ATOM 0 HB3 ALA A 70 4.855 4.011 3.392 1.00 23.44 H new ATOM 1002 N GLY A 71 6.201 6.270 0.650 1.00 41.10 N ATOM 1003 CA GLY A 71 6.286 7.691 0.484 1.00 0.23 C ATOM 1004 C GLY A 71 6.830 7.986 -0.893 1.00 71.30 C ATOM 1005 O GLY A 71 6.831 7.090 -1.758 1.00 20.15 O ATOM 0 H GLY A 71 5.976 5.775 -0.213 1.00 41.10 H new ATOM 0 HA2 GLY A 71 5.303 8.145 0.607 1.00 0.23 H new ATOM 0 HA3 GLY A 71 6.934 8.122 1.247 1.00 0.23 H new ATOM 1009 N ARG A 72 7.283 9.196 -1.125 1.00 1.13 N ATOM 1010 CA ARG A 72 7.909 9.509 -2.384 1.00 20.42 C ATOM 1011 C ARG A 72 9.348 9.778 -2.076 1.00 61.53 C ATOM 1012 O ARG A 72 9.668 10.709 -1.326 1.00 22.34 O ATOM 1013 CB ARG A 72 7.234 10.717 -3.087 1.00 73.53 C ATOM 1014 CG ARG A 72 7.619 10.895 -4.580 1.00 65.00 C ATOM 1015 CD ARG A 72 8.980 11.566 -4.807 1.00 53.11 C ATOM 1016 NE ARG A 72 8.929 13.025 -4.593 1.00 63.13 N ATOM 1017 CZ ARG A 72 9.987 13.856 -4.666 1.00 44.44 C ATOM 1018 NH1 ARG A 72 11.214 13.370 -4.753 1.00 25.32 N ATOM 1019 NH2 ARG A 72 9.811 15.170 -4.624 1.00 63.43 N ATOM 0 H ARG A 72 7.230 9.971 -0.465 1.00 1.13 H new ATOM 0 HA ARG A 72 7.806 8.681 -3.085 1.00 20.42 H new ATOM 0 HB2 ARG A 72 6.152 10.604 -3.016 1.00 73.53 H new ATOM 0 HB3 ARG A 72 7.496 11.627 -2.547 1.00 73.53 H new ATOM 0 HG2 ARG A 72 7.625 9.917 -5.060 1.00 65.00 H new ATOM 0 HG3 ARG A 72 6.848 11.487 -5.073 1.00 65.00 H new ATOM 0 HD2 ARG A 72 9.715 11.128 -4.132 1.00 53.11 H new ATOM 0 HD3 ARG A 72 9.318 11.362 -5.823 1.00 53.11 H new ATOM 0 HE ARG A 72 8.022 13.437 -4.373 1.00 63.13 H new ATOM 0 HH11 ARG A 72 11.363 12.361 -4.765 1.00 25.32 H new ATOM 0 HH12 ARG A 72 12.011 14.004 -4.808 1.00 25.32 H new ATOM 0 HH21 ARG A 72 8.871 15.556 -4.536 1.00 63.43 H new ATOM 0 HH22 ARG A 72 10.616 15.794 -4.680 1.00 63.43 H new ATOM 1033 N HIS A 73 10.201 8.984 -2.658 1.00 20.02 N ATOM 1034 CA HIS A 73 11.596 8.999 -2.390 1.00 20.10 C ATOM 1035 C HIS A 73 12.200 8.014 -3.396 1.00 13.32 C ATOM 1036 O HIS A 73 11.475 7.150 -3.893 1.00 31.01 O ATOM 1037 CB HIS A 73 11.777 8.467 -0.941 1.00 34.35 C ATOM 1038 CG HIS A 73 13.039 8.856 -0.268 1.00 60.10 C ATOM 1039 ND1 HIS A 73 13.706 8.068 0.640 1.00 52.35 N ATOM 1040 CD2 HIS A 73 13.715 10.014 -0.330 1.00 74.22 C ATOM 1041 CE1 HIS A 73 14.748 8.763 1.095 1.00 33.43 C ATOM 1042 NE2 HIS A 73 14.804 9.961 0.535 1.00 73.41 N ATOM 0 H HIS A 73 9.928 8.289 -3.353 1.00 20.02 H new ATOM 0 HA HIS A 73 12.061 9.981 -2.476 1.00 20.10 H new ATOM 0 HB2 HIS A 73 10.941 8.819 -0.337 1.00 34.35 H new ATOM 0 HB3 HIS A 73 11.719 7.379 -0.963 1.00 34.35 H new ATOM 0 HD2 HIS A 73 13.454 10.856 -0.954 1.00 74.22 H new ATOM 0 HE1 HIS A 73 15.454 8.397 1.825 1.00 33.43 H new ATOM 0 HE2 HIS A 73 15.498 10.690 0.702 1.00 73.41 H new ATOM 1050 N PRO A 74 13.479 8.126 -3.772 1.00 53.21 N ATOM 1051 CA PRO A 74 14.093 7.137 -4.656 1.00 5.15 C ATOM 1052 C PRO A 74 14.405 5.846 -3.894 1.00 21.22 C ATOM 1053 O PRO A 74 14.562 4.772 -4.482 1.00 24.42 O ATOM 1054 CB PRO A 74 15.385 7.819 -5.120 1.00 33.42 C ATOM 1055 CG PRO A 74 15.716 8.785 -4.038 1.00 2.13 C ATOM 1056 CD PRO A 74 14.406 9.240 -3.460 1.00 41.14 C ATOM 0 HA PRO A 74 13.445 6.849 -5.484 1.00 5.15 H new ATOM 0 HB2 PRO A 74 16.186 7.094 -5.261 1.00 33.42 H new ATOM 0 HB3 PRO A 74 15.243 8.327 -6.074 1.00 33.42 H new ATOM 0 HG2 PRO A 74 16.335 8.315 -3.274 1.00 2.13 H new ATOM 0 HG3 PRO A 74 16.281 9.630 -4.431 1.00 2.13 H new ATOM 0 HD2 PRO A 74 14.480 9.411 -2.386 1.00 41.14 H new ATOM 0 HD3 PRO A 74 14.073 10.176 -3.909 1.00 41.14 H new ATOM 1064 N GLU A 75 14.444 5.960 -2.573 1.00 31.02 N ATOM 1065 CA GLU A 75 14.789 4.848 -1.710 1.00 11.12 C ATOM 1066 C GLU A 75 13.559 4.068 -1.249 1.00 14.31 C ATOM 1067 O GLU A 75 13.696 3.062 -0.556 1.00 42.14 O ATOM 1068 CB GLU A 75 15.567 5.331 -0.482 1.00 54.25 C ATOM 1069 CG GLU A 75 16.871 6.050 -0.794 1.00 42.15 C ATOM 1070 CD GLU A 75 17.675 6.357 0.454 1.00 34.31 C ATOM 1071 OE1 GLU A 75 17.427 7.388 1.105 1.00 2.35 O ATOM 1072 OE2 GLU A 75 18.579 5.564 0.794 1.00 31.31 O ATOM 0 H GLU A 75 14.237 6.826 -2.075 1.00 31.02 H new ATOM 0 HA GLU A 75 15.414 4.180 -2.303 1.00 11.12 H new ATOM 0 HB2 GLU A 75 14.929 6.000 0.095 1.00 54.25 H new ATOM 0 HB3 GLU A 75 15.785 4.472 0.153 1.00 54.25 H new ATOM 0 HG2 GLU A 75 17.470 5.435 -1.466 1.00 42.15 H new ATOM 0 HG3 GLU A 75 16.653 6.979 -1.320 1.00 42.15 H new ATOM 1079 N SER A 76 12.369 4.517 -1.612 1.00 32.41 N ATOM 1080 CA SER A 76 11.178 3.828 -1.178 1.00 10.23 C ATOM 1081 C SER A 76 10.924 2.607 -2.058 1.00 25.41 C ATOM 1082 O SER A 76 11.227 2.621 -3.262 1.00 12.30 O ATOM 1083 CB SER A 76 9.969 4.780 -1.138 1.00 70.54 C ATOM 1084 OG SER A 76 9.763 5.415 -2.383 1.00 73.12 O ATOM 0 H SER A 76 12.209 5.339 -2.194 1.00 32.41 H new ATOM 0 HA SER A 76 11.329 3.473 -0.158 1.00 10.23 H new ATOM 0 HB2 SER A 76 9.075 4.221 -0.862 1.00 70.54 H new ATOM 0 HB3 SER A 76 10.125 5.534 -0.366 1.00 70.54 H new ATOM 0 HG SER A 76 10.488 6.053 -2.548 1.00 73.12 H new ATOM 1090 N ASP A 77 10.444 1.536 -1.460 1.00 10.45 N ATOM 1091 CA ASP A 77 10.172 0.322 -2.220 1.00 11.13 C ATOM 1092 C ASP A 77 8.948 0.506 -3.085 1.00 34.25 C ATOM 1093 O ASP A 77 8.916 0.078 -4.243 1.00 74.54 O ATOM 1094 CB ASP A 77 10.029 -0.908 -1.325 1.00 62.41 C ATOM 1095 CG ASP A 77 9.841 -2.184 -2.142 1.00 4.43 C ATOM 1096 OD1 ASP A 77 10.800 -2.600 -2.851 1.00 31.21 O ATOM 1097 OD2 ASP A 77 8.738 -2.766 -2.119 1.00 12.20 O ATOM 0 H ASP A 77 10.235 1.475 -0.464 1.00 10.45 H new ATOM 0 HA ASP A 77 11.034 0.142 -2.862 1.00 11.13 H new ATOM 0 HB2 ASP A 77 10.914 -1.006 -0.697 1.00 62.41 H new ATOM 0 HB3 ASP A 77 9.178 -0.775 -0.657 1.00 62.41 H new ATOM 1102 N ILE A 78 7.960 1.179 -2.554 1.00 43.44 N ATOM 1103 CA ILE A 78 6.781 1.480 -3.321 1.00 41.21 C ATOM 1104 C ILE A 78 6.782 2.956 -3.672 1.00 5.12 C ATOM 1105 O ILE A 78 7.143 3.805 -2.841 1.00 61.12 O ATOM 1106 CB ILE A 78 5.449 1.085 -2.617 1.00 10.14 C ATOM 1107 CG1 ILE A 78 5.241 1.863 -1.313 1.00 52.21 C ATOM 1108 CG2 ILE A 78 5.421 -0.417 -2.351 1.00 31.54 C ATOM 1109 CD1 ILE A 78 3.899 1.610 -0.667 1.00 15.23 C ATOM 0 H ILE A 78 7.949 1.528 -1.596 1.00 43.44 H new ATOM 0 HA ILE A 78 6.823 0.870 -4.223 1.00 41.21 H new ATOM 0 HB ILE A 78 4.630 1.346 -3.287 1.00 10.14 H new ATOM 0 HG12 ILE A 78 6.030 1.595 -0.610 1.00 52.21 H new ATOM 0 HG13 ILE A 78 5.343 2.929 -1.515 1.00 52.21 H new ATOM 0 HG21 ILE A 78 4.485 -0.682 -1.859 1.00 31.54 H new ATOM 0 HG22 ILE A 78 5.499 -0.955 -3.296 1.00 31.54 H new ATOM 0 HG23 ILE A 78 6.259 -0.688 -1.709 1.00 31.54 H new ATOM 0 HD11 ILE A 78 3.821 2.193 0.251 1.00 15.23 H new ATOM 0 HD12 ILE A 78 3.104 1.904 -1.352 1.00 15.23 H new ATOM 0 HD13 ILE A 78 3.802 0.550 -0.433 1.00 15.23 H new ATOM 1121 N PHE A 79 6.469 3.262 -4.896 1.00 0.03 N ATOM 1122 CA PHE A 79 6.430 4.629 -5.323 1.00 71.41 C ATOM 1123 C PHE A 79 5.018 5.156 -5.251 1.00 55.30 C ATOM 1124 O PHE A 79 4.112 4.646 -5.909 1.00 52.12 O ATOM 1125 CB PHE A 79 7.011 4.798 -6.737 1.00 64.11 C ATOM 1126 CG PHE A 79 6.971 6.219 -7.253 1.00 31.51 C ATOM 1127 CD1 PHE A 79 7.929 7.142 -6.863 1.00 10.11 C ATOM 1128 CD2 PHE A 79 5.968 6.632 -8.122 1.00 3.24 C ATOM 1129 CE1 PHE A 79 7.891 8.441 -7.330 1.00 14.23 C ATOM 1130 CE2 PHE A 79 5.925 7.930 -8.588 1.00 50.24 C ATOM 1131 CZ PHE A 79 6.888 8.835 -8.193 1.00 61.24 C ATOM 0 H PHE A 79 6.236 2.581 -5.619 1.00 0.03 H new ATOM 0 HA PHE A 79 7.055 5.212 -4.647 1.00 71.41 H new ATOM 0 HB2 PHE A 79 8.044 4.451 -6.738 1.00 64.11 H new ATOM 0 HB3 PHE A 79 6.459 4.157 -7.424 1.00 64.11 H new ATOM 0 HD1 PHE A 79 8.715 6.841 -6.186 1.00 10.11 H new ATOM 0 HD2 PHE A 79 5.212 5.928 -8.437 1.00 3.24 H new ATOM 0 HE1 PHE A 79 8.646 9.149 -7.020 1.00 14.23 H new ATOM 0 HE2 PHE A 79 5.138 8.237 -9.261 1.00 50.24 H new ATOM 0 HZ PHE A 79 6.857 9.851 -8.558 1.00 61.24 H new ATOM 1141 N LEU A 80 4.846 6.144 -4.431 1.00 61.21 N ATOM 1142 CA LEU A 80 3.596 6.828 -4.267 1.00 72.41 C ATOM 1143 C LEU A 80 3.897 8.277 -4.485 1.00 21.30 C ATOM 1144 O LEU A 80 4.954 8.748 -4.072 1.00 24.53 O ATOM 1145 CB LEU A 80 