USER MOD reduce.3.24.130724 H: found=0, std=0, add=1171, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1171 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 81 GLN : amide:sc= 0.141! K(o=1.1!,f=3.3) USER MOD Set 1.2: A 122 TYR OH : rot -142:sc= 1.18 USER MOD Set 1.3: A 127 SER OG : rot -139:sc= -0.273 USER MOD Set 2.1: A 111 THR OG1 : rot 180:sc= -0.217 USER MOD Set 2.2: A 143 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 102 SER OG : rot -120:sc= -0.359 USER MOD Set 3.2: A 106 MET CE :methyl -140:sc= -6.11! (180deg=-10!) USER MOD Set 4.1: A 93 CYS SG : rot 180:sc= 1.05 USER MOD Set 4.2: A 97 GLN : amide:sc= -1.06! K(o=-0.0047!,f=2) USER MOD Set 5.1: A 76 ASN : amide:sc= -1.03 K(o=0.22,f=-4.4!) USER MOD Set 5.2: A 78 THR OG1 : rot 88:sc= 1.25 USER MOD Set 6.1: A 69 HIS : no HE2:sc= -8.21! C(o=-15!,f=-17!) USER MOD Set 6.2: A 71 GLN : amide:sc= -7.26! K(o=-15!,f=-11) USER MOD Set 7.1: A 67 THR OG1 : rot 38:sc= -0.697! USER MOD Set 7.2: A 146 THR OG1 : rot 93:sc= -0.0815 USER MOD Set 8.1: A 42 ASN : amide:sc= -4.91! C(o=-4!,f=-3.8!) USER MOD Set 8.2: A 120 TYR OH : rot 48:sc= 0.951 USER MOD Single : A 1 MET CE :methyl -156:sc= -0.235 (180deg=-1.06) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= -1.53! K(o=-1.5!,f=-0.15) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 23 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 47 LYS NZ :NH3+ -169:sc= 0.518 (180deg=-0.00734) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 THR OG1 : rot 50:sc= 0.0907 USER MOD Single : A 57 SER OG : rot 70:sc= 1.38 USER MOD Single : A 58 SER OG : rot 180:sc= 0 USER MOD Single : A 62 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0835) USER MOD Single : A 64 GLN : amide:sc= -7.57! K(o=-7.6!,f=-1.6) USER MOD Single : A 72 THR OG1 : rot -151:sc= -1.9 USER MOD Single : A 73 SER OG : rot 180:sc= -0.0503 USER MOD Single : A 89 THR OG1 : rot 180:sc= 0 USER MOD Single : A 113 MET CE :methyl -157:sc= 0 (180deg=-0.44) USER MOD Single : A 115 THR OG1 : rot 124:sc= 0.698 USER MOD Single : A 118 SER OG : rot 50:sc= -0.923 USER MOD Single : A 119 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 CYS SG : rot 123:sc= -1.43 USER MOD Single : A 125 GLN : amide:sc= -0.904 K(o=-0.9,f=-0.1) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 131 TYR OH : rot 2:sc= -0.4 USER MOD Single : A 135 HIS : no HD1:sc= 0 X(o=0,f=-0.019) USER MOD Single : A 139 CYS SG : rot -97:sc= -7.15! USER MOD Single : A 145 LYS NZ :NH3+ -157:sc= 2.34 (180deg=0.19) USER MOD Single : A 152 HIS : no HD1:sc= 0 X(o=0,f=-0.052) USER MOD Single : A 153 HIS : no HD1:sc= -0.105 X(o=-0.11,f=-0.49) USER MOD Single : A 154 HIS : no HD1:sc= -0.789 K(o=-0.79,f=-0.0056) USER MOD Single : A 155 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 156 HIS : no HE2:sc= 0.137 K(o=0.14,f=-1.5) USER MOD Single : A 157 HIS : no HE2:sc= 0.796 K(o=0.8,f=-6.1!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 31.827 -17.774 68.656 1.00 49.39 N ATOM 2 CA MET A 1 32.446 -16.539 69.187 1.00 49.13 C ATOM 3 C MET A 1 32.228 -15.385 68.220 1.00 48.56 C ATOM 4 O MET A 1 31.495 -14.441 68.516 1.00 48.67 O ATOM 5 CB MET A 1 33.941 -16.756 69.423 1.00 49.37 C ATOM 6 CG MET A 1 34.636 -15.570 70.073 1.00 49.76 C ATOM 7 SD MET A 1 36.386 -15.882 70.387 1.00 50.09 S ATOM 8 CE MET A 1 36.293 -17.360 71.388 1.00 50.23 C ATOM 0 H1 MET A 1 31.982 -18.555 69.325 1.00 49.39 H new ATOM 0 H2 MET A 1 30.806 -17.624 68.530 1.00 49.39 H new ATOM 0 H3 MET A 1 32.258 -18.012 67.740 1.00 49.39 H new ATOM 0 HA MET A 1 31.975 -16.292 70.138 1.00 49.13 H new ATOM 0 HB2 MET A 1 34.076 -17.635 70.053 1.00 49.37 H new ATOM 0 HB3 MET A 1 34.423 -16.970 68.469 1.00 49.37 H new ATOM 0 HG2 MET A 1 34.536 -14.696 69.429 1.00 49.76 H new ATOM 0 HG3 MET A 1 34.138 -15.332 71.013 1.00 49.76 H new ATOM 0 HE1 MET A 1 37.190 -17.441 72.002 1.00 50.23 H new ATOM 0 HE2 MET A 1 35.416 -17.308 72.033 1.00 50.23 H new ATOM 0 HE3 MET A 1 36.216 -18.234 70.741 1.00 50.23 H new ATOM 20 N GLY A 2 32.864 -15.472 67.062 1.00 47.99 N ATOM 21 CA GLY A 2 32.684 -14.466 66.042 1.00 47.44 C ATOM 22 C GLY A 2 31.931 -15.023 64.857 1.00 46.69 C ATOM 23 O GLY A 2 31.817 -16.243 64.727 1.00 46.54 O ATOM 0 H GLY A 2 33.504 -16.226 66.812 1.00 47.99 H new ATOM 0 HA2 GLY A 2 32.140 -13.617 66.456 1.00 47.44 H new ATOM 0 HA3 GLY A 2 33.656 -14.095 65.717 1.00 47.44 H new ATOM 27 N GLN A 3 31.416 -14.142 64.007 1.00 46.26 N ATOM 28 CA GLN A 3 30.647 -14.550 62.833 1.00 45.58 C ATOM 29 C GLN A 3 29.344 -15.243 63.238 1.00 45.14 C ATOM 30 O GLN A 3 29.284 -16.471 63.361 1.00 45.18 O ATOM 31 CB GLN A 3 31.479 -15.455 61.911 1.00 45.54 C ATOM 32 CG GLN A 3 32.338 -14.684 60.922 1.00 45.20 C ATOM 33 CD GLN A 3 31.505 -13.981 59.862 1.00 45.11 C ATOM 34 OE1 GLN A 3 31.878 -12.922 59.361 1.00 45.20 O ATOM 35 NE2 GLN A 3 30.372 -14.569 59.512 1.00 45.01 N ATOM 0 H GLN A 3 31.517 -13.132 64.109 1.00 46.26 H new ATOM 0 HA GLN A 3 30.391 -13.647 62.279 1.00 45.58 H new ATOM 0 HB2 GLN A 3 32.122 -16.090 62.521 1.00 45.54 H new ATOM 0 HB3 GLN A 3 30.808 -16.115 61.361 1.00 45.54 H new ATOM 0 HG2 GLN A 3 32.935 -13.947 61.460 1.00 45.20 H new ATOM 0 HG3 GLN A 3 33.035 -15.368 60.439 1.00 45.20 H new ATOM 0 HE21 GLN A 3 30.097 -15.448 59.951 1.00 45.01 H new ATOM 0 HE22 GLN A 3 29.774 -14.143 58.803 1.00 45.01 H new ATOM 44 N PRO A 4 28.285 -14.450 63.453 1.00 44.78 N ATOM 45 CA PRO A 4 26.977 -14.961 63.872 1.00 44.40 C ATOM 46 C PRO A 4 26.238 -15.666 62.740 1.00 43.91 C ATOM 47 O PRO A 4 26.451 -15.373 61.563 1.00 43.73 O ATOM 48 CB PRO A 4 26.228 -13.693 64.286 1.00 44.25 C ATOM 49 CG PRO A 4 26.830 -12.621 63.449 1.00 44.46 C ATOM 50 CD PRO A 4 28.280 -12.985 63.293 1.00 44.80 C ATOM 0 HA PRO A 4 27.062 -15.707 64.662 1.00 44.40 H new ATOM 0 HB2 PRO A 4 25.157 -13.786 64.104 1.00 44.25 H new ATOM 0 HB3 PRO A 4 26.354 -13.486 65.349 1.00 44.25 H new ATOM 0 HG2 PRO A 4 26.336 -12.559 62.479 1.00 44.46 H new ATOM 0 HG3 PRO A 4 26.721 -11.646 63.925 1.00 44.46 H new ATOM 0 HD2 PRO A 4 28.666 -12.686 62.319 1.00 44.80 H new ATOM 0 HD3 PRO A 4 28.900 -12.497 64.045 1.00 44.80 H new ATOM 58 N PRO A 5 25.369 -16.625 63.081 1.00 43.76 N ATOM 59 CA PRO A 5 24.539 -17.315 62.100 1.00 43.36 C ATOM 60 C PRO A 5 23.457 -16.397 61.539 1.00 42.76 C ATOM 61 O PRO A 5 22.936 -15.537 62.256 1.00 42.58 O ATOM 62 CB PRO A 5 23.905 -18.469 62.894 1.00 43.41 C ATOM 63 CG PRO A 5 24.639 -18.518 64.194 1.00 43.89 C ATOM 64 CD PRO A 5 25.134 -17.125 64.442 1.00 44.02 C ATOM 0 HA PRO A 5 25.117 -17.654 61.240 1.00 43.36 H new ATOM 0 HB2 PRO A 5 22.840 -18.297 63.052 1.00 43.41 H new ATOM 0 HB3 PRO A 5 23.999 -19.412 62.356 1.00 43.41 H new ATOM 0 HG2 PRO A 5 23.984 -18.848 65.000 1.00 43.89 H new ATOM 0 HG3 PRO A 5 25.468 -19.224 64.148 1.00 43.89 H new ATOM 0 HD2 PRO A 5 24.399 -16.522 64.975 1.00 44.02 H new ATOM 0 HD3 PRO A 5 26.045 -17.118 65.040 1.00 44.02 H new ATOM 72 N ALA A 6 23.143 -16.587 60.255 1.00 42.50 N ATOM 73 CA ALA A 6 22.107 -15.818 59.555 1.00 41.97 C ATOM 74 C ALA A 6 22.544 -14.379 59.293 1.00 41.42 C ATOM 75 O ALA A 6 22.528 -13.526 60.182 1.00 41.39 O ATOM 76 CB ALA A 6 20.784 -15.849 60.314 1.00 42.03 C ATOM 0 H ALA A 6 23.602 -17.282 59.667 1.00 42.50 H new ATOM 0 HA ALA A 6 21.957 -16.298 58.588 1.00 41.97 H new ATOM 0 HB1 ALA A 6 20.038 -15.270 59.769 1.00 42.03 H new ATOM 0 HB2 ALA A 6 20.444 -16.880 60.410 1.00 42.03 H new ATOM 0 HB3 ALA A 6 20.923 -15.419 61.306 1.00 42.03 H new ATOM 82 N GLU A 7 22.939 -14.119 58.058 1.00 41.05 N ATOM 83 CA GLU A 7 23.333 -12.781 57.640 1.00 40.56 C ATOM 84 C GLU A 7 22.200 -12.132 56.847 1.00 40.16 C ATOM 85 O GLU A 7 21.225 -12.801 56.491 1.00 40.13 O ATOM 86 CB GLU A 7 24.622 -12.845 56.812 1.00 40.61 C ATOM 87 CG GLU A 7 24.522 -13.742 55.588 1.00 40.78 C ATOM 88 CD GLU A 7 25.872 -14.041 54.970 1.00 41.03 C ATOM 89 OE1 GLU A 7 26.327 -13.261 54.107 1.00 40.82 O ATOM 90 OE2 GLU A 7 26.481 -15.066 55.341 1.00 41.50 O ATOM 0 H GLU A 7 22.996 -14.822 57.321 1.00 41.05 H new ATOM 0 HA GLU A 7 23.529 -12.170 58.521 1.00 40.56 H new ATOM 0 HB2 GLU A 7 24.887 -11.837 56.492 1.00 40.61 H new ATOM 0 HB3 GLU A 7 25.433 -13.202 57.447 1.00 40.61 H new ATOM 0 HG2 GLU A 7 24.040 -14.679 55.868 1.00 40.78 H new ATOM 0 HG3 GLU A 7 23.884 -13.265 54.844 1.00 40.78 H new ATOM 97 N GLU A 8 22.325 -10.840 56.569 1.00 39.89 N ATOM 98 CA GLU A 8 21.265 -10.102 55.892 1.00 39.55 C ATOM 99 C GLU A 8 21.836 -9.222 54.785 1.00 39.08 C ATOM 100 O GLU A 8 23.051 -9.127 54.620 1.00 38.77 O ATOM 101 CB GLU A 8 20.486 -9.240 56.893 1.00 39.61 C ATOM 102 CG GLU A 8 21.353 -8.228 57.623 1.00 39.77 C ATOM 103 CD GLU A 8 20.561 -7.369 58.589 1.00 40.05 C ATOM 104 OE1 GLU A 8 20.058 -7.906 59.599 1.00 40.33 O ATOM 105 OE2 GLU A 8 20.418 -6.155 58.330 1.00 40.04 O ATOM 0 H GLU A 8 23.147 -10.283 56.801 1.00 39.89 H new ATOM 0 HA GLU A 8 20.585 -10.827 55.444 1.00 39.55 H new ATOM 0 HB2 GLU A 8 19.691 -8.713 56.365 1.00 39.61 H new ATOM 0 HB3 GLU A 8 20.006 -9.890 57.624 1.00 39.61 H new ATOM 0 HG2 GLU A 8 22.137 -8.753 58.169 1.00 39.77 H new ATOM 0 HG3 GLU A 8 21.848 -7.586 56.894 1.00 39.77 H new ATOM 112 N ALA A 9 20.947 -8.580 54.044 1.00 39.09 N ATOM 113 CA ALA A 9 21.333 -7.676 52.973 1.00 38.75 C ATOM 114 C ALA A 9 20.233 -6.648 52.753 1.00 38.56 C ATOM 115 O ALA A 9 19.095 -6.861 53.168 1.00 38.67 O ATOM 116 CB ALA A 9 21.608 -8.452 51.689 1.00 38.76 C ATOM 0 H ALA A 9 19.939 -8.671 54.168 1.00 39.09 H new ATOM 0 HA ALA A 9 22.250 -7.160 53.256 1.00 38.75 H new ATOM 0 HB1 ALA A 9 21.895 -7.758 50.899 1.00 38.76 H new ATOM 0 HB2 ALA A 9 22.417 -9.163 51.860 1.00 38.76 H new ATOM 0 HB3 ALA A 9 20.709 -8.990 51.390 1.00 38.76 H new ATOM 122 N GLU A 10 20.567 -5.539 52.105 1.00 38.35 N ATOM 123 CA GLU A 10 19.583 -4.500 51.840 1.00 38.21 C ATOM 124 C GLU A 10 18.885 -4.773 50.518 1.00 37.73 C ATOM 125 O GLU A 10 17.769 -5.290 50.481 1.00 37.49 O ATOM 126 CB GLU A 10 20.233 -3.115 51.794 1.00 38.40 C ATOM 127 CG GLU A 10 21.015 -2.751 53.045 1.00 38.59 C ATOM 128 CD GLU A 10 21.606 -1.358 52.966 1.00 38.73 C ATOM 129 OE1 GLU A 10 22.294 -1.057 51.971 1.00 38.81 O ATOM 130 OE2 GLU A 10 21.386 -0.556 53.896 1.00 38.82 O ATOM 0 H GLU A 10 21.504 -5.338 51.756 1.00 38.35 H new ATOM 0 HA GLU A 10 18.857 -4.513 52.653 1.00 38.21 H new ATOM 0 HB2 GLU A 10 20.902 -3.069 50.935 1.00 38.40 H new ATOM 0 HB3 GLU A 10 19.457 -2.367 51.634 1.00 38.40 H new ATOM 0 HG2 GLU A 10 20.359 -2.817 53.913 1.00 38.59 H new ATOM 0 HG3 GLU A 10 21.816 -3.475 53.195 1.00 38.59 H new ATOM 137 N GLN A 11 19.563 -4.438 49.428 1.00 37.65 N ATOM 138 CA GLN A 11 19.010 -4.627 48.100 1.00 37.26 C ATOM 139 C GLN A 11 19.813 -5.657 47.325 1.00 36.82 C ATOM 140 O GLN A 11 21.028 -5.527 47.187 1.00 36.78 O ATOM 141 CB GLN A 11 19.021 -3.315 47.318 1.00 37.34 C ATOM 142 CG GLN A 11 18.272 -2.178 47.985 1.00 37.71 C ATOM 143 CD GLN A 11 18.322 -0.907 47.161 1.00 37.79 C ATOM 144 OE1 GLN A 11 17.464 -0.668 46.314 1.00 37.58 O ATOM 145 NE2 GLN A 11 19.328 -0.083 47.403 1.00 38.16 N ATOM 0 H GLN A 11 20.499 -4.033 49.441 1.00 37.65 H new ATOM 0 HA GLN A 11 17.984 -4.975 48.220 1.00 37.26 H new ATOM 0 HB2 GLN A 11 20.055 -3.009 47.161 1.00 37.34 H new ATOM 0 HB3 GLN A 11 18.588 -3.490 46.333 1.00 37.34 H new ATOM 0 HG2 GLN A 11 17.233 -2.469 48.140 1.00 37.71 H new ATOM 0 HG3 GLN A 11 18.700 -1.989 48.969 1.00 37.71 H new ATOM 0 HE21 GLN A 11 20.020 -0.318 48.115 1.00 38.16 H new ATOM 0 HE22 GLN A 11 19.412 0.787 46.878 1.00 38.16 H new ATOM 154 N PRO A 12 19.150 -6.711 46.834 1.00 36.56 N ATOM 155 CA PRO A 12 19.753 -7.636 45.876 1.00 36.18 C ATOM 156 C PRO A 12 20.163 -6.915 44.591 1.00 35.97 C ATOM 157 O PRO A 12 21.102 -7.325 43.905 1.00 36.19 O ATOM 158 CB PRO A 12 18.642 -8.654 45.598 1.00 36.06 C ATOM 159 CG PRO A 12 17.708 -8.541 46.756 1.00 36.50 C ATOM 160 CD PRO A 12 17.782 -7.110 47.209 1.00 36.70 C ATOM 0 HA PRO A 12 20.663 -8.097 46.260 1.00 36.18 H new ATOM 0 HB2 PRO A 12 18.133 -8.435 44.659 1.00 36.06 H new ATOM 0 HB3 PRO A 12 19.045 -9.663 45.514 1.00 36.06 H new ATOM 0 HG2 PRO A 12 16.692 -8.806 46.465 1.00 36.50 H new ATOM 0 HG3 PRO A 12 17.997 -9.220 47.558 1.00 36.50 H new ATOM 0 HD2 PRO A 12 17.032 -6.492 46.715 1.00 36.70 H new ATOM 0 HD3 PRO A 12 17.615 -7.018 48.282 1.00 36.70 H new ATOM 168 N GLY A 13 19.461 -5.823 44.288 1.00 35.61 N ATOM 169 CA GLY A 13 19.782 -5.017 43.124 1.00 35.47 C ATOM 170 C GLY A 13 18.957 -5.404 41.921 1.00 35.16 C ATOM 171 O GLY A 13 19.417 -5.282 40.785 1.00 35.17 O ATOM 0 H GLY A 13 18.670 -5.482 44.834 1.00 35.61 H new ATOM 0 HA2 GLY A 13 19.615 -3.965 43.355 1.00 35.47 H new ATOM 0 HA3 GLY A 13 20.840 -5.127 42.888 1.00 35.47 H new ATOM 175 N ALA A 14 17.729 -5.850 42.186 1.00 34.97 N ATOM 176 CA ALA A 14 16.836 -6.374 41.157 1.00 34.74 C ATOM 177 C ALA A 14 17.506 -7.522 40.408 1.00 34.24 C ATOM 178 O ALA A 14 17.492 -8.661 40.881 1.00 34.14 O ATOM 179 CB ALA A 14 16.391 -5.274 40.196 1.00 35.03 C ATOM 0 H ALA A 14 17.326 -5.857 43.123 1.00 34.97 H new ATOM 0 HA ALA A 14 15.941 -6.759 41.646 1.00 34.74 H new ATOM 0 HB1 ALA A 14 15.727 -5.696 39.442 1.00 35.03 H new ATOM 0 HB2 ALA A 14 15.863 -4.498 40.750 1.00 35.03 H new ATOM 0 HB3 ALA A 14 17.265 -4.841 39.709 1.00 35.03 H new ATOM 185 N LEU A 15 18.110 -7.198 39.264 1.00 34.01 N ATOM 186 CA LEU A 15 18.881 -8.146 38.472 1.00 33.60 C ATOM 187 C LEU A 15 19.304 -7.487 37.166 1.00 33.26 C ATOM 188 O LEU A 15 20.358 -6.859 37.095 1.00 33.39 O ATOM 189 CB LEU A 15 18.083 -9.419 38.173 1.00 33.42 C ATOM 190 CG LEU A 15 18.877 -10.546 37.503 1.00 33.48 C ATOM 191 CD1 LEU A 15 19.979 -11.044 38.428 1.00 33.70 C ATOM 192 CD2 LEU A 15 17.953 -11.688 37.116 1.00 33.25 C ATOM 0 H LEU A 15 18.075 -6.262 38.861 1.00 34.01 H new ATOM 0 HA LEU A 15 19.759 -8.433 39.050 1.00 33.60 H new ATOM 0 HB2 LEU A 15 17.667 -9.795 39.107 1.00 33.42 H new ATOM 0 HB3 LEU A 15 17.241 -9.158 37.531 1.00 33.42 H new ATOM 0 HG LEU A 15 19.338 -10.152 36.597 1.00 33.48 H new ATOM 0 HD11 LEU A 15 20.533 -11.844 37.937 1.00 33.70 H new ATOM 0 HD12 LEU A 15 20.657 -10.223 38.661 1.00 33.70 H new ATOM 0 HD13 LEU A 15 19.537 -11.422 39.350 1.00 33.70 H new ATOM 0 HD21 LEU A 15 18.532 -12.480 36.642 1.00 33.25 H new ATOM 0 HD22 LEU A 15 17.465 -12.080 38.009 1.00 33.25 H new ATOM 0 HD23 LEU A 15 17.197 -11.325 36.420 1.00 33.25 H new ATOM 204 N ALA A 16 18.436 -7.603 36.159 1.00 32.89 N ATOM 205 CA ALA A 16 18.674 -7.064 34.819 1.00 32.59 C ATOM 206 C ALA A 16 17.581 -7.559 33.882 1.00 31.98 C ATOM 207 O ALA A 16 17.071 -6.822 33.037 1.00 31.63 O ATOM 208 CB ALA A 16 20.042 -7.491 34.282 1.00 32.80 C ATOM 0 H ALA A 16 17.539 -8.079 36.252 1.00 32.89 H new ATOM 0 HA ALA A 16 18.659 -5.976 34.876 1.00 32.59 H new ATOM 0 HB1 ALA A 16 20.188 -7.074 33.285 1.00 32.80 H new ATOM 0 HB2 ALA A 16 20.824 -7.124 34.947 1.00 32.80 H new ATOM 0 HB3 ALA A 16 20.090 -8.579 34.231 1.00 32.80 H new ATOM 214 N ARG A 17 17.223 -8.825 34.058 1.00 31.94 N ATOM 215 CA ARG A 17 16.202 -9.472 33.254 1.00 31.46 C ATOM 216 C ARG A 17 15.118 -10.055 34.151 1.00 31.11 C ATOM 217 O ARG A 17 15.392 -10.925 34.975 1.00 31.11 O ATOM 218 CB ARG A 17 16.855 -10.577 32.416 1.00 31.72 C ATOM 219 CG ARG A 17 15.879 -11.398 31.593 1.00 31.75 C ATOM 220 CD ARG A 17 15.174 -10.538 30.563 1.00 31.70 C ATOM 221 NE ARG A 17 14.237 -11.316 29.760 1.00 31.67 N ATOM 222 CZ ARG A 17 14.343 -11.480 28.442 1.00 31.67 C ATOM 223 NH1 ARG A 17 15.330 -10.903 27.771 1.00 31.70 N ATOM 224 NH2 ARG A 17 13.463 -12.223 27.791 1.00 31.71 N ATOM 0 H ARG A 17 17.636 -9.432 34.766 1.00 31.94 H new ATOM 0 HA ARG A 17 15.738 -8.741 32.592 1.00 31.46 H new ATOM 0 HB2 ARG A 17 17.586 -10.124 31.746 1.00 31.72 H new ATOM 0 HB3 ARG A 17 17.403 -11.245 33.081 1.00 31.72 H new ATOM 0 HG2 ARG A 17 16.411 -12.207 31.093 1.00 31.75 H new ATOM 0 HG3 ARG A 17 15.143 -11.860 32.251 1.00 31.75 H new ATOM 0 HD2 ARG A 17 14.640 -9.732 31.066 1.00 31.70 H new ATOM 0 HD3 ARG A 17 15.913 -10.072 29.911 1.00 31.70 H new ATOM 0 HE ARG A 17 13.453 -11.762 30.237 1.00 31.67 H new ATOM 0 HH11 ARG A 17 16.014 -10.329 28.264 1.00 31.70 H new ATOM 0 HH12 ARG A 17 15.405 -11.033 26.762 1.00 31.70 H new ATOM 0 HH21 ARG A 17 12.701 -12.672 28.298 1.00 31.71 H new ATOM 0 HH22 ARG A 17 13.547 -12.346 26.782 1.00 31.71 H new ATOM 238 N GLU A 18 13.896 -9.558 34.018 1.00 30.90 N ATOM 239 CA GLU A 18 12.782 -10.093 34.788 1.00 30.62 C ATOM 240 C GLU A 18 11.903 -10.994 33.924 1.00 30.39 C ATOM 241 O GLU A 18 11.578 -12.117 34.307 1.00 30.35 O ATOM 242 CB GLU A 18 11.946 -8.965 35.401 1.00 30.67 C ATOM 243 CG GLU A 18 11.455 -7.930 34.400 1.00 30.69 C ATOM 244 CD GLU A 18 10.264 -7.157 34.919 1.00 30.90 C ATOM 245 OE1 GLU A 18 10.472 -6.188 35.678 