3.064 6.616 -2.848 1.00 61.54 C ATOM 1146 CG LEU A 80 2.891 5.162 -2.401 1.00 35.21 C ATOM 1147 CD1 LEU A 80 2.416 5.109 -0.972 1.00 2.15 C ATOM 1148 CD2 LEU A 80 1.919 4.424 -3.303 1.00 30.10 C ATOM 0 H LEU A 80 5.591 6.510 -3.838 1.00 61.21 H new ATOM 0 HA LEU A 80 2.841 6.460 -4.962 1.00 72.41 H new ATOM 0 HB2 LEU A 80 3.741 7.110 -2.151 1.00 61.54 H new ATOM 0 HB3 LEU A 80 2.099 7.117 -2.765 1.00 61.54 H new ATOM 0 HG LEU A 80 3.861 4.669 -2.472 1.00 35.21 H new ATOM 0 HD11 LEU A 80 2.297 4.069 -0.666 1.00 2.15 H new ATOM 0 HD12 LEU A 80 3.148 5.595 -0.327 1.00 2.15 H new ATOM 0 HD13 LEU A 80 1.459 5.624 -0.887 1.00 2.15 H new ATOM 0 HD21 LEU A 80 1.816 3.394 -2.961 1.00 30.10 H new ATOM 0 HD22 LEU A 80 0.947 4.916 -3.270 1.00 30.10 H new ATOM 0 HD23 LEU A 80 2.295 4.431 -4.326 1.00 30.10 H new ATOM 1160 N ASP A 81 3.032 8.970 -5.147 1.00 41.40 N ATOM 1161 CA ASP A 81 3.296 10.354 -5.451 1.00 43.41 C ATOM 1162 C ASP A 81 2.676 11.223 -4.389 1.00 31.41 C ATOM 1163 O ASP A 81 1.454 11.247 -4.231 1.00 1.35 O ATOM 1164 CB ASP A 81 2.760 10.716 -6.829 1.00 41.33 C ATOM 1165 CG ASP A 81 3.186 12.093 -7.273 1.00 35.10 C ATOM 1166 OD1 ASP A 81 4.331 12.240 -7.731 1.00 15.44 O ATOM 1167 OD2 ASP A 81 2.374 13.044 -7.224 1.00 43.42 O ATOM 0 H ASP A 81 2.140 8.613 -5.490 1.00 41.40 H new ATOM 0 HA ASP A 81 4.373 10.519 -5.463 1.00 43.41 H new ATOM 0 HB2 ASP A 81 3.107 9.981 -7.555 1.00 41.33 H new ATOM 0 HB3 ASP A 81 1.671 10.663 -6.817 1.00 41.33 H new ATOM 1172 N ASP A 82 3.502 11.942 -3.688 1.00 32.31 N ATOM 1173 CA ASP A 82 3.065 12.746 -2.560 1.00 31.13 C ATOM 1174 C ASP A 82 3.082 14.225 -2.974 1.00 63.32 C ATOM 1175 O ASP A 82 3.563 14.560 -4.066 1.00 50.41 O ATOM 1176 CB ASP A 82 4.025 12.489 -1.371 1.00 62.31 C ATOM 1177 CG ASP A 82 3.551 13.043 -0.038 1.00 13.31 C ATOM 1178 OD1 ASP A 82 3.574 14.265 0.158 1.00 22.33 O ATOM 1179 OD2 ASP A 82 3.178 12.250 0.836 1.00 31.12 O ATOM 0 H ASP A 82 4.503 11.995 -3.874 1.00 32.31 H new ATOM 0 HA ASP A 82 2.052 12.481 -2.257 1.00 31.13 H new ATOM 0 HB2 ASP A 82 4.175 11.414 -1.269 1.00 62.31 H new ATOM 0 HB3 ASP A 82 4.996 12.925 -1.605 1.00 62.31 H new ATOM 1184 N VAL A 83 2.594 15.091 -2.130 1.00 14.40 N ATOM 1185 CA VAL A 83 2.558 16.513 -2.402 1.00 65.12 C ATOM 1186 C VAL A 83 3.920 17.109 -2.042 1.00 2.34 C ATOM 1187 O VAL A 83 4.371 18.102 -2.627 1.00 34.12 O ATOM 1188 CB VAL A 83 1.455 17.223 -1.571 1.00 10.21 C ATOM 1189 CG1 VAL A 83 1.308 18.684 -1.984 1.00 51.13 C ATOM 1190 CG2 VAL A 83 0.124 16.489 -1.684 1.00 62.02 C ATOM 0 H VAL A 83 2.205 14.833 -1.223 1.00 14.40 H new ATOM 0 HA VAL A 83 2.332 16.662 -3.458 1.00 65.12 H new ATOM 0 HB VAL A 83 1.763 17.200 -0.526 1.00 10.21 H new ATOM 0 HG11 VAL A 83 0.529 19.155 -1.385 1.00 51.13 H new ATOM 0 HG12 VAL A 83 2.252 19.204 -1.824 1.00 51.13 H new ATOM 0 HG13 VAL A 83 1.038 18.739 -3.039 1.00 51.13 H new ATOM 0 HG21 VAL A 83 -0.629 17.009 -1.092 1.00 62.02 H new ATOM 0 HG22 VAL A 83 -0.189 16.462 -2.728 1.00 62.02 H new ATOM 0 HG23 VAL A 83 0.238 15.470 -1.313 1.00 62.02 H new ATOM 1200 N THR A 84 4.563 16.488 -1.089 1.00 3.34 N ATOM 1201 CA THR A 84 5.850 16.895 -0.638 1.00 54.15 C ATOM 1202 C THR A 84 6.768 15.655 -0.667 1.00 44.43 C ATOM 1203 O THR A 84 6.430 14.647 -1.311 1.00 74.11 O ATOM 1204 CB THR A 84 5.749 17.523 0.792 1.00 24.14 C ATOM 1205 OG1 THR A 84 7.009 18.089 1.192 1.00 74.51 O ATOM 1206 CG2 THR A 84 5.289 16.501 1.836 1.00 45.51 C ATOM 0 H THR A 84 4.193 15.672 -0.601 1.00 3.34 H new ATOM 0 HA THR A 84 6.269 17.666 -1.285 1.00 54.15 H new ATOM 0 HB THR A 84 5.000 18.313 0.738 1.00 24.14 H new ATOM 0 HG1 THR A 84 7.383 17.565 1.931 1.00 74.51 H new ATOM 0 HG21 THR A 84 5.233 16.980 2.814 1.00 45.51 H new ATOM 0 HG22 THR A 84 4.306 16.119 1.562 1.00 45.51 H new ATOM 0 HG23 THR A 84 6.001 15.676 1.876 1.00 45.51 H new ATOM 1214 N VAL A 85 7.906 15.708 -0.028 1.00 5.00 N ATOM 1215 CA VAL A 85 8.785 14.573 -0.046 1.00 22.01 C ATOM 1216 C VAL A 85 8.587 13.749 1.206 1.00 12.55 C ATOM 1217 O VAL A 85 9.123 14.069 2.285 1.00 22.32 O ATOM 1218 CB VAL A 85 10.277 14.972 -0.174 1.00 11.21 C ATOM 1219 CG1 VAL A 85 11.165 13.735 -0.309 1.00 53.14 C ATOM 1220 CG2 VAL A 85 10.483 15.903 -1.350 1.00 5.44 C ATOM 0 H VAL A 85 8.241 16.512 0.503 1.00 5.00 H new ATOM 0 HA VAL A 85 8.529 13.987 -0.929 1.00 22.01 H new ATOM 0 HB VAL A 85 10.563 15.498 0.737 1.00 11.21 H new ATOM 0 HG11 VAL A 85 12.207 14.043 -0.397 1.00 53.14 H new ATOM 0 HG12 VAL A 85 11.046 13.104 0.572 1.00 53.14 H new ATOM 0 HG13 VAL A 85 10.876 13.175 -1.198 1.00 53.14 H new ATOM 0 HG21 VAL A 85 11.537 16.171 -1.422 1.00 5.44 H new ATOM 0 HG22 VAL A 85 10.172 15.404 -2.268 1.00 5.44 H new ATOM 0 HG23 VAL A 85 9.888 16.805 -1.208 1.00 5.44 H new ATOM 1230 N SER A 86 7.816 12.714 1.083 1.00 75.24 N ATOM 1231 CA SER A 86 7.620 11.811 2.164 1.00 31.13 C ATOM 1232 C SER A 86 8.700 10.735 2.156 1.00 15.32 C ATOM 1233 O SER A 86 8.492 9.614 1.724 1.00 70.13 O ATOM 1234 CB SER A 86 6.196 11.249 2.177 1.00 3.14 C ATOM 1235 OG SER A 86 5.276 12.281 2.464 1.00 43.42 O ATOM 0 H SER A 86 7.308 12.475 0.231 1.00 75.24 H new ATOM 0 HA SER A 86 7.724 12.354 3.103 1.00 31.13 H new ATOM 0 HB2 SER A 86 5.964 10.801 1.211 1.00 3.14 H new ATOM 0 HB3 SER A 86 6.114 10.459 2.923 1.00 3.14 H new ATOM 0 HG SER A 86 4.403 12.057 2.080 1.00 43.42 H new ATOM 1241 N ARG A 87 9.887 11.156 2.556 1.00 11.23 N ATOM 1242 CA ARG A 87 11.071 10.301 2.616 1.00 64.54 C ATOM 1243 C ARG A 87 10.983 9.258 3.716 1.00 51.03 C ATOM 1244 O ARG A 87 11.371 8.107 3.533 1.00 11.12 O ATOM 1245 CB ARG A 87 12.346 11.152 2.734 1.00 43.45 C ATOM 1246 CG ARG A 87 12.240 12.337 3.686 1.00 14.51 C ATOM 1247 CD ARG A 87 13.512 13.153 3.680 1.00 61.22 C ATOM 1248 NE ARG A 87 13.279 14.520 4.157 1.00 54.02 N ATOM 1249 CZ ARG A 87 14.041 15.556 3.826 1.00 73.12 C ATOM 1250 NH1 ARG A 87 15.312 15.363 3.490 1.00 31.14 N ATOM 1251 NH2 ARG A 87 13.572 16.787 3.956 1.00 35.21 N ATOM 0 H ARG A 87 10.063 12.115 2.854 1.00 11.23 H new ATOM 0 HA ARG A 87 11.119 9.745 1.680 1.00 64.54 H new ATOM 0 HB2 ARG A 87 13.164 10.511 3.064 1.00 43.45 H new ATOM 0 HB3 ARG A 87 12.611 11.523 1.744 1.00 43.45 H new ATOM 0 HG2 ARG A 87 11.399 12.967 3.396 1.00 14.51 H new ATOM 0 HG3 ARG A 87 12.038 11.980 4.696 1.00 14.51 H new ATOM 0 HD2 ARG A 87 14.258 12.669 4.310 1.00 61.22 H new ATOM 0 HD3 ARG A 87 13.920 13.184 2.670 1.00 61.22 H new ATOM 0 HE ARG A 87 12.487 14.684 4.778 1.00 54.02 H new ATOM 0 HH11 ARG A 87 15.701 14.420 3.487 1.00 31.14 H new ATOM 0 HH12 ARG A 87 15.899 16.158 3.235 1.00 31.14 H new ATOM 0 HH21 ARG A 87 12.627 16.938 4.310 1.00 35.21 H new ATOM 0 HH22 ARG A 87 14.155 17.584 3.702 1.00 35.21 H new ATOM 1265 N ARG A 88 10.471 9.656 4.846 1.00 43.02 N ATOM 1266 CA ARG A 88 10.286 8.762 5.964 1.00 11.30 C ATOM 1267 C ARG A 88 8.924 9.005 6.547 1.00 72.02 C ATOM 1268 O ARG A 88 8.773 9.718 7.533 1.00 1.23 O ATOM 1269 CB ARG A 88 11.386 8.928 7.043 1.00 35.23 C ATOM 1270 CG ARG A 88 12.795 8.500 6.614 1.00 4.35 C ATOM 1271 CD ARG A 88 12.887 6.990 6.392 1.00 72.24 C ATOM 1272 NE ARG A 88 12.660 6.235 7.638 1.00 43.42 N ATOM 1273 CZ ARG A 88 12.184 4.978 7.720 1.00 42.44 C ATOM 1274 NH1 ARG A 88 11.865 4.288 6.631 1.00 23.22 N ATOM 1275 NH2 ARG A 88 12.035 4.409 8.888 1.00 60.04 N ATOM 0 H ARG A 88 10.167 10.614 5.023 1.00 43.02 H new ATOM 0 HA ARG A 88 10.366 7.736 5.606 1.00 11.30 H new ATOM 0 HB2 ARG A 88 11.419 9.974 7.347 1.00 35.23 H new ATOM 0 HB3 ARG A 88 11.100 8.350 7.922 1.00 35.23 H new ATOM 0 HG2 ARG A 88 13.069 9.020 5.696 1.00 4.35 H new ATOM 0 HG3 ARG A 88 13.514 8.800 7.377 1.00 4.35 H new ATOM 0 HD2 ARG A 88 12.152 6.688 5.646 1.00 72.24 H new ATOM 0 HD3 ARG A 88 13.870 6.741 5.991 1.00 72.24 H new ATOM 0 HE ARG A 88 12.883 6.706 8.515 1.00 43.42 H new ATOM 0 HH11 ARG A 88 11.979 4.709 5.709 1.00 23.22 H new ATOM 0 HH12 ARG A 88 11.506 3.337 6.717 1.00 23.22 H new ATOM 0 HH21 ARG A 88 12.279 4.917 9.738 1.00 60.04 H new ATOM 0 HH22 ARG A 88 11.674 3.457 8.949 1.00 60.04 H new ATOM 1289 N