1.00 31.24 O ATOM 246 OE2 GLU A 18 9.123 -7.500 34.565 1.00 30.81 O ATOM 0 H GLU A 18 13.652 -8.792 33.390 1.00 30.90 H new ATOM 0 HA GLU A 18 13.198 -10.692 35.598 1.00 30.62 H new ATOM 0 HB2 GLU A 18 11.084 -9.401 35.906 1.00 30.67 H new ATOM 0 HB3 GLU A 18 12.541 -8.462 36.163 1.00 30.67 H new ATOM 0 HG2 GLU A 18 12.264 -7.237 34.170 1.00 30.69 H new ATOM 0 HG3 GLU A 18 11.186 -8.427 33.468 1.00 30.69 H new ATOM 253 N PHE A 19 11.530 -10.499 32.750 1.00 30.33 N ATOM 254 CA PHE A 19 10.669 -11.246 31.851 1.00 30.21 C ATOM 255 C PHE A 19 10.929 -10.842 30.408 1.00 29.75 C ATOM 256 O PHE A 19 11.332 -11.667 29.594 1.00 29.69 O ATOM 257 CB PHE A 19 9.199 -11.018 32.216 1.00 30.57 C ATOM 258 CG PHE A 19 8.241 -11.878 31.439 1.00 30.68 C ATOM 259 CD1 PHE A 19 8.190 -13.246 31.644 1.00 31.05 C ATOM 260 CD2 PHE A 19 7.386 -11.312 30.505 1.00 30.51 C ATOM 261 CE1 PHE A 19 7.306 -14.034 30.930 1.00 31.24 C ATOM 262 CE2 PHE A 19 6.502 -12.095 29.789 1.00 30.71 C ATOM 263 CZ PHE A 19 6.477 -13.476 30.002 1.00 31.07 C ATOM 0 H PHE A 19 11.812 -9.583 32.401 1.00 30.33 H new ATOM 0 HA PHE A 19 10.893 -12.308 31.955 1.00 30.21 H new ATOM 0 HB2 PHE A 19 9.064 -11.211 33.280 1.00 30.57 H new ATOM 0 HB3 PHE A 19 8.951 -9.970 32.048 1.00 30.57 H new ATOM 0 HD1 PHE A 19 8.847 -13.703 32.369 1.00 31.05 H new ATOM 0 HD2 PHE A 19 7.412 -10.246 30.336 1.00 30.51 H new ATOM 0 HE1 PHE A 19 7.272 -15.099 31.108 1.00 31.24 H new ATOM 0 HE2 PHE A 19 5.835 -11.643 29.070 1.00 30.71 H new ATOM 0 HZ PHE A 19 5.803 -14.100 29.433 1.00 31.07 H new ATOM 273 N LEU A 20 10.717 -9.569 30.099 1.00 29.50 N ATOM 274 CA LEU A 20 10.970 -9.059 28.758 1.00 29.16 C ATOM 275 C LEU A 20 11.983 -7.920 28.807 1.00 28.50 C ATOM 276 O LEU A 20 12.552 -7.630 29.862 1.00 28.35 O ATOM 277 CB LEU A 20 9.671 -8.570 28.107 1.00 29.33 C ATOM 278 CG LEU A 20 8.628 -9.653 27.818 1.00 29.60 C ATOM 279 CD1 LEU A 20 7.378 -9.031 27.209 1.00 29.57 C ATOM 280 CD2 LEU A 20 9.212 -10.720 26.897 1.00 29.85 C ATOM 0 H LEU A 20 10.371 -8.872 30.758 1.00 29.50 H new ATOM 0 HA LEU A 20 11.376 -9.873 28.157 1.00 29.16 H new ATOM 0 HB2 LEU A 20 9.220 -7.820 28.757 1.00 29.33 H new ATOM 0 HB3 LEU A 20 9.920 -8.071 27.170 1.00 29.33 H new ATOM 0 HG LEU A 20 8.348 -10.132 28.756 1.00 29.60 H new ATOM 0 HD11 LEU A 20 6.644 -9.811 27.008 1.00 29.57 H new ATOM 0 HD12 LEU A 20 6.956 -8.306 27.905 1.00 29.57 H new ATOM 0 HD13 LEU A 20 7.638 -8.529 26.277 1.00 29.57 H new ATOM 0 HD21 LEU A 20 8.459 -11.483 26.701 1.00 29.85 H new ATOM 0 HD22 LEU A 20 9.518 -10.261 25.957 1.00 29.85 H new ATOM 0 HD23 LEU A 20 10.077 -11.179 27.375 1.00 29.85 H new ATOM 292 N ALA A 21 12.208 -7.292 27.659 1.00 28.20 N ATOM 293 CA ALA A 21 13.097 -6.141 27.559 1.00 27.66 C ATOM 294 C ALA A 21 12.287 -4.847 27.614 1.00 27.05 C ATOM 295 O ALA A 21 11.120 -4.861 28.001 1.00 26.92 O ATOM 296 CB ALA A 21 13.904 -6.222 26.267 1.00 27.59 C ATOM 0 H ALA A 21 11.781 -7.565 26.774 1.00 28.20 H new ATOM 0 HA ALA A 21 13.790 -6.146 28.401 1.00 27.66 H new ATOM 0 HB1 ALA A 21 14.567 -5.359 26.197 1.00 27.59 H new ATOM 0 HB2 ALA A 21 14.497 -7.136 26.265 1.00 27.59 H new ATOM 0 HB3 ALA A 21 13.225 -6.228 25.414 1.00 27.59 H new ATOM 302 N ALA A 22 12.902 -3.734 27.229 1.00 26.78 N ATOM 303 CA ALA A 22 12.237 -2.440 27.273 1.00 26.29 C ATOM 304 C ALA A 22 12.655 -1.576 26.091 1.00 25.93 C ATOM 305 O ALA A 22 13.668 -1.847 25.447 1.00 26.15 O ATOM 306 CB ALA A 22 12.548 -1.731 28.584 1.00 26.23 C ATOM 0 H ALA A 22 13.861 -3.704 26.883 1.00 26.78 H new ATOM 0 HA ALA A 22 11.161 -2.606 27.210 1.00 26.29 H new ATOM 0 HB1 ALA A 22 12.044 -0.765 28.603 1.00 26.23 H new ATOM 0 HB2 ALA A 22 12.199 -2.339 29.418 1.00 26.23 H new ATOM 0 HB3 ALA A 22 13.624 -1.581 28.670 1.00 26.23 H new ATOM 312 N MET A 23 11.840 -0.558 25.802 1.00 25.45 N ATOM 313 CA MET A 23 12.124 0.434 24.756 1.00 25.17 C ATOM 314 C MET A 23 11.966 -0.143 23.349 1.00 24.29 C ATOM 315 O MET A 23 12.262 0.526 22.357 1.00 24.04 O ATOM 316 CB MET A 23 13.518 1.044 24.929 1.00 25.82 C ATOM 317 CG MET A 23 13.654 1.901 26.175 1.00 26.18 C ATOM 318 SD MET A 23 12.541 3.318 26.157 1.00 26.73 S ATOM 319 CE MET A 23 12.872 4.028 27.768 1.00 27.47 C ATOM 0 H MET A 23 10.959 -0.396 26.289 1.00 25.45 H new ATOM 0 HA MET A 23 11.382 1.225 24.871 1.00 25.17 H new ATOM 0 HB2 MET A 23 14.255 0.242 24.967 1.00 25.82 H new ATOM 0 HB3 MET A 23 13.752 1.650 24.054 1.00 25.82 H new ATOM 0 HG2 MET A 23 13.449 1.292 27.056 1.00 26.18 H new ATOM 0 HG3 MET A 23 14.683 2.251 26.262 1.00 26.18 H new ATOM 0 HE1 MET A 23 12.257 4.917 27.907 1.00 27.47 H new ATOM 0 HE2 MET A 23 12.636 3.298 28.543 1.00 27.47 H new ATOM 0 HE3 MET A 23 13.925 4.302 27.836 1.00 27.47 H new ATOM 329 N GLU A 24 11.497 -1.381 23.270 1.00 23.92 N ATOM 330 CA GLU A 24 11.155 -2.003 21.997 1.00 23.15 C ATOM 331 C GLU A 24 9.791 -2.679 22.119 1.00 22.22 C ATOM 332 O GLU A 24 9.695 -3.829 22.544 1.00 22.21 O ATOM 333 CB GLU A 24 12.217 -3.026 21.562 1.00 23.57 C ATOM 334 CG GLU A 24 13.608 -2.441 21.373 1.00 23.67 C ATOM 335 CD GLU A 24 14.571 -3.429 20.754 1.00 24.03 C ATOM 336 OE1 GLU A 24 14.893 -4.442 21.411 1.00 24.41 O ATOM 337 OE2 GLU A 24 14.995 -3.212 19.600 1.00 24.02 O ATOM 0 H GLU A 24 11.343 -1.980 24.081 1.00 23.92 H new ATOM 0 HA GLU A 24 11.118 -1.226 21.233 1.00 23.15 H new ATOM 0 HB2 GLU A 24 12.267 -3.819 22.308 1.00 23.57 H new ATOM 0 HB3 GLU A 24 11.899 -3.487 20.627 1.00 23.57 H new ATOM 0 HG2 GLU A 24 13.544 -1.556 20.740 1.00 23.67 H new ATOM 0 HG3 GLU A 24 13.996 -2.116 22.338 1.00 23.67 H new ATOM 344 N PRO A 25 8.714 -1.951 21.785 1.00 21.54 N ATOM 345 CA PRO A 25 7.349 -2.457 21.907 1.00 20.70 C ATOM 346 C PRO A 25 6.923 -3.294 20.706 1.00 19.96 C ATOM 347 O PRO A 25 7.449 -3.143 19.602 1.00 19.79 O ATOM 348 CB PRO A 25 6.527 -1.175 21.990 1.00 20.35 C ATOM 349 CG PRO A 25 7.282 -0.191 21.162 1.00 20.99 C ATOM 350 CD PRO A 25 8.740 -0.570 21.262 1.00 21.63 C ATOM 0 HA PRO A 25 7.228 -3.124 22.761 1.00 20.70 H new ATOM 0 HB2 PRO A 25 5.518 -1.325 21.606 1.00 20.35 H new ATOM 0 HB3 PRO A 25 6.428 -0.833 23.020 1.00 20.35 H new ATOM 0 HG2 PRO A 25 6.945 -0.218 20.126 1.00 20.99 H new ATOM 0 HG3 PRO A 25 7.120 0.824 21.524 1.00 20.99 H new ATOM 0 HD2 PRO A 25 9.233 -0.520 20.291 1.00 21.63 H new ATOM 0 HD3 PRO A 25 9.282 0.100 21.930 1.00 21.63 H new ATOM 358 N GLU A 26 5.974 -4.187 20.935 1.00 19.63 N ATOM 359 CA GLU A 26 5.436 -5.009 19.869 1.00 19.01 C ATOM 360 C GLU A 26 4.145 -4.388 19.338 1.00 17.82 C ATOM 361 O GLU A 26 3.394 -3.762 20.093 1.00 17.39 O ATOM 362 CB GLU A 26 5.220 -6.448 20.361 1.00 19.23 C ATOM 363 CG GLU A 26 4.247 -6.580 21.525 1.00 19.90 C ATOM 364 CD GLU A 26 4.261 -7.970 22.133 1.00 20.41 C ATOM 365 OE1 GLU A 26 4.357 -8.962 21.376 1.00 20.64 O ATOM 366 OE2 GLU A 26 4.207 -8.078 23.378 1.00 20.67 O ATOM 0 H GLU A 26 5.561 -4.360 21.852 1.00 19.63 H new ATOM 0 HA GLU A 26 6.150 -5.052 19.046 1.00 19.01 H new ATOM 0 HB2 GLU A 26 4.856 -7.052 19.530 1.00 19.23 H new ATOM 0 HB3 GLU A 26 6.182 -6.864 20.660 1.00 19.23 H new ATOM 0 HG2 GLU A 26 4.500 -5.848 22.292 1.00 19.90 H new ATOM 0 HG3 GLU A 26 3.239 -6.346 21.181 1.00 19.90 H new ATOM 373 N PRO A 27 3.897 -4.515 18.027 1.00 17.38 N ATOM 374 CA PRO A 27 2.731 -3.909 17.376 1.00 16.31 C ATOM 375 C PRO A 27 1.415 -4.520 17.838 1.00 15.58 C ATOM 376 O PRO A 27 1.298 -5.740 17.974 1.00 15.74 O ATOM 377 CB PRO A 27 2.945 -4.199 15.883 1.00 16.33 C ATOM 378 CG PRO A 27 4.369 -4.616 15.758 1.00 17.43 C ATOM 379 CD PRO A 27 4.730 -5.254 17.068 1.00 18.02 C ATOM 0 HA PRO A 27 2.657 -2.848 17.614 1.00 16.31 H new ATOM 0 HB2 PRO A 27 2.274 -4.985 15.536 1.00 16.33 H new ATOM 0 HB3 PRO A 27 2.740 -3.315 15.278 1.00 16.33 H new ATOM 0 HG2 PRO A 27 4.499 -5.317 14.934 1.00 17.43 H new ATOM 0 HG3 PRO A 27 5.010 -3.759 15.552 1.00 17.43 H new ATOM 0 HD2 PRO A 27 4.506 -6.321 17.074 1.00 18.02 H new ATOM 0 HD3 PRO A 27 5.792 -5.150 17.290 1.00 18.02 H new ATOM 387 N ALA A 28 0.427 -3.666 18.077 1.00 14.93 N ATOM 388 CA ALA A 28 -0.901 -4.123 18.451 1.00 14.31 C ATOM 389 C ALA A 28 -1.723 -4.424 17.205 1.00 13.28 C ATOM 390 O ALA A 28 -1.686 -3.666 16.230 1.00 12.82 O ATOM 391 CB ALA A 28 -1.603 -3.086 19.319 1.00 14.27 C ATOM 0 H ALA A 28 0.523 -2.652 18.018 1.00 14.93 H new ATOM 0 HA ALA A 28 -0.801 -5.040 19.033 1.00 14.31 H new ATOM 0 HB1 ALA A 28 -2.595 -3.448 19.588 1.00 14.27 H new ATOM 0 HB2 ALA A 28 -1.021 -2.916 20.225 1.00 14.27 H new ATOM 0 HB3 ALA A 28 -1.695 -2.151 18.766 1.00 14.27 H new ATOM 397 N PRO A 29 -2.466 -5.541 17.208 1.00 13.06 N ATOM 398 CA PRO A 29 -3.296 -5.929 16.068 1.00 12.21 C ATOM 399 C PRO A 29 -4.384 -4.905 15.779 1.00 11.34 C ATOM 400 O PRO A 29 -5.148 -4.521 16.666 1.00 11.36 O ATOM 401 CB PRO A 29 -3.926 -7.257 16.504 1.00 12.51 C ATOM 402 CG PRO A 29 -3.086 -7.740 17.637 1.00 13.50 C ATOM 403 CD PRO A 29 -2.560 -6.508 18.314 1.00 13.81 C ATOM 0 HA PRO A 29 -2.711 -6.004 15.152 1.00 12.21 H new ATOM 0 HB2 PRO A 29 -4.962 -7.118 16.814 1.00 12.51 H new ATOM 0 HB3 PRO A 29 -3.933 -7.976 15.685 1.00 12.51 H new ATOM 0 HG2 PRO A 29 -3.673 -8.345 18.328 1.00 13.50 H new ATOM 0 HG3 PRO A 29 -2.270 -8.367 17.278 1.00 13.50 H new ATOM 0 HD2 PRO A 29 -3.232 -6.160 19.099 1.00 13.81 H new ATOM 0 HD3 PRO A 29 -1.590 -6.685 18.779 1.00 13.81 H new ATOM 411 N ALA A 30 -4.450 -4.464 14.531 1.00 10.76 N ATOM 412 CA ALA A 30 -5.493 -3.547 14.098 1.00 10.06 C ATOM 413 C ALA A 30 -5.887 -3.817 12.647 1.00 8.93 C ATOM 414 O ALA A 30 -5.640 -2.991 11.762 1.00 8.35 O ATOM 415 CB ALA A 30 -5.047 -2.101 14.272 1.00 10.54 C ATOM 0 H ALA A 30 -3.791 -4.728 13.799 1.00 10.76 H new ATOM 0 HA ALA A 30 -6.369 -3.713 14.725 1.00 10.06 H new ATOM 0 HB1 ALA A 30 -5.842 -1.433 13.942 1.00 10.54 H new ATOM 0 HB2 ALA A 30 -4.827 -1.912 15.323 1.00 10.54 H new ATOM 0 HB3 ALA A 30 -4.152 -1.922 13.676 1.00 10.54 H new ATOM 421 N PRO A 31 -6.469 -5.002 12.373 1.00 8.82 N ATOM 422 CA PRO A 31 -7.000 -5.328 11.049 1.00 7.95 C ATOM 423 C PRO A 31 -8.053 -4.318 10.606 1.00 6.75 C ATOM 424 O PRO A 31 -9.078 -4.148 11.266 1.00 6.83 O ATOM 425 CB PRO A 31 -7.632 -6.712 11.233 1.00 8.63 C ATOM 426 CG PRO A 31 -6.970 -7.284 12.437 1.00 9.60 C ATOM 427 CD PRO A 31 -6.637 -6.117 13.323 1.00 9.77 C ATOM 0 HA PRO A 31 -6.226 -5.309 10.281 1.00 7.95 H new ATOM 0 HB2 PRO A 31 -8.710 -6.637 11.374 1.00 8.63 H new ATOM 0 HB3 PRO A 31 -7.468 -7.340 10.357 1.00 8.63 H new ATOM 0 HG2 PRO A 31 -7.629 -7.986 12.948 1.00 9.60 H new ATOM 0 HG3 PRO A 31 -6.070 -7.834 12.163 1.00 9.60 H new ATOM 0 HD2 PRO A 31 -7.433 -5.917 14.040 1.00 9.77 H new ATOM 0 HD3 PRO A 31 -5.728 -6.295 13.898 1.00 9.77 H new ATOM 435 N ALA A 32 -7.787 -3.635 9.503 1.00 5.86 N ATOM 436 CA ALA A 32 -8.695 -2.617 9.006 1.00 4.75 C ATOM 437 C ALA A 32 -9.556 -3.163 7.878 1.00 3.89 C ATOM 438 O ALA A 32 -9.043 -3.543 6.825 1.00 3.98 O ATOM 439 CB ALA A 32 -7.917 -1.396 8.537 1.00 4.57 C ATOM 0 H ALA A 32 -6.949 -3.768 8.936 1.00 5.86 H new ATOM 0 HA ALA A 32 -9.353 -2.319 9.822 1.00 4.75 H new ATOM 0 HB1 ALA A 32 -8.612 -0.642 8.167 1.00 4.57 H new ATOM 0 HB2 ALA A 32 -7.346 -0.986 9.370 1.00 4.57 H new ATOM 0 HB3 ALA A 32 -7.235 -1.684 7.737 1.00 4.57 H new ATOM 445 N PRO A 33 -10.877 -3.214 8.089 1.00 3.62 N ATOM 446 CA PRO A 33 -11.835 -3.656 7.073 1.00 3.45 C ATOM 447 C PRO A 33 -12.105 -2.563 6.043 1.00 2.48 C ATOM 448 O PRO A 33 -12.869 -2.751 5.094 1.00 3.06 O ATOM 449 CB PRO A 33 -13.110 -3.955 7.882 1.00 4.15 C ATOM 450 CG PRO A 33 -12.742 -3.778 9.324 1.00 4.47 C ATOM 451 CD PRO A 33 -11.553 -2.868 9.343 1.00 4.26 C ATOM 0 HA PRO A 33 -11.470 -4.513 6.507 1.00 3.45 H new ATOM 0 HB2 PRO A 33 -13.917 -3.279 7.600 1.00 4.15 H new ATOM 0 HB3 PRO A 33 -13.463 -4.969 7.692 1.00 4.15 H new ATOM 0 HG2 PRO A 33 -13.570 -3.348 9.887 1.00 4.47 H new ATOM 0 HG3 PRO A 33 -12.506 -4.737 9.786 1.00 4.47 H new ATOM 0 HD2 PRO A 33 -11.844 -1.818 9.372 1.00 4.26 H new ATOM 0 HD3 PRO A 33 -10.918 -3.046 10.211 1.00 4.26 H new ATOM 459 N GLU A 34 -11.458 -1.423 6.235 1.00 1.57 N ATOM 460 CA GLU A 34 -11.666 -0.269 5.383 1.00 1.27 C ATOM 461 C GLU A 34 -10.556 -0.200 4.344 1.00 1.08 C ATOM 462 O GLU A 34 -9.421 -0.594 4.620 1.00 1.44 O ATOM 463 CB GLU A 34 -11.684 1.015 6.224 1.00 2.01 C ATOM 464 CG GLU A 34 -12.569 0.930 7.465 1.00 2.68 C ATOM 465 CD GLU A 34 -14.022 0.644 7.149 1.00 3.58 C ATOM 466 OE1 GLU A 34 -14.779 1.607 6.911 1.00 4.13 O ATOM 467 OE2 GLU A 34 -14.419 -0.535 7.158 1.00 4.13 O ATOM 0 H GLU A 34 -10.779 -1.275 6.982 1.00 1.57 H new ATOM 0 HA GLU A 34 -12.627 -0.365 4.877 1.00 1.27 H new ATOM 0 HB2 GLU A 34 -10.665 1.250 6.532 1.00 2.01 H new ATOM 0 HB3 GLU A 34 -12.027 1.841 5.601 1.00 2.01 H new ATOM 0 HG2 GLU A 34 -12.187 0.148 8.122 1.00 2.68 H new ATOM 0 HG3 GLU A 34 -12.502 1.869 8.015 1.00 2.68 H new ATOM 474 N GLU A 35 -10.879 0.282 3.157 1.00 1.01 N ATOM 475 CA GLU A 35 -9.899 0.384 2.089 1.00 0.87 C ATOM 476 C GLU A 35 -9.116 1.684 2.215 1.00 0.73 C ATOM 477 O GLU A 35 -9.697 2.768 2.232 1.00 0.89 O ATOM 478 CB GLU A 35 -10.587 0.305 0.724 1.00 1.09 C ATOM 479 CG GLU A 35 -11.399 -0.964 0.537 1.00 1.72 C ATOM 480 CD GLU A 35 -11.757 -1.234 -0.906 1.00 1.94 C ATOM 481 OE1 GLU A 35 -10.886 -1.729 -1.652 1.00 2.36 O ATOM 482 OE2 GLU A 35 -12.918 -0.984 -1.292 1.00 2.45 O ATOM 0 H GLU A 35 -11.812 0.609 2.908 1.00 1.01 H new ATOM 0 HA GLU A 35 -9.203 -0.451 2.173 1.00 0.87 H new ATOM 0 HB2 GLU A 35 -11.241 1.168 0.603 1.00 1.09 H new ATOM 0 HB3 GLU A 35 -9.832 0.365 -0.060 1.00 1.09 H new ATOM 0 HG2 GLU A 35 -10.834 -1.810 0.929 1.00 1.72 H new ATOM 0 HG3 GLU A 35 -12.314 -0.892 1.124 1.00 1.72 H new ATOM 489 N TRP A 36 -7.801 1.565 2.341 1.00 0.53 N ATOM 490 CA TRP A 36 -6.933 2.738 2.434 1.00 0.45 C ATOM 491 C TRP A 36 -6.672 3.317 1.047 1.00 0.46 C ATOM 492 O TRP A 36 -7.328 2.951 0.073 1.00 0.52 O ATOM 493 CB TRP A 36 -5.588 2.390 3.081 1.00 0.38 C ATOM 494 CG TRP A 36 -5.640 1.260 4.060 1.00 0.34 C ATOM 495 CD1 TRP A 36 -6.546 1.077 5.065 1.00 0.39 C ATOM 496 CD2 TRP A 36 -4.730 0.159 4.128 1.00 0.27 C ATOM 497 NE1 TRP A 36 -6.263 -0.081 5.745 1.00 0.36 N ATOM 498 CE2 TRP A 36 -5.150 -0.663 5.190 1.00 0.28 C ATOM 499 CE3 TRP A 36 -3.604 -0.218 3.387 1.00 0.21 C ATOM 500 CZ2 TRP A 36 -4.473 -1.834 5.530 1.00 0.24 C ATOM 501 CZ3 TRP A 36 -2.948 -1.371 3.728 1.00 0.17 C ATOM 502 CH2 TRP A 36 -3.378 -2.168 4.786 1.00 0.19 C ATOM 0 H TRP A 36 -7.310 0.672 2.381 1.00 0.53 H new ATOM 0 HA TRP A 36 -7.447 3.471 3.056 1.00 0.45 H new ATOM 0 HB2 TRP A 36 -4.876 2.139 2.295 1.00 0.38 H new ATOM 0 HB3 TRP A 36 -5.204 3.275 3.588 1.00 0.38 H new ATOM 0 HD1 TRP A 36 -7.364 1.745 5.291 1.00 0.39 H new ATOM 0 HE1 TRP A 36 -6.793 -0.450 6.535 1.00 0.36 H new ATOM 0 HE3 TRP A 36 -3.259 0.388 2.562 1.00 0.21 H new ATOM 0 HZ2 TRP A 36 -4.803 -2.453 6.351 1.00 0.24 H new ATOM 0 HZ3 TRP A 36 -2.077 -1.669 3.163 1.00 0.17 H new ATOM 0 HH2 TRP A 36 -2.833 -3.070 5.023 1.00 0.19 H new ATOM 513 N LEU A 37 -5.689 4.203 0.966 1.00 0.43 N ATOM 514 CA LEU A 37 -5.311 4.825 -0.294 1.00 0.42 C ATOM 515 C LEU A 37 -4.593 3.824 -1.185 1.00 0.37 C ATOM 516 O LEU A 37 -3.476 3.405 -0.878 1.00 0.35 O ATOM 517 CB LEU A 37 -4.394 6.020 -0.032 1.00 0.45 C ATOM 518 CG LEU A 37 -3.972 6.813 -1.273 1.00 0.46 C ATOM 519 CD1 LEU A 37 -5.177 7.458 -1.935 1.00 0.49 C ATOM 520 CD2 LEU A 37 -2.933 7.863 -0.905 1.00 0.50 C ATOM 0 H LEU A 37 -5.135 4.509 1.766 1.00 0.43 H new ATOM 0 HA LEU A 37 -6.217 5.164 -0.797 1.00 0.42 H new ATOM 0 HB2 LEU A 37 -4.898 6.698 0.657 1.00 0.45 H new ATOM 0 HB3 LEU A 37 -3.496 5.663 0.472 1.00 0.45 H new ATOM 0 HG LEU A 37 -3.524 6.121 -1.987 1.00 0.46 H new ATOM 0 HD11 LEU A 37 -4.854 8.016 -2.814 1.00 0.49 H new ATOM 0 HD12 LEU A 37 -5.884 6.685 -2.236 1.00 0.49 H new ATOM 0 HD13 LEU A 37 -5.659 8.137 -1.231 1.00 0.49 H new ATOM 0 HD21 LEU A 37 -2.644 8.417 -1.798 1.00 0.50 H new ATOM 0 HD22 LEU A 37 -3.354 8.550 -0.172 1.00 0.50 H new ATOM 0 HD23 LEU A 37 -2.056 7.374 -0.482 1.00 0.50 H new ATOM 532 N ASP A 38 -5.235 3.424 -2.269 1.00 0.38 N ATOM 533 CA ASP A 38 -4.582 2.564 -3.236 1.00 0.41 C ATOM 534 C ASP A 38 -3.583 3.352 -4.063 1.00 0.39 C ATOM 535 O ASP A 38 -3.909 4.387 -4.646 1.00 0.44 O ATOM 536 CB ASP A 38 -5.576 1.865 -4.151 1.00 0.56 C ATOM 537 CG ASP A 38 -4.929 0.699 -4.863 1.00 1.78 C ATOM 538 OD1 ASP A 38 -4.284 0.909 -5.905 1.00 2.14 O ATOM 539 OD2 ASP A 38 -5.065 -0.438 -4.392 1.00 2.51 O ATOM 0 H ASP A 38 -6.196 3.678 -2.499 1.00 0.38 H new ATOM 0 HA ASP A 38 -4.057 1.794 -2.671 1.00 0.41 H new ATOM 0 HB2 ASP A 38 -6.427 1.513 -3.568 1.00 0.56 H new ATOM 0 HB3 ASP A 38 -5.963 2.574 -4.883 1.00 0.56 H new ATOM 544 N ILE A 39 -2.367 2.838 -4.092 1.00 0.38 N ATOM 545 CA ILE A 39 -1.257 3.439 -4.807 1.00 0.38 C ATOM 546 C ILE A 39 -1.569 3.603 -6.288 1.00 0.39 C ATOM 547 O ILE A 39 -1.167 4.584 -6.918 1.00 0.46 O ATOM 548 CB ILE A 39 0.001 2.565 -4.637 1.00 0.39 C ATOM 549 CG1 ILE A 39 0.289 2.388 -3.142 1.00 0.40 C ATOM 550 CG2 ILE A 39 1.196 3.156 -5.371 1.00 0.41 C ATOM 551 CD1 ILE A 39 1.670 1.860 -2.827 1.00 0.43 C ATOM 0 H ILE A 39 -2.119 1.974 -3.610 1.00 0.38 H new ATOM 0 HA ILE A 39 -1.082 4.430 -4.388 1.00 0.38 H new ATOM 0 HB ILE A 39 -0.182 1.587 -5.083 1.00 0.39 H new ATOM 0 HG12 ILE A 39 0.159 3.349 -2.644 1.00 0.40 H new ATOM 0 HG13 ILE A 39 -0.451 1.708 -2.721 1.00 0.40 H new ATOM 0 HG21 ILE A 39 2.065 2.513 -5.229 1.00 0.41 H new ATOM 0 HG22 ILE A 39 0.969 3.230 -6.435 1.00 0.41 H new ATOM 0 HG23 ILE A 39 1.411 4.149 -4.976 1.00 0.41 H new ATOM 0 HD11 ILE A 39 1.786 1.766 -1.747 1.00 0.43 H new ATOM 0 HD12 ILE A 39 1.801 0.883 -3.292 1.00 0.43 H new ATOM 0 HD13 ILE A 39 2.420 2.550 -3.214 1.00 0.43 H new ATOM 563 N LEU A 40 -2.301 2.650 -6.838 1.00 0.39 N ATOM 564 CA LEU A 40 -2.648 2.681 -8.246 1.00 0.49 C ATOM 565 C LEU A 40 -4.136 2.934 -8.416 1.00 0.49 C ATOM 566 O LEU A 40 -4.644 3.037 -9.534 1.00 0.62 O ATOM 567 CB LEU A 40 -2.254 1.361 -8.909 1.00 0.56 C ATOM 568 CG LEU A 40 -0.777 0.986 -8.774 1.00 0.59 C ATOM 569 CD1 LEU A 40 -0.494 -0.331 -9.469 1.00 0.62 C ATOM 570 CD2 LEU A 40 0.099 2.083 -9.347 1.00 0.72 C ATOM 0 H LEU A 40 -2.666 1.845 -6.330 1.00 0.39 H new ATOM 0 HA LEU A 40 -2.102 3.493 -8.727 1.00 0.49 H new ATOM 0 HB2 LEU A 40 -2.857 0.561 -8.479 1.00 0.56 H new ATOM 0 HB3 LEU A 40 -2.504 1.415 -9.968 1.00 0.56 H new ATOM 0 HG LEU A 40 -0.547 0.872 -7.715 1.00 0.59 H new ATOM 0 HD11 LEU A 40 0.562 -0.580 -9.361 1.00 0.62 H new ATOM 0 HD12 LEU A 40 -1.100 -1.117 -9.019 1.00 0.62 H new ATOM 0 HD13 LEU A 40 -0.740 -0.244 -10.527 1.00 0.62 H new ATOM 0 HD21 LEU A 40 1.147 1.803 -9.244 1.00 0.72 H new ATOM 0 HD22 LEU A 40 -0.137 2.224 -10.402 1.00 0.72 H new ATOM 0 HD23 LEU A 40 -0.083 3.013 -8.808 1.00 0.72 H new ATOM 582 N GLY A 41 -4.824 3.051 -7.288 1.00 0.43 N ATOM 583 CA GLY A 41 -6.268 3.137 -7.288 1.00 0.51 C ATOM 584 C GLY A 41 -6.905 1.895 -7.882 1.00 0.45 C ATOM 585 O GLY A 41 -8.013 1.947 -8.417 1.00 0.52 O ATOM 0 H GLY A 41 -4.399 3.088 -6.362 1.00 0.43 H new ATOM 0 HA2 GLY A 41 -6.624 3.276 -6.267 1.00 0.51 H new ATOM 0 HA3 GLY A 41 -6.580 4.013 -7.856 1.00 0.51 H new ATOM 589 N ASN A 42 -6.196 0.772 -7.793 1.00 0.39 N ATOM 590 CA ASN A 42 -6.684 -0.479 -8.362 1.00 0.42 C ATOM 591 C ASN A 42 -7.403 -1.333 -7.315 1.00 0.43 C ATOM 592 O ASN A 42 -8.312 -2.089 -7.647 1.00 0.56 O ATOM 593 CB ASN A 42 -5.554 -1.264 -9.069 1.00 0.49 C ATOM 594 CG ASN A 42 -4.556 -2.008 -8.172 1.00 0.55 C ATOM 595 OD1 ASN A 42 -4.047 -3.058 -8.554 1.00 0.95 O ATOM 596 ND2 ASN A 42 -4.236 -1.478 -7.003 1.00 0.44 N ATOM 0 H ASN A 42 -5.287 0.704 -7.335 1.00 0.39 H new ATOM 0 HA ASN A 42 -7.419 -0.222 -9.124 1.00 0.42 H new ATOM 0 HB2 ASN A 42 -6.014 -1.990 -9.739 1.00 0.49 H new ATOM 0 HB3 ASN A 42 -4.995 -0.566 -9.692 1.00 0.49 H new ATOM 0 HD21 ASN A 42 -3.556 -1.942 -6.402 1.00 0.44 H new ATOM 0 HD22 ASN A 42 -4.670 -0.605 -6.703 1.00 0.44 H new ATOM 603 N GLY A 43 -7.008 -1.198 -6.056 1.00 0.40 N ATOM 604 CA GLY A 43 -7.694 -1.888 -4.975 1.00 0.50 C ATOM 605 C GLY A 43 -6.839 -2.985 -4.378 1.00 0.45 C ATOM 606 O GLY A 43 -7.165 -3.557 -3.340 1.00 0.72 O ATOM 0 H GLY A 43 -6.221 -0.620 -5.761 1.00 0.40 H new ATOM 0 HA2 GLY A 43 -7.961 -1.172 -4.198 1.00 0.50 H new ATOM 0 HA3 GLY A 43 -8.625 -2.315 -5.349 1.00 0.50 H new ATOM 610 N LEU A 44 -5.727 -3.256 -5.039 1.00 0.29 N ATOM 611 CA LEU A 44 -4.840 -4.345 -4.664 1.00 0.36 C ATOM 612 C LEU A 44 -3.679 -3.836 -3.816 1.00 0.25 C ATOM 613 O LEU A 44 -3.181 -4.535 -2.939 1.00 0.27 O ATOM 614 CB LEU A 44 -4.287 -5.029 -5.926 1.00 0.60 C ATOM 615 CG LEU A 44 -5.276 -5.885 -6.730 1.00 0.51 C ATOM 616 CD1 LEU A 44 -6.411 -5.053 -7.315 1.00 1.46 C ATOM 617 CD2 LEU A 44 -4.552 -6.629 -7.833 1.00 1.56 C ATOM 0 H LEU A 44 -5.413 -2.727 -5.852 1.00 0.29 H new ATOM 0 HA LEU A 44 -5.414 -5.062 -4.077 1.00 0.36 H new ATOM 0 HB2 LEU A 44 -3.889 -4.258 -6.585 1.00 0.60 H new ATOM 0 HB3 LEU A 44 -3.449 -5.661 -5.632 1.00 0.60 H new ATOM 0 HG LEU A 44 -5.719 -6.603 -6.040 1.00 0.51 H new ATOM 0 HD11 LEU A 44 -7.085 -5.701 -7.875 1.00 1.46 H new ATOM 0 HD12 LEU A 44 -6.960 -4.568 -6.508 1.00 1.46 H new ATOM 0 HD13 LEU A 44 -6.000 -4.294 -7.981 1.00 1.46 H new ATOM 0 HD21 LEU A 44 -5.266 -7.232 -8.395 1.00 1.56 H new ATOM 0 HD22 LEU A 44 -4.075 -5.913 -8.503 1.00 1.56 H new ATOM 0 HD23 LEU A 44 -3.793 -7.278 -7.397 1.00 1.56 H new ATOM 629 N LEU A 45 -3.251 -2.618 -4.099 1.00 0.23 N ATOM 630 CA LEU A 45 -2.037 -2.061 -3.519 1.00 0.22 C ATOM 631 C LEU A 45 -2.324 -0.751 -2.774 1.00 0.22 C ATOM 632 O LEU A 45 -2.432 0.296 -3.391 1.00 0.32 O ATOM 633 CB LEU A 45 -1.029 -1.867 -4.654 1.00 0.30 C ATOM 634 CG LEU A 45 0.170 -0.976 -4.361 1.00 0.26 C ATOM 635 CD1 LEU A 45 0.985 -1.518 -3.202 1.00 0.28 C ATOM 636 CD2 LEU A 45 1.021 -0.855 -5.609 1.00 0.31 C ATOM 0 H LEU A 45 -3.734 -1.986 -4.737 1.00 0.23 H new ATOM 0 HA LEU A 45 -1.625 -2.742 -2.774 1.00 0.22 H new ATOM 0 HB2 LEU A 45 -0.659 -2.848 -4.951 1.00 0.30 H new ATOM 0 HB3 LEU A 45 -1.559 -1.453 -5.512 1.00 0.30 H new ATOM 0 HG LEU A 45 -0.187 0.013 -4.072 1.00 0.26 H new ATOM 0 HD11 LEU A 45 1.835 -0.861 -3.016 1.00 0.28 H new ATOM 0 HD12 LEU A 45 0.361 -1.566 -2.310 1.00 0.28 H new ATOM 0 HD13 LEU A 45 1.346 -2.517 -3.447 1.00 0.28 H new ATOM 0 HD21 LEU A 45 1.881 -0.217 -5.403 1.00 0.31 H new ATOM 0 HD22 LEU A 45 1.367 -1.844 -5.911 1.00 0.31 H new ATOM 0 HD23 LEU A 45 0.429 -0.417 -6.412 1.00 0.31 H new ATOM 648 N ARG A 46 -2.419 -0.805 -1.450 1.00 0.20 N ATOM 649 CA ARG A 46 -2.867 0.352 -0.665 1.00 0.22 C ATOM 650 C ARG A 46 -1.939 0.607 0.519 1.00 0.19 C ATOM 651 O ARG A 46 -1.502 -0.335 1.170 1.00 0.19 O ATOM 652 CB ARG A 46 -4.282 0.090 -0.152 1.00 0.25 C ATOM 653 CG ARG A 46 -5.247 -0.332 -1.247 1.00 0.36 C ATOM 654 CD ARG A 46 -6.573 -0.805 -0.688 1.00 0.37 C ATOM 655 NE ARG A 46 -6.401 -1.951 0.206 1.00 0.54 N ATOM 656 CZ ARG A 46 -7.400 -2.681 0.701 1.00 0.75 C ATOM 657 NH1 ARG A 46 -8.648 -2.463 0.315 1.00 1.14 N ATOM 658 NH2 ARG A 46 -7.142 -3.653 1.562 1.00 0.99 N ATOM 0 H ARG A 46 -2.194 -1.631 -0.895 1.00 0.20 H new ATOM 0 HA ARG A 46 -2.853 1.233 -1.307 1.00 0.22 H new ATOM 0 HB2 ARG A 46 -4.247 -0.687 0.612 1.00 0.25 H new ATOM 0 HB3 ARG A 46 -4.660 0.992 0.329 1.00 0.25 H new ATOM 0 HG2 ARG A 46 -5.417 0.507 -1.922 1.00 0.36 H new ATOM 0 HG3 ARG A 46 -4.798 -1.130 -1.837 1.00 0.36 H new ATOM 0 HD2 ARG A 46 -7.053 0.011 -0.147 1.00 0.37 H new ATOM 0 HD3 ARG A 46 -7.238 -1.078 -1.508 1.00 0.37 H new ATOM 0 HE ARG A 46 -5.450 -2.209 0.469 1.00 0.54 H new ATOM 0 HH11 ARG A 46 -8.851 -1.732 -0.366 1.00 1.14 H new ATOM 0 HH12 ARG A 46 -9.406 -3.027 0.699 1.00 1.14 H new ATOM 0 HH21 ARG A 46 -6.180 -3.842 1.845 1.00 0.99 H new ATOM 0 HH22 ARG A 46 -7.905 -4.213 1.942 1.00 0.99 H new ATOM 672 N LYS A 47 -1.666 1.876 0.814 1.00 0.20 N ATOM 673 CA LYS A 47 -0.762 2.235 1.907 1.00 0.17 C ATOM 674 C LYS A 47 -1.542 2.901 3.043 1.00 0.18 C ATOM 675 O LYS A 47 -2.228 3.899 2.825 1.00 0.22 O ATOM 676 CB LYS A 47 0.330 3.198 1.403 1.00 0.23 C ATOM 677 CG LYS A 47 1.607 3.166 2.237 1.00 0.25 C ATOM 678 CD LYS A 47 2.393 4.473 2.197 1.00 0.32 C ATOM 679 CE LYS A 47 1.571 5.677 2.656 1.00 0.20 C ATOM 680 NZ LYS A 47 2.428 6.854 2.989 1.00 0.35 N ATOM 0 H LYS A 47 -2.057 2.673 0.312 1.00 0.20 H new ATOM 0 HA LYS A 47 -0.294 1.324 2.278 1.00 0.17 H new ATOM 0 HB2 LYS A 47 0.574 2.948 0.371 1.00 0.23 H new ATOM 0 HB3 LYS A 47 -0.066 4.213 1.400 1.00 0.23 H new ATOM 0 HG2 LYS A 47 1.350 2.937 3.271 1.00 0.25 H new ATOM 0 HG3 LYS A 47 2.244 2.357 1.880 1.00 0.25 H new ATOM 0 HD2 LYS A 47 3.275 4.380 2.830 1.00 0.32 H new ATOM 0 HD3 LYS A 47 2.747 4.647 1.181 1.00 0.32 H new ATOM 0 HE2 LYS A 47 0.866 5.954 1.872 1.00 0.20 H new ATOM 0 HE3 LYS A 47 0.982 5.400 3.530 1.00 0.20 H new ATOM 0 HZ1 LYS A 47 1.854 7.577 3.468 1.00 0.35 H new ATOM 0 HZ2 LYS A 47 3.201 6.554 3.617 1.00 0.35 H new ATOM 0 HZ3 LYS A 47 2.827 7.252 2.115 1.00 0.35 H new ATOM 694 N LYS A 48 -1.446 2.351 4.247 1.00 0.16 N ATOM 695 CA LYS A 48 -2.073 2.965 5.411 1.00 0.18 C ATOM 696 C LYS A 48 -1.036 3.714 6.230 1.00 0.17 C ATOM 697 O LYS A 48 -0.053 3.127 6.681 1.00 0.22 O ATOM 698 CB LYS A 48 -2.738 1.928 6.324 1.00 0.25 C ATOM 699 CG LYS A 48 -3.589 2.568 7.416 1.00 0.32 C ATOM 700 CD LYS A 48 -3.647 1.738 8.694 1.00 0.69 C ATOM 701 CE LYS A 48 -4.194 0.344 8.461 1.00 0.52 C ATOM 702 NZ LYS A 48 -4.650 -0.285 9.732 1.00 1.07 N ATOM 0 H LYS A 48 -0.943 1.486 4.443 1.00 0.16 H new ATOM 0 HA LYS A 48 -2.837 3.645 5.033 1.00 0.18 H new ATOM 0 HB2 LYS A 48 -3.362 1.267 5.723 1.00 0.25 H new ATOM 0 HB3 LYS A 48 -1.969 1.308 6.784 1.00 0.25 H new ATOM 0 HG2 LYS A 48 -3.188 3.555 7.649 1.00 0.32 H new ATOM 0 HG3 LYS A 48 -4.601 2.716 7.040 1.00 0.32 H new ATOM 0 HD2 LYS A 48 -2.647 1.665 9.121 1.00 0.69 H new ATOM 0 HD3 LYS A 48 -4.270 2.250 9.427 1.00 0.69 H new ATOM 0 HE2 LYS A 48 -5.026 0.392 7.759 1.00 0.52 H new ATOM 0 HE3 LYS A 48 -3.425 -0.277 8.002 1.00 0.52 H new ATOM 0 HZ1 LYS A 48 -5.018 -1.238 9.535 1.00 1.07 H new ATOM 0 HZ2 LYS A 48 -3.850 -0.353 10.393 1.00 1.07 H new ATOM 0 HZ3 LYS A 48 -5.401 0.296 10.157 1.00 1.07 H new ATOM 716 N THR A 49 -1.256 4.999 6.424 1.00 0.18 N ATOM 717 CA THR A 49 -0.392 5.795 7.271 1.00 0.20 C ATOM 718 C THR A 49 -0.677 5.529 8.745 1.00 0.21 C ATOM 719 O THR A 49 -1.664 6.022 9.295 1.00 0.29 O ATOM 720 CB THR A 49 -0.562 7.294 6.973 1.00 0.25 C ATOM 721 OG1 THR A 49 -1.954 7.602 6.792 1.00 0.33 O ATOM 722 CG2 THR A 49 0.225 7.692 5.734 1.00 0.25 C ATOM 0 H THR A 49 -2.029 5.515 6.004 1.00 0.18 H new ATOM 0 HA THR A 49 0.637 5.507 7.055 1.00 0.20 H new ATOM 0 HB THR A 49 -0.176 7.860 7.821 1.00 0.25 H new ATOM 0 HG1 THR A 49 -2.470 7.233 7.539 1.00 0.33 H new ATOM 0 HG21 THR A 49 0.089 8.757 5.543 1.00 0.25 H new ATOM 0 HG22 THR A 49 1.283 7.484 5.893 1.00 0.25 H new ATOM 0 HG23 THR A 49 -0.133 7.121 4.877 1.00 0.25 H new ATOM 730 N LEU A 50 0.165 4.714 9.368 1.00 0.18 N ATOM 731 CA LEU A 50 0.105 4.527 10.811 1.00 0.21 C ATOM 732 C LEU A 50 0.547 5.825 11.445 1.00 0.23 C ATOM 733 O LEU A 50 -0.154 6.441 12.250 1.00 0.28 O ATOM 734 CB LEU A 50 1.051 3.404 11.230 1.00 0.21 C ATOM 735 CG LEU A 50 1.009 2.173 10.334 1.00 0.20 C ATOM 736 CD1 LEU A 50 2.205 1.288 10.614 1.00 0.21 C ATOM 737 CD2 LEU A 50 -0.294 1.414 10.529 1.00 0.24 C ATOM 0 H LEU A 50 0.893 4.175 8.899 1.00 0.18 H new ATOM 0 HA LEU A 50 -0.904 4.260 11.125 1.00 0.21 H new ATOM 0 HB2 LEU A 50 2.070 3.792 11.245 1.00 0.21 H new ATOM 0 HB3 LEU A 50 0.809 3.104 12.249 1.00 0.21 H new ATOM 0 HG LEU A 50 1.055 2.491 9.293 1.00 0.20 H new ATOM 0 HD11 LEU A 50 2.167 0.410 9.969 1.00 0.21 H new ATOM 0 HD12 LEU A 50 3.122 1.843 10.418 1.00 0.21 H new ATOM 0 HD13 LEU A 50 2.188 0.973 11.657 1.00 0.21 H new ATOM 0 HD21 LEU A 50 -0.305 0.538 9.880 1.00 0.24 H new ATOM 0 HD22 LEU A 50 -0.378 1.097 11.568 1.00 0.24 H new ATOM 0 HD23 LEU A 50 -1.134 2.062 10.278 1.00 0.24 H new ATOM 749 N VAL A 51 1.735 6.219 11.037 1.00 0.23 N ATOM 750 CA VAL A 51 2.269 7.536 11.280 1.00 0.27 C ATOM 751 C VAL A 51 2.756 8.047 9.949 1.00 0.24 C ATOM 752 O VAL A 51 3.495 7.345 9.283 1.00 0.23 O ATOM 753 CB VAL A 51 3.461 7.505 12.238 1.00 0.30 C ATOM 754 CG1 VAL A 51 4.004 8.904 12.486 1.00 0.36 C ATOM 755 CG2 VAL A 51 3.081 6.837 13.543 1.00 0.36 C ATOM 0 H VAL A 51 2.369 5.615 10.514 1.00 0.23 H new ATOM 0 HA VAL A 51 1.498 8.162 11.728 1.00 0.27 H new ATOM 0 HB VAL A 51 4.252 6.919 11.770 1.00 0.30 H new ATOM 0 HG11 VAL A 51 4.850 8.850 13.171 1.00 0.36 H new ATOM 0 HG12 VAL A 51 4.329 9.341 11.542 1.00 0.36 H new ATOM 0 HG13 VAL A 51 3.223 9.525 12.924 1.00 0.36 H new ATOM 0 HG21 VAL A 51 3.943 6.825 14.210 1.00 0.36 H new ATOM 0 HG22 VAL A 51 2.267 7.390 14.011 1.00 0.36 H new ATOM 0 HG23 VAL A 51 2.759 5.814 13.348 1.00 0.36 H new ATOM 765 N PRO A 52 2.320 9.222 9.520 1.00 0.29 N ATOM 766 CA PRO A 52 2.676 9.768 8.222 1.00 0.32 C ATOM 767 C PRO A 52 3.717 10.886 8.296 1.00 0.34 C ATOM 768 O PRO A 52 3.462 12.017 7.882 1.00 0.54 O ATOM 769 CB PRO A 52 1.319 10.292 7.800 1.00 0.41 C ATOM 770 CG PRO A 52 0.733 10.862 9.063 1.00 0.46 C ATOM 771 CD PRO A 52 1.374 10.109 10.210 1.00 0.37 C ATOM 0 HA PRO A 52 3.145 9.053 7.546 1.00 0.32 H new ATOM 0 HB2 PRO A 52 1.410 11.053 7.025 1.00 0.41 H new ATOM 0 HB3 PRO A 52 0.694 9.497 7.395 1.00 0.41 H new ATOM 0 HG2 PRO A 52 0.937 11.930 9.138 1.00 0.46 H new ATOM 0 HG3 PRO A 52 -0.350 10.742 9.077 1.00 0.46 H new ATOM 0 HD2 PRO A 52 1.880 10.781 10.904 1.00 0.37 H new ATOM 0 HD3 PRO A 52 0.639 9.548 10.788 1.00 0.37 H new ATOM 779 N GLY A 53 4.888 10.555 8.824 1.00 0.24 N ATOM 780 CA GLY A 53 5.979 11.503 8.895 1.00 0.28 C ATOM 781 C GLY A 53 5.813 12.523 10.004 1.00 0.29 C ATOM 782 O GLY A 53 4.687 12.827 10.412 1.00 0.55 O ATOM 0 H GLY A 53 5.102 9.635 9.208 1.00 0.24 H new ATOM 0 HA2 GLY A 53 6.913 10.962 9.045 1.00 0.28 H new ATOM 0 HA3 GLY A 53 6.062 12.024 7.941 1.00 0.28 H new ATOM 786 N PRO A 54 6.922 13.047 10.539 1.00 0.52 N ATOM 787 CA PRO A 54 6.878 14.151 11.495 1.00 0.67 C ATOM 788 C PRO A 54 6.409 15.430 10.811 1.00 0.78 C ATOM 789 O PRO A 54 6.422 15.506 9.582 1.00 1.20 O ATOM 790 CB PRO A 54 8.333 14.286 11.957 1.00 1.03 C ATOM 791 CG PRO A 54 9.147 13.691 10.860 1.00 1.42 C ATOM 792 CD PRO A 54 8.299 12.608 10.252 1.00 0.91 C ATOM 0 HA PRO A 54 6.187 13.975 12.319 1.00 0.67 H new ATOM 0 HB2 PRO A 54 8.598 15.330 12.123 1.00 1.03 H new ATOM 0 HB3 PRO A 54 8.498 13.762 12.898 1.00 1.03 H new ATOM 0 HG2 PRO A 54 9.409 14.444 10.117 1.00 1.42 H new ATOM 0 HG3 PRO A 54 10.082 13.284 11.245 1.00 1.42 H new ATOM 0 HD2 PRO A 54 8.475 12.514 9.180 1.00 0.91 H new ATOM 0 HD3 PRO A 54 8.511 11.635 10.696 1.00 0.91 H new ATOM 800 N PRO A 55 5.984 16.446 11.579 1.00 0.97 N ATOM 801 CA PRO A 55 5.534 17.723 11.014 1.00 1.24 C ATOM 802 C PRO A 55 6.593 18.354 10.108 1.00 0.93 C ATOM 803 O PRO A 55 7.549 18.967 10.588 1.00 1.20 O ATOM 804 CB PRO A 55 5.278 18.603 12.246 1.00 1.81 C ATOM 805 CG PRO A 55 5.947 17.898 13.382 1.00 2.04 C ATOM 806 CD PRO A 55 5.908 16.438 13.044 1.00 1.47 C ATOM 0 HA PRO A 55 4.653 17.601 10.384 1.00 1.24 H new ATOM 0 HB2 PRO A 55 5.689 19.603 12.107 1.00 1.81 H new ATOM 0 HB3 PRO A 55 4.210 18.720 12.430 1.00 1.81 H new ATOM 0 HG2 PRO A 55 6.974 18.243 13.504 1.00 2.04 H new ATOM 0 HG3 PRO A 55 5.431 18.095 14.322 1.00 2.04 H new ATOM 0 HD2 PRO A 55 6.742 15.896 13.490 1.00 1.47 H new ATOM 0 HD3 PRO A 55 4.993 15.964 13.400 1.00 1.47 H new ATOM 814 N GLY A 56 6.434 18.163 8.802 1.00 0.98 N ATOM 815 CA GLY A 56 7.378 18.703 7.846 1.00 0.82 C ATOM 816 C GLY A 56 8.462 17.706 7.465 1.00 0.64 C ATOM 817 O GLY A 56 9.652 18.017 7.543 1.00 0.69 O ATOM 0 H GLY A 56 5.662 17.640 8.389 1.00 0.98 H new ATOM 0 HA2 GLY A 56 6.843 19.013 6.948 1.00 0.82 H new ATOM 0 HA3 GLY A 56 7.842 19.596 8.264 1.00 0.82 H new ATOM 821 N SER A 57 8.054 16.504 7.072 1.00 0.52 N ATOM 822 CA SER A 57 8.969 15.500 6.576 1.00 0.40 C ATOM 823 C SER A 57 9.258 15.736 5.092 1.00 0.34 C ATOM 824 O SER A 57 9.018 16.826 4.573 1.00 0.43 O ATOM 825 CB SER A 57 8.344 14.123 6.811 1.00 0.40 C ATOM 826 OG SER A 57 6.931 14.215 6.802 1.00 0.99 O ATOM 0 H SER A 57 7.079 16.205 7.091 1.00 0.52 H new ATOM 0 HA SER A 57 9.921 15.557 7.104 1.00 0.40 H new ATOM 0 HB2 SER A 57 8.675 13.430 6.038 1.00 0.40 H new ATOM 0 HB3 SER A 57 8.683 13.721 7.766 1.00 0.40 H new ATOM 0 HG SER A 57 6.621 14.397 5.890 1.00 0.99 H new ATOM 832 N SER A 58 9.785 14.728 4.420 1.00 0.28 N ATOM 833 CA SER A 58 10.092 14.830 3.005 1.00 0.30 C ATOM 834 C SER A 58 10.027 13.444 2.382 1.00 0.27 C ATOM 835 O SER A 58 10.635 12.510 2.891 1.00 0.38 O ATOM 836 CB SER A 58 11.489 15.437 2.822 1.00 0.38 C ATOM 837 OG SER A 58 11.775 15.680 1.458 1.00 1.28 O ATOM 0 H SER A 58 10.010 13.824 4.835 1.00 0.28 H new ATOM 0 HA SER A 58 9.367 15.477 2.512 1.00 0.30 H new ATOM 0 HB2 SER A 58 11.557 16.370 3.381 1.00 0.38 H new ATOM 0 HB3 SER A 58 12.237 14.762 3.237 1.00 0.38 H new ATOM 0 HG SER A 58 12.671 16.068 1.376 1.00 1.28 H new ATOM 843 N ARG A 59 9.276 13.295 1.306 1.00 0.32 N ATOM 844 CA ARG A 59 9.173 12.002 0.649 1.00 0.30 C ATOM 845 C ARG A 59 10.234 11.855 -0.432 1.00 0.27 C ATOM 846 O ARG A 59 10.327 12.684 -1.341 1.00 0.34 O ATOM 847 CB ARG A 59 7.773 11.775 0.074 1.00 0.42 C ATOM 848 CG ARG A 59 7.094 13.024 -0.463 1.00 0.64 C ATOM 849 CD ARG A 59 5.700 12.703 -0.965 1.00 0.68 C ATOM 850 NE ARG A 59 4.847 13.885 -1.021 1.00 1.41 N ATOM 851 CZ ARG A 59 3.555 13.857 -1.347 1.00 1.81 C ATOM 852 NH1 ARG A 59 2.973 12.712 -1.684 1.00 1.78 N ATOM 853 NH2 ARG A 59 2.843 14.969 -1.315 1.00 2.81 N ATOM 0 H ARG A 59 8.734 14.042 0.872 1.00 0.32 H new ATOM 0 HA ARG A 59 9.348 11.235 1.404 1.00 0.30 H new ATOM 0 HB2 ARG A 59 7.840 11.041 -0.729 1.00 0.42 H new ATOM 0 HB3 ARG A 59 7.143 11.341 0.850 1.00 0.42 H new ATOM 0 HG2 ARG A 59 7.039 13.779 0.321 1.00 0.64 H new ATOM 0 HG3 ARG A 59 7.689 13.448 -1.272 1.00 0.64 H new ATOM 0 HD2 ARG A 59 5.767 12.258 -1.958 1.00 0.68 H new ATOM 0 HD3 ARG A 59 5.244 11.959 -0.313 1.00 0.68 H new ATOM 0 HE ARG A 59 5.265 14.788 -0.797 1.00 1.41 H new ATOM 0 HH11 ARG A 59 3.515 11.848 -1.694 1.00 1.78 H new ATOM 0 HH12 ARG A 59 1.984 12.696 -1.933 1.00 1.78 H new ATOM 0 HH21 ARG A 59 3.282 15.848 -1.041 1.00 2.81 H new ATOM 0 HH22 ARG A 59 1.854 14.949 -1.564 1.00 2.81 H new ATOM 867 N PRO A 60 11.075 10.811 -0.309 1.00 0.23 N ATOM 868 CA PRO A 60 12.145 10.506 -1.269 1.00 0.26 C ATOM 869 C PRO A 60 11.679 10.440 -2.725 1.00 0.26 C ATOM 870 O PRO A 60 10.519 10.144 -3.022 1.00 0.28 O ATOM 871 CB PRO A 60 12.658 9.129 -0.818 1.00 0.30 C ATOM 872 CG PRO A 60 11.651 8.628 0.161 1.00 0.28 C ATOM 873 CD PRO A 60 11.078 9.850 0.807 1.00 0.21 C ATOM 0 HA PRO A 60 12.898 11.294 -1.264 1.00 0.26 H new ATOM 0 HB2 PRO A 60 12.753 8.449 -1.665 1.00 0.30 H new ATOM 0 HB3 PRO A 60 13.644 9.208 -0.360 1.00 0.30 H new ATOM 0 HG2 PRO A 60 10.875 8.047 -0.337 1.00 0.28 H new ATOM 0 HG3 PRO A 60 12.114 7.974 0.900 1.00 0.28 H new ATOM 0 HD2 PRO A 60 10.075 9.674 1.197 1.00 0.21 H new ATOM 0 HD3 PRO A 60 11.688 10.195 1.641 1.00 0.21 H new ATOM 881 N VAL A 61 12.610 10.721 -3.624 1.00 0.29 N ATOM 882 CA VAL A 61 12.358 10.656 -5.055 1.00 0.31 C ATOM 883 C VAL A 61 12.909 9.345 -5.609 1.00 0.28 C ATOM 884 O VAL A 61 13.806 8.744 -5.015 1.00 0.27 O ATOM 885 CB VAL A 61 13.021 11.845 -5.790 1.00 0.40 C ATOM 886 CG1 VAL A 61 12.624 11.890 -7.259 1.00 0.81 C ATOM 887 CG2 VAL A 61 12.670 13.156 -5.104 1.00 0.88 C ATOM 0 H VAL A 61 13.561 11.000 -3.382 1.00 0.29 H new ATOM 0 HA VAL A 61 11.281 10.707 -5.218 1.00 0.31 H new ATOM 0 HB VAL A 61 14.100 11.701 -5.745 1.00 0.40 H new ATOM 0 HG11 VAL A 61 13.109 12.738 -7.741 1.00 0.81 H new ATOM 0 HG12 VAL A 61 12.936 10.967 -7.749 1.00 0.81 H new ATOM 0 HG13 VAL A 61 11.542 11.997 -7.340 1.00 0.81 H new ATOM 0 HG21 VAL A 61 13.144 13.982 -5.634 1.00 0.88 H new ATOM 0 HG22 VAL A 61 11.589 13.293 -5.112 1.00 0.88 H new ATOM 0 HG23 VAL A 61 13.025 13.134 -4.074 1.00 0.88 H new ATOM 897 N LYS A 62 12.367 8.893 -6.729 1.00 0.27 N ATOM 898 CA LYS A 62 12.844 7.680 -7.371 1.00 0.27 C ATOM 899 C LYS A 62 14.273 7.860 -7.843 1.00 0.25 C ATOM 900 O LYS A 62 14.544 8.575 -8.805 1.00 0.31 O ATOM 901 CB LYS A 62 11.938 7.270 -8.530 1.00 0.30 C ATOM 902 CG LYS A 62 10.583 6.765 -8.073 1.00 0.37 C ATOM 903 CD LYS A 62 9.784 6.196 -9.227 1.00 0.41 C ATOM 904 CE LYS A 62 8.440 5.656 -8.759 1.00 0.60 C ATOM 905 NZ LYS A 62 7.681 5.016 -9.866 1.00 1.17 N ATOM 0 H LYS A 62 11.594 9.350 -7.213 1.00 0.27 H new ATOM 0 HA LYS A 62 12.819 6.877 -6.634 1.00 0.27 H new ATOM 0 HB2 LYS A 62 11.797 8.124 -9.193 1.00 0.30 H new ATOM 0 HB3 LYS A 62 12.432 6.492 -9.112 1.00 0.30 H new ATOM 0 HG2 LYS A 62 10.718 5.999 -7.310 1.00 0.37 H new ATOM 0 HG3 LYS A 62 10.027 7.581 -7.611 1.00 0.37 H new ATOM 0 HD2 LYS A 62 9.625 6.970 -9.978 1.00 0.41 H new ATOM 0 HD3 LYS A 62 10.352 5.398 -9.706 1.00 0.41 H new ATOM 0 HE2 LYS A 62 8.599 4.930 -7.961 1.00 0.60 H new ATOM 0 HE3 LYS A 62 7.849 6.469 -8.337 1.00 0.60 H new ATOM 0 HZ1 LYS A 62 6.721 4.784 -9.540 1.00 1.17 H new ATOM 0 HZ2 LYS A 62 7.624 5.671 -10.672 1.00 1.17 H new ATOM 0 HZ3 LYS A 62 8.166 4.145 -10.162 1.00 1.17 H new ATOM 919 N GLY A 63 15.179 7.218 -7.131 1.00 0.25 N ATOM 920 CA GLY A 63 16.585 7.351 -7.402 1.00 0.27 C ATOM 921 C GLY A 63 17.364 7.377 -6.115 1.00 0.30 C ATOM 922 O GLY A 63 18.542 7.036 -6.070 1.00 0.42 O ATOM 0 H GLY A 63 14.957 6.595 -6.355 1.00 0.25 H new ATOM 0 HA2 GLY A 63 16.923 6.521 -8.023 1.00 0.27 H new ATOM 0 HA3 GLY A 63 16.769 8.266 -7.965 1.00 0.27 H new ATOM 926 N GLN A 64 16.698 7.783 -5.048 1.00 0.26 N ATOM 927 CA GLN A 64 17.345 7.819 -3.746 1.00 0.28 C ATOM 928 C GLN A 64 17.295 6.438 -3.124 1.00 0.24 C ATOM 929 O GLN A 64 16.276 5.756 -3.221 1.00 0.24 O ATOM 930 CB GLN A 64 16.673 8.827 -2.806 1.00 0.30 C ATOM 931 CG GLN A 64 16.061 10.048 -3.485 1.00 0.36 C ATOM 932 CD GLN A 64 17.040 10.925 -4.267 1.00 0.44 C ATOM 933 OE1 GLN A 64 16.871 12.140 -4.317 1.00 0.59 O ATOM 934 NE2 GLN A 64 18.036 10.338 -4.913 1.00 0.43 N ATOM 0 H GLN A 64 15.725 8.088 -5.054 1.00 0.26 H new ATOM 0 HA GLN A 64 18.379 8.133 -3.891 1.00 0.28 H new ATOM 0 HB2 GLN A 64 15.891 8.312 -2.248 1.00 0.30 H new ATOM 0 HB3 GLN A 64 17.411 9.168 -2.079 1.00 0.30 H new ATOM 0 HG2 GLN A 64 15.279 9.710 -4.165 1.00 0.36 H new ATOM 0 HG3 GLN A 64 15.578 10.661 -2.724 1.00 0.36 H new ATOM 0 HE21 GLN A 64 18.155 9.327 -4.856 1.00 0.43 H new ATOM 0 HE22 GLN A 64 18.684 10.897 -5.468 1.00 0.43 H new ATOM 943 N VAL A 65 18.391 6.015 -2.516 1.00 0.28 N ATOM 944 CA VAL A 65 18.381 4.768 -1.779 1.00 0.31 C ATOM 945 C VAL A 65 17.775 5.035 -0.407 1.00 0.25 C ATOM 946 O VAL A 65 18.086 6.032 0.246 1.00 0.32 O ATOM 947 CB VAL A 65 19.782 4.111 -1.649 1.00 0.49 C ATOM 948 CG1 VAL A 65 20.504 4.110 -2.988 1.00 1.22 C ATOM 949 CG2 VAL A 65 20.623 4.766 -0.566 1.00 1.05 C ATOM 0 H VAL A 65 19.284 6.509 -2.518 1.00 0.28 H new ATOM 0 HA VAL A 65 17.781 4.049 -2.337 1.00 0.31 H new ATOM 0 HB VAL A 65 19.629 3.076 -1.344 1.00 0.49 H new ATOM 0 HG11 VAL A 65 21.483 3.645 -2.873 1.00 1.22 H new ATOM 0 HG12 VAL A 65 19.919 3.549 -3.716 1.00 1.22 H new ATOM 0 HG13 VAL A 65 20.628 5.136 -3.335 1.00 1.22 H new ATOM 0 HG21 VAL A 65 21.594 4.273 -0.512 1.00 1.05 H new ATOM 0 HG22 VAL A 65 20.764 5.821 -0.803 1.00 1.05 H new ATOM 0 HG23 VAL A 65 20.115 4.674 0.394 1.00 1.05 H new ATOM 959 N VAL A 66 16.872 4.181 -0.003 1.00 0.19 N ATOM 960 CA VAL A 66 16.153 4.374 1.236 1.00 0.15 C ATOM 961 C VAL A 66 16.233 3.140 2.104 1.00 0.16 C ATOM 962 O VAL A 66 16.233 2.014 1.601 1.00 0.21 O ATOM 963 CB VAL A 66 14.671 4.722 0.986 1.00 0.17 C ATOM 964 CG1 VAL A 66 14.533 6.108 0.384 1.00 0.18 C ATOM 965 CG2 VAL A 66 14.036 3.705 0.067 1.00 0.25 C ATOM 0 H VAL A 66 16.613 3.338 -0.516 1.00 0.19 H new ATOM 0 HA VAL A 66 16.627 5.211 1.749 1.00 0.15 H new ATOM 0 HB VAL A 66 14.158 4.705 1.948 1.00 0.17 H new ATOM 0 HG11 VAL A 66 13.479 6.329 0.217 1.00 0.18 H new ATOM 0 HG12 VAL A 66 14.955 6.845 1.067 1.00 0.18 H new ATOM 0 HG13 VAL A 66 15.066 6.147 -0.566 1.00 0.18 H new ATOM 0 HG21 VAL A 66 12.991 3.966 -0.098 1.00 0.25 H new ATOM 0 HG22 VAL A 66 14.563 3.697 -0.887 1.00 0.25 H new ATOM 0 HG23 VAL A 66 14.095 2.716 0.522 1.00 0.25 H new ATOM 975 N THR A 67 16.333 3.355 3.399 1.00 0.13 N ATOM 976 CA THR A 67 16.300 2.266 4.343 1.00 0.15 C ATOM 977 C THR A 67 14.883 2.075 4.837 1.00 0.16 C ATOM 978 O THR A 67 14.341 2.941 5.535 1.00 0.21 O ATOM 979 CB THR A 67 17.201 2.537 5.559 1.00 0.20 C ATOM 980 OG1 THR A 67 16.834 3.778 6.163 1.00 0.29 O ATOM 981 CG2 THR A 67 18.667 2.575 5.170 1.00 0.27 C ATOM 0 H THR A 67 16.438 4.278 3.820 1.00 0.13 H new ATOM 0 HA THR A 67 16.663 1.375 3.831 1.00 0.15 H new ATOM 0 HB THR A 67 17.061 1.721 6.268 1.00 0.20 H new ATOM 0 HG1 THR A 67 15.860 3.880 6.135 1.00 0.29 H new ATOM 0 HG21 THR A 67 19.273 2.769 6.055 1.00 0.27 H new ATOM 0 HG22 THR A 67 18.953 1.617 4.737 1.00 0.27 H new ATOM 0 HG23 THR A 67 18.829 3.367 4.439 1.00 0.27 H new ATOM 989 N VAL A 68 14.275 0.964 4.484 1.00 0.15 N ATOM 990 CA VAL A 68 12.965 0.664 5.007 1.00 0.15 C ATOM 991 C VAL A 68 13.051 -0.493 5.971 1.00 0.15 C ATOM 992 O VAL A 68 13.838 -1.409 5.788 1.00 0.17 O ATOM 993 CB VAL A 68 11.919 0.336 3.911 1.00 0.16 C ATOM 994 CG1 VAL A 68 11.609 1.563 3.072 1.00 0.18 C ATOM 995 CG2 VAL A 68 12.403 -0.804 3.027 1.00 0.19 C ATOM 0 H VAL A 68 14.660 0.266 3.848 1.00 0.15 H new ATOM 0 HA VAL A 68 12.624 1.568 5.512 1.00 0.15 H new ATOM 0 HB VAL A 68 11.001 0.021 4.407 1.00 0.16 H new ATOM 0 HG11 VAL A 68 10.873 1.306 2.310 1.00 0.18 H new ATOM 0 HG12 VAL A 68 11.210 2.350 3.712 1.00 0.18 H new ATOM 0 HG13 VAL A 68 12.522 1.915 2.591 1.00 0.18 H new ATOM 0 HG21 VAL A 68 11.653 -1.017 2.265 1.00 0.19 H new ATOM 0 HG22 VAL A 68 13.339 -0.519 2.546 1.00 0.19 H new ATOM 0 HG23 VAL A 68 12.564 -1.693 3.636 1.00 0.19 H new ATOM 1005 N HIS A 69 12.266 -0.435 7.007 1.00 0.14 N ATOM 1006 CA HIS A 69 12.105 -1.579 7.865 1.00 0.15 C ATOM 1007 C HIS A 69 10.781 -2.209 7.509 1.00 0.14 C ATOM 1008 O HIS A 69 9.742 -1.599 7.705 1.00 0.15 O ATOM 1009 CB HIS A 69 12.122 -1.180 9.353 1.00 0.15 C ATOM 1010 CG HIS A 69 11.827 -2.344 10.271 1.00 0.15 C ATOM 1011 ND1 HIS A 69 12.436 -2.576 11.488 1.00 0.19 N ATOM 1012 CD2 HIS A 69 10.961 -3.360 10.110 1.00 0.18 C ATOM 1013 CE1 HIS A 69 11.934 -3.696 12.009 1.00 0.18 C ATOM 1014 NE2 HIS A 69 11.044 -4.174 11.194 1.00 0.18 N ATOM 0 H HIS A 69 11.728 0.387 7.280 1.00 0.14 H new ATOM 0 HA HIS A 69 12.931 -2.275 7.719 1.00 0.15 H new ATOM 0 HB2 HIS A 69 13.098 -0.764 9.602 1.00 0.15 H new ATOM 0 HB3 HIS A 69 11.387 -0.393 9.523 1.00 0.15 H new ATOM 0 HD1 HIS A 69 13.151 -1.989 11.917 1.00 0.19 H new ATOM 0 HD2 HIS A 69 10.309 -3.504 9.261 1.00 0.18 H new ATOM 0 HE1 HIS A 69 12.221 -4.134 12.954 1.00 0.18 H new ATOM 1023 N LEU A 70 10.805 -3.428 7.009 1.00 0.15 N ATOM 1024 CA LEU A 70 9.566 -4.089 6.696 1.00 0.16 C ATOM 1025 C LEU A 70 9.451 -5.403 7.446 1.00 0.15 C ATOM 1026 O LEU A 70 10.411 -6.147 7.599 1.00 0.21 O ATOM 1027 CB LEU A 70 9.380 -4.341 5.197 1.00 0.21 C ATOM 1028 CG LEU A 70 10.006 -5.624 4.678 1.00 0.31 C ATOM 1029 CD1 LEU A 70 9.308 -6.089 3.413 1.00 0.39 C ATOM 1030 CD2 LEU A 70 11.485 -5.423 4.405 1.00 0.38 C ATOM 0 H LEU A 70 11.650 -3.966 6.816 1.00 0.15 H new ATOM 0 HA LEU A 70 8.776 -3.409 7.014 1.00 0.16 H new ATOM 0 HB2 LEU A 70 8.313 -4.361 4.977 1.00 0.21 H new ATOM 0 HB3 LEU A 70 9.803 -3.500 4.647 1.00 0.21 H new ATOM 0 HG LEU A 70 9.889 -6.390 5.445 1.00 0.31 H new ATOM 0 HD11 LEU A 70 9.772 -7.009 3.059 1.00 0.39 H new ATOM 0 HD12 LEU A 70 8.255 -6.272 3.625 1.00 0.39 H new ATOM 0 HD13 LEU A 70 9.395 -5.320 2.646 1.00 0.39 H new ATOM 0 HD21 LEU A 70 11.916 -6.353 4.034 1.00 0.38 H new ATOM 0 HD22 LEU A 70 11.614 -4.640 3.658 1.00 0.38 H new ATOM 0 HD23 LEU A 70 11.989 -5.132 5.327 1.00 0.38 H new ATOM 1042 N GLN A 71 8.273 -5.638 7.946 1.00 0.13 N ATOM 1043 CA GLN A 71 7.876 -6.935 8.453 1.00 0.14 C ATOM 1044 C GLN A 71 6.530 -7.192 7.864 1.00 0.14 C ATOM 1045 O GLN A 71 5.564 -6.477 8.132 1.00 0.14 O ATOM 1046 CB GLN A 71 7.798 -7.002 9.977 1.00 0.15 C ATOM 1047 CG GLN A 71 8.672 -6.001 10.698 1.00 0.15 C ATOM 1048 CD GLN A 71 7.990 -4.671 10.946 1.00 0.16 C ATOM 1049 OE1 GLN A 71 8.319 -3.971 11.896 1.00 0.27 O ATOM 1050 NE2 GLN A 71 7.030 -4.331 10.116 1.00 0.18 N ATOM 0 H GLN A 71 7.544 -4.928 8.018 1.00 0.13 H new ATOM 0 HA GLN A 71 8.621 -7.680 8.176 1.00 0.14 H new ATOM 0 HB2 GLN A 71 6.763 -6.846 10.282 1.00 0.15 H new ATOM 0 HB3 GLN A 71 8.077 -8.006 10.298 1.00 0.15 H new ATOM 0 HG2 GLN A 71 8.984 -6.424 11.653 1.00 0.15 H new ATOM 0 HG3 GLN A 71 9.577 -5.833 10.113 1.00 0.15 H new ATOM 0 HE21 GLN A 71 6.788 -4.944 9.337 1.00 0.18 H new ATOM 0 HE22 GLN A 71 6.527 -3.454 10.250 1.00 0.18 H new ATOM 1059 N THR A 72 6.486 -8.179 7.037 1.00 0.15 N ATOM 1060 CA THR A 72 5.368 -8.373 6.175 1.00 0.16 C ATOM 1061 C THR A 72 4.506 -9.511 6.656 1.00 0.16 C ATOM 1062 O THR A 72 4.996 -10.604 6.923 1.00 0.17 O ATOM 1063 CB THR A 72 5.861 -8.659 4.767 1.00 0.17 C ATOM 1064 OG1 THR A 72 6.702 -7.594 4.316 1.00 0.19 O ATOM 1065 CG2 THR A 72 4.704 -8.838 3.824 1.00 0.19 C ATOM 0 H THR A 72 7.224 -8.876 6.938 1.00 0.15 H new ATOM 0 HA THR A 72 4.765 -7.465 6.178 1.00 0.16 H new ATOM 0 HB THR A 72 6.436 -9.585 4.785 1.00 0.17 H new ATOM 0 HG1 THR A 72 6.644 -7.522 3.340 1.00 0.19 H new ATOM 0 HG21 THR A 72 5.080 -9.042 2.821 1.00 0.19 H new ATOM 0 HG22 THR A 72 4.089 -9.674 4.158 1.00 0.19 H new ATOM 0 HG23 THR A 72 4.103 -7.929 3.808 1.00 0.19 H new ATOM 1073 N SER A 73 3.230 -9.242 6.754 1.00 0.17 N ATOM 1074 CA SER A 73 2.281 -10.220 7.185 1.00 0.17 C ATOM 1075 C SER A 73 1.507 -10.718 5.979 1.00 0.15 C ATOM 1076 O SER A 73 1.639 -10.186 4.873 1.00 0.26 O ATOM 1077 CB SER A 73 1.327 -9.608 8.208 1.00 0.23 C ATOM 1078 OG SER A 73 0.694 -10.606 8.986 1.00 1.06 O ATOM 0 H SER A 73 2.824 -8.332 6.535 1.00 0.17 H new ATOM 0 HA SER A 73 2.801 -11.055 7.655 1.00 0.17 H new ATOM 0 HB2 SER A 73 1.877 -8.930 8.861 1.00 0.23 H new ATOM 0 HB3 SER A 73 0.573 -9.013 7.694 1.00 0.23 H new ATOM 0 HG SER A 73 0.091 -10.183 9.633 1.00 1.06 H new ATOM 1084 N LEU A 74 0.707 -11.729 6.201 1.00 0.19 N ATOM 1085 CA LEU A 74 -0.095 -12.310 5.156 1.00 0.18 C ATOM 1086 C LEU A 74 -1.515 -11.810 5.284 1.00 0.19 C ATOM 1087 O LEU A 74 -1.878 -11.241 6.311 1.00 0.21 O ATOM 1088 CB LEU A 74 -0.054 -13.833 5.246 1.00 0.22 C ATOM 1089 CG LEU A 74 1.254 -14.476 4.808 1.00 0.38 C ATOM 1090 CD1 LEU A 74 1.069 -15.961 4.542 1.00 0.84 C ATOM 1091 CD2 LEU A 74 1.801 -13.766 3.592 1.00 0.72 C ATOM 0 H LEU A 74 0.593 -12.173 7.112 1.00 0.19 H new ATOM 0 HA LEU A 74 0.303 -12.016 4.185 1.00 0.18 H new ATOM 0 HB2 LEU A 74 -0.256 -14.125 6.277 1.00 0.22 H new ATOM 0 HB3 LEU A 74 -0.861 -14.238 4.636 1.00 0.22 H new ATOM 0 HG LEU A 74 1.978 -14.377 5.617 1.00 0.38 H new ATOM 0 HD11 LEU A 74 2.019 -16.396 4.231 1.00 0.84 H new ATOM 0 HD12 LEU A 74 0.725 -16.454 5.452 1.00 0.84 H new ATOM 0 HD13 LEU A 74 0.330 -16.100 3.753 1.00 0.84 H new ATOM 0 HD21 LEU A 74 2.737 -14.234 3.287 1.00 0.72 H new ATOM 0 HD22 LEU A 74 1.080 -13.832 2.777 1.00 0.72 H new ATOM 0 HD23 LEU A 74 1.981 -12.718 3.833 1.00 0.72 H new ATOM 1103 N GLU A 75 -2.312 -12.005 4.246 1.00 0.21 N ATOM 1104 CA GLU A 75 -3.720 -11.647 4.296 1.00 0.26 C ATOM 1105 C GLU A 75 -4.411 -12.348 5.473 1.00 0.32 C ATOM 1106 O GLU A 75 -5.436 -11.890 5.971 1.00 0.39 O ATOM 1107 CB GLU A 75 -4.411 -12.013 2.981 1.00 0.30 C ATOM 1108 CG GLU A 75 -4.302 -13.481 2.606 1.00 0.34 C ATOM 1109 CD GLU A 75 -5.006 -13.792 1.301 1.00 0.67 C ATOM 1110 OE1 GLU A 75 -4.439 -13.496 0.232 1.00 0.82 O ATOM 1111 OE2 GLU A 75 -6.133 -14.325 1.341 1.00 1.14 O ATOM 0 H GLU A 75 -2.009 -12.409 3.360 1.00 0.21 H new ATOM 0 HA GLU A 75 -3.796 -10.569 4.441 1.00 0.26 H new ATOM 0 HB2 GLU A 75 -5.465 -11.745 3.051 1.00 0.30 H new ATOM 0 HB3 GLU A 75 -3.982 -11.412 2.179 1.00 0.30 H new ATOM 0 HG2 GLU A 75 -3.251 -13.756 2.524 1.00 0.34 H new ATOM 0 HG3 GLU A 75 -4.730 -14.090 3.402 1.00 0.34 H new ATOM 1118 N ASN A 76 -3.822 -13.460 5.912 1.00 0.34 N ATOM 1119 CA ASN A 76 -4.358 -14.235 7.024 1.00 0.41 C ATOM 1120 C ASN A 76 -3.803 -13.752 8.361 1.00 0.39 C ATOM 1121 O ASN A 76 -4.248 -14.187 9.417 1.00 0.51 O ATOM 1122 CB ASN A 76 -4.045 -15.719 6.839 1.00 0.50 C ATOM 1123 CG ASN A 76 -2.561 -15.997 6.719 1.00 1.13 C ATOM 1124 OD1 ASN A 76 -1.844 -16.048 7.714 1.00 2.14 O ATOM 1125 ND2 ASN A 76 -2.097 -16.223 5.500 1.00 1.13 N ATOM 0 H ASN A 76 -2.967 -13.844 5.509 1.00 0.34 H new ATOM 0 HA ASN A 76 -5.439 -14.093 7.033 1.00 0.41 H new ATOM 0 HB2 ASN A 76 -4.447 -16.278 7.684 1.00 0.50 H new ATOM 0 HB3 ASN A 76 -4.551 -16.083 5.945 1.00 0.50 H new ATOM 0 HD21 ASN A 76 -1.112 -16.449 5.363 1.00 1.13 H new ATOM 0 HD22 ASN A 76 -2.725 -16.171 4.698 1.00 1.13 H new ATOM 1132 N GLY A 77 -2.822 -12.860 8.314 1.00 0.30 N ATOM 1133 CA GLY A 77 -2.284 -12.302 9.537 1.00 0.32 C ATOM 1134 C GLY A 77 -0.978 -12.939 9.971 1.00 0.32 C ATOM 1135 O GLY A 77 -0.516 -12.706 11.091 1.00 0.51 O ATOM 0 H GLY A 77 -2.392 -12.515 7.456 1.00 0.30 H new ATOM 0 HA2 GLY A 77 -2.129 -11.232 9.401 1.00 0.32 H new ATOM 0 HA3 GLY A 77 -3.018 -12.419 10.334 1.00 0.32 H new ATOM 1139 N THR A 78 -0.380 -13.746 9.109 1.00 0.28 N ATOM 1140 CA THR A 78 0.904 -14.361 9.431 1.00 0.28 C ATOM 1141 C THR A 78 2.080 -13.610 8.808 1.00 0.23 C ATOM 1142 O THR A 78 2.231 -13.579 7.590 1.00 0.21 O ATOM 1143 CB THR A 78 0.941 -15.839 8.994 1.00 0.34 C ATOM 1144 OG1 THR A 78 -0.102 -16.566 9.661 1.00 0.46 O ATOM 1145 CG2 THR A 78 2.287 -16.480 9.303 1.00 0.39 C ATOM 0 H THR A 78 -0.754 -13.990 8.192 1.00 0.28 H new ATOM 0 HA THR A 78 1.006 -14.306 10.515 1.00 0.28 H new ATOM 0 HB THR A 78 0.789 -15.875 7.915 1.00 0.34 H new ATOM 0 HG1 THR A 78 -0.929 -16.506 9.138 1.00 0.46 H new ATOM 0 HG21 THR A 78 2.276 -17.521 8.981 1.00 0.39 H new ATOM 0 HG22 THR A 78 3.075 -15.945 8.773 1.00 0.39 H new ATOM 0 HG23 THR A 78 2.474 -16.433 10.376 1.00 0.39 H new ATOM 1153 N ARG A 79 2.904 -13.000 9.654 1.00 0.24 N ATOM 1154 CA ARG A 79 4.113 -12.324 9.202 1.00 0.22 C ATOM 1155 C ARG A 79 5.136 -13.336 8.724 1.00 0.24 C ATOM 1156 O ARG A 79 5.495 -14.273 9.434 1.00 0.33 O ATOM 1157 CB ARG A 79 4.683 -11.433 10.299 1.00 0.25 C ATOM 1158 