HIS A 89 7.920 8.549 5.842 1.00 41.51 N ATOM 1290 CA HIS A 89 6.576 8.698 6.324 1.00 33.42 C ATOM 1291 C HIS A 89 6.091 7.401 6.947 1.00 35.24 C ATOM 1292 O HIS A 89 5.700 7.381 8.126 1.00 35.44 O ATOM 1293 CB HIS A 89 5.646 9.177 5.193 1.00 51.50 C ATOM 1294 CG HIS A 89 4.200 9.329 5.582 1.00 60.30 C ATOM 1295 ND1 HIS A 89 3.200 9.137 4.681 1.00 75.32 N ATOM 1296 CD2 HIS A 89 3.658 9.644 6.774 1.00 51.41 C ATOM 1297 CE1 HIS A 89 2.079 9.331 5.336 1.00 25.00 C ATOM 1298 NE2 HIS A 89 2.304 9.637 6.609 1.00 71.22 N ATOM 0 H HIS A 89 8.008 8.077 4.942 1.00 41.51 H new ATOM 0 HA HIS A 89 6.560 9.461 7.102 1.00 33.42 H new ATOM 0 HB2 HIS A 89 6.011 10.136 4.824 1.00 51.50 H new ATOM 0 HB3 HIS A 89 5.712 8.471 4.365 1.00 51.50 H new ATOM 0 HD1 HIS A 89 3.300 8.892 3.696 1.00 75.32 H new ATOM 0 HD2 HIS A 89 4.193 9.861 7.687 1.00 51.41 H new ATOM 0 HE1 HIS A 89 1.096 9.252 4.895 1.00 25.00 H new ATOM 1306 N ALA A 90 6.183 6.308 6.208 1.00 11.14 N ATOM 1307 CA ALA A 90 5.722 5.044 6.736 1.00 64.44 C ATOM 1308 C ALA A 90 6.494 3.898 6.146 1.00 62.01 C ATOM 1309 O ALA A 90 7.186 4.055 5.128 1.00 1.33 O ATOM 1310 CB ALA A 90 4.226 4.868 6.462 1.00 35.42 C ATOM 0 H ALA A 90 6.564 6.273 5.263 1.00 11.14 H new ATOM 0 HA ALA A 90 5.888 5.048 7.813 1.00 64.44 H new ATOM 0 HB1 ALA A 90 3.892 3.912 6.865 1.00 35.42 H new ATOM 0 HB2 ALA A 90 3.671 5.676 6.939 1.00 35.42 H new ATOM 0 HB3 ALA A 90 4.048 4.891 5.387 1.00 35.42 H new ATOM 1316 N GLU A 91 6.414 2.771 6.794 1.00 0.24 N ATOM 1317 CA GLU A 91 6.981 1.560 6.303 1.00 62.04 C ATOM 1318 C GLU A 91 6.096 0.398 6.697 1.00 31.50 C ATOM 1319 O GLU A 91 5.433 0.420 7.739 1.00 14.44 O ATOM 1320 CB GLU A 91 8.453 1.350 6.760 1.00 33.15 C ATOM 1321 CG GLU A 91 8.683 1.278 8.266 1.00 74.33 C ATOM 1322 CD GLU A 91 10.155 1.102 8.615 1.00 13.32 C ATOM 1323 OE1 GLU A 91 10.937 2.066 8.435 1.00 2.23 O ATOM 1324 OE2 GLU A 91 10.560 0.001 9.063 1.00 41.31 O ATOM 0 H GLU A 91 5.943 2.672 7.694 1.00 0.24 H new ATOM 0 HA GLU A 91 7.025 1.624 5.216 1.00 62.04 H new ATOM 0 HB2 GLU A 91 8.823 0.428 6.312 1.00 33.15 H new ATOM 0 HB3 GLU A 91 9.056 2.164 6.359 1.00 33.15 H new ATOM 0 HG2 GLU A 91 8.307 2.188 8.733 1.00 74.33 H new ATOM 0 HG3 GLU A 91 8.111 0.447 8.680 1.00 74.33 H new ATOM 1331 N PHE A 92 6.038 -0.567 5.857 1.00 25.11 N ATOM 1332 CA PHE A 92 5.285 -1.746 6.113 1.00 50.44 C ATOM 1333 C PHE A 92 6.282 -2.789 6.448 1.00 53.10 C ATOM 1334 O PHE A 92 7.175 -3.089 5.652 1.00 33.14 O ATOM 1335 CB PHE A 92 4.461 -2.160 4.893 1.00 34.03 C ATOM 1336 CG PHE A 92 3.596 -1.060 4.354 1.00 74.45 C ATOM 1337 CD1 PHE A 92 2.567 -0.540 5.110 1.00 32.31 C ATOM 1338 CD2 PHE A 92 3.816 -0.547 3.090 1.00 50.12 C ATOM 1339 CE1 PHE A 92 1.772 0.475 4.621 1.00 42.12 C ATOM 1340 CE2 PHE A 92 3.023 0.466 2.596 1.00 4.55 C ATOM 1341 CZ PHE A 92 1.999 0.977 3.362 1.00 14.51 C ATOM 0 H PHE A 92 6.518 -0.564 4.957 1.00 25.11 H new ATOM 0 HA PHE A 92 4.571 -1.589 6.922 1.00 50.44 H new ATOM 0 HB2 PHE A 92 5.136 -2.499 4.107 1.00 34.03 H new ATOM 0 HB3 PHE A 92 3.831 -3.009 5.161 1.00 34.03 H new ATOM 0 HD1 PHE A 92 2.381 -0.933 6.099 1.00 32.31 H new ATOM 0 HD2 PHE A 92 4.617 -0.944 2.484 1.00 50.12 H new ATOM 0 HE1 PHE A 92 0.972 0.875 5.227 1.00 42.12 H new ATOM 0 HE2 PHE A 92 3.205 0.860 1.607 1.00 4.55 H new ATOM 0 HZ PHE A 92 1.376 1.770 2.975 1.00 14.51 H new ATOM 1351 N ARG A 93 6.178 -3.299 7.610 1.00 31.14 N ATOM 1352 CA ARG A 93 7.155 -4.182 8.108 1.00 65.23 C ATOM 1353 C ARG A 93 6.582 -5.580 8.163 1.00 24.12 C ATOM 1354 O ARG A 93 5.452 -5.794 8.604 1.00 74.50 O ATOM 1355 CB ARG A 93 7.624 -3.681 9.456 1.00 3.11 C ATOM 1356 CG ARG A 93 8.857 -4.351 9.959 1.00 2.23 C ATOM 1357 CD ARG A 93 9.372 -3.645 11.190 1.00 62.20 C ATOM 1358 NE ARG A 93 10.578 -4.278 11.684 1.00 31.13 N ATOM 1359 CZ ARG A 93 11.806 -3.768 11.600 1.00 53.44 C ATOM 1360 NH1 ARG A 93 12.014 -2.568 11.027 1.00 72.23 N ATOM 1361 NH2 ARG A 93 12.831 -4.469 12.059 1.00 74.54 N ATOM 0 H ARG A 93 5.405 -3.115 8.250 1.00 31.14 H new ATOM 0 HA ARG A 93 8.026 -4.220 7.453 1.00 65.23 H new ATOM 0 HB2 ARG A 93 7.808 -2.609 9.389 1.00 3.11 H new ATOM 0 HB3 ARG A 93 6.824 -3.823 10.183 1.00 3.11 H new ATOM 0 HG2 ARG A 93 8.643 -5.394 10.192 1.00 2.23 H new ATOM 0 HG3 ARG A 93 9.623 -4.349 9.183 1.00 2.23 H new ATOM 0 HD2 ARG A 93 9.575 -2.600 10.956 1.00 62.20 H new ATOM 0 HD3 ARG A 93 8.607 -3.655 11.966 1.00 62.20 H new ATOM 0 HE ARG A 93 10.479 -5.189 12.133 1.00 31.13 H new ATOM 0 HH11 ARG A 93 11.227 -2.039 10.651 1.00 72.23 H new ATOM 0 HH12 ARG A 93 12.959 -2.188 10.968 1.00 72.23 H new ATOM 0 HH21 ARG A 93 12.676 -5.389 12.471 1.00 74.54 H new ATOM 0 HH22 ARG A 93 13.776 -4.089 12.000 1.00 74.54 H new ATOM 1375 N ILE A 94 7.332 -6.502 7.677 1.00 45.15 N ATOM 1376 CA ILE A 94 6.902 -7.851 7.520 1.00 25.34 C ATOM 1377 C ILE A 94 7.887 -8.761 8.209 1.00 22.35 C ATOM 1378 O ILE A 94 9.092 -8.703 7.942 1.00 64.30 O ATOM 1379 CB ILE A 94 6.887 -8.204 6.012 1.00 4.23 C ATOM 1380 CG1 ILE A 94 6.059 -7.174 5.247 1.00 24.41 C ATOM 1381 CG2 ILE A 94 6.351 -9.618 5.774 1.00 52.52 C ATOM 1382 CD1 ILE A 94 6.122 -7.327 3.760 1.00 4.43 C ATOM 0 H ILE A 94 8.290 -6.338 7.368 1.00 45.15 H new ATOM 0 HA ILE A 94 5.907 -7.973 7.948 1.00 25.34 H new ATOM 0 HB ILE A 94 7.913 -8.179 5.644 1.00 4.23 H new ATOM 0 HG12 ILE A 94 5.019 -7.249 5.566 1.00 24.41 H new ATOM 0 HG13 ILE A 94 6.403 -6.175 5.514 1.00 24.41 H new ATOM 0 HG21 ILE A 94 6.354 -9.833 4.705 1.00 52.52 H new ATOM 0 HG22 ILE A 94 6.984 -10.339 6.291 1.00 52.52 H new ATOM 0 HG23 ILE A 94 5.333 -9.690 6.156 1.00 52.52 H new ATOM 0 HD11 ILE A 94 5.508 -6.559 3.289 1.00 4.43 H new ATOM 0 HD12 ILE A 94 7.154 -7.222 3.427 1.00 4.43 H new ATOM 0 HD13 ILE A 94 5.749 -8.312 3.479 1.00 4.43 H new ATOM 1394 N ASN A 95 7.408 -9.557 9.109 1.00 45.53 N ATOM 1395 CA ASN A 95 8.252 -10.540 9.739 1.00 11.23 C ATOM 1396 C ASN A 95 7.596 -11.886 9.775 1.00 4.12 C ATOM 1397 O ASN A 95 6.507 -12.030 10.310 1.00 60.44 O ATOM 1398 CB ASN A 95 8.804 -10.105 11.138 1.00 63.21 C ATOM 1399 CG ASN A 95 7.794 -9.661 12.217 1.00 61.33 C ATOM 1400 OD1 ASN A 95 8.120 -8.814 13.033 1.00 53.42 O ATOM 1401 ND2 ASN A 95 6.631 -10.236 12.283 1.00 54.02 N ATOM 0 H ASN A 95 6.440 -9.552 9.429 1.00 45.53 H new ATOM 0 HA ASN A 95 9.136 -10.621 9.106 1.00 11.23 H new ATOM 0 HB2 ASN A 95 9.378 -10.939 11.543 1.00 63.21 H new ATOM 0 HB3 ASN A 95 9.503 -9.284 10.979 1.00 63.21 H new ATOM 0 HD21 ASN A 95 5.977 -9.981 13.023 1.00 54.02 H new ATOM 0 HD22 ASN A 95 6.371 -10.942 11.594 1.00 54.02 H new ATOM 1408 N GLU A 96 8.221 -12.850 9.117 1.00 21.44 N ATOM 1409 CA GLU A 96 7.790 -14.254 9.116 1.00 53.42 C ATOM 1410 C GLU A 96 6.325 -14.406 8.657 1.00 70.43 C ATOM 1411 O GLU A 96 5.578 -15.264 9.143 1.00 12.45 O ATOM 1412 CB GLU A 96 8.009 -14.842 10.511 1.00 53.31 C ATOM 1413 CG GLU A 96 9.458 -14.763 10.962 1.00 63.43 C ATOM 1414 CD GLU A 96 9.663 -15.286 12.347 1.00 23.52 C ATOM 1415 OE1 GLU A 96 9.496 -14.522 13.313 1.00 70.41 O ATOM 1416 OE2 GLU A 96 9.986 -16.471 12.499 1.00 41.35 O ATOM 0 H GLU A 96 9.057 -12.684 8.557 1.00 21.44 H new ATOM 0 HA GLU A 96 8.391 -14.808 8.395 1.00 53.42 H new ATOM 0 HB2 GLU A 96 7.381 -14.311 11.227 1.00 53.31 H new ATOM 0 HB3 GLU A 96 7.688 -15.884 10.516 1.00 53.31 H new ATOM 0 HG2 GLU A 96 10.081 -15.329 10.269 1.00 63.43 H new ATOM 0 HG3 GLU A 96 9.792 -13.726 10.917 1.00 63.43 H new ATOM 1423 N GLY A 97 5.945 -13.600 7.685 1.00 23.34 N ATOM 1424 CA GLY A 97 4.605 -13.649 7.135 1.00 51.33 C ATOM 1425 C GLY A 97 3.598 -12.809 7.897 1.00 45.42 C ATOM 1426 O GLY A 97 2.413 -12.851 7.602 1.00 44.13 O ATOM 0 H GLY A 97 6.550 -12.899 7.258 1.00 23.34 H new ATOM 0 HA2 GLY A 97 4.635 -13.312 6.099 1.00 51.33 H new ATOM 0 HA3 GLY A 97 4.265 -14.685 7.123 1.00 51.33 H new ATOM 1430 N GLU A 98 4.058 -12.053 8.867 1.00 62.41 N ATOM 1431 CA GLU A 98 3.186 -11.157 9.588 1.00 33.13 C ATOM 1432 C GLU A 98 3.424 -9.767 9.037 1.00 43.01 C ATOM 1433 O GLU A 98 4.578 -9.329 8.933 1.00 34.22 O ATOM 1434 CB GLU A 98 3.531 -11.181 11.076 1.00 15.14 C ATOM 1435 CG GLU A 98 3.512 -12.562 11.699 1.00 52.14 C ATOM 1436 CD GLU A 98 3.913 -12.543 13.155 1.00 63.24 C ATOM 1437 OE1 GLU A 98 3.109 -12.110 14.007 1.00 74.34 O ATOM 1438 OE2 GLU A 98 5.042 -12.949 13.477 1.00 24.25 O ATOM 0 H GLU A 98 5.031 -12.041 9.174 1.00 62.41 H new ATOM 0 HA GLU A 98 2.144 -11.454 9.471 1.00 33.13 H new ATOM 0 HB2 GLU A 98 4.521 -10.747 11.214 1.00 15.14 H new ATOM 0 HB3 GLU A 98 2.826 -10.544 11.611 1.00 15.14 H new ATOM 0 HG2 GLU A 98 2.512 -12.986 11.606 1.00 52.14 H new ATOM 0 HG3 GLU A 98 4.188 -13.216 11.147 1.00 52.14 H new ATOM 1445 N PHE A 99 2.362 -9.080 8.700 1.00 34.23 N ATOM 1446 CA PHE A 99 2.450 -7.784 8.049 1.00 71.35 C ATOM 1447 C PHE A 99 1.950 -6.698 8.991 1.00 42.43 C ATOM 1448 O PHE A 99 0.835 -6.786 9.513 1.00 71.42 O ATOM 1449 CB PHE A 99 1.582 -7.772 6.766 1.00 34.55 C ATOM 1450 CG PHE A 99 1.912 -8.843 5.746 1.00 60.00 C ATOM 1451 CD1 PHE A 99 1.349 -10.109 5.835 1.00 11.52 C ATOM 1452 CD2 PHE A 99 2.775 -8.581 4.702 1.00 24.51 C ATOM 1453 CE1 PHE A 99 1.649 -11.086 4.905 1.00 51.32 C ATOM 1454 CE2 PHE A 99 3.078 -9.556 3.768 1.00 45.43 C ATOM 1455 CZ PHE A 99 2.514 -10.807 3.872 1.00 63.10 C ATOM 0 H PHE A 99 1.407 -9.398 8.867 1.00 34.23 H new ATOM 0 HA PHE A 99 3.491 -7.597 7.787 1.00 71.35 H new ATOM 0 HB2 PHE A 99 0.536 -7.879 7.055 1.00 34.55 H new ATOM 0 HB3 PHE A 99 1.683 -6.797 6.289 1.00 34.55 H new ATOM 0 HD1 PHE A 99 0.667 -10.333 6.642 1.00 11.52 H new ATOM 0 HD2 PHE A 99 3.220 -7.601 4.612 1.00 24.51 H new ATOM 0 HE1 PHE A 99 1.205 -12.067 4.989 1.00 51.32 H new ATOM 0 HE2 PHE A 99 3.757 -9.335 2.958 1.00 45.43 H new ATOM 0 HZ PHE A 99 2.750 -11.569 3.144 1.00 63.10 H new ATOM 1465 N GLU A 100 2.761 -5.714 9.238 1.00 20.33 N ATOM 1466 CA GLU A 100 2.372 -4.601 10.077 1.00 25.40 C ATOM 1467 C GLU A 100 2.693 -3.266 9.403 1.00 23.25 C ATOM 1468 O GLU A 100 3.632 -3.169 8.615 1.00 45.43 O ATOM 1469 CB GLU A 100 3.024 -4.694 11.453 1.00 22.55 C ATOM 1470 CG GLU A 100 4.533 -4.651 11.430 1.00 32.14 C ATOM 1471 CD GLU A 100 5.122 -4.817 12.785 1.00 71.41 C ATOM 1472 OE1 GLU A 100 5.253 -3.829 13.500 1.00 51.44 O ATOM 1473 OE2 GLU A 100 5.453 -5.952 13.158 1.00 42.04 O ATOM 0 H GLU A 100 3.710 -5.652 8.869 1.00 20.33 H new ATOM 0 HA GLU A 100 1.292 -4.652 10.218 1.00 25.40 H new ATOM 0 HB2 GLU A 100 2.658 -3.874 12.071 1.00 22.55 H new ATOM 0 HB3 GLU A 100 2.706 -5.621 11.931 1.00 22.55 H new ATOM 0 HG2 GLU A 100 4.907 -5.438 10.775 1.00 32.14 H new ATOM 0 HG3 GLU A 100 4.861 -3.701 11.007 1.00 32.14 H new ATOM 1480 N VAL A 101 1.900 -2.270 9.679 1.00 74.33 N ATOM 1481 CA VAL A 101 2.118 -0.940 9.165 1.00 15.50 C ATOM 1482 C VAL A 101 2.712 -0.130 10.295 1.00 64.42 C ATOM 1483 O VAL A 101 2.146 -0.091 11.395 1.00 4.31 O ATOM 1484 CB VAL A 101 0.771 -0.257 8.773 1.00 2.24 C ATOM 1485 CG1 VAL A 101 1.003 1.122 8.167 1.00 44.10 C ATOM 1486 CG2 VAL A 101 -0.054 -1.123 7.840 1.00 31.34 C ATOM 0 H VAL A 101 1.075 -2.355 10.273 1.00 74.33 H new ATOM 0 HA VAL A 101 2.759 -0.993 8.285 1.00 15.50 H new ATOM 0 HB VAL A 101 0.201 -0.132 9.693 1.00 2.24 H new ATOM 0 HG11 VAL A 101 0.045 1.570 7.905 1.00 44.10 H new ATOM 0 HG12 VAL A 101 1.514 1.756 8.891 1.00 44.10 H new ATOM 0 HG13 VAL A 101 1.616 1.027 7.271 1.00 44.10 H new ATOM 0 HG21 VAL A 101 -0.983 -0.609 7.593 1.00 31.34 H new ATOM 0 HG22 VAL A 101 0.510 -1.313 6.927 1.00 31.34 H new ATOM 0 HG23 VAL A 101 -0.282 -2.070 8.329 1.00 31.34 H new ATOM 1496 N VAL A 102 3.859 0.442 10.064 1.00 24.31 N ATOM 1497 CA VAL A 102 4.488 1.285 11.045 1.00 74.32 C ATOM 1498 C VAL A 102 4.681 2.685 10.469 1.00 30.54 C ATOM 1499 O VAL A 102 5.294 2.852 9.402 1.00 23.15 O ATOM 1500 CB VAL A 102 5.873 0.725 11.497 1.00 64.21 C ATOM 1501 CG1 VAL A 102 6.472 1.581 12.605 1.00 71.34 C ATOM 1502 CG2 VAL A 102 5.770 -0.728 11.945 1.00 24.35 C ATOM 0 H VAL A 102 4.384 0.339 9.195 1.00 24.31 H new ATOM 0 HA VAL A 102 3.835 1.316 11.917 1.00 74.32 H new ATOM 0 HB VAL A 102 6.536 0.763 10.633 1.00 64.21 H new ATOM 0 HG11 VAL A 102 7.437 1.169 12.902 1.00 71.34 H new ATOM 0 HG12 VAL A 102 6.608 2.600 12.244 1.00 71.34 H new ATOM 0 HG13 VAL A 102 5.800 1.587 13.464 1.00 71.34 H new ATOM 0 HG21 VAL A 102 6.753 -1.084 12.253 1.00 24.35 H new ATOM 0 HG22 VAL A 102 5.078 -0.802 12.784 1.00 24.35 H new ATOM 0 HG23 VAL A 102 5.405 -1.338 11.119 1.00 24.35 H new ATOM 1512 N ASP A 103 4.145 3.660 11.129 1.00 41.43 N ATOM 1513 CA ASP A 103 4.389 5.037 10.775 1.00 74.32 C ATOM 1514 C ASP A 103 5.725 5.429 11.355 1.00 62.25 C ATOM 1515 O ASP A 103 5.988 5.212 12.543 1.00 45.12 O ATOM 1516 CB ASP A 103 3.299 5.942 11.339 1.00 21.14 C ATOM 1517 CG ASP A 103 3.548 7.406 11.091 1.00 63.54 C ATOM 1518 OD1 ASP A 103 4.374 8.007 11.793 1.00 31.42 O ATOM 1519 OD2 ASP A 103 2.891 8.000 10.226 1.00 22.31 O ATOM 0 H ASP A 103 3.525 3.534 11.929 1.00 41.43 H new ATOM 0 HA ASP A 103 4.387 5.147 9.691 1.00 74.32 H new ATOM 0 HB2 ASP A 103 2.342 5.664 10.897 1.00 21.14 H new ATOM 0 HB3 ASP A 103 3.216 5.772 12.412 1.00 21.14 H new ATOM 1524 N VAL A 104 6.563 5.988 10.550 1.00 51.52 N ATOM 1525 CA VAL A 104 7.883 6.337 10.990 1.00 13.15 C ATOM 1526 C VAL A 104 8.136 7.815 10.848 1.00 64.20 C ATOM 1527 O VAL A 104 9.283 8.245 10.820 1.00 12.24 O ATOM 1528 CB VAL A 104 8.979 5.532 10.244 1.00 1.13 C ATOM 1529 CG1 VAL A 104 8.913 4.061 10.625 1.00 52.13 C ATOM 1530 CG2 VAL A 104 8.845 5.695 8.732 1.00 70.30 C ATOM 0 H VAL A 104 6.362 6.217 9.577 1.00 51.52 H new ATOM 0 HA VAL A 104 7.938 6.075 12.047 1.00 13.15 H new ATOM 0 HB VAL A 104 9.949 5.927 10.544 1.00 1.13 H new ATOM 0 HG11 VAL A 104 9.689 3.512 10.092 1.00 52.13 H new ATOM 0 HG12 VAL A 104 9.067 3.956 11.699 1.00 52.13 H new ATOM 0 HG13 VAL A 104 7.936 3.659 10.357 1.00 52.13 H new ATOM 0 HG21 VAL A 104 9.626 5.120 8.233 1.00 70.30 H new ATOM 0 HG22 VAL A 104 7.868 5.333 8.412 1.00 70.30 H new ATOM 0 HG23 VAL A 104 8.946 6.748 8.469 1.00 70.30 H new ATOM 1540 N GLY A 105 7.083 8.604 10.836 1.00 53.32 N ATOM 1541 CA GLY A 105 7.288 10.011 10.673 1.00 12.22 C ATOM 1542 C GLY A 105 6.057 10.839 10.878 1.00 61.02 C ATOM 1543 O GLY A 105 6.144 11.923 11.463 1.00 22.20 O ATOM 0 H GLY A 105 6.114 8.302 10.934 1.00 53.32 H new ATOM 0 HA2 GLY A 105 8.054 10.339 11.376 1.00 12.22 H new ATOM 0 HA3 GLY A 105 7.674 10.197 9.671 1.00 12.22 H new ATOM 1547 N SER A 106 4.899 10.327 10.415 1.00 73.42 N ATOM 1548 CA SER A 106 3.624 11.066 10.437 1.00 70.20 C ATOM 1549 C SER A 106 3.759 12.327 9.592 1.00 13.12 C ATOM 1550 O SER A 106 3.084 13.323 9.805 1.00 1.23 O ATOM 1551 CB SER A 106 3.205 11.386 11.884 1.00 12.12 C ATOM 1552 OG SER A 106 3.064 10.183 12.645 1.00 61.20 O ATOM 0 H SER A 106 4.823 9.391 10.016 1.00 73.42 H new ATOM 0 HA SER A 106 2.835 10.448 10.008 1.00 70.20 H new ATOM 0 HB2 SER A 106 3.949 12.032 12.349 1.00 12.12 H new ATOM 0 HB3 SER A 106 2.263 11.934 11.883 1.00 12.12 H new ATOM 0 HG SER A 106 3.805 9.576 12.438 1.00 61.20 H new ATOM 1558 N LEU A 107 4.605 12.205 8.571 1.00 22.12 N ATOM 1559 CA LEU A 107 4.976 13.291 7.704 1.00 33.04 C ATOM 1560 C LEU A 107 3.760 13.824 6.936 1.00 75.21 C ATOM 1561 O LEU A 107 3.517 15.001 6.952 1.00 41.33 O ATOM 1562 CB LEU A 107 6.124 12.807 6.775 1.00 40.33 C ATOM 1563 CG LEU A 107 6.947 13.858 5.992 1.00 14.53 C ATOM 1564 CD1 LEU A 107 8.224 13.220 5.475 1.00 53.34 C ATOM 1565 CD2 LEU A 107 6.167 14.441 4.823 1.00 74.22 C ATOM 0 H LEU A 107 5.055 11.322 8.329 1.00 22.12 H new ATOM 0 HA LEU A 107 5.343 14.136 8.287 1.00 33.04 H new ATOM 0 HB2 LEU A 107 6.820 12.231 7.384 1.00 40.33 H new ATOM 0 HB3 LEU A 107 5.692 12.119 6.048 1.00 40.33 H new ATOM 0 HG LEU A 107 7.178 14.673 6.678 1.00 14.53 H new ATOM 0 HD11 LEU A 107 8.803 13.961 4.924 1.00 53.34 H new ATOM 0 HD12 LEU A 107 8.812 12.851 6.315 1.00 53.34 H new ATOM 0 HD13 LEU A 107 7.974 12.390 4.815 1.00 53.34 H new ATOM 0 HD21 LEU A 107 6.784 15.174 4.303 1.00 74.22 H new ATOM 0 HD22 LEU A 107 5.894 13.642 4.134 1.00 74.22 H new ATOM 0 HD23 LEU A 107 5.264 14.925 5.194 1.00 74.22 H