CG ARG A 79 3.814 -10.217 10.550 1.00 0.25 C ATOM 1159 CD ARG A 79 4.640 -9.031 11.017 1.00 0.28 C ATOM 1160 NE ARG A 79 3.833 -7.812 11.174 1.00 0.33 N ATOM 1161 CZ ARG A 79 4.308 -6.654 11.652 1.00 0.38 C ATOM 1162 NH1 ARG A 79 5.546 -6.581 12.126 1.00 0.42 N ATOM 1163 NH2 ARG A 79 3.532 -5.579 11.701 1.00 0.47 N ATOM 0 H ARG A 79 2.754 -12.961 10.662 1.00 0.24 H new ATOM 0 HA ARG A 79 3.855 -11.681 8.361 1.00 0.22 H new ATOM 0 HB2 ARG A 79 4.778 -12.008 11.220 1.00 0.25 H new ATOM 0 HB3 ARG A 79 5.686 -11.111 10.020 1.00 0.25 H new ATOM 0 HG2 ARG A 79 3.281 -9.954 9.636 1.00 0.25 H new ATOM 0 HG3 ARG A 79 3.060 -10.455 11.301 1.00 0.25 H new ATOM 0 HD2 ARG A 79 5.114 -9.274 11.968 1.00 0.28 H new ATOM 0 HD3 ARG A 79 5.440 -8.844 10.300 1.00 0.28 H new ATOM 0 HE ARG A 79 2.851 -7.850 10.902 1.00 0.33 H new ATOM 0 HH11 ARG A 79 6.141 -7.409 12.128 1.00 0.42 H new ATOM 0 HH12 ARG A 79 5.902 -5.697 12.489 1.00 0.42 H new ATOM 0 HH21 ARG A 79 2.567 -5.631 11.374 1.00 0.47 H new ATOM 0 HH22 ARG A 79 3.900 -4.701 12.066 1.00 0.47 H new ATOM 1177 N VAL A 80 5.586 -13.138 7.503 1.00 0.20 N ATOM 1178 CA VAL A 80 6.400 -14.116 6.814 1.00 0.22 C ATOM 1179 C VAL A 80 7.845 -13.667 6.673 1.00 0.21 C ATOM 1180 O VAL A 80 8.741 -14.484 6.456 1.00 0.27 O ATOM 1181 CB VAL A 80 5.820 -14.394 5.422 1.00 0.23 C ATOM 1182 CG1 VAL A 80 4.459 -15.046 5.548 1.00 0.26 C ATOM 1183 CG2 VAL A 80 5.727 -13.113 4.606 1.00 0.22 C ATOM 0 H VAL A 80 5.398 -12.295 6.961 1.00 0.20 H new ATOM 0 HA VAL A 80 6.388 -15.024 7.417 1.00 0.22 H new ATOM 0 HB VAL A 80 6.490 -15.076 4.898 1.00 0.23 H new ATOM 0 HG11 VAL A 80 4.055 -15.240 4.554 1.00 0.26 H new ATOM 0 HG12 VAL A 80 4.555 -15.987 6.090 1.00 0.26 H new ATOM 0 HG13 VAL A 80 3.786 -14.382 6.090 1.00 0.26 H new ATOM 0 HG21 VAL A 80 5.313 -13.337 3.623 1.00 0.22 H new ATOM 0 HG22 VAL A 80 5.080 -12.401 5.119 1.00 0.22 H new ATOM 0 HG23 VAL A 80 6.721 -12.682 4.491 1.00 0.22 H new ATOM 1193 N GLN A 81 8.072 -12.371 6.791 1.00 0.18 N ATOM 1194 CA GLN A 81 9.396 -11.813 6.592 1.00 0.19 C ATOM 1195 C GLN A 81 9.603 -10.611 7.502 1.00 0.19 C ATOM 1196 O GLN A 81 8.802 -9.678 7.501 1.00 0.26 O ATOM 1197 CB GLN A 81 9.583 -11.437 5.112 1.00 0.23 C ATOM 1198 CG GLN A 81 8.522 -10.484 4.582 1.00 0.23 C ATOM 1199 CD GLN A 81 8.509 -10.389 3.072 1.00 0.37 C ATOM 1200 OE1 GLN A 81 9.230 -9.599 2.471 1.00 0.59 O ATOM 1201 NE2 GLN A 81 7.651 -11.184 2.452 1.00 0.50 N ATOM 0 H GLN A 81 7.354 -11.685 7.024 1.00 0.18 H new ATOM 0 HA GLN A 81 10.148 -12.558 6.852 1.00 0.19 H new ATOM 0 HB2 GLN A 81 10.565 -10.981 4.984 1.00 0.23 H new ATOM 0 HB3 GLN A 81 9.574 -12.347 4.512 1.00 0.23 H new ATOM 0 HG2 GLN A 81 7.542 -10.813 4.928 1.00 0.23 H new ATOM 0 HG3 GLN A 81 8.692 -9.492 5.001 1.00 0.23 H new ATOM 0 HE21 GLN A 81 7.070 -11.826 2.991 1.00 0.50 H new ATOM 0 HE22 GLN A 81 7.571 -11.154 1.436 1.00 0.50 H new ATOM 1210 N GLU A 82 10.653 -10.656 8.307 1.00 0.24 N ATOM 1211 CA GLU A 82 10.971 -9.549 9.193 1.00 0.24 C ATOM 1212 C GLU A 82 12.335 -8.980 8.843 1.00 0.25 C ATOM 1213 O GLU A 82 13.352 -9.672 8.904 1.00 0.41 O ATOM 1214 CB GLU A 82 10.920 -9.997 10.652 1.00 0.35 C ATOM 1215 CG GLU A 82 10.958 -8.847 11.645 1.00 0.44 C ATOM 1216 CD GLU A 82 10.200 -9.168 12.914 1.00 0.82 C ATOM 1217 OE1 GLU A 82 10.803 -9.732 13.849 1.00 1.34 O ATOM 1218 OE2 GLU A 82 8.987 -8.869 12.971 1.00 1.21 O ATOM 0 H GLU A 82 11.297 -11.445 8.365 1.00 0.24 H new ATOM 0 HA GLU A 82 10.226 -8.764 9.060 1.00 0.24 H new ATOM 0 HB2 GLU A 82 10.010 -10.575 10.814 1.00 0.35 H new ATOM 0 HB3 GLU A 82 11.760 -10.663 10.848 1.00 0.35 H new ATOM 0 HG2 GLU A 82 11.994 -8.614 11.891 1.00 0.44 H new ATOM 0 HG3 GLU A 82 10.532 -7.956 11.184 1.00 0.44 H new ATOM 1225 N GLU A 83 12.343 -7.722 8.448 1.00 0.22 N ATOM 1226 CA GLU A 83 13.545 -7.065 7.975 1.00 0.26 C ATOM 1227 C GLU A 83 13.671 -5.671 8.574 1.00 0.23 C ATOM 1228 O GLU A 83 12.926 -4.759 8.217 1.00 0.24 O ATOM 1229 CB GLU A 83 13.504 -7.007 6.443 1.00 0.39 C ATOM 1230 CG GLU A 83 14.598 -6.172 5.809 1.00 1.20 C ATOM 1231 CD GLU A 83 15.955 -6.822 5.921 1.00 1.73 C ATOM 1232 OE1 GLU A 83 16.555 -6.772 7.019 1.00 2.59 O ATOM 1233 OE2 GLU A 83 16.441 -7.363 4.908 1.00 1.69 O ATOM 0 H GLU A 83 11.515 -7.126 8.446 1.00 0.22 H new ATOM 0 HA GLU A 83 14.421 -7.631 8.291 1.00 0.26 H new ATOM 0 HB2 GLU A 83 13.570 -8.023 6.053 1.00 0.39 H new ATOM 0 HB3 GLU A 83 12.537 -6.609 6.134 1.00 0.39 H new ATOM 0 HG2 GLU A 83 14.363 -6.007 4.758 1.00 1.20 H new ATOM 0 HG3 GLU A 83 14.627 -5.193 6.286 1.00 1.20 H new ATOM 1240 N PRO A 84 14.612 -5.496 9.513 1.00 0.23 N ATOM 1241 CA PRO A 84 14.834 -4.222 10.190 1.00 0.21 C ATOM 1242 C PRO A 84 15.393 -3.149 9.267 1.00 0.19 C ATOM 1243 O PRO A 84 15.278 -1.954 9.559 1.00 0.20 O ATOM 1244 CB PRO A 84 15.837 -4.554 11.309 1.00 0.25 C ATOM 1245 CG PRO A 84 15.879 -6.045 11.381 1.00 0.50 C ATOM 1246 CD PRO A 84 15.524 -6.539 10.008 1.00 0.31 C ATOM 0 HA PRO A 84 13.897 -3.807 10.561 1.00 0.21 H new ATOM 0 HB2 PRO A 84 16.822 -4.144 11.086 1.00 0.25 H new ATOM 0 HB3 PRO A 84 15.520 -4.124 12.259 1.00 0.25 H new ATOM 0 HG2 PRO A 84 16.869 -6.393 11.676 1.00 0.50 H new ATOM 0 HG3 PRO A 84 15.175 -6.419 12.124 1.00 0.50 H new ATOM 0 HD2 PRO A 84 16.405 -6.640 9.374 1.00 0.31 H new ATOM 0 HD3 PRO A 84 15.041 -7.516 10.042 1.00 0.31 H new ATOM 1254 N GLU A 85 15.977 -3.550 8.149 1.00 0.20 N ATOM 1255 CA GLU A 85 16.553 -2.576 7.242 1.00 0.22 C ATOM 1256 C GLU A 85 16.828 -3.151 5.872 1.00 0.24 C ATOM 1257 O GLU A 85 17.675 -4.023 5.689 1.00 0.35 O ATOM 1258 CB GLU A 85 17.825 -1.980 7.847 1.00 0.31 C ATOM 1259 CG GLU A 85 18.449 -0.879 7.009 1.00 0.34 C ATOM 1260 CD GLU A 85 19.365 0.005 7.826 1.00 0.90 C ATOM 1261 OE1 GLU A 85 18.846 0.929 8.487 1.00 1.37 O ATOM 1262 OE2 GLU A 85 20.592 -0.219 7.823 1.00 1.30 O ATOM 0 H GLU A 85 16.063 -4.522 7.854 1.00 0.20 H new ATOM 0 HA GLU A 85 15.816 -1.784 7.105 1.00 0.22 H new ATOM 0 HB2 GLU A 85 17.594 -1.583 8.836 1.00 0.31 H new ATOM 0 HB3 GLU A 85 18.557 -2.776 7.986 1.00 0.31 H new ATOM 0 HG2 GLU A 85 19.011 -1.323 6.188 1.00 0.34 H new ATOM 0 HG3 GLU A 85 17.661 -0.271 6.564 1.00 0.34 H new ATOM 1269 N LEU A 86 16.080 -2.637 4.922 1.00 0.23 N ATOM 1270 CA LEU A 86 16.250 -2.938 3.531 1.00 0.24 C ATOM 1271 C LEU A 86 16.529 -1.641 2.779 1.00 0.23 C ATOM 1272 O LEU A 86 15.659 -0.777 2.682 1.00 0.25 O ATOM 1273 CB LEU A 86 14.981 -3.599 2.993 1.00 0.26 C ATOM 1274 CG LEU A 86 14.981 -3.837 1.495 1.00 0.33 C ATOM 1275 CD1 LEU A 86 16.080 -4.813 1.097 1.00 0.38 C ATOM 1276 CD2 LEU A 86 13.617 -4.325 1.030 1.00 0.38 C ATOM 0 H LEU A 86 15.320 -1.983 5.107 1.00 0.23 H new ATOM 0 HA LEU A 86 17.086 -3.624 3.394 1.00 0.24 H new ATOM 0 HB2 LEU A 86 14.841 -4.554 3.500 1.00 0.26 H new ATOM 0 HB3 LEU A 86 14.125 -2.974 3.249 1.00 0.26 H new ATOM 0 HG LEU A 86 15.187 -2.888 0.999 1.00 0.33 H new ATOM 0 HD11 LEU A 86 16.058 -4.966 0.018 1.00 0.38 H new ATOM 0 HD12 LEU A 86 17.049 -4.407 1.386 1.00 0.38 H new ATOM 0 HD13 LEU A 86 15.921 -5.766 1.602 1.00 0.38 H new ATOM 0 HD21 LEU A 86 13.637 -4.490 -0.047 1.00 0.38 H new ATOM 0 HD22 LEU A 86 13.373 -5.259 1.536 1.00 0.38 H new ATOM 0 HD23 LEU A 86 12.862 -3.576 1.268 1.00 0.38 H new ATOM 1288 N VAL A 87 17.751 -1.484 2.297 1.00 0.24 N ATOM 1289 CA VAL A 87 18.112 -0.301 1.531 1.00 0.22 C ATOM 1290 C VAL A 87 18.088 -0.631 0.036 1.00 0.21 C ATOM 1291 O VAL A 87 18.534 -1.705 -0.381 1.00 0.28 O ATOM 1292 CB VAL A 87 19.502 0.243 1.941 1.00 0.27 C ATOM 1293 CG1 VAL A 87 20.610 -0.726 1.575 1.00 1.00 C ATOM 1294 CG2 VAL A 87 19.759 1.601 1.313 1.00 0.94 C ATOM 0 H VAL A 87 18.507 -2.157 2.421 1.00 0.24 H new ATOM 0 HA VAL A 87 17.381 0.479 1.744 1.00 0.22 H new ATOM 0 HB VAL A 87 19.500 0.356 3.025 1.00 0.27 H new ATOM 0 HG11 VAL A 87 21.571 -0.311 1.878 1.00 1.00 H new ATOM 0 HG12 VAL A 87 20.447 -1.675 2.086 1.00 1.00 H new ATOM 0 HG13 VAL A 87 20.609 -0.890 0.497 1.00 1.00 H new ATOM 0 HG21 VAL A 87 20.742 1.962 1.616 1.00 0.94 H new ATOM 0 HG22 VAL A 87 19.724 1.512 0.227 1.00 0.94 H new ATOM 0 HG23 VAL A 87 18.996 2.305 1.644 1.00 0.94 H new ATOM 1304 N PHE A 88 17.534 0.272 -0.757 1.00 0.17 N ATOM 1305 CA PHE A 88 17.421 0.062 -2.196 1.00 0.19 C ATOM 1306 C PHE A 88 17.234 1.388 -2.912 1.00 0.20 C ATOM 1307 O PHE A 88 16.797 2.368 -2.308 1.00 0.23 O ATOM 1308 CB PHE A 88 16.239 -0.860 -2.502 1.00 0.21 C ATOM 1309 CG PHE A 88 14.902 -0.247 -2.200 1.00 0.18 C ATOM 1310 CD1 PHE A 88 14.410 -0.236 -0.904 1.00 0.19 C ATOM 1311 CD2 PHE A 88 14.139 0.314 -3.211 1.00 0.17 C ATOM 1312 CE1 PHE A 88 13.180 0.322 -0.625 1.00 0.17 C ATOM 1313 CE2 PHE A 88 12.908 0.868 -2.939 1.00 0.16 C ATOM 1314 CZ PHE A 88 12.428 0.875 -1.648 1.00 0.15 C ATOM 0 H PHE A 88 17.154 1.160 -0.430 1.00 0.17 H new ATOM 0 HA PHE A 88 18.341 -0.404 -2.550 1.00 0.19 H new ATOM 0 HB2 PHE A 88 16.271 -1.140 -3.555 1.00 0.21 H new ATOM 0 HB3 PHE A 88 16.347 -1.778 -1.925 1.00 0.21 H new ATOM 0 HD1 PHE A 88 14.995 -0.668 -0.106 1.00 0.19 H new ATOM 0 HD2 PHE A 88 14.514 0.317 -4.224 1.00 0.17 H new ATOM 0 HE1 PHE A 88 12.805 0.328 0.388 1.00 0.17 H new ATOM 0 HE2 PHE A 88 12.320 1.296 -3.737 1.00 0.16 H new ATOM 0 HZ PHE A 88 11.464 1.312 -1.433 1.00 0.15 H new ATOM 1324 N THR A 89 17.569 1.412 -4.188 1.00 0.23 N ATOM 1325 CA THR A 89 17.341 2.579 -5.013 1.00 0.25 C ATOM 1326 C THR A 89 15.865 2.657 -5.389 1.00 0.21 C ATOM 1327 O THR A 89 15.324 1.735 -6.000 1.00 0.22 O ATOM 1328 CB THR A 89 18.201 2.528 -6.290 1.00 0.33 C ATOM 1329 OG1 THR A 89 19.569 2.270 -5.941 1.00 0.42 O ATOM 1330 CG2 THR A 89 18.101 3.833 -7.071 1.00 0.37 C ATOM 0 H THR A 89 18.003 0.629 -4.677 1.00 0.23 H new ATOM 0 HA THR A 89 17.624 3.465 -4.445 1.00 0.25 H new ATOM 0 HB THR A 89 17.828 1.724 -6.924 1.00 0.33 H new ATOM 0 HG1 THR A 89 20.114 2.236 -6.755 1.00 0.42 H new ATOM 0 HG21 THR A 89 18.718 3.769 -7.967 1.00 0.37 H new ATOM 0 HG22 THR A 89 17.064 4.008 -7.356 1.00 0.37 H new ATOM 0 HG23 THR A 89 18.450 4.657 -6.449 1.00 0.37 H new ATOM 1338 N LEU A 90 15.212 3.735 -4.983 1.00 0.19 N ATOM 1339 CA LEU A 90 13.808 3.944 -5.301 1.00 0.16 C ATOM 1340 C LEU A 90 13.610 4.042 -6.809 1.00 0.15 C ATOM 1341 O LEU A 90 14.361 4.726 -7.493 1.00 0.18 O ATOM 1342 CB LEU A 90 13.311 5.219 -4.630 1.00 0.16 C ATOM 1343 CG LEU A 90 11.797 5.366 -4.573 1.00 0.34 C ATOM 1344 CD1 LEU A 90 11.189 4.160 -3.879 1.00 0.60 C ATOM 1345 CD2 LEU A 90 11.421 6.654 -3.857 1.00 0.60 C ATOM 0 H LEU A 90 15.634 4.481 -4.430 1.00 0.19 H new ATOM 0 HA LEU A 90 13.236 3.094 -4.930 1.00 0.16 H new ATOM 0 HB2 LEU A 90 13.703 5.254 -3.614 1.00 0.16 H new ATOM 0 HB3 LEU A 90 13.725 6.076 -5.161 1.00 0.16 H new ATOM 0 HG LEU A 90 11.402 5.416 -5.588 1.00 0.34 H new ATOM 0 HD11 LEU A 90 10.105 4.270 -3.841 1.00 0.60 H new ATOM 0 HD12 LEU A 90 11.443 3.256 -4.432 1.00 0.60 H new ATOM 0 HD13 LEU A 90 11.582 4.087 -2.865 1.00 0.60 H new ATOM 0 HD21 LEU A 90 10.336 6.748 -3.823 1.00 0.60 H new ATOM 0 HD22 LEU A 90 11.816 6.634 -2.841 1.00 0.60 H new ATOM 0 HD23 LEU A 90 11.842 7.505 -4.393 1.00 0.60 H new ATOM 1357 N GLY A 91 12.621 3.334 -7.329 1.00 0.20 N ATOM 1358 CA GLY A 91 12.331 3.395 -8.750 1.00 0.23 C ATOM 1359 C GLY A 91 13.212 2.457 -9.545 1.00 0.26 C ATOM 1360 O GLY A 91 13.037 2.295 -10.755 1.00 0.37 O ATOM 0 H GLY A 91 12.011 2.716 -6.794 1.00 0.20 H new ATOM 0 HA2 GLY A 91 11.285 3.141 -8.918 1.00 0.23 H new ATOM 0 HA3 GLY A 91 12.472 4.415 -9.106 1.00 0.23 H new ATOM 1364 N ASP A 92 14.155 1.820 -8.858 1.00 0.27 N ATOM 1365 CA ASP A 92 15.102 0.918 -9.503 1.00 0.32 C ATOM 1366 C ASP A 92 14.469 -0.446 -9.646 1.00 0.30 C ATOM 1367 O ASP A 92 14.920 -1.280 -10.436 1.00 0.37 O ATOM 1368 CB ASP A 92 16.404 0.837 -8.691 1.00 0.42 C ATOM 1369 CG ASP A 92 17.489 0.000 -9.355 1.00 0.59 C ATOM 1370 OD1 ASP A 92 17.420 -1.248 -9.269 1.00 0.93 O ATOM 1371 OD2 ASP A 92 18.402 0.576 -9.980 1.00 0.82 O ATOM 0 H ASP A 92 14.284 1.913 -7.850 1.00 0.27 H new ATOM 0 HA ASP A 92 15.352 1.299 -10.493 1.00 0.32 H new ATOM 0 HB2 ASP A 92 16.784 1.846 -8.529 1.00 0.42 H new ATOM 0 HB3 ASP A 92 16.184 0.418 -7.709 1.00 0.42 H new ATOM 1376 N CYS A 93 13.374 -0.636 -8.909 1.00 0.28 N ATOM 1377 CA CYS A 93 12.696 -1.919 -8.845 1.00 0.27 C ATOM 1378 C CYS A 93 13.631 -2.955 -8.243 1.00 0.26 C ATOM 1379 O CYS A 93 13.543 -4.149 -8.540 1.00 0.31 O ATOM 1380 CB CYS A 93 12.220 -2.347 -10.232 1.00 0.38 C ATOM 1381 SG CYS A 93 11.336 -1.046 -11.126 1.00 0.62 S ATOM 0 H CYS A 93 12.939 0.094 -8.345 1.00 0.28 H new ATOM 0 HA CYS A 93 11.815 -1.829 -8.209 1.00 0.27 H new ATOM 0 HB2 CYS A 93 13.081 -2.661 -10.822 1.00 0.38 H new ATOM 0 HB3 CYS A 93 11.568 -3.215 -10.132 1.00 0.38 H new ATOM 0 HG CYS A 93 10.970 -1.492 -12.291 1.00 0.62 H new ATOM 1387 N ASP A 94 14.516 -2.474 -7.369 1.00 0.27 N ATOM 1388 CA ASP A 94 15.431 -3.340 -6.637 1.00 0.33 C ATOM 1389 C ASP A 94 14.613 -4.274 -5.763 1.00 0.33 C ATOM 1390 O ASP A 94 15.003 -5.403 -5.458 1.00 0.48 O ATOM 1391 CB ASP A 94 16.377 -2.488 -5.774 1.00 0.41 C ATOM 1392 CG ASP A 94 17.424 -3.303 -5.026 1.00 0.65 C ATOM 1393 OD1 ASP A 94 17.117 -3.835 -3.935 1.00 0.96 O ATOM 1394 OD2 ASP A 94 18.575 -3.384 -5.508 1.00 1.33 O ATOM 0 H ASP A 94 14.616 -1.482 -7.152 1.00 0.27 H new ATOM 0 HA ASP A 94 16.035 -3.924 -7.332 1.00 0.33 H new ATOM 0 HB2 ASP A 94 16.882 -1.762 -6.412 1.00 0.41 H new ATOM 0 HB3 ASP A 94 15.787 -1.922 -5.053 1.00 0.41 H new ATOM 1399 N VAL A 95 13.437 -3.780 -5.428 1.00 0.23 N ATOM 1400 CA VAL A 95 12.520 -4.433 -4.521 1.00 0.21 C ATOM 1401 C VAL A 95 11.255 -4.853 -5.243 1.00 0.20 C ATOM 1402 O VAL A 95 11.236 -4.974 -6.470 1.00 0.22 O ATOM 1403 CB VAL A 95 12.141 -3.458 -3.404 1.00 0.20 C ATOM 1404 CG1 VAL A 95 13.323 -3.238 -2.495 1.00 0.23 C ATOM 1405 CG2 VAL A 95 11.685 -2.136 -4.006 1.00 0.19 C ATOM 0 H VAL A 95 13.087 -2.893 -5.789 1.00 0.23 H new ATOM 0 HA VAL A 95 13.008 -5.318 -4.113 1.00 0.21 H new ATOM 0 HB VAL A 95 11.323 -3.879 -2.820 1.00 0.20 H new ATOM 0 HG11 VAL A 95 13.048 -2.543 -1.702 1.00 0.23 H new ATOM 0 HG12 VAL A 95 13.626 -4.188 -2.056 1.00 0.23 H new ATOM 0 HG13 VAL A 95 14.151 -2.823 -3.069 1.00 0.23 H new ATOM 0 HG21 VAL A 95 11.416 -1.446 -3.206 1.00 0.19 H new ATOM 0 HG22 VAL A 95 12.493 -1.708 -4.599 1.00 0.19 H new ATOM 0 HG23 VAL A 95 10.818 -2.307 -4.644 1.00 0.19 H new ATOM 1415 N ILE A 96 10.191 -5.040 -4.479 1.00 0.19 N ATOM 1416 CA ILE A 96 8.901 -5.331 -5.035 1.00 0.19 C ATOM 1417 C ILE A 96 8.250 -4.017 -5.406 1.00 0.16 C ATOM 1418 O ILE A 96 8.383 -3.027 -4.682 1.00 0.15 O ATOM 1419 CB ILE A 96 8.021 -6.114 -4.038 1.00 0.22 C ATOM 1420 CG1 ILE A 96 7.824 -5.325 -2.736 1.00 0.25 C ATOM 1421 CG2 ILE A 96 8.655 -7.462 -3.747 1.00 0.26 C ATOM 1422 CD1 ILE A 96 6.923 -6.018 -1.734 1.00 0.29 C ATOM 0 H ILE A 96 10.208 -4.992 -3.460 1.00 0.19 H new ATOM 0 HA ILE A 96 9.014 -5.962 -5.917 1.00 0.19 H new ATOM 0 HB ILE A 96 7.040 -6.266 -4.488 1.00 0.22 H new ATOM 0 HG12 ILE A 96 8.797 -5.151 -2.277 1.00 0.25 H new ATOM 0 HG13 ILE A 96 7.404 -4.348 -2.974 1.00 0.25 H new ATOM 0 HG21 ILE A 96 8.032 -8.013 -3.043 1.00 0.26 H new ATOM 0 HG22 ILE A 96 8.744 -8.030 -4.673 1.00 0.26 H new ATOM 0 HG23 ILE A 96 9.645 -7.313 -3.316 1.00 0.26 H new ATOM 0 HD11 ILE A 96 6.831 -5.401 -0.840 1.00 0.29 H new ATOM 0 HD12 ILE A 96 5.937 -6.168 -2.174 1.00 0.29 H new ATOM 0 HD13 ILE A 96 7.352 -6.984 -1.466 1.00 0.29 H new ATOM 1434 N GLN A 97 7.582 -3.994 -6.535 1.00 0.17 N ATOM 1435 CA GLN A 97 7.029 -2.755 -7.056 1.00 0.17 C ATOM 1436 C GLN A 97 6.029 -2.148 -6.075 1.00 0.16 C ATOM 1437 O GLN A 97 5.842 -0.936 -6.049 1.00 0.16 O ATOM 1438 CB GLN A 97 6.367 -2.969 -8.412 1.00 0.19 C ATOM 1439 CG GLN A 97 6.578 -1.797 -9.356 1.00 0.25 C ATOM 1440 CD GLN A 97 7.994 -1.745 -9.914 1.00 0.31 C ATOM 1441 OE1 GLN A 97 8.271 -2.312 -10.971 1.00 0.40 O ATOM 1442 NE2 GLN A 97 8.908 -1.078 -9.210 1.00 0.32 N ATOM 0 H GLN A 97 7.406 -4.815 -7.114 1.00 0.17 H new ATOM 0 HA GLN A 97 7.858 -2.059 -7.186 1.00 0.17 H new ATOM 0 HB2 GLN A 97 6.766 -3.875 -8.868 1.00 0.19 H new ATOM 0 HB3 GLN A 97 5.298 -3.128 -8.269 1.00 0.19 H new ATOM 0 HG2 GLN A 97 5.868 -1.866 -10.180 1.00 0.25 H new ATOM 0 HG3 GLN A 97 6.364 -0.867 -8.829 1.00 0.25 H new ATOM 0 HE21 GLN A 97 8.645 -0.619 -8.338 1.00 0.32 H new ATOM 0 HE22 GLN A 97 9.871 -1.026 -9.543 1.00 0.32 H new ATOM 1451 N ALA A 98 5.400 -2.997 -5.264 1.00 0.17 N ATOM 1452 CA ALA A 98 4.512 -2.527 -4.206 1.00 0.18 C ATOM 1453 C ALA A 98 5.249 -1.574 -3.286 1.00 0.17 C ATOM 1454 O ALA A 98 4.734 -0.525 -2.908 1.00 0.20 O ATOM 1455 CB ALA A 98 3.986 -3.697 -3.401 1.00 0.20 C ATOM 0 H ALA A 98 5.490 -4.012 -5.320 1.00 0.17 H new ATOM 0 HA ALA A 98 3.675 -2.005 -4.669 1.00 0.18 H new ATOM 0 HB1 ALA A 98 3.325 -3.330 -2.616 1.00 0.20 H new ATOM 0 HB2 ALA