new ATOM 1577 N ASN A 108 2.976 12.963 6.315 1.00 2.41 N ATOM 1578 CA ASN A 108 1.792 13.470 5.600 1.00 43.51 C ATOM 1579 C ASN A 108 0.529 13.105 6.397 1.00 1.31 C ATOM 1580 O ASN A 108 -0.515 13.746 6.302 1.00 52.14 O ATOM 1581 CB ASN A 108 1.736 12.877 4.169 1.00 63.30 C ATOM 1582 CG ASN A 108 0.793 13.620 3.204 1.00 14.12 C ATOM 1583 OD1 ASN A 108 -0.197 14.225 3.588 1.00 61.12 O ATOM 1584 ND2 ASN A 108 1.099 13.576 1.944 1.00 21.54 N ATOM 0 H ASN A 108 3.116 11.953 6.282 1.00 2.41 H new ATOM 0 HA ASN A 108 1.853 14.555 5.509 1.00 43.51 H new ATOM 0 HB2 ASN A 108 2.742 12.881 3.749 1.00 63.30 H new ATOM 0 HB3 ASN A 108 1.422 11.835 4.233 1.00 63.30 H new ATOM 0 HD21 ASN A 108 0.510 14.050 1.259 1.00 21.54 H new ATOM 0 HD22 ASN A 108 1.928 13.067 1.638 1.00 21.54 H new ATOM 1591 N GLY A 109 0.676 12.133 7.265 1.00 62.53 N ATOM 1592 CA GLY A 109 -0.436 11.661 8.045 1.00 32.15 C ATOM 1593 C GLY A 109 -0.852 10.291 7.588 1.00 21.52 C ATOM 1594 O GLY A 109 -1.458 10.140 6.522 1.00 32.01 O ATOM 0 H GLY A 109 1.558 11.654 7.447 1.00 62.53 H new ATOM 0 HA2 GLY A 109 -0.162 11.632 9.100 1.00 32.15 H new ATOM 0 HA3 GLY A 109 -1.273 12.352 7.952 1.00 32.15 H new ATOM 1598 N THR A 110 -0.458 9.285 8.332 1.00 2.54 N ATOM 1599 CA THR A 110 -0.778 7.929 7.982 1.00 72.05 C ATOM 1600 C THR A 110 -2.128 7.528 8.564 1.00 11.41 C ATOM 1601 O THR A 110 -2.392 7.703 9.766 1.00 32.13 O ATOM 1602 CB THR A 110 0.314 6.973 8.495 1.00 11.34 C ATOM 1603 OG1 THR A 110 1.584 7.473 8.078 1.00 70.42 O ATOM 1604 CG2 THR A 110 0.132 5.567 7.928 1.00 71.32 C ATOM 0 H THR A 110 0.088 9.385 9.188 1.00 2.54 H new ATOM 0 HA THR A 110 -0.830 7.861 6.895 1.00 72.05 H new ATOM 0 HB THR A 110 0.247 6.918 9.582 1.00 11.34 H new ATOM 0 HG1 THR A 110 1.458 8.298 7.564 1.00 70.42 H new ATOM 0 HG21 THR A 110 0.919 4.916 8.309 1.00 71.32 H new ATOM 0 HG22 THR A 110 -0.840 5.176 8.229 1.00 71.32 H new ATOM 0 HG23 THR A 110 0.187 5.604 6.840 1.00 71.32 H new ATOM 1612 N TYR A 111 -2.961 6.997 7.728 1.00 30.13 N ATOM 1613 CA TYR A 111 -4.232 6.486 8.125 1.00 1.43 C ATOM 1614 C TYR A 111 -4.246 5.006 7.870 1.00 11.21 C ATOM 1615 O TYR A 111 -3.954 4.573 6.767 1.00 23.34 O ATOM 1616 CB TYR A 111 -5.351 7.122 7.310 1.00 61.02 C ATOM 1617 CG TYR A 111 -5.584 8.597 7.538 1.00 35.35 C ATOM 1618 CD1 TYR A 111 -4.785 9.562 6.939 1.00 21.25 C ATOM 1619 CD2 TYR A 111 -6.624 9.020 8.339 1.00 32.33 C ATOM 1620 CE1 TYR A 111 -5.024 10.904 7.143 1.00 60.44 C ATOM 1621 CE2 TYR A 111 -6.870 10.353 8.549 1.00 32.54 C ATOM 1622 CZ TYR A 111 -6.070 11.289 7.955 1.00 51.24 C ATOM 1623 OH TYR A 111 -6.324 12.615 8.161 1.00 32.50 O ATOM 0 H TYR A 111 -2.772 6.905 6.730 1.00 30.13 H new ATOM 0 HA TYR A 111 -4.390 6.711 9.180 1.00 1.43 H new ATOM 0 HB2 TYR A 111 -5.135 6.968 6.253 1.00 61.02 H new ATOM 0 HB3 TYR A 111 -6.278 6.591 7.527 1.00 61.02 H new ATOM 0 HD1 TYR A 111 -3.966 9.257 6.305 1.00 21.25 H new ATOM 0 HD2 TYR A 111 -7.259 8.285 8.812 1.00 32.33 H new ATOM 0 HE1 TYR A 111 -4.398 11.647 6.671 1.00 60.44 H new ATOM 0 HE2 TYR A 111 -7.691 10.661 9.180 1.00 32.54 H new ATOM 0 HH TYR A 111 -5.487 13.121 8.102 1.00 32.50 H new ATOM 1633 N VAL A 112 -4.573 4.247 8.866 1.00 12.41 N ATOM 1634 CA VAL A 112 -4.687 2.813 8.726 1.00 75.40 C ATOM 1635 C VAL A 112 -6.108 2.484 9.108 1.00 22.40 C ATOM 1636 O VAL A 112 -6.572 2.909 10.194 1.00 52.34 O ATOM 1637 CB VAL A 112 -3.697 2.038 9.638 1.00 72.24 C ATOM 1638 CG1 VAL A 112 -3.738 0.553 9.321 1.00 44.45 C ATOM 1639 CG2 VAL A 112 -2.277 2.574 9.500 1.00 34.21 C ATOM 0 H VAL A 112 -4.771 4.595 9.804 1.00 12.41 H new ATOM 0 HA VAL A 112 -4.441 2.514 7.707 1.00 75.40 H new ATOM 0 HB VAL A 112 -4.009 2.186 10.672 1.00 72.24 H new ATOM 0 HG11 VAL A 112 -3.039 0.023 9.968 1.00 44.45 H new ATOM 0 HG12 VAL A 112 -4.746 0.173 9.488 1.00 44.45 H new ATOM 0 HG13 VAL A 112 -3.459 0.395 8.279 1.00 44.45 H new ATOM 0 HG21 VAL A 112 -1.610 2.009 10.152 1.00 34.21 H new ATOM 0 HG22 VAL A 112 -1.948 2.470 8.466 1.00 34.21 H new ATOM 0 HG23 VAL A 112 -2.256 3.626 9.783 1.00 34.21 H new ATOM 1649 N ASN A 113 -6.791 1.778 8.230 1.00 22.03 N ATOM 1650 CA ASN A 113 -8.242 1.535 8.290 1.00 71.23 C ATOM 1651 C ASN A 113 -8.930 2.908 8.356 1.00 23.42 C ATOM 1652 O ASN A 113 -9.918 3.115 9.056 1.00 21.13 O ATOM 1653 CB ASN A 113 -8.618 0.636 9.497 1.00 5.10 C ATOM 1654 CG ASN A 113 -9.982 -0.064 9.352 1.00 25.34 C ATOM 1655 OD1 ASN A 113 -10.922 0.440 8.729 1.00 5.42 O ATOM 1656 ND2 ASN A 113 -10.078 -1.257 9.896 1.00 73.35 N ATOM 0 H ASN A 113 -6.349 1.337 7.423 1.00 22.03 H new ATOM 0 HA ASN A 113 -8.577 0.993 7.406 1.00 71.23 H new ATOM 0 HB2 ASN A 113 -7.844 -0.121 9.629 1.00 5.10 H new ATOM 0 HB3 ASN A 113 -8.627 1.244 10.402 1.00 5.10 H new ATOM 0 HD21 ASN A 113 -10.944 -1.789 9.809 1.00 73.35 H new ATOM 0 HD22 ASN A 113 -9.287 -1.650 10.405 1.00 73.35 H new ATOM 1663 N ARG A 114 -8.350 3.854 7.578 1.00 25.30 N ATOM 1664 CA ARG A 114 -8.813 5.254 7.462 1.00 25.51 C ATOM 1665 C ARG A 114 -8.731 6.061 8.766 1.00 25.10 C ATOM 1666 O ARG A 114 -9.195 7.201 8.814 1.00 72.21 O ATOM 1667 CB ARG A 114 -10.216 5.303 6.882 1.00 45.44 C ATOM 1668 CG ARG A 114 -10.283 5.030 5.395 1.00 35.44 C ATOM 1669 CD ARG A 114 -11.709 4.758 4.957 1.00 41.44 C ATOM 1670 NE ARG A 114 -12.118 3.371 5.234 1.00 74.03 N ATOM 1671 CZ ARG A 114 -12.747 2.931 6.326 1.00 53.33 C ATOM 1672 NH1 ARG A 114 -13.072 3.766 7.307 1.00 21.24 N ATOM 1673 NH2 ARG A 114 -13.057 1.644 6.422 1.00 45.10 N ATOM 0 H ARG A 114 -7.531 3.659 7.003 1.00 25.30 H new ATOM 0 HA ARG A 114 -8.116 5.740 6.779 1.00 25.51 H new ATOM 0 HB2 ARG A 114 -10.838 4.574 7.402 1.00 45.44 H new ATOM 0 HB3 ARG A 114 -10.644 6.286 7.079 1.00 45.44 H new ATOM 0 HG2 ARG A 114 -9.887 5.885 4.846 1.00 35.44 H new ATOM 0 HG3 ARG A 114 -9.654 4.174 5.150 1.00 35.44 H new ATOM 0 HD2 ARG A 114 -12.383 5.444 5.471 1.00 41.44 H new ATOM 0 HD3 ARG A 114 -11.804 4.957 3.890 1.00 41.44 H new ATOM 0 HE ARG A 114 -11.899 2.677 4.520 1.00 74.03 H new ATOM 0 HH11 ARG A 114 -12.841 4.757 7.231 1.00 21.24 H new ATOM 0 HH12 ARG A 114 -13.553 3.416 8.136 1.00 21.24 H new ATOM 0 HH21 ARG A 114 -12.815 1.003 5.666 1.00 45.10 H new ATOM 0 HH22 ARG A 114 -13.538 1.296 7.251 1.00 45.10 H new ATOM 1687 N GLU A 115 -8.105 5.511 9.785 1.00 34.32 N ATOM 1688 CA GLU A 115 -7.920 6.223 11.036 1.00 43.14 C ATOM 1689 C GLU A 115 -6.485 6.688 11.131 1.00 43.22 C ATOM 1690 O GLU A 115 -5.576 5.906 10.821 1.00 62.44 O ATOM 1691 CB GLU A 115 -8.202 5.330 12.239 1.00 71.02 C ATOM 1692 CG GLU A 115 -9.596 4.760 12.322 1.00 32.41 C ATOM 1693 CD GLU A 115 -9.816 4.069 13.640 1.00 1.30 C ATOM 1694 OE1 GLU A 115 -9.507 2.876 13.771 1.00 70.45 O ATOM 1695 OE2 GLU A 115 -10.283 4.736 14.594 1.00 21.24 O ATOM 0 H GLU A 115 -7.713 4.569 9.773 1.00 34.32 H new ATOM 0 HA GLU A 115 -8.615 7.062 11.047 1.00 43.14 H new ATOM 0 HB2 GLU A 115 -7.492 4.503 12.228 1.00 71.02 H new ATOM 0 HB3 GLU A 115 -8.010 5.903 13.146 1.00 71.02 H new ATOM 0 HG2 GLU A 115 -10.328 5.559 12.199 1.00 32.41 H new ATOM 0 HG3 GLU A 115 -9.754 4.055 11.506 1.00 32.41 H new ATOM 1702 N PRO A 116 -6.234 7.946 11.552 1.00 73.20 N ATOM 1703 CA PRO A 116 -4.868 8.445 11.715 1.00 62.54 C ATOM 1704 C PRO A 116 -4.183 7.639 12.807 1.00 52.12 C ATOM 1705 O PRO A 116 -4.664 7.583 13.952 1.00 24.35 O ATOM 1706 CB PRO A 116 -5.055 9.912 12.143 1.00 22.13 C ATOM 1707 CG PRO A 116 -6.455 9.995 12.663 1.00 11.32 C ATOM 1708 CD PRO A 116 -7.247 8.954 11.923 1.00 1.03 C ATOM 0 HA PRO A 116 -4.255 8.362 10.817 1.00 62.54 H new ATOM 0 HB2 PRO A 116 -4.333 10.193 12.910 1.00 22.13 H new ATOM 0 HB3 PRO A 116 -4.907 10.589 11.302 1.00 22.13 H new ATOM 0 HG2 PRO A 116 -6.481 9.812 13.737 1.00 11.32 H new ATOM 0 HG3 PRO A 116 -6.872 10.989 12.499 1.00 11.32 H new ATOM 0 HD2 PRO A 116 -8.029 8.525 12.549 1.00 1.03 H new ATOM 0 HD3 PRO A 116 -7.737 9.373 11.044 1.00 1.03 H new ATOM 1716 N ARG A 117 -3.080 7.030 12.483 1.00 43.44 N ATOM 1717 CA ARG A 117 -2.495 6.086 13.390 1.00 34.12 C ATOM 1718 C ARG A 117 -0.996 6.022 13.182 