A 98 3.433 -4.370 -4.056 1.00 0.20 H new ATOM 0 HB3 ALA A 98 4.821 -4.234 -2.951 1.00 0.20 H new ATOM 1461 N LEU A 99 6.471 -1.945 -2.958 1.00 0.17 N ATOM 1462 CA LEU A 99 7.289 -1.153 -2.058 1.00 0.17 C ATOM 1463 C LEU A 99 7.883 0.031 -2.790 1.00 0.15 C ATOM 1464 O LEU A 99 7.930 1.145 -2.268 1.00 0.15 O ATOM 1465 CB LEU A 99 8.423 -1.982 -1.474 1.00 0.19 C ATOM 1466 CG LEU A 99 9.284 -1.229 -0.460 1.00 0.18 C ATOM 1467 CD1 LEU A 99 8.441 -0.767 0.719 1.00 0.21 C ATOM 1468 CD2 LEU A 99 10.441 -2.087 0.014 1.00 0.22 C ATOM 0 H LEU A 99 6.921 -2.793 -3.302 1.00 0.17 H new ATOM 0 HA LEU A 99 6.644 -0.807 -1.250 1.00 0.17 H new ATOM 0 HB2 LEU A 99 8.003 -2.866 -0.994 1.00 0.19 H new ATOM 0 HB3 LEU A 99 9.059 -2.332 -2.287 1.00 0.19 H new ATOM 0 HG LEU A 99 9.697 -0.350 -0.954 1.00 0.18 H new ATOM 0 HD11 LEU A 99 9.071 -0.233 1.430 1.00 0.21 H new ATOM 0 HD12 LEU A 99 7.652 -0.104 0.364 1.00 0.21 H new ATOM 0 HD13 LEU A 99 7.995 -1.633 1.209 1.00 0.21 H new ATOM 0 HD21 LEU A 99 11.038 -1.528 0.735 1.00 0.22 H new ATOM 0 HD22 LEU A 99 10.055 -2.990 0.486 1.00 0.22 H new ATOM 0 HD23 LEU A 99 11.064 -2.361 -0.838 1.00 0.22 H new ATOM 1480 N ASP A 100 8.307 -0.230 -4.013 1.00 0.15 N ATOM 1481 CA ASP A 100 9.015 0.742 -4.825 1.00 0.16 C ATOM 1482 C ASP A 100 8.125 1.948 -5.086 1.00 0.15 C ATOM 1483 O ASP A 100 8.598 3.067 -5.254 1.00 0.16 O ATOM 1484 CB ASP A 100 9.442 0.070 -6.131 1.00 0.17 C ATOM 1485 CG ASP A 100 10.314 0.944 -7.002 1.00 0.20 C ATOM 1486 OD1 ASP A 100 11.546 0.926 -6.816 1.00 0.21 O ATOM 1487 OD2 ASP A 100 9.765 1.684 -7.844 1.00 0.26 O ATOM 0 H ASP A 100 8.169 -1.129 -4.474 1.00 0.15 H new ATOM 0 HA ASP A 100 9.904 1.097 -4.303 1.00 0.16 H new ATOM 0 HB2 ASP A 100 9.980 -0.849 -5.898 1.00 0.17 H new ATOM 0 HB3 ASP A 100 8.552 -0.215 -6.692 1.00 0.17 H new ATOM 1492 N LEU A 101 6.827 1.699 -5.121 1.00 0.16 N ATOM 1493 CA LEU A 101 5.843 2.751 -5.279 1.00 0.16 C ATOM 1494 C LEU A 101 5.373 3.308 -3.923 1.00 0.15 C ATOM 1495 O LEU A 101 5.075 4.501 -3.793 1.00 0.16 O ATOM 1496 CB LEU A 101 4.661 2.204 -6.069 1.00 0.19 C ATOM 1497 CG LEU A 101 5.011 1.600 -7.436 1.00 0.22 C ATOM 1498 CD1 LEU A 101 3.751 1.185 -8.179 1.00 0.25 C ATOM 1499 CD2 LEU A 101 5.846 2.568 -8.261 1.00 0.25 C ATOM 0 H LEU A 101 6.428 0.764 -5.041 1.00 0.16 H new ATOM 0 HA LEU A 101 6.303 3.579 -5.818 1.00 0.16 H new ATOM 0 HB2 LEU A 101 4.165 1.441 -5.469 1.00 0.19 H new ATOM 0 HB3 LEU A 101 3.941 3.009 -6.219 1.00 0.19 H new ATOM 0 HG LEU A 101 5.611 0.705 -7.270 1.00 0.22 H new ATOM 0 HD11 LEU A 101 4.022 0.759 -9.145 1.00 0.25 H new ATOM 0 HD12 LEU A 101 3.212 0.441 -7.593 1.00 0.25 H new ATOM 0 HD13 LEU A 101 3.115 2.057 -8.332 1.00 0.25 H new ATOM 0 HD21 LEU A 101 6.081 2.116 -9.225 1.00 0.25 H new ATOM 0 HD22 LEU A 101 5.285 3.489 -8.419 1.00 0.25 H new ATOM 0 HD23 LEU A 101 6.771 2.793 -7.731 1.00 0.25 H new ATOM 1511 N SER A 102 5.313 2.443 -2.916 1.00 0.15 N ATOM 1512 CA SER A 102 4.810 2.837 -1.603 1.00 0.17 C ATOM 1513 C SER A 102 5.732 3.863 -0.957 1.00 0.15 C ATOM 1514 O SER A 102 5.278 4.769 -0.265 1.00 0.18 O ATOM 1515 CB SER A 102 4.658 1.611 -0.691 1.00 0.23 C ATOM 1516 OG SER A 102 4.281 1.980 0.621 1.00 1.01 O ATOM 0 H SER A 102 5.605 1.468 -2.982 1.00 0.15 H new ATOM 0 HA SER A 102 3.829 3.292 -1.740 1.00 0.17 H new ATOM 0 HB2 SER A 102 3.910 0.937 -1.109 1.00 0.23 H new ATOM 0 HB3 SER A 102 5.599 1.062 -0.659 1.00 0.23 H new ATOM 0 HG SER A 102 4.964 1.677 1.255 1.00 1.01 H new ATOM 1522 N VAL A 103 7.025 3.723 -1.211 1.00 0.15 N ATOM 1523 CA VAL A 103 8.032 4.594 -0.621 1.00 0.16 C ATOM 1524 C VAL A 103 7.891 6.056 -1.054 1.00 0.16 C ATOM 1525 O VAL A 103 7.861 6.935 -0.209 1.00 0.18 O ATOM 1526 CB VAL A 103 9.436 4.104 -0.952 1.00 0.18 C ATOM 1527 CG1 VAL A 103 10.488 5.133 -0.555 1.00 0.21 C ATOM 1528 CG2 VAL A 103 9.702 2.785 -0.260 1.00 0.19 C ATOM 0 H VAL A 103 7.405 3.006 -1.829 1.00 0.15 H new ATOM 0 HA VAL A 103 7.868 4.552 0.456 1.00 0.16 H new ATOM 0 HB VAL A 103 9.500 3.960 -2.031 1.00 0.18 H new ATOM 0 HG11 VAL A 103 11.479 4.754 -0.804 1.00 0.21 H new ATOM 0 HG12 VAL A 103 10.309 6.063 -1.094 1.00 0.21 H new ATOM 0 HG13 VAL A 103 10.429 5.318 0.517 1.00 0.21 H new ATOM 0 HG21 VAL A 103 10.708 2.443 -0.503 1.00 0.19 H new ATOM 0 HG22 VAL A 103 9.614 2.916 0.819 1.00 0.19 H new ATOM 0 HG23 VAL A 103 8.976 2.045 -0.596 1.00 0.19 H new ATOM 1538 N PRO A 104 7.844 6.353 -2.368 1.00 0.17 N ATOM 1539 CA PRO A 104 7.620 7.724 -2.849 1.00 0.21 C ATOM 1540 C PRO A 104 6.261 8.269 -2.409 1.00 0.19 C ATOM 1541 O PRO A 104 6.045 9.481 -2.365 1.00 0.22 O ATOM 1542 CB PRO A 104 7.697 7.599 -4.376 1.00 0.27 C ATOM 1543 CG PRO A 104 7.499 6.153 -4.659 1.00 0.21 C ATOM 1544 CD PRO A 104 8.058 5.421 -3.480 1.00 0.17 C ATOM 0 HA PRO A 104 8.351 8.424 -2.444 1.00 0.21 H new ATOM 0 HB2 PRO A 104 6.930 8.204 -4.860 1.00 0.27 H new ATOM 0 HB3 PRO A 104 8.660 7.946 -4.751 1.00 0.27 H new ATOM 0 HG2 PRO A 104 6.442 5.923 -4.795 1.00 0.21 H new ATOM 0 HG3 PRO A 104 8.010 5.862 -5.577 1.00 0.21 H new ATOM 0 HD2 PRO A 104 7.544 4.474 -3.315 1.00 0.17 H new ATOM 0 HD3 PRO A 104 9.115 5.191 -3.614 1.00 0.17 H new ATOM 1552 N LEU A 105 5.342 7.362 -2.099 1.00 0.18 N ATOM 1553 CA LEU A 105 4.062 7.735 -1.508 1.00 0.19 C ATOM 1554 C LEU A 105 4.185 7.897 0.010 1.00 0.22 C ATOM 1555 O LEU A 105 3.265 8.369 0.683 1.00 0.32 O ATOM 1556 CB LEU A 105 3.025 6.670 -1.831 1.00 0.18 C ATOM 1557 CG LEU A 105 2.477 6.707 -3.261 1.00 0.25 C ATOM 1558 CD1 LEU A 105 1.178 5.925 -3.346 1.00 0.53 C ATOM 1559 CD2 LEU A 105 2.272 8.142 -3.727 1.00 0.64 C ATOM 0 H LEU A 105 5.460 6.360 -2.248 1.00 0.18 H new ATOM 0 HA LEU A 105 3.751 8.691 -1.928 1.00 0.19 H new ATOM 0 HB2 LEU A 105 3.467 5.690 -1.653 1.00 0.18 H new ATOM 0 HB3 LEU A 105 2.191 6.775 -1.137 1.00 0.18 H new ATOM 0 HG LEU A 105 3.208 6.241 -3.922 1.00 0.25 H new ATOM 0 HD11 LEU A 105 0.799 5.959 -4.367 1.00 0.53 H new ATOM 0 HD12 LEU A 105 1.358 4.889 -3.060 1.00 0.53 H new ATOM 0 HD13 LEU A 105 0.444 6.365 -2.672 1.00 0.53 H new ATOM 0 HD21 LEU A 105 1.882 8.142 -4.745 1.00 0.64 H new ATOM 0 HD22 LEU A 105 1.562 8.641 -3.067 1.00 0.64 H new ATOM 0 HD23 LEU A 105 3.224 8.672 -3.703 1.00 0.64 H new ATOM 1571 N MET A 106 5.307 7.444 0.528 1.00 0.20 N ATOM 1572 CA MET A 106 5.636 7.529 1.942 1.00 0.24 C ATOM 1573 C MET A 106 6.550 8.724 2.239 1.00 0.21 C ATOM 1574 O MET A 106 7.465 9.019 1.474 1.00 0.26 O ATOM 1575 CB MET A 106 6.326 6.222 2.322 1.00 0.33 C ATOM 1576 CG MET A 106 6.857 6.163 3.731 1.00 0.53 C ATOM 1577 SD MET A 106 7.466 4.518 4.147 1.00 0.78 S ATOM 1578 CE MET A 106 6.021 3.542 3.777 1.00 0.54 C ATOM 0 H MET A 106 6.033 6.996 -0.031 1.00 0.20 H new ATOM 0 HA MET A 106 4.728 7.679 2.527 1.00 0.24 H new ATOM 0 HB2 MET A 106 5.620 5.403 2.182 1.00 0.33 H new ATOM 0 HB3 MET A 106 7.152 6.052 1.632 1.00 0.33 H new ATOM 0 HG2 MET A 106 7.662 6.889 3.847 1.00 0.53 H new ATOM 0 HG3 MET A 106 6.069 6.446 4.429 1.00 0.53 H new ATOM 0 HE1 MET A 106 5.900 2.769 4.536 1.00 0.54 H new ATOM 0 HE2 MET A 106 5.140 4.184 3.769 1.00 0.54 H new ATOM 0 HE3 MET A 106 6.138 3.075 2.799 1.00 0.54 H new ATOM 1588 N ASP A 107 6.307 9.403 3.355 1.00 0.18 N ATOM 1589 CA ASP A 107 7.149 10.526 3.763 1.00 0.18 C ATOM 1590 C ASP A 107 8.256 10.024 4.679 1.00 0.14 C ATOM 1591 O ASP A 107 8.099 8.994 5.347 1.00 0.13 O ATOM 1592 CB ASP A 107 6.336 11.613 4.484 1.00 0.25 C ATOM 1593 CG ASP A 107 6.206 12.897 3.679 1.00 0.56 C ATOM 1594 OD1 ASP A 107 5.636 12.868 2.571 1.00 0.97 O ATOM 1595 OD2 ASP A 107 6.678 13.952 4.162 1.00 0.92 O ATOM 0 H ASP A 107 5.537 9.198 3.992 1.00 0.18 H new ATOM 0 HA ASP A 107 7.578 10.970 2.864 1.00 0.18 H new ATOM 0 HB2 ASP A 107 5.341 11.227 4.704 1.00 0.25 H new ATOM 0 HB3 ASP A 107 6.809 11.837 5.440 1.00 0.25 H new ATOM 1600 N VAL A 108 9.381 10.729 4.702 1.00 0.16 N ATOM 1601 CA VAL A 108 10.498 10.328 5.544 1.00 0.16 C ATOM 1602 C VAL A 108 10.100 10.355 7.012 1.00 0.15 C ATOM 1603 O VAL A 108 9.621 11.365 7.528 1.00 0.19 O ATOM 1604 CB VAL A 108 11.751 11.217 5.307 1.00 0.21 C ATOM 1605 CG1 VAL A 108 12.569 11.395 6.581 1.00 0.68 C ATOM 1606 CG2 VAL A 108 12.628 10.618 4.216 1.00 0.80 C ATOM 0 H VAL A 108 9.542 11.573 4.152 1.00 0.16 H new ATOM 0 HA VAL A 108 10.761 9.307 5.268 1.00 0.16 H new ATOM 0 HB VAL A 108 11.396 12.199 4.993 1.00 0.21 H new ATOM 0 HG11 VAL A 108 13.436 12.022 6.372 1.00 0.68 H new ATOM 0 HG12 VAL A 108 11.953 11.869 7.345 1.00 0.68 H new ATOM 0 HG13 VAL A 108 12.904 10.421 6.938 1.00 0.68 H new ATOM 0 HG21 VAL A 108 13.501 11.252 4.062 1.00 0.80 H new ATOM 0 HG22 VAL A 108 12.952 9.621 4.516 1.00 0.80 H new ATOM 0 HG23 VAL A 108 12.060 10.551 3.288 1.00 0.80 H new ATOM 1616 N GLY A 109 10.293 9.228 7.666 1.00 0.15 N ATOM 1617 CA GLY A 109 10.041 9.143 9.081 1.00 0.17 C ATOM 1618 C GLY A 109 8.662 8.606 9.398 1.00 0.18 C ATOM 1619 O GLY A 109 8.207 8.706 10.537 1.00 0.28 O ATOM 0 H GLY A 109 10.623 8.363 7.238 1.00 0.15 H new ATOM 0 HA2 GLY A 109 10.791 8.500 9.541 1.00 0.17 H new ATOM 0 HA3 GLY A 109 10.152 10.132 9.526 1.00 0.17 H new ATOM 1623 N GLU A 110 7.979 8.045 8.405 1.00 0.13 N ATOM 1624 CA GLU A 110 6.666 7.483 8.651 1.00 0.13 C ATOM 1625 C GLU A 110 6.733 5.970 8.667 1.00 0.10 C ATOM 1626 O GLU A 110 7.748 5.369 8.312 1.00 0.12 O ATOM 1627 CB GLU A 110 5.625 7.946 7.621 1.00 0.17 C ATOM 1628 CG GLU A 110 5.578 7.131 6.351 1.00 0.20 C ATOM 1629 CD GLU A 110 4.336 7.392 5.514 1.00 0.27 C ATOM 1630 OE1 GLU A 110 4.252 8.455 4.873 1.00 0.41 O ATOM 1631 OE2 GLU A 110 3.448 6.511 5.459 1.00 0.39 O ATOM 0 H GLU A 110 8.309 7.970 7.443 1.00 0.13 H new ATOM 0 HA GLU A 110 6.346 7.847 9.627 1.00 0.13 H new ATOM 0 HB2 GLU A 110 4.640 7.922 8.087 1.00 0.17 H new ATOM 0 HB3 GLU A 110 5.830 8.985 7.361 1.00 0.17 H new ATOM 0 HG2 GLU A 110 6.463 7.351 5.754 1.00 0.20 H new ATOM 0 HG3 GLU A 110 5.620 6.072 6.605 1.00 0.20 H new ATOM 1638 N THR A 111 5.656 5.363 9.109 1.00 0.10 N ATOM 1639 CA THR A 111 5.525 3.938 9.063 1.00 0.11 C ATOM 1640 C THR A 111 4.169 3.603 8.498 1.00 0.11 C ATOM 1641 O THR A 111 3.140 4.014 9.037 1.00 0.12 O ATOM 1642 CB THR A 111 5.710 3.297 10.448 1.00 0.16 C ATOM 1643 OG1 THR A 111 6.922 3.777 11.044 1.00 0.22 O ATOM 1644 CG2 THR A 111 5.768 1.781 10.341 1.00 0.19 C ATOM 0 H THR A 111 4.852 5.848 9.508 1.00 0.10 H new ATOM 0 HA THR A 111 6.311 3.532 8.426 1.00 0.11 H new ATOM 0 HB THR A 111 4.857 3.571 11.069 1.00 0.16 H new ATOM 0 HG1 THR A 111 7.037 3.368 11.927 1.00 0.22 H new ATOM 0 HG21 THR A 111 5.899 1.351 11.334 1.00 0.19 H new ATOM 0 HG22 THR A 111 4.840 1.411 9.905 1.00 0.19 H new ATOM 0 HG23 THR A 111 6.607 1.493 9.707 1.00 0.19 H new ATOM 1652 N ALA A 112 4.177 2.896 7.389 1.00 0.12 N ATOM 1653 CA ALA A 112 2.963 2.592 6.677 1.00 0.13 C ATOM 1654 C ALA A 112 2.728 1.101 6.634 1.00 0.12 C ATOM 1655 O ALA A 112 3.655 0.321 6.418 1.00 0.13 O ATOM 1656 CB ALA A 112 3.032 3.157 5.277 1.00 0.18 C ATOM 0 H ALA A 112 5.022 2.519 6.960 1.00 0.12 H new ATOM 0 HA ALA A 112 2.126 3.051 7.203 1.00 0.13 H new ATOM 0 HB1 ALA A 112 2.110 2.923 4.744 1.00 0.18 H new ATOM 0 HB2 ALA A 112 3.158 4.239 5.327 1.00 0.18 H new ATOM 0 HB3 ALA A 112 3.878 2.717 4.749 1.00 0.18 H new ATOM 1662 N MET A 113 1.492 0.705 6.850 1.00 0.12 N ATOM 1663 CA MET A 113 1.103 -0.669 6.638 1.00 0.12 C ATOM 1664 C MET A 113 0.488 -0.743 5.260 1.00 0.12 C ATOM 1665 O MET A 113 -0.539 -0.123 5.004 1.00 0.14 O ATOM 1666 CB MET A 113 0.084 -1.127 7.687 1.00 0.16 C ATOM 1667 CG MET A 113 -0.627 -2.424 7.324 1.00 0.25 C ATOM 1668 SD MET A 113 -1.808 -2.935 8.586 1.00 0.53 S ATOM 1669 CE MET A 113 -2.459 -4.430 7.852 1.00 1.32 C ATOM 0 H MET A 113 0.741 1.316 7.172 1.00 0.12 H new ATOM 0 HA MET A 113 1.971 -1.322 6.725 1.00 0.12 H new ATOM 0 HB2 MET A 113 0.593 -1.257 8.642 1.00 0.16 H new ATOM 0 HB3 MET A 113 -0.659 -0.342 7.826 1.00 0.16 H new ATOM 0 HG2 MET A 113 -1.146 -2.297 6.374 1.00 0.25 H new ATOM 0 HG3 MET A 113 0.112 -3.213 7.181 1.00 0.25 H new ATOM 0 HE1 MET A 113 -3.443 -4.642 8.270 1.00 1.32 H new ATOM 0 HE2 MET A 113 -2.543 -4.299 6.773 1.00 1.32 H new ATOM 0 HE3 MET A 113 -1.788 -5.262 8.065 1.00 1.32 H new ATOM 1679 N VAL A 114 1.112 -1.478 4.377 1.00 0.12 N ATOM 1680 CA VAL A 114 0.677 -1.528 3.000 1.00 0.12 C ATOM 1681 C VAL A 114 0.163 -2.902 2.686 1.00 0.13 C ATOM 1682 O VAL A 114 0.795 -3.895 3.030 1.00 0.16 O ATOM 1683 CB VAL A 114 1.839 -1.227 2.040 1.00 0.15 C ATOM 1684 CG1 VAL A 114 1.347 -0.871 0.649 1.00 0.18 C ATOM 1685 CG2 VAL A 114 2.723 -0.142 2.606 1.00 0.17 C ATOM 0 H VAL A 114 1.928 -2.054 4.585 1.00 0.12 H new ATOM 0 HA VAL A 114 -0.104 -0.779 2.870 1.00 0.12 H new ATOM 0 HB VAL A 114 2.432 -2.136 1.940 1.00 0.15 H new ATOM 0 HG11 VAL A 114 2.200 -0.666 0.003 1.00 0.18 H new ATOM 0 HG12 VAL A 114 0.775 -1.704 0.241 1.00 0.18 H new ATOM 0 HG13 VAL A 114 0.712 0.013 0.703 1.00 0.18 H new ATOM 0 HG21 VAL A 114 3.541 0.059 1.914 1.00 0.17 H new ATOM 0 HG22 VAL A 114 2.138 0.766 2.750 1.00 0.17 H new ATOM 0 HG23 VAL A 114 3.130 -0.467 3.564 1.00 0.17 H new ATOM 1695 N THR A 115 -0.978 -2.974 2.058 1.00 0.14 N ATOM 1696 CA THR A 115 -1.435 -4.234 1.567 1.00 0.14 C ATOM 1697 C THR A 115 -1.388 -4.230 0.058 1.00 0.13 C ATOM 1698 O THR A 115 -2.069 -3.453 -0.610 1.00 0.16 O ATOM 1699 CB THR A 115 -2.828 -4.609 2.070 1.00 0.17 C ATOM 1700 OG1 THR A 115 -2.844 -4.602 3.500 1.00 0.21 O ATOM 1701 CG2 THR A 115 -3.178 -5.990 1.582 1.00 0.20 C ATOM 0 H THR A 115 -1.598 -2.184 1.878 1.00 0.14 H new ATOM 0 HA THR A 115 -0.764 -5.000 1.957 1.00 0.14 H new ATOM 0 HB THR A 115 -3.552 -3.886 1.694 1.00 0.17 H new ATOM 0 HG1 THR A 115 -3.544 -3.994 3.816 1.00 0.21 H new ATOM 0 HG21 THR A 115 -4.172 -6.261 1.939 1.00 0.20 H new ATOM 0 HG22 THR A 115 -3.168 -6.004 0.492 1.00 0.20 H new ATOM 0 HG23 THR A 115 -2.448 -6.706 1.961 1.00 0.20 H new ATOM 1709 N ALA A 116 -0.528 -5.071 -0.446 1.00 0.12 N ATOM 1710 CA ALA A 116 -0.313 -5.213 -1.865 1.00 0.13 C ATOM 1711 C ALA A 116 -0.537 -6.643 -2.274 1.00 0.12 C ATOM 1712 O ALA A 116 -0.081 -7.563 -1.594 1.00 0.13 O ATOM 1713 CB ALA A 116 1.098 -4.784 -2.212 1.00 0.15 C ATOM 0 H ALA A 116 0.053 -5.687 0.123 1.00 0.12 H new ATOM 0 HA ALA A 116 -1.018 -4.579 -2.403 1.00 0.13 H new ATOM 0 HB1 ALA A 116 1.258 -4.892 -3.285 1.00 0.15 H new ATOM 0 HB2 ALA A 116 1.242 -3.742 -1.927 1.00 0.15 H new ATOM 0 HB3 ALA A 116 1.811 -5.409 -1.674 1.00 0.15 H new ATOM 1719 N ASP A 117 -1.255 -6.831 -3.365 1.00 0.13 N ATOM 1720 CA ASP A 117 -1.424 -8.156 -3.927 1.00 0.13 C ATOM 1721 C ASP A 117 -0.059 -8.789 -4.117 1.00 0.11 C ATOM 1722 O ASP A 117 0.918 -8.090 -4.399 1.00 0.12 O ATOM 1723 CB ASP A 117 -2.132 -8.092 -5.274 1.00 0.16 C ATOM 1724 CG ASP A 117 -2.638 -9.452 -5.737 1.00 0.20 C ATOM 1725 OD1 ASP A 117 -1.810 -10.349 -5.962 1.00 0.58 O ATOM 1726 OD2 ASP A 117 -3.876 -9.627 -5.842 1.00 0.50 O ATOM 0 H ASP A 117 -1.728 -6.087 -3.877 1.00 0.13 H new ATOM 0 HA ASP A 117 -2.031 -8.749 -3.243 1.00 0.13 H new ATOM 0 HB2 ASP A 117 -2.972 -7.400 -5.206 1.00 0.16 H new ATOM 0 HB3 ASP A 117 -1.448 -7.690 -6.021 1.00 0.16 H new ATOM 1731 N SER A 118 0.011 -10.095 -3.967 1.00 0.13 N ATOM 1732 CA SER A 118 1.261 -10.812 -4.101 1.00 0.16 C ATOM 1733 C SER A 118 1.889 -10.522 -5.464 1.00 0.13 C ATOM 1734 O SER A 118 3.098 -10.544 -5.617 1.00 0.15 O ATOM 1735 CB SER A 118 1.016 -12.306 -3.937 1.00 0.27 C ATOM 1736 OG SER A 118 2.190 -12.984 -3.537 1.00 0.82 O ATOM 0 H SER A 118 -0.791 -10.686 -3.750 1.00 0.13 H new ATOM 0 HA SER A 118 1.950 -10.480 -3.325 1.00 0.16 H new ATOM 0 HB2 SER A 118 0.232 -12.468 -3.198 1.00 0.27 H new ATOM 0 HB3 SER A 118 0.657 -12.722 -4.878 1.00 0.27 H new ATOM 0 HG SER A 118 2.588 -12.523 -2.769 1.00 0.82 H new ATOM 1742 N LYS A 119 1.059 -10.226 -6.447 1.00 0.13 N ATOM 1743 CA LYS A 119 1.546 -9.843 -7.767 1.00 0.14 C ATOM 1744 C LYS A 119 2.507 -8.649 -7.691 1.00 0.14 C ATOM 1745 O LYS A 119 3.429 -8.542 -8.501 1.00 0.18 O ATOM 1746 CB LYS A 119 0.376 -9.509 -8.686 1.00 0.17 C ATOM 1747 CG LYS A 119 -0.604 -8.536 -8.089 1.00 0.19 C ATOM 1748 CD LYS A 119 -1.643 -8.107 -9.104 1.00 0.29 C ATOM 1749 CE LYS A 119 -2.522 -9.266 -9.532 1.00 0.38 C ATOM 1750 NZ LYS A 119 -3.312 -8.937 -10.750 1.00 0.81 N ATOM 0 H LYS A 119 0.043 -10.242 -6.360 1.00 0.13 H new ATOM 0 HA LYS A 119 2.095 -10.692 -8.174 1.00 0.14 H new ATOM 0 HB2 LYS A 119 0.764 -9.095 -9.617 1.00 0.17 H new ATOM 0 HB3 LYS A 119 -0.149 -10.430 -8.940 1.00 0.17 H new ATOM 0 HG2 LYS A 119 -1.098 -8.994 -7.232 1.00 0.19 H new ATOM 0 HG3 LYS A 119 -0.071 -7.660 -7.719 1.00 0.19 H new ATOM 0 HD2 LYS A 119 -2.263 -7.318 -8.679 1.00 0.29 H new ATOM 0 HD3 LYS A 119 -1.146 -7.686 -9.978 1.00 0.29 H new ATOM 0 HE2 LYS A 119 -1.902 -10.141 -9.726 1.00 0.38 H new ATOM 0 HE3 LYS A 119 -3.199 -9.529 -8.719 1.00 