1.00 23.22 C ATOM 1719 O ARG A 117 -0.474 6.602 12.219 1.00 13.03 O ATOM 1720 CB ARG A 117 -3.103 4.722 13.073 1.00 63.01 C ATOM 1721 CG ARG A 117 -2.977 3.692 14.161 1.00 2.13 C ATOM 1722 CD ARG A 117 -3.454 2.351 13.676 1.00 62.52 C ATOM 1723 NE ARG A 117 -4.789 2.415 13.062 1.00 25.11 N ATOM 1724 CZ ARG A 117 -5.933 1.987 13.600 1.00 25.15 C ATOM 1725 NH1 ARG A 117 -5.947 1.409 14.803 1.00 23.31 N ATOM 1726 NH2 ARG A 117 -7.056 2.106 12.901 1.00 14.03 N ATOM 0 H ARG A 117 -2.572 7.167 11.609 1.00 43.44 H new ATOM 0 HA ARG A 117 -2.689 6.379 14.422 1.00 34.12 H new ATOM 0 HB2 ARG A 117 -4.160 4.858 12.845 1.00 63.01 H new ATOM 0 HB3 ARG A 117 -2.630 4.333 12.171 1.00 63.01 H new ATOM 0 HG2 ARG A 117 -1.938 3.620 14.483 1.00 2.13 H new ATOM 0 HG3 ARG A 117 -3.559 3.999 15.030 1.00 2.13 H new ATOM 0 HD2 ARG A 117 -2.743 1.957 12.950 1.00 62.52 H new ATOM 0 HD3 ARG A 117 -3.476 1.653 14.513 1.00 62.52 H new ATOM 0 HE ARG A 117 -4.846 2.828 12.131 1.00 25.11 H new ATOM 0 HH11 ARG A 117 -5.077 1.290 15.322 1.00 23.31 H new ATOM 0 HH12 ARG A 117 -6.828 1.086 15.203 1.00 23.31 H new ATOM 0 HH21 ARG A 117 -7.035 2.519 11.969 1.00 14.03 H new ATOM 0 HH22 ARG A 117 -7.939 1.784 13.297 1.00 14.03 H new ATOM 1740 N ASN A 118 -0.310 5.355 14.090 1.00 1.45 N ATOM 1741 CA ASN A 118 1.105 5.123 13.946 1.00 45.15 C ATOM 1742 C ASN A 118 1.370 3.674 13.539 1.00 63.42 C ATOM 1743 O ASN A 118 1.734 3.398 12.410 1.00 52.22 O ATOM 1744 CB ASN A 118 1.878 5.477 15.232 1.00 2.34 C ATOM 1745 CG ASN A 118 3.375 5.184 15.126 1.00 33.23 C ATOM 1746 OD1 ASN A 118 3.827 4.095 15.455 1.00 72.13 O ATOM 1747 ND2 ASN A 118 4.148 6.148 14.686 1.00 43.43 N ATOM 0 H ASN A 118 -0.718 4.964 14.939 1.00 1.45 H new ATOM 0 HA ASN A 118 1.468 5.782 13.157 1.00 45.15 H new ATOM 0 HB2 ASN A 118 1.735 6.534 15.457 1.00 2.34 H new ATOM 0 HB3 ASN A 118 1.461 4.914 16.067 1.00 2.34 H new ATOM 0 HD21 ASN A 118 5.154 6.000 14.611 1.00 43.43 H new ATOM 0 HD22 ASN A 118 3.743 7.045 14.419 1.00 43.43 H new ATOM 1754 N ALA A 119 1.117 2.757 14.426 1.00 23.52 N ATOM 1755 CA ALA A 119 1.438 1.374 14.187 1.00 33.15 C ATOM 1756 C ALA A 119 0.198 0.519 14.261 1.00 23.21 C ATOM 1757 O ALA A 119 -0.659 0.729 15.120 1.00 35.40 O ATOM 1758 CB ALA A 119 2.456 0.910 15.198 1.00 3.43 C ATOM 0 H ALA A 119 0.685 2.941 15.331 1.00 23.52 H new ATOM 0 HA ALA A 119 1.857 1.277 13.185 1.00 33.15 H new ATOM 0 HB1 ALA A 119 2.698 -0.137 15.016 1.00 3.43 H new ATOM 0 HB2 ALA A 119 3.360 1.513 15.107 1.00 3.43 H new ATOM 0 HB3 ALA A 119 2.047 1.019 16.202 1.00 3.43 H new ATOM 1764 N GLN A 120 0.075 -0.395 13.329 1.00 63.30 N ATOM 1765 CA GLN A 120 -1.058 -1.291 13.278 1.00 41.33 C ATOM 1766 C GLN A 120 -0.696 -2.590 12.586 1.00 11.55 C ATOM 1767 O GLN A 120 0.013 -2.572 11.591 1.00 62.13 O ATOM 1768 CB GLN A 120 -2.197 -0.606 12.521 1.00 24.10 C ATOM 1769 CG GLN A 120 -3.446 -1.442 12.317 1.00 62.32 C ATOM 1770 CD GLN A 120 -4.095 -1.862 13.609 1.00 4.11 C ATOM 1771 OE1 GLN A 120 -4.039 -1.151 14.620 1.00 30.33 O ATOM 1772 NE2 GLN A 120 -4.659 -3.036 13.610 1.00 30.31 N ATOM 0 H GLN A 120 0.757 -0.540 12.584 1.00 63.30 H new ATOM 0 HA GLN A 120 -1.367 -1.525 14.297 1.00 41.33 H new ATOM 0 HB2 GLN A 120 -2.473 0.301 13.059 1.00 24.10 H new ATOM 0 HB3 GLN A 120 -1.825 -0.297 11.544 1.00 24.10 H new ATOM 0 HG2 GLN A 120 -4.163 -0.873 11.725 1.00 62.32 H new ATOM 0 HG3 GLN A 120 -3.190 -2.331 11.740 1.00 62.32 H new ATOM 0 HE21 GLN A 120 -4.684 -3.591 12.754 1.00 30.31 H new ATOM 0 HE22 GLN A 120 -5.076 -3.401 14.466 1.00 30.31 H new ATOM 1781 N VAL A 121 -1.149 -3.704 13.121 1.00 24.23 N ATOM 1782 CA VAL A 121 -1.057 -4.971 12.409 1.00 12.25 C ATOM 1783 C VAL A 121 -1.963 -4.846 11.191 1.00 0.43 C ATOM 1784 O VAL A 121 -3.105 -4.385 11.314 1.00 32.13 O ATOM 1785 CB VAL A 121 -1.491 -6.186 13.278 1.00 62.44 C ATOM 1786 CG1 VAL A 121 -1.401 -7.489 12.484 1.00 62.54 C ATOM 1787 CG2 VAL A 121 -0.623 -6.285 14.515 1.00 62.03 C ATOM 0 H VAL A 121 -1.584 -3.763 14.042 1.00 24.23 H new ATOM 0 HA VAL A 121 -0.019 -5.160 12.134 1.00 12.25 H new ATOM 0 HB VAL A 121 -2.528 -6.030 13.575 1.00 62.44 H new ATOM 0 HG11 VAL A 121 -1.710 -8.322 13.115 1.00 62.54 H new ATOM 0 HG12 VAL A 121 -2.055 -7.431 11.614 1.00 62.54 H new ATOM 0 HG13 VAL A 121 -0.373 -7.645 12.155 1.00 62.54 H new ATOM 0 HG21 VAL A 121 -0.938 -7.140 15.113 1.00 62.03 H new ATOM 0 HG22 VAL A 121 0.418 -6.413 14.219 1.00 62.03 H new ATOM 0 HG23 VAL A 121 -0.723 -5.373 15.104 1.00 62.03 H new ATOM 1797 N MET A 122 -1.484 -5.246 10.053 1.00 74.34 N ATOM 1798 CA MET A 122 -2.177 -4.976 8.820 1.00 60.44 C ATOM 1799 C MET A 122 -3.175 -6.088 8.571 1.00 32.11 C ATOM 1800 O MET A 122 -2.835 -7.269 8.628 1.00 4.24 O ATOM 1801 CB MET A 122 -1.136 -4.957 7.694 1.00 50.44 C ATOM 1802 CG MET A 122 -1.643 -4.557 6.325 1.00 1.54 C ATOM 1803 SD MET A 122 -0.397 -4.831 5.032 1.00 75.13 S ATOM 1804 CE MET A 122 0.979 -3.847 5.602 1.00 55.53 C ATOM 0 H MET A 122 -0.612 -5.764 9.947 1.00 74.34 H new ATOM 0 HA MET A 122 -2.703 -4.022 8.864 1.00 60.44 H new ATOM 0 HB2 MET A 122 -0.337 -4.272 7.977 1.00 50.44 H new ATOM 0 HB3 MET A 122 -0.693 -5.950 7.619 1.00 50.44 H new ATOM 0 HG2 MET A 122 -2.541 -5.128 6.090 1.00 1.54 H new ATOM 0 HG3 MET A 122 -1.928 -3.505 6.337 1.00 1.54 H new ATOM 0 HE1 MET A 122 1.859 -4.068 4.998 1.00 55.53 H new ATOM 0 HE2 MET A 122 0.732 -2.789 5.511 1.00 55.53 H new ATOM 0 HE3 MET A 122 1.187 -4.082 6.646 1.00 55.53 H new ATOM 1814 N GLN A 123 -4.398 -5.705 8.298 1.00 44.21 N ATOM 1815 CA GLN A 123 -5.457 -6.649 8.098 1.00 15.32 C ATOM 1816 C GLN A 123 -5.922 -6.571 6.658 1.00 3.32 C ATOM 1817 O GLN A 123 -5.827 -5.528 6.035 1.00 45.30 O ATOM 1818 CB GLN A 123 -6.611 -6.376 9.093 1.00 72.53 C ATOM 1819 CG GLN A 123 -7.384 -5.075 8.863 1.00 65.35 C ATOM 1820 CD GLN A 123 -8.285 -4.720 10.029 1.00 4.30 C ATOM 1821 OE1 GLN A 123 -9.430 -5.156 10.109 1.00 15.23 O ATOM 1822 NE2 GLN A 123 -7.802 -3.868 10.889 1.00 51.13 N ATOM 0 H GLN A 123 -4.682 -4.729 8.209 1.00 44.21 H new ATOM 0 HA GLN A 123 -5.100 -7.661 8.290 1.00 15.32 H new ATOM 0 HB2 GLN A 123 -7.313 -7.209 9.046 1.00 72.53 H new ATOM 0 HB3 GLN A 123 -6.201 -6.361 10.103 1.00 72.53 H new ATOM 0 HG2 GLN A 123 -6.678 -4.262 8.693 1.00 65.35 H new ATOM 0 HG3 GLN A 123 -7.986 -5.169 7.959 1.00 65.35 H new ATOM 0 HE21 GLN A 123 -6.845 -3.529 10.789 1.00 51.13 H new ATOM 0 HE22 GLN A 123 -8.381 -3.540 11.662 1.00 51.13 H new ATOM 1831 N THR A 124 -6.382 -7.666 6.121 1.00 40.14 N ATOM 1832 CA THR A 124 -6.824 -7.684 4.762 1.00 45.21 C ATOM 1833 C THR A 124 -8.178 -6.951 4.657 1.00 2.42 C ATOM 1834 O THR A 124 -9.079 -7.182 5.465 1.00 73.23 O ATOM 1835 CB THR A 124 -6.877 -9.148 4.211 1.00 55.41 C ATOM 1836 OG1 THR A 124 -7.111 -9.141 2.809 1.00 74.21 O ATOM 1837 CG2 THR A 124 -7.935 -9.998 4.907 1.00 75.45 C ATOM 0 H THR A 124 -6.459 -8.559 6.608 1.00 40.14 H new ATOM 0 HA THR A 124 -6.110 -7.153 4.132 1.00 45.21 H new ATOM 0 HB THR A 124 -5.907 -9.599 4.420 1.00 55.41 H new ATOM 0 HG1 THR A 124 -7.731 -9.863 2.577 1.00 74.21 H new ATOM 0 HG21 THR A 124 -7.929 -11.003 4.486 1.00 75.45 H new ATOM 0 HG22 THR A 124 -7.716 -10.050 5.974 1.00 75.45 H new ATOM 0 HG23 THR A 124 -8.917 -9.549 4.759 1.00 75.45 H new ATOM 1845 N GLY A 125 -8.287 -6.035 3.713 1.00 65.41 N ATOM 1846 CA GLY A 125 -9.488 -5.234 3.584 1.00 2.35 C ATOM 1847 C GLY A 125 -9.314 -3.864 4.220 1.00 51.51 C ATOM 1848 O GLY A 125 -10.235 -3.033 4.206 1.00 21.21 O ATOM 0 H GLY A 125 -7.561 -5.828 3.027 1.00 65.41 H new ATOM 0 HA2 GLY A 125 -9.738 -5.118 2.529 1.00 2.35 H new ATOM 0 HA3 GLY A 125 -10.324 -5.751 4.054 1.00 2.35 H new ATOM 1852 N ASP A 126 -8.132 -3.634 4.773 1.00 50.24 N ATOM 1853 CA ASP A 126 -7.797 -2.367 5.431 1.00 24.14 C ATOM 1854 C ASP A 126 -7.497 -1.325 4.370 1.00 61.13 C ATOM 1855 O ASP A 126 -7.015 -1.668 3.268 1.00 1.22 O ATOM 1856 CB ASP A 126 -6.546 -2.554 6.309 1.00 64.02 C ATOM 1857 CG ASP A 126 -6.261 -1.399 7.257 1.00 41.34 C ATOM 1858 OD1 ASP A 126 -5.802 -0.328 6.802 1.00 22.43 O ATOM 1859 OD2 ASP A 126 -6.474 -1.571 8.474 1.00 74.53 O ATOM 0 H ASP A 126 -7.374 -4.317 4.781 1.00 50.24 H new ATOM 0 HA ASP A 126 -8.635 -2.047 6.050 1.00 24.14 H new ATOM 0 HB2 ASP A 126 -6.661 -3.467 6.893 1.00 64.02 H new ATOM 0 HB3 ASP A 126 -5.681 -2.697 5.661 1.00 64.02 H new ATOM 1864 N GLU A 127 -7.799 -0.089 4.654 1.00 33.10 N ATOM 1865 CA GLU A 127 -7.481 0.967 3.748 1.00 32.21 C ATOM 1866 C GLU A 127 -6.465 1.863 4.397 1.00 51.24 C ATOM 1867 O GLU A 127 -6.713 2.449 5.462 1.00 35.15 O ATOM 1868 CB GLU A 127 -8.728 1.761 3.388 1.00 22.24 C ATOM 1869 CG GLU A 127 -9.756 0.969 2.617 1.00 31.13 C ATOM 1870 CD GLU A 127 -11.019 1.735 2.415 1.00 61.04 C ATOM 1871 OE1 GLU A 127 -11.116 2.518 1.454 1.00 10.15 O ATOM 1872 OE2 GLU A 127 -11.946 1.576 3.237 1.00 54.30 O ATOM 0 H GLU A 127 -8.267 0.208 5.510 1.00 33.10 H new ATOM 0 HA GLU A 127 -7.075 0.547 2.827 1.00 32.21 H new ATOM 0 HB2 GLU A 127 -9.185 2.136 4.304 1.00 22.24 H new ATOM 0 HB3 GLU A 127 -8.436 2.630 2.798 1.00 22.24 H new ATOM 0 HG2 GLU A 127 -9.344 0.688 1.648 1.00 31.13 H new ATOM 0 HG3 GLU A 127 -9.975 0.044 3.150 1.00 31.13 H new ATOM 1879 N ILE A 128 -5.389 2.045 3.719 1.00 3.41 N ATOM 1880 CA ILE A 128 -4.289 2.804 4.209 1.00 41.44 C ATOM 1881 C ILE A 128 -4.262 4.089 3.424 1.00 30.03 C ATOM 1882 O ILE A 128 -4.054 4.081 2.219 1.00 31.23 O ATOM 1883 CB ILE A 128 -2.957 2.028 4.001 1.00 73.32 C ATOM 1884 CG1 ILE A 128 -3.055 0.637 4.665 1.00 32.25 C ATOM 1885 CG2 ILE A 128 -1.776 2.820 4.576 1.00 12.11 C ATOM 1886 CD1 ILE A 128 -1.869 -0.270 4.407 1.00 43.45 C ATOM 0 H ILE A 128 -5.243 1.662 2.785 1.00 3.41 H new ATOM 0 HA ILE A 128 -4.397 2.995 5.277 1.00 41.44 H new ATOM 0 HB ILE A 128 -2.786 1.898 2.932 1.00 73.32 H new ATOM 0 HG12 ILE A 128 -3.167 0.770 5.741 1.00 32.25 H new ATOM 0 HG13 ILE A 128 -3.959 0.142 4.309 1.00 32.25 H new ATOM 0 HG21 ILE A 128 -0.853 2.261 4.421 1.00 12.11 H new ATOM 0 HG22 ILE A 128 -1.705 3.784 4.073 1.00 12.11 H new ATOM 0 HG23 ILE A 128 -1.929 2.978 5.643 1.00 12.11 H new ATOM 0 HD11 ILE A 128 -2.024 -1.224 4.911 1.00 43.45 H new ATOM 0 HD12 ILE A 128 -1.766 -0.438 3.335 1.00 43.45 H new ATOM 0 HD13 ILE A 128 -0.962 0.199 4.789 1.00 43.45 H new ATOM 1898 N GLN A 129 -4.521 5.167 4.071 1.00 64.41 N ATOM 1899 CA GLN A 129 -4.585 6.422 3.397 1.00 11.21 C ATOM 1900 C GLN A 129 -3.382 7.256 3.761 1.00 61.23 C ATOM 1901 O GLN A 129 -3.055 7.423 4.936 1.00 72.35 O ATOM 1902 CB GLN A 129 -5.927 7.131 3.684 1.00 72.54 C ATOM 1903 CG GLN A 129 -6.144 8.463 2.974 1.00 14.04 C ATOM 1904 CD GLN A 129 -7.508 9.051 3.294 1.00 24.30 C ATOM 1905 OE1 GLN A 129 -8.049 8.832 4.375 1.00 20.32 O ATOM 1906 NE2 GLN A 129 -8.084 9.776 2.365 1.00 53.35 N ATOM 0 H GLN A 129 -4.694 5.210 5.075 1.00 64.41 H new ATOM 0 HA GLN A 129 -4.553 6.264 2.319 1.00 11.21 H new ATOM 0 HB2 GLN A 129 -6.738 6.457 3.406 1.00 72.54 H new ATOM 0 HB3 GLN A 129 -6.005 7.298 4.758 1.00 72.54 H new ATOM 0 HG2 GLN A 129 -5.365 9.166 3.271 1.00 14.04 H new ATOM 0 HG3 GLN A 129 -6.052 8.321 1.897 1.00 14.04 H new ATOM 0 HE21 GLN A 129 -7.608 9.940 1.478 1.00 53.35 H new ATOM 0 HE22 GLN A 129 -9.008 10.176 2.530 1.00 53.35 H new ATOM 1915 N ILE A 130 -2.702 7.704 2.758 1.00 14.44 N ATOM 1916 CA ILE A 130 -1.546 8.527 2.910 1.00 2.24 C ATOM 1917 C ILE A 130 -1.904 9.900 2.442 1.00 71.52 C ATOM 1918 O ILE A 130 -2.153 10.129 1.242 1.00 63.34 O ATOM 1919 CB ILE A 130 -0.315 7.942 2.150 1.00 42.52 C ATOM 1920 CG1 ILE A 130 0.164 6.665 2.876 1.00 53.24 C ATOM 1921 CG2 ILE A 130 0.817 8.972 1.990 1.00 41.14 C ATOM 1922 CD1 ILE A 130 1.376 6.002 2.266 1.00 41.12 C ATOM 0 H ILE A 130 -2.940 7.504 1.787 1.00 14.44 H new ATOM 0 HA ILE A 130 -1.245 8.565 3.957 1.00 2.24 H new ATOM 0 HB ILE A 130 -0.620 7.683 1.136 1.00 42.52 H new ATOM 0 HG12 ILE A 130 0.389 6.917 3.912 1.00 53.24 H new ATOM 0 HG13 ILE A 130 -0.655 5.946 2.893 1.00 53.24 H new ATOM 0 HG21 ILE A 130 1.650 8.517 1.455 1.00 41.14 H new ATOM 0 HG22 ILE A 130 0.451 9.831 1.428 1.00 41.14 H new ATOM 0 HG23 ILE A 130 1.153 9.299 2.974 1.00 41.14 H new ATOM 0 HD11 ILE A 130 1.636 5.116 2.845 1.00 41.12 H new ATOM 0 HD12 ILE A 130 1.154 5.713 1.239 1.00 41.12 H new ATOM 0 HD13 ILE A 130 2.214 6.699 2.274 1.00 41.12 H new ATOM 1934 N GLY A 131 -2.019 10.792 3.389 1.00 41.20 N ATOM 1935 CA GLY A 131 -2.456 12.110 3.087 1.00 13.25 C ATOM 1936 C GLY A 131 -3.913 12.086 2.719 1.00 14.55 C ATOM 1937 O GLY A 131 -4.770 11.899 3.575 1.00 23.41 O ATOM 0 H GLY A 131 -1.814 10.621 4.373 1.00 41.20 H new ATOM 0 HA2 GLY A 131 -2.298 12.762 3.946 1.00 13.25 H new ATOM 0 HA3 GLY A 131 -1.869 12.519 2.264 1.00 13.25 H new ATOM 1941 N LYS A 132 -4.202 12.222 1.447 1.00 5.43 N ATOM 1942 CA LYS A 132 -5.572 12.192 1.009 1.00 15.30 C ATOM 1943 C LYS A 132 -5.847 11.006 0.100 1.00 42.30 C ATOM 1944 O LYS A 132 -7.001 10.663 -0.133 1.00 52.42 O ATOM 1945 CB LYS A 132 -5.998 13.498 0.316 1.00 33.13 C ATOM 1946 CG LYS A 132 -5.224 13.841 -0.960 1.00 51.12 C ATOM 1947 CD LYS A 132 -5.811 15.070 -1.661 1.00 60.32 C ATOM 1948 CE LYS A 132 -7.245 14.811 -2.135 1.00 54.32 C ATOM 1949 NZ LYS A 132 -7.843 15.978 -2.810 1.00 50.13 N ATOM 0 H LYS A 132 -3.514 12.353 0.706 1.00 5.43 H new ATOM 0 HA LYS A 132 -6.172 12.084 1.912 1.00 15.30 H new ATOM 0 HB2 LYS A 132 -7.058 13.432 0.072 1.00 33.13 H new ATOM 0 HB3 LYS A 132 -5.884 14.320 1.023 1.00 33.13 H new ATOM 0 HG2 LYS A 132 -4.179 14.026 -0.714 1.00 51.12 H new ATOM 0 HG3 LYS A 132 -5.245 12.989 -1.639 1.00 51.12 H new ATOM 0 HD2 LYS A 132 -5.800 15.920 -0.979 1.00 60.32 H new ATOM 0 HD3 LYS A 132 -5.187 15.337 -2.514 1.00 60.32 H new ATOM 0 HE2 LYS A 132 -7.249 13.961 -2.817 1.00 54.32 H new ATOM 0 HE3 LYS A 132 -7.862 14.536 -1.279 1.00 54.32 H new ATOM 0 HZ1 LYS A 132 -8.812 15.747 -3.109 1.00 50.13 H new ATOM 0 HZ2 LYS A 132 -7.866 16.784 -2.154 1.00 50.13 H new ATOM 0 HZ3 LYS A 132 -7.273 16.227 -3.644 1.00 50.13 H new ATOM 1963 N PHE A 133 -4.817 10.351 -0.386 1.00 51.41 N ATOM 1964 CA PHE A 133 -5.040 9.268 -1.313 1.00 63.41 C ATOM 1965 C PHE A 133 -4.974 7.933 -0.600 1.00 54.52 C ATOM 1966 O PHE A 133 -4.153 7.740 0.296 1.00 24.22 O ATOM 1967 CB PHE A 133 -4.127 9.347 -2.556 1.00 2.41 C ATOM 1968 CG PHE A 133 -2.638 9.227 -2.336 1.00 70.40 C ATOM 1969 CD1 PHE A 133 -1.873 10.338 -2.024 1.00 21.50 C ATOM 1970 CD2 PHE A 133 -2.001 8.003 -2.494 1.00 10.14 C ATOM 1971 CE1 PHE A 133 -0.505 10.232 -1.873 1.00 45.22 C ATOM 1972 CE2 PHE A 133 -0.636 7.891 -2.337 1.00 24.32 C ATOM 1973 CZ PHE A 133 0.116 9.005 -2.029 1.00 24.42 C ATOM 0 H PHE A 133 -3.841 10.543 -0.162 1.00 51.41 H new ATOM 0 HA PHE A 133 -6.051 9.370 -1.708 1.00 63.41 H new ATOM 0 HB2 PHE A 133 -4.430 8.559 -3.246 1.00 2.41 H new ATOM 0 HB3 PHE A 133 -4.318 10.298 -3.054 1.00 2.41 H new ATOM 0 HD1 PHE A 133 -2.352 11.298 -1.897 1.00 21.50 H new ATOM 0 HD2 PHE A 133 -2.583 7.128 -2.743 1.00 10.14 H new ATOM 0 HE1 PHE A 133 0.081 11.107 -1.633 1.00 45.22 H new ATOM 0 HE2 PHE A 133 -0.156 6.931 -2.455 1.00 24.32 H new ATOM 0 HZ PHE A 133 1.186 8.920 -1.910 1.00 24.42 H new ATOM 1983 N ARG A 134 -5.843 7.020 -0.973 1.00 45.42 N ATOM 1984 CA ARG A 134 -5.947 5.778 -0.246 1.00 42.43 C ATOM 1985 C ARG A 134 -5.491 4.588 -1.058 1.00 51.03 C ATOM 1986 O ARG A 134 -5.685 4.522 -2.291 1.00 63.22 O ATOM 1987 CB ARG A 134 -7.377 5.540 0.282 1.00 15.12 C ATOM 1988 CG ARG A 134 -8.422 5.266 -0.800 1.00 52.41 C ATOM 1989 CD ARG A 134 -9.797 5.010 -0.200 1.00 22.15 C ATOM 1990 NE ARG A 134 -10.333 6.197 0.471 1.00 42.34 N ATOM 1991 CZ ARG A 134 -11.377 6.205 1.312 1.00 32.10 C ATOM 1992 NH1 ARG A 134 -11.953 5.057 1.705 1.00 62.30 N ATOM 1993 NH2 ARG A 134 -11.818 7.364 1.788 1.00 72.35 N ATOM 0 H ARG A 134 -6.479 7.113 -1.765 1.00 45.42 H new ATOM 0 HA ARG A 134 -5.273 5.877 0.605 1.00 42.43 H new ATOM 0 HB2 ARG A 134 -7.359 4.696 0.972 1.00 15.12 H new ATOM 0 HB3 ARG A 134 -7.688 6.414 0.855 1.00 15.12 H new ATOM 0 HG2 ARG A 134 -8.474 6.116 -1.480 1.00 52.41 H new ATOM 0 HG3 ARG A 134 -8.116 4.403 -1.392 1.00 52.41 H new ATOM 0 HD2 ARG A 134 -10.483 4.698 -0.987 1.00 22.15 H new ATOM 0 HD3 ARG A 134 -9.734 4.188 0.513 1.00 22.15 H new ATOM 0 HE ARG A 134 -9.875 7.089 0.283 1.00 42.34 H new ATOM 0 HH11 ARG A 134 -11.597 4.164 1.363 1.00 62.30 H new ATOM 0 HH12 ARG A 134 -12.747 5.078 2.345 1.00 62.30 H new ATOM 0 HH21 ARG A 134 -11.363 8.235 1.513 1.00 72.35 H new ATOM 0 HH22 ARG A 134 -12.612 7.383 2.429 1.00 72.35 H new ATOM 2007 N LEU A 135 -4.883 3.679 -0.368 1.00 74.14 N ATOM 2008 CA LEU A 135 -4.456 2.429 -0.891 1.00 25.25 C ATOM 2009 C LEU A 135 -5.273 1.380 -0.179 1.00 10.05 C ATOM 2010 O LEU A 135 -5.534 1.509 1.016 1.00 41.43 O ATOM 2011 CB LEU A 135 -2.946 2.173 -0.633 1.00 2.53 C ATOM 2012 CG LEU A 135 -1.917 3.151 -1.258 1.00 22.54 C ATOM 2013 CD1 LEU A 135 -1.913 4.518 -0.576 1.00 50.33 C ATOM 2014 CD2 LEU A 135 -0.531 2.544 -1.231 1.00 22.15 C ATOM 0 H LEU A 135 -4.662 3.796 0.621 1.00 74.14 H new ATOM 0 HA LEU A 135 -4.596 2.408 -1.972 1.00 25.25 H new ATOM 0 HB2 LEU A 135 -2.789 2.170 0.446 1.00 2.53 H new ATOM 0 HB3 LEU A 135 -2.713 1.171 -0.992 1.00 2.53 H new ATOM 0 HG LEU A 135 -2.221 3.314 -2.292 1.00 22.54 H new ATOM 0 HD11 LEU A 135 -1.174 5.161 -1.054 1.00 50.33 H new ATOM 0 HD12 LEU A 135 -2.900 4.971 -0.664 1.00 50.33 H new ATOM 0 HD13 LEU A 135 -1.662 4.398 0.478 1.00 50.33 H new ATOM 0 HD21 LEU A 135 0.180 3.242 -1.673 1.00 22.15 H new ATOM 0 HD22 LEU A 135 -0.244 2.338 -0.200 1.00 22.15 H new ATOM 0 HD23 LEU A 135 -0.530 1.615 -1.801 1.00 22.15 H new ATOM 2026 N VAL A 136 -5.703 0.386 -0.875 1.00 72.13 N ATOM 2027 CA VAL A 136 -6.510 -0.642 -0.272 1.00 13.43 C ATOM 2028 C VAL A 136 -5.702 -1.916 -0.242 1.00 11.52 C ATOM 2029 O VAL A 136 -5.122 -2.310 -1.262 1.00 52.42 O ATOM 2030 CB VAL A 136 -7.838 -0.870 -1.052 1.00 14.52 C ATOM 2031 CG1 VAL A 136 -8.738 -1.869 -0.331 1.00 63.23 C ATOM 2032 CG2 VAL A 136 -8.573 0.448 -1.277 1.00 32.43 C ATOM 0 H VAL A 136 -5.514 0.254 -1.868 1.00 72.13 H new ATOM 0 HA VAL A 136 -6.783 -0.332 0.737 1.00 13.43 H new ATOM 0 HB VAL A 136 -7.581 -1.289 -2.025 1.00 14.52 H new ATOM 0 HG11 VAL A 136 -9.657 -2.007 -0.900 1.00 63.23 H new ATOM 0 HG12 VAL A 136 -8.221 -2.824 -0.239 1.00 63.23 H new ATOM 0 HG13 VAL A 136 -8.980 -1.490 0.662 1.00 63.23 H new ATOM 0 HG21 VAL A 136 -9.497 0.261 -1.824 1.00 32.43 H new ATOM 0 HG22 VAL A 136 -8.807 0.903 -0.315 1.00 32.43 H new ATOM 0 HG23 VAL A 136 -7.941 1.123 -1.854 1.00 32.43 H new ATOM 2042 N PHE A 137 -5.618 -2.524 0.905 1.00 62.00 N ATOM 2043 CA PHE A 137 -4.851 -3.728 1.069 1.00 54.22 C ATOM 2044 C PHE A 137 -5.731 -4.961 0.911 1.00 63.11 C ATOM 2045 O PHE A 137 -6.708 -5.144 1.646 1.00 34.32 O ATOM 2046 CB PHE A 137 -4.146 -3.727 2.430 1.00 63.43 C ATOM 2047 CG PHE A 137 -3.415 -4.999 2.728 1.00 32.23 C ATOM 2048 CD1 PHE A 137 -2.247 -5.315 2.069 1.00 51.42 C ATOM 2049 CD2 PHE A 137 -3.908 -5.879 3.664 1.00 71.22 C ATOM 2050 CE1 PHE A 137 -1.587 -6.485 2.342 1.00 32.33 C ATOM 2051 CE2 PHE A 137 -3.256 -7.054 3.946 1.00 12.23 C ATOM 2052 CZ PHE A 137 -2.096 -7.363 3.286 1.00 71.32 C ATOM 0 H PHE A 137 -6.079 -2.200 1.755 1.00 62.00 H new ATOM 0 HA PHE A 137 -4.091 -3.762 0.288 1.00 54.22 H new ATOM 0 HB2 PHE A 137 -3.441 -2.896 2.464 1.00 63.43 H new ATOM 0 HB3 PHE A 137 -4.884 -3.550 3.212 1.00 63.43 H new ATOM 0 HD1 PHE A 137 -1.848 -4.635 1.331 1.00 51.42 H new ATOM 0 HD2 PHE A 137 -4.823 -5.641 4.186 1.00 71.22 H new ATOM 0 HE1 PHE A 137 -0.671 -6.723 1.822 1.00 32.33 H new ATOM 0 HE2 PHE A 137 -3.656 -7.732 4.685 1.00 12.23 H new ATOM 0 HZ PHE A 137 -1.580 -8.287 3.500 1.00 71.32 H new ATOM 2062 N LEU A 138 -5.379 -5.807 -0.024 1.00 54.04 N ATOM 2063 CA LEU A 138 -6.127 -7.013 -0.283 1.00 25.33 C ATOM 2064 C LEU A 138 -5.242 -8.223 -0.101 1.00 55.54 C ATOM 2065 O LEU A 138 -4.005 -8.131 -0.131 1.00 12.10 O ATOM 2066 CB LEU A 138 -6.729 -7.067 -1.715 1.00 53.31 C ATOM 2067 CG LEU A 138 -7.812 -6.040 -2.104 1.00 63.32 C ATOM 2068 CD1 LEU A 138 -7.230 -4.663 -2.352 1.00 63.45 C ATOM 2069 CD2 LEU A 138 -8.580 -6.525 -3.322 1.00 3.20 C ATOM 0 H LEU A 138 -4.566 -5.680 -0.627 1.00 54.04 H new ATOM 0 HA LEU A 138 -6.951 -7.013 0.431 1.00 25.33 H new ATOM 0 HB2 LEU A 138 -5.907 -6.964 -2.423 1.00 53.31 H new ATOM 0 HB3 LEU A 138 -7.151 -8.062 -1.859 1.00 53.31 H new ATOM 0 HG LEU A 138 -8.498 -5.950 -1.262 1.00 63.32 H new ATOM 0 HD11 LEU A 138 -8.030 -3.973 -2.623 1.00 63.45 H new ATOM 0 HD12 LEU A 138 -6.736 -4.308 -1.447 1.00 63.45 H new ATOM 0 HD13 LEU A 138 -6.505 -4.715 -3.164 1.00 63.45 H new ATOM 0 HD21 LEU A 138 -9.342 -5.792 -3.587 1.00 3.20 H new ATOM 0 HD22 LEU A 138 -7.893 -6.653 -4.158 1.00 3.20 H new ATOM 0 HD23 LEU A 138 -9.057 -7.478 -3.095 1.00 3.20 H new ATOM 2081 N ALA A 139 -5.864 -9.350 0.113 1.00 54.14 N ATOM 2082 CA ALA A 139 -5.149 -10.599 0.163 1.00 70.43 C ATOM 2083 C ALA A 139 -4.790 -10.983 -1.264 1.00 62.21 C ATOM 2084 O ALA A 139 -5.671 -11.063 -2.129 1.00 73.12 O ATOM 2085 CB ALA A 139 -6.008 -11.674 0.804 1.00 60.51 C ATOM 0 H ALA A 139 -6.871 -9.431 0.257 1.00 54.14 H new ATOM 0 HA ALA A 139 -4.246 -10.497 0.765 1.00 70.43 H new ATOM 0 HB1 ALA A 139 -5.454 -12.612 0.835 1.00 60.51 H new ATOM 0 HB2 ALA A 139 -6.270 -11.374 1.819 1.00 60.51 H new ATOM 0 HB3 ALA A 139 -6.918 -11.809 0.220 1.00 60.51 H new ATOM 2091 N GLY A 140 -3.526 -11.199 -1.509 1.00 54.32 N ATOM 2092 CA GLY A 140 -3.068 -11.469 -2.844 1.00 71.23 C ATOM 2093 C GLY A 140 -3.394 -12.875 -3.285 1.00 14.04 C ATOM 2094 O GLY A 140 -3.378 -13.789 -2.464 1.00 60.33 O ATOM 0 H GLY A 140 -2.793 -11.193 -0.799 1.00 54.32 H new ATOM 0 HA2 GLY A 140 -3.524 -10.759 -3.533 1.00 71.23 H new ATOM 0 HA3 GLY A 140 -1.990 -11.315 -2.895 1.00 71.23 H new ATOM 2098 N PRO A 141 -3.761 -13.067 -4.557 1.00 4.11 N ATOM 2099 CA PRO A 141 -4.034 -14.388 -5.119 1.00 52.32 C ATOM 2100 C PRO A 141 -2.759 -15.209 -5.295 1.00 22.31 C ATOM 2101 O PRO A 141 -1.648 -14.668 -5.304 1.00 24.12 O ATOM 2102 CB PRO A 141 -4.655 -14.086 -6.481 1.00 4.45 C ATOM 2103 CG PRO A 141 -4.135 -12.744 -6.851 1.00 24.04 C ATOM 2104 CD PRO A 141 -3.947 -11.996 -5.562 1.00 12.50 C ATOM 0 HA PRO A 141 -4.678 -14.978 -4.467 1.00 52.32 H new ATOM 0 HB2 PRO A 141 -4.372 -14.836 -7.219 1.00 4.45 H new ATOM 0 HB3 PRO A 141 -5.744 -14.087 -6.427 1.00 4.45 H new ATOM 0 HG2 PRO A 141 -3.193 -12.828 -7.393 1.00 24.04 H new ATOM 0 HG3 PRO A 141 -4.834 -12.223 -7.505 1.00 24.04 H new ATOM 0 HD2 PRO A 141 -3.082 -11.334 -5.606 1.00 12.50 H new ATOM 0 HD3 PRO A 141 -4.812 -11.375 -5.330 1.00 12.50 H new ATOM 2112 N ALA A 142 -2.920 -16.498 -5.454 1.00 75.40 N ATOM 2113 CA ALA A 142 -1.803 -17.424 -5.639 1.00 54.41 C ATOM 2114 C ALA A 142 -1.382 -17.447 -7.116 1.00 12.34 C ATOM 2115 O ALA A 142 -1.119 -18.502 -7.696 1.00 14.51 O ATOM 2116 CB ALA A 142 -2.225 -18.820 -5.189 1.00 22.14 C ATOM 0 H ALA A 142 -3.834 -16.951 -5.461 1.00 75.40 H new ATOM 0 HA ALA A 142 -0.954 -17.095 -5.040 1.00 54.41 H new ATOM 0 HB1 ALA A 142 -1.395 -19.513 -5.326 1.00 22.14 H new ATOM 0 HB2 ALA A 142 -2.506 -18.793 -4.136 1.00 22.14 H new ATOM 0 HB3 ALA A 142 -3.076 -19.152 -5.783 1.00 22.14 H new ATOM 2122 N GLU A 143 -1.298 -16.287 -7.703 1.00 62.11 N ATOM 2123 CA GLU A 143 -0.966 -16.146 -9.085 1.00 73.32 C ATOM 2124 C GLU A 143 0.141 -15.107 -9.164 1.00 52.41 C ATOM 2125 O GLU A 143 -0.150 -13.910 -9.146 1.00 37.92 O ATOM 2126 CB GLU A 143 -2.236 -15.714 -9.857 1.00 15.34 C ATOM 2127 CG GLU A 143 -2.252 -15.977 -11.373 1.00 62.55 C ATOM 2128 CD GLU A 143 -1.298 -15.128 -12.174 1.00 74.11 C ATOM 2129 OE1 GLU A 143 -1.645 -13.977 -12.501 1.00 14.20 O ATOM 2130 OE2 GLU A 143 -0.197 -15.605 -12.514 1.00 42.04 O ATOM 2131 OXT GLU A 143 1.323 -15.492 -9.189 1.00 37.92 O ATOM 0 H GLU A 143 -1.461 -15.401 -7.224 1.00 62.11 H new ATOM 0 HA GLU A 143 -0.616 -17.076 -9.534 1.00 73.32 H new ATOM 0 HB2 GLU A 143 -3.092 -16.224 -9.415 1.00 15.34 H new ATOM 0 HB3 GLU A 143 -2.384 -14.646 -9.696 1.00 15.34 H new ATOM 0 HG2 GLU A 143 -2.016 -17.027 -11.548 1.00 62.55 H new ATOM 0 HG3 GLU A 143 -3.263 -15.812 -11.745 1.00 62.55 H new TER 2138 GLU A 143