0.38 H new ATOM 0 HZ1 LYS A 119 -3.901 -9.753 -11.013 1.00 0.81 H new ATOM 0 HZ2 LYS A 119 -3.922 -8.117 -10.557 1.00 0.81 H new ATOM 0 HZ3 LYS A 119 -2.665 -8.710 -11.532 1.00 0.81 H new ATOM 1764 N TYR A 120 2.299 -7.759 -6.718 1.00 0.13 N ATOM 1765 CA TYR A 120 3.202 -6.632 -6.516 1.00 0.15 C ATOM 1766 C TYR A 120 4.230 -6.980 -5.460 1.00 0.15 C ATOM 1767 O TYR A 120 5.124 -6.189 -5.156 1.00 0.19 O ATOM 1768 CB TYR A 120 2.437 -5.376 -6.089 1.00 0.16 C ATOM 1769 CG TYR A 120 1.377 -4.940 -7.055 1.00 0.20 C ATOM 1770 CD1 TYR A 120 0.096 -5.458 -6.979 1.00 0.23 C ATOM 1771 CD2 TYR A 120 1.659 -4.015 -8.041 1.00 0.28 C ATOM 1772 CE1 TYR A 120 -0.888 -5.066 -7.863 1.00 0.30 C ATOM 1773 CE2 TYR A 120 0.685 -3.610 -8.934 1.00 0.34 C ATOM 1774 CZ TYR A 120 -0.589 -4.141 -8.845 1.00 0.34 C ATOM 1775 OH TYR A 120 -1.561 -3.746 -9.735 1.00 0.42 O ATOM 0 H TYR A 120 1.518 -7.799 -6.063 1.00 0.13 H new ATOM 0 HA TYR A 120 3.700 -6.426 -7.464 1.00 0.15 H new ATOM 0 HB2 TYR A 120 1.975 -5.559 -5.119 1.00 0.16 H new ATOM 0 HB3 TYR A 120 3.147 -4.560 -5.955 1.00 0.16 H new ATOM 0 HD1 TYR A 120 -0.138 -6.183 -6.213 1.00 0.23 H new ATOM 0 HD2 TYR A 120 2.654 -3.602 -8.115 1.00 0.28 H new ATOM 0 HE1 TYR A 120 -1.883 -5.479 -7.788 1.00 0.30 H new ATOM 0 HE2 TYR A 120 0.918 -2.882 -9.698 1.00 0.34 H new ATOM 0 HH TYR A 120 -2.378 -3.514 -9.246 1.00 0.42 H new ATOM 1785 N CYS A 121 4.096 -8.177 -4.923 1.00 0.14 N ATOM 1786 CA CYS A 121 4.957 -8.653 -3.860 1.00 0.15 C ATOM 1787 C CYS A 121 5.750 -9.870 -4.324 1.00 0.16 C ATOM 1788 O CYS A 121 6.808 -9.724 -4.928 1.00 0.18 O ATOM 1789 CB CYS A 121 4.126 -8.986 -2.628 1.00 0.14 C ATOM 1790 SG CYS A 121 3.154 -7.596 -2.014 1.00 0.16 S ATOM 0 H CYS A 121 3.385 -8.848 -5.213 1.00 0.14 H new ATOM 0 HA CYS A 121 5.665 -7.867 -3.598 1.00 0.15 H new ATOM 0 HB2 CYS A 121 3.455 -9.811 -2.865 1.00 0.14 H new ATOM 0 HB3 CYS A 121 4.789 -9.333 -1.836 1.00 0.14 H new ATOM 0 HG CYS A 121 1.898 -7.928 -1.975 1.00 0.16 H new ATOM 1796 N TYR A 122 5.240 -11.074 -4.066 1.00 0.16 N ATOM 1797 CA TYR A 122 5.937 -12.276 -4.508 1.00 0.18 C ATOM 1798 C TYR A 122 4.966 -13.352 -5.020 1.00 0.18 C ATOM 1799 O TYR A 122 5.188 -14.525 -4.759 1.00 0.20 O ATOM 1800 CB TYR A 122 6.787 -12.867 -3.368 1.00 0.19 C ATOM 1801 CG TYR A 122 7.545 -11.855 -2.535 1.00 0.20 C ATOM 1802 CD1 TYR A 122 8.799 -11.396 -2.925 1.00 0.21 C ATOM 1803 CD2 TYR A 122 7.006 -11.361 -1.355 1.00 0.19 C ATOM 1804 CE1 TYR A 122 9.492 -10.481 -2.156 1.00 0.23 C ATOM 1805 CE2 TYR A 122 7.691 -10.447 -0.584 1.00 0.20 C ATOM 1806 CZ TYR A 122 8.933 -10.005 -0.990 1.00 0.22 C ATOM 1807 OH TYR A 122 9.622 -9.088 -0.226 1.00 0.24 O ATOM 0 H TYR A 122 4.367 -11.240 -3.565 1.00 0.16 H new ATOM 0 HA TYR A 122 6.584 -11.975 -5.332 1.00 0.18 H new ATOM 0 HB2 TYR A 122 6.134 -13.439 -2.709 1.00 0.19 H new ATOM 0 HB3 TYR A 122 7.502 -13.569 -3.797 1.00 0.19 H new ATOM 0 HD1 TYR A 122 9.237 -11.760 -3.842 1.00 0.21 H new ATOM 0 HD2 TYR A 122 6.032 -11.699 -1.035 1.00 0.19 H new ATOM 0 HE1 TYR A 122 10.468 -10.140 -2.468 1.00 0.23 H new ATOM 0 HE2 TYR A 122 7.257 -10.078 0.334 1.00 0.20 H new ATOM 0 HH TYR A 122 9.475 -9.278 0.724 1.00 0.24 H new ATOM 1817 N GLY A 123 3.913 -12.956 -5.755 1.00 0.19 N ATOM 1818 CA GLY A 123 2.936 -13.910 -6.288 1.00 0.21 C ATOM 1819 C GLY A 123 3.552 -15.138 -6.933 1.00 0.21 C ATOM 1820 O GLY A 123 3.651 -16.183 -6.299 1.00 0.25 O ATOM 0 H GLY A 123 3.720 -11.983 -5.991 1.00 0.19 H new ATOM 0 HA2 GLY A 123 2.279 -14.230 -5.479 1.00 0.21 H new ATOM 0 HA3 GLY A 123 2.313 -13.401 -7.023 1.00 0.21 H new ATOM 1824 N PRO A 124 3.964 -15.054 -8.202 1.00 0.25 N ATOM 1825 CA PRO A 124 4.630 -16.156 -8.880 1.00 0.30 C ATOM 1826 C PRO A 124 6.129 -16.111 -8.637 1.00 0.30 C ATOM 1827 O PRO A 124 6.913 -16.776 -9.317 1.00 0.34 O ATOM 1828 CB PRO A 124 4.304 -15.896 -10.350 1.00 0.37 C ATOM 1829 CG PRO A 124 4.137 -14.413 -10.464 1.00 0.58 C ATOM 1830 CD PRO A 124 3.807 -13.887 -9.084 1.00 0.32 C ATOM 0 HA PRO A 124 4.306 -17.138 -8.535 1.00 0.30 H new ATOM 0 HB2 PRO A 124 5.104 -16.252 -10.999 1.00 0.37 H new ATOM 0 HB3 PRO A 124 3.395 -16.418 -10.649 1.00 0.37 H new ATOM 0 HG2 PRO A 124 5.049 -13.952 -10.842 1.00 0.58 H new ATOM 0 HG3 PRO A 124 3.341 -14.169 -11.168 1.00 0.58 H new ATOM 0 HD2 PRO A 124 4.478 -13.078 -8.796 1.00 0.32 H new ATOM 0 HD3 PRO A 124 2.793 -13.490 -9.042 1.00 0.32 H new ATOM 1838 N GLN A 125 6.513 -15.303 -7.662 1.00 0.27 N ATOM 1839 CA GLN A 125 7.914 -15.044 -7.386 1.00 0.30 C ATOM 1840 C GLN A 125 8.359 -15.795 -6.142 1.00 0.32 C ATOM 1841 O GLN A 125 9.376 -16.495 -6.137 1.00 0.39 O ATOM 1842 CB GLN A 125 8.117 -13.542 -7.202 1.00 0.30 C ATOM 1843 CG GLN A 125 7.520 -12.717 -8.331 1.00 0.33 C ATOM 1844 CD GLN A 125 7.503 -11.234 -8.032 1.00 0.35 C ATOM 1845 OE1 GLN A 125 8.460 -10.514 -8.313 1.00 0.65 O ATOM 1846 NE2 GLN A 125 6.399 -10.766 -7.473 1.00 0.29 N ATOM 0 H GLN A 125 5.866 -14.812 -7.044 1.00 0.27 H new ATOM 0 HA GLN A 125 8.518 -15.392 -8.224 1.00 0.30 H new ATOM 0 HB2 GLN A 125 7.668 -13.234 -6.258 1.00 0.30 H new ATOM 0 HB3 GLN A 125 9.184 -13.332 -7.131 1.00 0.30 H new ATOM 0 HG2 GLN A 125 8.091 -12.892 -9.243 1.00 0.33 H new ATOM 0 HG3 GLN A 125 6.502 -13.056 -8.522 1.00 0.33 H new ATOM 0 HE21 GLN A 125 5.629 -11.399 -7.257 1.00 0.29 H new ATOM 0 HE22 GLN A 125 6.318 -9.772 -7.258 1.00 0.29 H new ATOM 1855 N GLY A 126 7.563 -15.646 -5.096 1.00 0.27 N ATOM 1856 CA GLY A 126 7.880 -16.211 -3.811 1.00 0.27 C ATOM 1857 C GLY A 126 8.845 -15.356 -3.022 1.00 0.28 C ATOM 1858 O GLY A 126 9.772 -14.760 -3.575 1.00 0.30 O ATOM 0 H GLY A 126 6.683 -15.130 -5.122 1.00 0.27 H new ATOM 0 HA2 GLY A 126 6.962 -16.339 -3.238 1.00 0.27 H new ATOM 0 HA3 GLY A 126 8.310 -17.203 -3.950 1.00 0.27 H new ATOM 1862 N SER A 127 8.621 -15.297 -1.726 1.00 0.27 N ATOM 1863 CA SER A 127 9.429 -14.471 -0.848 1.00 0.28 C ATOM 1864 C SER A 127 10.617 -15.246 -0.257 1.00 0.32 C ATOM 1865 O SER A 127 10.671 -16.474 -0.345 1.00 0.33 O ATOM 1866 CB SER A 127 8.544 -13.857 0.251 1.00 0.27 C ATOM 1867 OG SER A 127 9.317 -13.170 1.225 1.00 0.30 O ATOM 0 H SER A 127 7.881 -15.815 -1.253 1.00 0.27 H new ATOM 0 HA SER A 127 9.859 -13.663 -1.440 1.00 0.28 H new ATOM 0 HB2 SER A 127 7.830 -13.168 -0.200 1.00 0.27 H new ATOM 0 HB3 SER A 127 7.965 -14.644 0.734 1.00 0.27 H new ATOM 0 HG SER A 127 8.958 -13.356 2.118 1.00 0.30 H new ATOM 1873 N ARG A 128 11.571 -14.498 0.323 1.00 0.38 N ATOM 1874 CA ARG A 128 12.858 -15.048 0.772 1.00 0.42 C ATOM 1875 C ARG A 128 12.681 -16.256 1.692 1.00 0.42 C ATOM 1876 O ARG A 128 13.300 -17.298 1.485 1.00 0.52 O ATOM 1877 CB ARG A 128 13.707 -13.973 1.481 1.00 0.52 C ATOM 1878 CG ARG A 128 13.097 -13.436 2.771 1.00 1.12 C ATOM 1879 CD ARG A 128 14.114 -12.683 3.620 1.00 1.41 C ATOM 1880 NE ARG A 128 14.408 -11.349 3.099 1.00 1.81 N ATOM 1881 CZ ARG A 128 15.014 -10.398 3.813 1.00 2.33 C ATOM 1882 NH1 ARG A 128 15.456 -10.663 5.038 1.00 2.45 N ATOM 1883 NH2 ARG A 128 15.193 -9.193 3.294 1.00 3.17 N ATOM 0 H ARG A 128 11.470 -13.497 0.493 1.00 0.38 H new ATOM 0 HA ARG A 128 13.381 -15.381 -0.124 1.00 0.42 H new ATOM 0 HB2 ARG A 128 14.688 -14.392 1.705 1.00 0.52 H new ATOM 0 HB3 ARG A 128 13.865 -13.141 0.794 1.00 0.52 H new ATOM 0 HG2 ARG A 128 12.266 -12.773 2.529 1.00 1.12 H new ATOM 0 HG3 ARG A 128 12.686 -14.264 3.349 1.00 1.12 H new ATOM 0 HD2 ARG A 128 13.737 -12.595 4.639 1.00 1.41 H new ATOM 0 HD3 ARG A 128 15.037 -13.260 3.671 1.00 1.41 H new ATOM 0 HE ARG A 128 14.136 -11.134 2.140 1.00 1.81 H new ATOM 0 HH11 ARG A 128 15.332 -11.595 5.434 1.00 2.45 H new ATOM 0 HH12 ARG A 128 15.919 -9.935 5.582 1.00 2.45 H new ATOM 0 HH21 ARG A 128 14.868 -8.991 2.348 1.00 3.17 H new ATOM 0 HH22 ARG A 128 15.656 -8.466 3.840 1.00 3.17 H new ATOM 1897 N SER A 129 11.842 -16.120 2.704 1.00 0.42 N ATOM 1898 CA SER A 129 11.606 -17.214 3.621 1.00 0.44 C ATOM 1899 C SER A 129 10.478 -18.101 3.087 1.00 0.41 C ATOM 1900 O SER A 129 10.707 -19.274 2.795 1.00 0.44 O ATOM 1901 CB SER A 129 11.319 -16.691 5.034 1.00 0.48 C ATOM 1902 OG SER A 129 12.300 -15.746 5.430 1.00 1.23 O ATOM 0 H SER A 129 11.318 -15.269 2.908 1.00 0.42 H new ATOM 0 HA SER A 129 12.505 -17.826 3.693 1.00 0.44 H new ATOM 0 HB2 SER A 129 10.331 -16.231 5.063 1.00 0.48 H new ATOM 0 HB3 SER A 129 11.303 -17.523 5.738 1.00 0.48 H new ATOM 0 HG SER A 129 12.098 -15.423 6.333 1.00 1.23 H new ATOM 1908 N PRO A 130 9.243 -17.582 2.940 1.00 0.37 N ATOM 1909 CA PRO A 130 8.168 -18.301 2.294 1.00 0.36 C ATOM 1910 C PRO A 130 7.957 -17.832 0.870 1.00 0.32 C ATOM 1911 O PRO A 130 7.817 -16.643 0.624 1.00 0.27 O ATOM 1912 CB PRO A 130 6.940 -17.883 3.119 1.00 0.37 C ATOM 1913 CG PRO A 130 7.410 -16.752 3.993 1.00 0.37 C ATOM 1914 CD PRO A 130 8.732 -16.312 3.435 1.00 0.37 C ATOM 0 HA PRO A 130 8.361 -19.373 2.251 1.00 0.36 H new ATOM 0 HB2 PRO A 130 6.122 -17.566 2.472 1.00 0.37 H new ATOM 0 HB3 PRO A 130 6.568 -18.714 3.718 1.00 0.37 H new ATOM 0 HG2 PRO A 130 6.693 -15.931 3.987 1.00 0.37 H new ATOM 0 HG3 PRO A 130 7.513 -17.077 5.028 1.00 0.37 H new ATOM 0 HD2 PRO A 130 8.622 -15.571 2.643 1.00 0.37 H new ATOM 0 HD3 PRO A 130 9.378 -15.872 4.195 1.00 0.37 H new ATOM 1922 N TYR A 131 7.944 -18.745 -0.066 1.00 0.33 N ATOM 1923 CA TYR A 131 7.323 -18.473 -1.339 1.00 0.32 C ATOM 1924 C TYR A 131 5.877 -18.095 -1.055 1.00 0.30 C ATOM 1925 O TYR A 131 5.044 -18.966 -0.805 1.00 0.32 O ATOM 1926 CB TYR A 131 7.410 -19.709 -2.246 1.00 0.36 C ATOM 1927 CG TYR A 131 6.836 -19.531 -3.639 1.00 0.45 C ATOM 1928 CD1 TYR A 131 5.466 -19.415 -3.829 1.00 1.00 C ATOM 1929 CD2 TYR A 131 7.658 -19.469 -4.760 1.00 0.78 C ATOM 1930 CE1 TYR A 131 4.932 -19.240 -5.091 1.00 1.14 C ATOM 1931 CE2 TYR A 131 7.131 -19.294 -6.024 1.00 0.87 C ATOM 1932 CZ TYR A 131 5.799 -19.222 -6.203 1.00 0.81 C ATOM 1933 OH TYR A 131 5.235 -19.009 -7.439 1.00 1.00 O ATOM 0 H TYR A 131 8.352 -19.675 0.026 1.00 0.33 H new ATOM 0 HA TYR A 131 7.828 -17.660 -1.861 1.00 0.32 H new ATOM 0 HB2 TYR A 131 8.456 -20.000 -2.336 1.00 0.36 H new ATOM 0 HB3 TYR A 131 6.890 -20.534 -1.759 1.00 0.36 H new ATOM 0 HD1 TYR A 131 4.806 -19.462 -2.975 1.00 1.00 H new ATOM 0 HD2 TYR A 131 8.727 -19.559 -4.639 1.00 0.78 H new ATOM 0 HE1 TYR A 131 3.867 -19.119 -5.224 1.00 1.14 H new ATOM 0 HE2 TYR A 131 7.792 -19.214 -6.875 1.00 0.87 H new ATOM 0 HH TYR A 131 4.270 -18.873 -7.339 1.00 1.00 H new ATOM 1943 N ILE A 132 5.602 -16.795 -1.004 1.00 0.27 N ATOM 1944 CA ILE A 132 4.251 -16.334 -0.753 1.00 0.26 C ATOM 1945 C ILE A 132 3.377 -16.770 -1.931 1.00 0.25 C ATOM 1946 O ILE A 132 3.705 -16.472 -3.078 1.00 0.25 O ATOM 1947 CB ILE A 132 4.155 -14.783 -0.610 1.00 0.25 C ATOM 1948 CG1 ILE A 132 4.674 -14.210 0.728 1.00 0.39 C ATOM 1949 CG2 ILE A 132 2.711 -14.367 -0.745 1.00 0.26 C ATOM 1950 CD1 ILE A 132 5.446 -15.149 1.607 1.00 0.23 C ATOM 0 H ILE A 132 6.291 -16.054 -1.132 1.00 0.27 H new ATOM 0 HA ILE A 132 3.919 -16.767 0.191 1.00 0.26 H new ATOM 0 HB ILE A 132 4.797 -14.385 -1.396 1.00 0.25 H new ATOM 0 HG12 ILE A 132 5.308 -13.351 0.508 1.00 0.39 H new ATOM 0 HG13 ILE A 132 3.820 -13.839 1.294 1.00 0.39 H new ATOM 0 HG21 ILE A 132 2.634 -13.284 -0.646 1.00 0.26 H new ATOM 0 HG22 ILE A 132 2.335 -14.670 -1.722 1.00 0.26 H new ATOM 0 HG23 ILE A 132 2.120 -14.846 0.036 1.00 0.26 H new ATOM 0 HD11 ILE A 132 5.754 -14.628 2.514 1.00 0.23 H new ATOM 0 HD12 ILE A 132 4.817 -15.999 1.873 1.00 0.23 H new ATOM 0 HD13 ILE A 132 6.328 -15.503 1.074 1.00 0.23 H new ATOM 1962 N PRO A 133 2.278 -17.501 -1.664 1.00 0.27 N ATOM 1963 CA PRO A 133 1.371 -17.974 -2.716 1.00 0.28 C ATOM 1964 C PRO A 133 0.948 -16.853 -3.664 1.00 0.26 C ATOM 1965 O PRO A 133 0.737 -15.710 -3.237 1.00 0.26 O ATOM 1966 CB PRO A 133 0.163 -18.495 -1.935 1.00 0.34 C ATOM 1967 CG PRO A 133 0.716 -18.892 -0.610 1.00 0.61 C ATOM 1968 CD PRO A 133 1.838 -17.930 -0.322 1.00 0.31 C ATOM 0 HA PRO A 133 1.841 -18.724 -3.352 1.00 0.28 H new ATOM 0 HB2 PRO A 133 -0.603 -17.727 -1.831 1.00 0.34 H new ATOM 0 HB3 PRO A 133 -0.301 -19.342 -2.441 1.00 0.34 H new ATOM 0 HG2 PRO A 133 -0.050 -18.840 0.164 1.00 0.61 H new ATOM 0 HG3 PRO A 133 1.079 -19.920 -0.631 1.00 0.61 H new ATOM 0 HD2 PRO A 133 1.499 -17.086 0.278 1.00 0.31 H new ATOM 0 HD3 PRO A 133 2.646 -18.410 0.231 1.00 0.31 H new ATOM 1976 N PRO A 134 0.849 -17.155 -4.968 1.00 0.27 N ATOM 1977 CA PRO A 134 0.401 -16.189 -5.967 1.00 0.25 C ATOM 1978 C PRO A 134 -0.919 -15.546 -5.589 1.00 0.27 C ATOM 1979 O PRO A 134 -1.859 -16.228 -5.181 1.00 0.32 O ATOM 1980 CB PRO A 134 0.243 -17.018 -7.238 1.00 0.29 C ATOM 1981 CG PRO A 134 1.170 -18.164 -7.055 1.00 0.52 C ATOM 1982 CD PRO A 134 1.190 -18.454 -5.577 1.00 0.33 C ATOM 0 HA PRO A 134 1.106 -15.364 -6.073 1.00 0.25 H new ATOM 0 HB2 PRO A 134 -0.785 -17.356 -7.365 1.00 0.29 H new ATOM 0 HB3 PRO A 134 0.500 -16.438 -8.124 1.00 0.29 H new ATOM 0 HG2 PRO A 134 0.831 -19.033 -7.618 1.00 0.52 H new ATOM 0 HG3 PRO A 134 2.168 -17.919 -7.418 1.00 0.52 H new ATOM 0 HD2 PRO A 134 0.468 -19.225 -5.309 1.00 0.33 H new ATOM 0 HD3 PRO A 134 2.168 -18.806 -5.250 1.00 0.33 H new ATOM 1990 N HIS A 135 -0.953 -14.224 -5.701 1.00 0.26 N ATOM 1991 CA HIS A 135 -2.160 -13.431 -5.441 1.00 0.31 C ATOM 1992 C HIS A 135 -2.510 -13.347 -3.961 1.00 0.32 C ATOM 1993 O HIS A 135 -3.589 -12.872 -3.610 1.00 0.44 O ATOM 1994 CB HIS A 135 -3.372 -13.986 -6.195 1.00 0.41 C ATOM 1995 CG HIS A 135 -3.682 -13.287 -7.478 1.00 0.87 C ATOM 1996 ND1 HIS A 135 -4.814 -12.529 -7.658 1.00 1.81 N ATOM 1997 CD2 HIS A 135 -3.027 -13.266 -8.657 1.00 1.64 C ATOM 1998 CE1 HIS A 135 -4.845 -12.072 -8.890 1.00 2.38 C ATOM 1999 NE2 HIS A 135 -3.771 -12.506 -9.527 1.00 2.25 N ATOM 0 H HIS A 135 -0.145 -13.665 -5.975 1.00 0.26 H new ATOM 0 HA HIS A 135 -1.925 -12.428 -5.798 1.00 0.31 H new ATOM 0 HB2 HIS A 135 -3.200 -15.042 -6.404 1.00 0.41 H new ATOM 0 HB3 HIS A 135 -4.245 -13.928 -5.545 1.00 0.41 H new ATOM 0 HD2 HIS A 135 -2.090 -13.756 -8.877 1.00 1.64 H new ATOM 0 HE1 HIS A 135 -5.618 -11.447 -9.311 1.00 2.38 H new ATOM 0 HE2 HIS A 135 -3.535 -12.310 -10.500 1.00 2.25 H new ATOM 2008 N ALA A 136 -1.627 -13.810 -3.086 1.00 0.24 N ATOM 2009 CA ALA A 136 -1.865 -13.663 -1.660 1.00 0.24 C ATOM 2010 C ALA A 136 -1.634 -12.217 -1.263 1.00 0.21 C ATOM 2011 O ALA A 136 -0.560 -11.669 -1.502 1.00 0.22 O ATOM 2012 CB ALA A 136 -0.973 -14.593 -0.855 1.00 0.26 C ATOM 0 H ALA A 136 -0.757 -14.281 -3.333 1.00 0.24 H new ATOM 0 HA ALA A 136 -2.897 -13.937 -1.443 1.00 0.24 H new ATOM 0 HB1 ALA A 136 -1.174 -14.460 0.208 1.00 0.26 H new ATOM 0 HB2 ALA A 136 -1.177 -15.626 -1.136 1.00 0.26 H new ATOM 0 HB3 ALA A 136 0.072 -14.361 -1.058 1.00 0.26 H new ATOM 2018 N ALA A 137 -2.630 -11.594 -0.663 1.00 0.18 N ATOM 2019 CA ALA A 137 -2.538 -10.177 -0.375 1.00 0.19 C ATOM 2020 C ALA A 137 -1.581 -9.952 0.789 1.00 0.16 C ATOM 2021 O ALA A 137 -1.848 -10.347 1.922 1.00 0.20 O ATOM 2022 CB ALA A 137 -3.913 -9.585 -0.084 1.00 0.22 C ATOM 0 H ALA A 137 -3.500 -12.039 -0.369 1.00 0.18 H new ATOM 0 HA ALA A 137 -2.147 -9.663 -1.253 1.00 0.19 H new ATOM 0 HB1 ALA A 137 -3.813 -8.521 0.129 1.00 0.22 H new ATOM 0 HB2 ALA A 137 -4.559 -9.723 -0.951 1.00 0.22 H new ATOM 0 HB3 ALA A 137 -4.351 -10.088 0.778 1.00 0.22 H new ATOM 2028 N LEU A 138 -0.457 -9.335 0.489 1.00 0.13 N ATOM 2029 CA LEU A 138 0.606 -9.157 1.455 1.00 0.12 C ATOM 2030 C LEU A 138 0.409 -7.867 2.235 1.00 0.13 C ATOM 2031 O LEU A 138 0.174 -6.814 1.645 1.00 0.15 O ATOM 2032 CB LEU A 138 1.951 -9.123 0.734 1.00 0.13 C ATOM 2033 CG LEU A 138 2.986 -10.079 1.300 1.00 0.15 C ATOM 2034 CD1 LEU A 138 2.455 -11.492 1.276 1.00 0.22 C ATOM 2035 CD2 LEU A 138 4.287 -9.992 0.530 1.00 0.19 C ATOM 0 H LEU A 138 -0.255 -8.943 -0.431 1.00 0.13 H new ATOM 0 HA LEU A 138 0.587 -9.992 2.155 1.00 0.12 H new ATOM 0 HB2 LEU A 138 1.792 -9.359 -0.318 1.00 0.13 H new ATOM 0 HB3 LEU A 138 2.348 -8.109 0.777 1.00 0.13 H new ATOM 0 HG LEU A 138 3.186 -9.793 2.332 1.00 0.15 H new ATOM 0 HD11 LEU A 138 3.205 -12.170 1.684 1.00 0.22 H new ATOM 0 HD12 LEU A 138 1.548 -11.550 1.878 1.00 0.22 H new ATOM 0 HD13 LEU A 138 2.228 -11.778 0.249 1.00 0.22 H new ATOM 0 HD21 LEU A 138 5.010 -10.687 0.957 1.00 0.19 H new ATOM 0 HD22 LEU A 138 4.110 -10.249 -0.514 1.00 0.19 H new ATOM 0 HD23 LEU A 138 4.679 -8.977 0.592 1.00 0.19 H new ATOM 2047 N CYS A 139 0.514 -7.935 3.551 1.00 0.13 N ATOM 2048 CA CYS A 139 0.372 -6.748 4.366 1.00 0.14 C ATOM 2049 C CYS A 139 1.667 -6.451 5.104 1.00 0.13 C ATOM 2050 O CYS A 139 1.978 -7.048 6.130 1.00 0.14 O ATOM 2051 CB CYS A 139 -0.811 -6.897 5.322 1.00 0.18 C ATOM 2052 SG CYS A 139 -0.753 -8.325 6.422 1.00 1.20 S ATOM 0 H CYS A 139 0.696 -8.793 4.071 1.00 0.13 H new ATOM 0 HA CYS A 139 0.164 -5.895 3.720 1.00 0.14 H new ATOM 0 HB2 CYS A 139 -0.878 -5.995 5.931 1.00 0.18 H new ATOM 0 HB3 CYS A 139 -1.726 -6.953 4.732 1.00 0.18 H new ATOM 0 HG CYS A 139 -1.454 -9.294 5.913 1.00 1.20 H new ATOM 2058 N LEU A 140 2.417 -5.511 4.569 1.00 0.13 N ATOM 2059 CA LEU A 140 3.748 -5.221 5.062 1.00 0.14 C ATOM 2060 C LEU A 140 3.798 -3.883 5.771 1.00 0.13 C ATOM 2061 O LEU A 140 3.283 -2.883 5.280 1.00 0.12 O ATOM 2062 CB LEU A 140 4.752 -5.231 3.913 1.00 0.17 C ATOM 2063 CG LEU A 140 4.366 -4.397 2.695 1.00 0.17 C ATOM 2064 CD1 LEU A 140 5.558 -3.576 2.245 1.00 0.26 C ATOM 2065 CD2 LEU A 140 3.886 -5.290 1.562 1.00 0.32 C ATOM 0 H LEU A 140 2.124 -4.929 3.784 1.00 0.13 H new ATOM 0 HA LEU A 140 4.010 -5.998 5.780 1.00 0.14 H new ATOM 0 HB2 LEU A 140 5.710 -4.872 4.288 1.00 0.17 H new ATOM 0 HB3 LEU A 140 4.901 -6.262 3.593 1.00 0.17 H new ATOM 0 HG LEU A 140 3.550 -3.729 2.970 1.00 0.17 H new ATOM 0 HD11 LEU A 140 5.282 -2.980 1.375 1.00 0.26 H new ATOM 0 HD12 LEU A 140 5.870 -2.915 3.053 1.00 0.26 H new ATOM 0 HD13 LEU A 140 6.380 -4.242 1.983 1.00 0.26 H new ATOM 0 HD21 LEU A 140 3.616 -4.675 0.704 1.00 0.32 H new ATOM 0 HD22 LEU A 140 4.682 -5.978 1.279 1.00 0.32 H new ATOM 0 HD23 LEU A 140 3.015 -5.858 1.890 1.00 0.32 H new ATOM 2077 N GLU A 141 4.423 -3.878 6.926 1.00 0.14 N ATOM 2078 CA GLU A 141 4.605 -2.663 7.692 1.00 0.13 C ATOM 2079 C GLU A 141 6.006 -2.112 7.435 1.00 0.12 C ATOM 2080 O GLU A 141 7.000 -2.709 7.851 1.00 0.15 O ATOM 2081 CB GLU A 141 4.374 -2.977 9.170 1.00 0.18 C ATOM 2082 CG GLU A 141 4.601 -1.823 10.128 1.00 0.26 C ATOM 2083 CD GLU A 141 4.225 -2.212 11.549 1.00 0.30 C ATOM 2084 OE1 GLU A 141 4.816 -3.174 12.088 1.00 1.00 O ATOM 2085 OE2 GLU A 141 3.349 -1.542 12.136 1.00 1.05 O ATOM 0 H GLU A 141 4.819 -4.711 7.361 1.00 0.14 H new ATOM 0 HA GLU A 141 3.889 -1.898 7.391 1.00 0.13 H new ATOM 0 HB2 GLU A 141 3.350 -3.331 9.292 1.00 0.18 H new ATOM 0 HB3 GLU A 141 5.032 -3.798 9.456 1.00 0.18 H new ATOM 0 HG2 GLU A 141 5.647 -1.519 10.095 1.00 0.26 H new ATOM 0 HG3 GLU A 141 4.009 -0.963 9.814 1.00 0.26 H new ATOM 2092 N VAL A 142 6.079 -1.001 6.715 1.00 0.12 N ATOM 2093 CA VAL A 142 7.347 -0.439 6.291 1.00 0.12 C ATOM 2094 C VAL A 142 7.638 0.907 6.954 1.00 0.12 C ATOM 2095 O VAL A 142 6.903 1.882 6.781 1.00 0.15 O ATOM 2096 CB VAL A 142 7.415 -0.280 4.755 1.00 0.14 C ATOM 2097 CG1 VAL A 142 7.847 -1.581 4.112 1.00 0.19 C ATOM 2098 CG2 VAL A 142 6.070 0.153 4.191 1.00 0.19 C ATOM 0 H VAL A 142 5.264 -0.469 6.411 1.00 0.12 H new ATOM 0 HA VAL A 142 8.110 -1.149 6.610 1.00 0.12 H new ATOM 0 HB VAL A 142 8.149 0.493 4.529 1.00 0.14 H new ATOM 0 HG11 VAL A 142 7.891 -1.455 3.030 1.00 0.19 H new ATOM 0 HG12 VAL A 142 8.832 -1.862 4.485 1.00 0.19 H new ATOM 0 HG13 VAL A 142 7.130 -2.364 4.357 1.00 0.19 H new ATOM 0 HG21 VAL A 142 6.146 0.257 3.109 1.00 0.19 H new ATOM 0 HG22 VAL A 142 5.316 -0.597 4.431 1.00 0.19 H new ATOM 0 HG23 VAL A 142 5.783 1.109 4.628 1.00 0.19 H new ATOM 2108 N THR A 143 8.703 0.927 7.742 1.00 0.13 N ATOM 2109 CA THR A 143 9.237 2.149 8.329 1.00 0.13 C ATOM 2110 C THR A 143 10.263 2.800 7.402 1.00 0.12 C ATOM 2111 O THR A 143 11.332 2.233 7.163 1.00 0.15 O ATOM 2112 CB THR A 143 9.940 1.849 9.667 1.00 0.17 C ATOM 2113 OG1 THR A 143 9.117 0.994 10.473 1.00 0.28 O ATOM 2114 CG2 THR A 143 10.231 3.139 10.422 1.00 0.22 C ATOM 0 H THR A 143 9.226 0.089 7.995 1.00 0.13 H new ATOM 0 HA THR A 143 8.394 2.822 8.485 1.00 0.13 H new ATOM 0 HB THR A 143 10.884 1.347 9.454 1.00 0.17 H new ATOM 0 HG1 THR A 143 9.572 0.807 11.321 1.00 0.28 H new ATOM 0 HG21 THR A 143 10.727 2.905 11.364 1.00 0.22 H new ATOM 0 HG22 THR A 143 10.878 3.776 9.819 1.00 0.22 H new ATOM 0 HG23 THR A 143 9.296 3.661 10.625 1.00 0.22 H new ATOM 2122 N LEU A 144 9.944 3.976 6.881 1.00 0.13 N ATOM 2123 CA LEU A 144 10.913 4.739 6.114 1.00 0.12 C ATOM 2124 C LEU A 144 11.762 5.549 7.070 1.00 0.12 C ATOM 2125 O LEU A 144 11.395 6.647 7.481 1.00 0.14 O ATOM 2126 CB LEU A 144 10.226 5.650 5.100 1.00 0.14 C ATOM 2127 CG LEU A 144 11.168 6.435 4.191 1.00 0.12 C ATOM 2128 CD1 LEU A 144 12.033 5.488 3.372 1.00 0.15 C ATOM 2129 CD2 LEU A 144 10.374 7.356 3.284 1.00 0.13 C ATOM 0 H LEU A 144 9.030 4.418 6.975 1.00 0.13 H new ATOM 0 HA LEU A 144 11.544 4.051 5.552 1.00 0.12 H new ATOM 0 HB2 LEU A 144 9.568 5.044 4.478 1.00 0.14 H new ATOM 0 HB3 LEU A 144 9.594 6.356 5.639 1.00 0.14 H new ATOM 0 HG LEU A 144 11.825 7.043 4.812 1.00 0.12 H new ATOM 0 HD11 LEU A 144 12.698 6.066 2.730 1.00 0.15 H new ATOM 0 HD12 LEU A 144 12.626 4.865 4.042 1.00 0.15 H new ATOM 0 HD13 LEU A 144 11.395 4.853 2.756 1.00 0.15 H new ATOM 0 HD21 LEU A 144 11.057 7.910 2.641 1.00 0.13 H new ATOM 0 HD22 LEU A 144 9.696 6.765 2.669 1.00 0.13 H new ATOM 0 HD23 LEU A 144 9.798 8.055 3.890 1.00 0.13 H new ATOM 2141 N LYS A 145 12.885 4.974 7.444 1.00 0.14 N ATOM 2142 CA LYS A 145 13.728 5.553 8.471 1.00 0.17 C ATOM 2143 C LYS A 145 14.688 6.565 7.873 1.00 0.16 C ATOM 2144 O LYS A 145 15.028 7.560 8.508 1.00 0.21 O ATOM 2145 CB LYS A 145 14.513 4.450 9.175 1.00 0.26 C ATOM 2146 CG LYS A 145 13.662 3.240 9.529 1.00 0.40 C ATOM 2147 CD LYS A 145 14.495 2.119 10.130 1.00 0.60 C ATOM 2148 CE LYS A 145 15.449 1.530 9.107 1.00 0.38 C ATOM 2149 NZ LYS A 145 16.439 0.611 9.734 1.00 1.08 N ATOM 0 H LYS A 145 13.238 4.102 7.051 1.00 0.14 H new ATOM 0 HA LYS A 145 13.092 6.066 9.193 1.00 0.17 H new ATOM 0 HB2 LYS A 145 15.335 4.132 8.534 1.00 0.26 H new ATOM 0 HB3 LYS A 145 14.956 4.853 10.086 1.00 0.26 H new ATOM 0 HG2 LYS A 145 12.887 3.535 10.236 1.00 0.40 H new ATOM 0 HG3 LYS A 145 13.156 2.877 8.634 1.00 0.40 H new ATOM 0 HD2 LYS A 145 15.060 2.499 10.981 1.00 0.60 H new ATOM 0 HD3 LYS A 145 13.837 1.337 10.509 1.00 0.60 H new ATOM 0 HE2 LYS A 145 14.881 0.989 8.350 1.00 0.38 H new ATOM 0 HE3 LYS A 145 15.975 2.336 8.595 1.00 0.38 H new ATOM 0 HZ1 LYS A 145 17.279 0.538 9.125 1.00 1.08 H new ATOM 0 HZ2 LYS A 145 16.717 0.983 10.665 1.00 1.08 H new ATOM 0 HZ3 LYS A 145 16.013 -0.331 9.851 1.00 1.08 H new ATOM 2163 N THR A 146 15.108 6.319 6.643 1.00 0.16 N ATOM 2164 CA THR A 146 16.130 7.140 6.018 1.00 0.19 C ATOM 2165 C THR A 146 15.957 7.178 4.506 1.00 0.17 C ATOM 2166 O THR A 146 15.510 6.205 3.901 1.00 0.16 O ATOM 2167 CB THR A 146 17.543 6.595 6.329 1.00 0.25 C ATOM 2168 OG1 THR A 146 17.649 6.245 7.716 1.00 0.25 O ATOM 2169 CG2 THR A 146 18.623 7.614 5.983 1.00 0.37 C ATOM 0 H THR A 146 14.758 5.559 6.059 1.00 0.16 H new ATOM 0 HA THR A 146 16.021 8.145 6.425 1.00 0.19 H new ATOM 0 HB THR A 146 17.693 5.708 5.714 1.00 0.25 H new ATOM 0 HG1 THR A 146 17.432 5.296 7.831 1.00 0.25 H new ATOM 0 HG21 THR A 146 19.603 7.198 6.214 1.00 0.37 H new ATOM 0 HG22 THR A 146 18.571 7.852 4.921 1.00 0.37 H new ATOM 0 HG23 THR A 146 18.467 8.521 6.566 1.00 0.37 H new ATOM 2177 N ALA A 147 16.312 8.307 3.910 1.00 0.20 N ATOM 2178 CA ALA A 147 16.374 8.429 2.465 1.00 0.19 C ATOM 2179 C ALA A 147 17.670 9.125 2.078 1.00 0.22 C ATOM 2180 O ALA A 147 17.989 10.192 2.609 1.00 0.25 O ATOM 2181 CB ALA A 147 15.174 9.205 1.944 1.00 0.21 C ATOM 0 H ALA A 147 16.563 9.158 4.413 1.00 0.20 H new ATOM 0 HA ALA A 147 16.351 7.436 2.017 1.00 0.19 H new ATOM 0 HB1 ALA A 147 15.237 9.287 0.859 1.00 0.21 H new ATOM 0 HB2 ALA A 147 14.257 8.683 2.216 1.00 0.21 H new ATOM 0 HB3 ALA A 147 15.167 10.203 2.383 1.00 0.21 H new ATOM 2187 N VAL A 148 18.423 8.526 1.167 1.00 0.24 N ATOM 2188 CA VAL A 148 19.698 9.076 0.771 1.00 0.31 C ATOM 2189 C VAL A 148 19.744 9.249 -0.724 1.00 0.34 C ATOM 2190 O VAL A 148 19.520 8.299 -1.468 1.00 0.36 O ATOM 2191 CB VAL A 148 20.865 8.154 1.130 1.00 0.42 C ATOM 2192 CG1 VAL A 148 22.088 8.972 1.454 1.00 0.92 C ATOM 2193 CG2 VAL A 148 20.513 7.203 2.268 1.00 0.75 C ATOM 0 H VAL A 148 18.168 7.660 0.692 1.00 0.24 H new ATOM 0 HA VAL A 148 19.796 10.024 1.299 1.00 0.31 H new ATOM 0 HB VAL A 148 21.082 7.531 0.262 1.00 0.42 H new ATOM 0 HG11 VAL A 148 22.913 8.307 1.708 1.00 0.92 H new ATOM 0 HG12 VAL A 148 22.362 9.576 0.589 1.00 0.92 H new ATOM 0 HG13 VAL A 148 21.875 9.626 2.300 1.00 0.92 H new ATOM 0 HG21 VAL A 148 21.370 6.567 2.489 1.00 0.75 H new ATOM 0 HG22 VAL A 148 20.250 7.779 3.155 1.00 0.75 H new ATOM 0 HG23 VAL A 148 19.667 6.582 1.974 1.00 0.75 H new ATOM 2203 N ASP A 149 20.039 10.443 -1.170 1.00 0.44 N ATOM 2204 CA ASP A 149 20.238 10.663 -2.571 1.00 0.52 C ATOM 2205 C ASP A 149 21.539 10.014 -3.019 1.00 0.66 C ATOM 2206 O ASP A 149 22.619 10.363 -2.545 1.00 0.79 O ATOM 2207 CB ASP A 149 20.240 12.151 -2.881 1.00 0.68 C ATOM 2208 CG ASP A 149 21.050 12.974 -1.895 1.00 1.41 C ATOM 2209 OD1 ASP A 149 20.591 13.153 -0.744 1.00 2.27 O ATOM 2210 OD2 ASP A 149 22.134 13.470 -2.269 1.00 1.61 O ATOM 0 H ASP A 149 20.145 11.271 -0.584 1.00 0.44 H new ATOM 0 HA ASP A 149 19.415 10.206 -3.121 1.00 0.52 H new ATOM 0 HB2 ASP A 149 20.638 12.305 -3.884 1.00 0.68 H new ATOM 0 HB3 ASP A 149 19.212 12.514 -2.887 1.00 0.68 H new ATOM 2215 N LEU A 150 21.414 9.043 -3.913 1.00 0.68 N ATOM 2216 CA LEU A 150 22.561 8.294 -4.405 1.00 0.89 C ATOM 2217 C LEU A 150 22.311 7.890 -5.855 1.00 0.96 C ATOM 2218 O LEU A 150 22.867 6.914 -6.351 1.00 1.38 O ATOM 2219 CB LEU A 150 22.785 7.054 -3.527 1.00 1.00 C ATOM 2220 CG LEU A 150 24.243 6.716 -3.175 1.00 1.09 C ATOM 2221 CD1 LEU A 150 25.065 6.409 -4.419 1.00 1.81 C ATOM 2222 CD2 LEU A 150 24.885 7.846 -2.384 1.00 1.97 C ATOM 0 H LEU A 150 20.522 8.754 -4.315 1.00 0.68 H new ATOM 0 HA LEU A 150 23.457 8.914 -4.360 1.00 0.89 H new ATOM 0 HB2 LEU A 150 22.233 7.190 -2.597 1.00 1.00 H new ATOM 0 HB3 LEU A 150 22.348 6.194 -4.034 1.00 1.00 H new ATOM 0 HG LEU A 150 24.227 5.820 -2.555 1.00 1.09 H new ATOM 0 HD11 LEU A 150 26.089 6.175 -4.130 1.00 1.81 H new ATOM 0 HD12 LEU A 150 24.631 5.556 -4.940 1.00 1.81 H new ATOM 0 HD13 LEU A 150 25.064 7.276 -5.079 1.00 1.81 H new ATOM 0 HD21 LEU A 150 25.916 7.584 -2.147 1.00 1.97 H new ATOM 0 HD22 LEU A 150 24.870 8.760 -2.978 1.00 1.97 H new ATOM 0 HD23 LEU A 150 24.329 8.005 -1.460 1.00 1.97 H new ATOM 2234 N GLU A 151 21.469 8.652 -6.535 1.00 0.72 N ATOM 2235 CA GLU A 151 21.167 8.369 -7.927 1.00 0.79 C ATOM 2236 C GLU A 151 22.121 9.153 -8.811 1.00 1.44 C ATOM 2237 O GLU A 151 22.145 10.385 -8.778 1.00 2.14 O ATOM 2238 CB GLU A 151 19.711 8.712 -8.258 1.00 0.57 C ATOM 2239 CG GLU A 151 19.214 8.086 -9.557 1.00 0.60 C ATOM 2240 CD GLU A 151 19.231 9.054 -10.728 1.00 0.92 C ATOM 2241 OE1 GLU A 151 20.318 9.294 -11.297 1.00 1.57 O ATOM 2242 OE2 GLU A 151 18.151 9.584 -11.080 1.00 1.32 O ATOM 0 H GLU A 151 20.987 9.464 -6.149 1.00 0.72 H new ATOM 0 HA GLU A 151 21.297 7.302 -8.110 1.00 0.79 H new ATOM 0 HB2 GLU A 151 19.074 8.381 -7.438 1.00 0.57 H new ATOM 0 HB3 GLU A 151 19.608 9.795 -8.324 1.00 0.57 H new ATOM 0 HG2 GLU A 151 19.834 7.222 -9.798 1.00 0.60 H new ATOM 0 HG3 GLU A 151 18.198 7.719 -9.411 1.00 0.60 H new ATOM 2249 N HIS A 152 22.938 8.436 -9.556 1.00 2.00 N ATOM 2250 CA HIS A 152 23.869 9.059 -10.467 1.00 2.74 C ATOM 2251 C HIS A 152 23.827 8.328 -11.798 1.00 3.34 C ATOM 2252 O HIS A 152 24.705 7.517 -12.109 1.00 4.01 O ATOM 2253 CB HIS A 152 25.281 9.060 -9.873 1.00 3.58 C ATOM 2254 CG HIS A 152 26.209 10.037 -10.524 1.00 4.23 C ATOM 2255 ND1 HIS A 152 26.017 11.399 -10.476 1.00 4.97 N ATOM 2256 CD2 HIS A 152 27.342 9.848 -11.238 1.00 4.78 C ATOM 2257 CE1 HIS A 152 26.986 12.002 -11.132 1.00 5.79 C ATOM 2258 NE2 HIS A 152 27.807 11.086 -11.605 1.00 5.71 N ATOM 0 H HIS A 152 22.974 7.417 -9.546 1.00 2.00 H new ATOM 0 HA HIS A 152 23.585 10.099 -10.629 1.00 2.74 H new ATOM 0 HB2 HIS A 152 25.217 9.287 -8.809 1.00 3.58 H new ATOM 0 HB3 HIS A 152 25.703 8.059 -9.961 1.00 3.58 H new ATOM 0 HD2 HIS A 152 27.797 8.898 -11.476 1.00 4.78 H new ATOM 0 HE1 HIS A 152 27.091 13.069 -11.261 1.00 5.79 H new ATOM 0 HE2 HIS A 152 28.648 11.267 -12.153 1.00 5.71 H new ATOM 2267 N HIS A 153 22.751 8.582 -12.538 1.00 3.70 N ATOM 2268 CA HIS A 153 22.509 7.960 -13.835 1.00 4.77 C ATOM 2269 C HIS A 153 23.712 8.115 -14.766 1.00 5.09 C ATOM 2270 O HIS A 153 24.026 9.218 -15.220 1.00 5.37 O ATOM 2271 CB HIS A 153 21.272 8.590 -14.481 1.00 5.63 C ATOM 2272 CG HIS A 153 20.678 7.779 -15.593 1.00 6.19 C ATOM 2273 ND1 HIS A 153 19.395 7.290 -15.544 1.00 6.78 N ATOM 2274 CD2 HIS A 153 21.180 7.392 -16.789 1.00 6.64 C ATOM 2275 CE1 HIS A 153 19.133 6.638 -16.658 1.00 7.48 C ATOM 2276 NE2 HIS A 153 20.199 6.680 -17.435 1.00 7.41 N ATOM 0 H HIS A 153 22.017 9.230 -12.252 1.00 3.70 H new ATOM 0 HA HIS A 153 22.345 6.894 -13.674 1.00 4.77 H new ATOM 0 HB2 HIS A 153 20.514 8.743 -13.713 1.00 5.63 H new ATOM 0 HB3 HIS A 153 21.539 9.574 -14.867 1.00 5.63 H new ATOM 0 HD2 HIS A 153 22.170 7.604 -17.166 1.00 6.64 H new ATOM 0 HE1 HIS A 153 18.200 6.150 -16.896 1.00 7.48 H new ATOM 0 HE2 HIS A 153 20.281 6.256 -18.359 1.00 7.41 H new ATOM 2285 N HIS A 154 24.380 7.004 -15.034 1.00 5.42 N ATOM 2286 CA HIS A 154 25.500 6.974 -15.963 1.00 6.05 C ATOM 2287 C HIS A 154 25.371 5.745 -16.854 1.00 6.57 C ATOM 2288 O HIS A 154 25.169 5.863 -18.056 1.00 7.00 O ATOM 2289 CB HIS A 154 26.843 6.957 -15.213 1.00 6.58 C ATOM 2290 CG HIS A 154 28.046 6.982 -16.113 1.00 7.19 C ATOM 2291 ND1 HIS A 154 28.856 8.087 -16.266 1.00 7.60 N ATOM 2292 CD2 HIS A 154 28.575 6.024 -16.906 1.00 7.78 C ATOM 2293 CE1 HIS A 154 29.824 7.806 -17.118 1.00 8.35 C ATOM 2294 NE2 HIS A 154 29.674 6.560 -17.517 1.00 8.46 N ATOM 0 H HIS A 154 24.162 6.100 -14.615 1.00 5.42 H new ATOM 0 HA HIS A 154 25.479 7.876 -16.575 1.00 6.05 H new ATOM 0 HB2 HIS A 154 26.885 7.816 -14.544 1.00 6.58 H new ATOM 0 HB3 HIS A 154 26.888 6.065 -14.589 1.00 6.58 H new ATOM 0 HD2 HIS A 154 28.199 5.020 -17.033 1.00 7.78 H new ATOM 0 HE1 HIS A 154 30.605 8.482 -17.434 1.00 8.35 H new ATOM 0 HE2 HIS A 154 30.281 6.073 -18.176 1.00 8.46 H new ATOM 2303 N HIS A 155 25.491 4.565 -16.254 1.00 6.86 N ATOM 2304 CA HIS A 155 25.291 3.318 -16.980 1.00 7.69 C ATOM 2305 C HIS A 155 24.936 2.207 -15.995 1.00 8.40 C ATOM 2306 O HIS A 155 25.137 1.022 -16.256 1.00 8.69 O ATOM 2307 CB HIS A 155 26.539 2.952 -17.789 1.00 7.95 C ATOM 2308 CG HIS A 155 26.223 2.190 -19.034 1.00 8.17 C ATOM 2309 ND1 HIS A 155 25.813 2.802 -20.197 1.00 8.40 N ATOM 2310 CD2 HIS A 155 26.241 0.863 -19.295 1.00 8.48 C ATOM 2311 CE1 HIS A 155 25.591 1.888 -21.117 1.00 8.78 C ATOM 2312 NE2 HIS A 155 25.842 0.704 -20.595 1.00 8.83 N ATOM 0 H HIS A 155 25.725 4.447 -15.268 1.00 6.86 H new ATOM 0 HA HIS A 155 24.468 3.445 -17.684 1.00 7.69 H new ATOM 0 HB2 HIS A 155 27.074 3.864 -18.053 1.00 7.95 H new ATOM 0 HB3 HIS A 155 27.208 2.359 -17.166 1.00 7.95 H new ATOM 0 HD2 HIS A 155 26.518 0.077 -18.608 1.00 8.48 H new ATOM 0 HE1 HIS A 155 25.260 2.076 -22.128 1.00 8.78 H new ATOM 0 HE2 HIS A 155 25.753 -0.188 -21.082 1.00 8.83 H new ATOM 2321 N HIS A 156 24.383 2.620 -14.866 1.00 8.92 N ATOM 2322 CA HIS A 156 23.933 1.709 -13.824 1.00 9.83 C ATOM 2323 C HIS A 156 22.513 2.114 -13.465 1.00 10.27 C ATOM 2324 O HIS A 156 22.192 2.343 -12.299 1.00 10.47 O ATOM 2325 CB HIS A 156 24.845 1.805 -12.591 1.00 10.32 C ATOM 2326 CG HIS A 156 24.696 0.666 -11.628 1.00 10.97 C ATOM 2327 ND1 HIS A 156 23.640 0.545 -10.748 1.00 11.47 N ATOM 2328 CD2 HIS A 156 25.494 -0.400 -11.402 1.00 11.42 C ATOM 2329 CE1 HIS A 156 23.798 -0.547 -10.026 1.00 12.17 C ATOM 2330 NE2 HIS A 156 24.913 -1.137 -10.407 1.00 12.15 N ATOM 0 H HIS A 156 24.232 3.604 -14.645 1.00 8.92 H new ATOM 0 HA HIS A 156 23.967 0.677 -14.173 1.00 9.83 H new ATOM 0 HB2 HIS A 156 25.882 1.853 -12.923 1.00 10.32 H new ATOM 0 HB3 HIS A 156 24.634 2.738 -12.069 1.00 10.32 H new ATOM 0 HD1 HIS A 156 22.860 1.198 -10.669 1.00 11.47 H new ATOM 0 HD2 HIS A 156 26.418 -0.628 -11.912 1.00 11.42 H new ATOM 0 HE1 HIS A 156 23.128 -0.898 -9.255 1.00 12.17 H new ATOM 2339 N HIS A 157 21.682 2.187 -14.501 1.00 10.63 N ATOM 2340 CA HIS A 157 20.402 2.887 -14.449 1.00 11.28 C ATOM 2341 C HIS A 157 20.657 4.382 -14.345 1.00 11.64 C ATOM 2342 O HIS A 157 19.837 5.083 -13.733 1.00 11.96 O ATOM 2343 CB HIS A 157 19.512 2.417 -13.287 1.00 11.62 C ATOM 2344 CG HIS A 157 18.827 1.111 -13.533 1.00 12.24 C ATOM 2345 ND1 HIS A 157 18.459 0.258 -12.518 1.00 12.87 N ATOM 2346 CD2 HIS A 157 18.412 0.523 -14.679 1.00 12.51 C ATOM 2347 CE1 HIS A 157 17.857 -0.795 -13.027 1.00 13.46 C ATOM 2348 NE2 HIS A 157 17.809 -0.662 -14.339 1.00 13.27 N ATOM 2349 OXT HIS A 157 21.703 4.837 -14.873 1.00 11.78 O ATOM 0 H HIS A 157 21.879 1.759 -15.406 1.00 10.63 H new ATOM 0 HA HIS A 157 19.860 2.656 -15.366 1.00 11.28 H new ATOM 0 HB2 HIS A 157 20.122 2.331 -12.388 1.00 11.62 H new ATOM 0 HB3 HIS A 157 18.758 3.179 -13.090 1.00 11.62 H new ATOM 0 HD1 HIS A 157 18.627 0.418 -11.525 1.00 12.87 H new ATOM 0 HD2 HIS A 157 18.533 0.915 -15.678 1.00 12.51 H new ATOM 0 HE1 HIS A 157 17.467 -1.630 -12.464 1.00 13.46 H new TER 2358 HIS A 157