USER MOD reduce.3.24.130724 H: found=0, std=0, add=1146, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 1141 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 77 THR OG1 : rot 91:sc= 1.22 USER MOD Set 1.2: A 79 THR OG1 : rot -14:sc= 1.63 USER MOD Set 2.1: A 52 MET CE :methyl -147:sc= -4.23! (180deg=-4.62!) USER MOD Set 2.2: A 54 MET CE :methyl 178:sc= -8.87! (180deg=-7.42!) USER MOD Set 2.3: A 93 THR OG1 : rot 80:sc= 0.382 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 SER OG : rot 180:sc= 0.014 USER MOD Single : A 8 SER OG : rot 43:sc= 0.692 USER MOD Single : A 9 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 18 THR OG1 : rot -89:sc= -2.99! USER MOD Single : A 39 ASN : amide:sc= -0.405 X(o=-0.4,f=0) USER MOD Single : A 42 ASN : amide:sc= -1.78 K(o=-1.8,f=-8.1!) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 50 GLN : amide:sc= -0.156 X(o=-0.16,f=-0.13) USER MOD Single : A 53 MET CE :methyl -175:sc= -4.65! (180deg=-4.77!) USER MOD Single : A 56 SER OG : rot 33:sc= -0.0377 USER MOD Single : A 66 HIS : no HD1:sc= -2.7! C(o=-2.7!,f=-6.2!) USER MOD Single : A 71 ASN : amide:sc= -2.22! C(o=-2.2!,f=-8.7!) USER MOD Single : A 72 CYS SG : rot 180:sc= 0 USER MOD Single : A 83 HIS : no HD1:sc= -4.1! C(o=-4.1!,f=-7!) USER MOD Single : A 98 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.019) USER MOD Single : A 123 HIS : no HE2:sc= -10.6! C(o=-11!,f=-17!) USER MOD Single : A 129 TYR OH : rot 180:sc= -0.271 USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 ASN : amide:sc= -0.219 K(o=-0.22,f=-1.8!) USER MOD Single : A 142 HIS :FLIP no HD1:sc=-0.00496 F(o=-0.52,f=-0.005) USER MOD Single : A 152 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 117.708 36.758 -12.573 1.00 0.00 N ATOM 2 CA MET A 1 118.899 35.858 -12.612 1.00 0.00 C ATOM 3 C MET A 1 118.649 34.699 -13.584 1.00 0.00 C ATOM 4 O MET A 1 117.615 34.061 -13.547 1.00 0.00 O ATOM 5 CB MET A 1 119.051 35.337 -11.177 1.00 0.00 C ATOM 6 CG MET A 1 120.506 35.486 -10.718 1.00 0.00 C ATOM 7 SD MET A 1 120.547 36.207 -9.057 1.00 0.00 S ATOM 8 CE MET A 1 121.065 34.716 -8.170 1.00 0.00 C ATOM 0 H1 MET A 1 117.886 37.541 -11.912 1.00 0.00 H new ATOM 0 H2 MET A 1 117.531 37.141 -13.524 1.00 0.00 H new ATOM 0 H3 MET A 1 116.876 36.220 -12.256 1.00 0.00 H new ATOM 0 HA MET A 1 119.797 36.372 -12.954 1.00 0.00 H new ATOM 0 HB2 MET A 1 118.391 35.890 -10.508 1.00 0.00 H new ATOM 0 HB3 MET A 1 118.750 34.290 -11.127 1.00 0.00 H new ATOM 0 HG2 MET A 1 120.999 34.514 -10.716 1.00 0.00 H new ATOM 0 HG3 MET A 1 121.055 36.120 -11.414 1.00 0.00 H new ATOM 0 HE1 MET A 1 121.155 34.938 -7.107 1.00 0.00 H new ATOM 0 HE2 MET A 1 120.324 33.930 -8.315 1.00 0.00 H new ATOM 0 HE3 MET A 1 122.029 34.381 -8.553 1.00 0.00 H new ATOM 20 N GLU A 2 119.586 34.423 -14.456 1.00 0.00 N ATOM 21 CA GLU A 2 119.396 33.307 -15.433 1.00 0.00 C ATOM 22 C GLU A 2 120.487 32.240 -15.247 1.00 0.00 C ATOM 23 O GLU A 2 121.621 32.448 -15.631 1.00 0.00 O ATOM 24 CB GLU A 2 119.517 33.963 -16.809 1.00 0.00 C ATOM 25 CG GLU A 2 118.907 33.043 -17.873 1.00 0.00 C ATOM 26 CD GLU A 2 117.608 33.655 -18.401 1.00 0.00 C ATOM 27 OE1 GLU A 2 117.678 34.706 -19.017 1.00 0.00 O ATOM 28 OE2 GLU A 2 116.564 33.062 -18.181 1.00 0.00 O ATOM 0 H GLU A 2 120.473 34.921 -14.534 1.00 0.00 H new ATOM 0 HA GLU A 2 118.438 32.804 -15.302 1.00 0.00 H new ATOM 0 HB2 GLU A 2 119.006 34.926 -16.810 1.00 0.00 H new ATOM 0 HB3 GLU A 2 120.564 34.158 -17.039 1.00 0.00 H new ATOM 0 HG2 GLU A 2 119.612 32.900 -18.692 1.00 0.00 H new ATOM 0 HG3 GLU A 2 118.710 32.059 -17.447 1.00 0.00 H new ATOM 35 N PRO A 3 120.110 31.127 -14.662 1.00 0.00 N ATOM 36 CA PRO A 3 121.080 30.024 -14.428 1.00 0.00 C ATOM 37 C PRO A 3 121.457 29.333 -15.743 1.00 0.00 C ATOM 38 O PRO A 3 120.619 29.076 -16.586 1.00 0.00 O ATOM 39 CB PRO A 3 120.320 29.066 -13.515 1.00 0.00 C ATOM 40 CG PRO A 3 118.877 29.335 -13.790 1.00 0.00 C ATOM 41 CD PRO A 3 118.767 30.791 -14.166 1.00 0.00 C ATOM 0 HA PRO A 3 122.018 30.373 -13.996 1.00 0.00 H new ATOM 0 HB2 PRO A 3 120.576 28.029 -13.730 1.00 0.00 H new ATOM 0 HB3 PRO A 3 120.562 29.243 -12.467 1.00 0.00 H new ATOM 0 HG2 PRO A 3 118.513 28.699 -14.597 1.00 0.00 H new ATOM 0 HG3 PRO A 3 118.269 29.116 -12.912 1.00 0.00 H new ATOM 0 HD2 PRO A 3 118.007 30.950 -14.931 1.00 0.00 H new ATOM 0 HD3 PRO A 3 118.491 31.406 -13.309 1.00 0.00 H new ATOM 49 N ALA A 4 122.718 29.024 -15.917 1.00 0.00 N ATOM 50 CA ALA A 4 123.176 28.339 -17.167 1.00 0.00 C ATOM 51 C ALA A 4 124.705 28.261 -17.185 1.00 0.00 C ATOM 52 O ALA A 4 125.383 29.262 -17.305 1.00 0.00 O ATOM 53 CB ALA A 4 122.673 29.206 -18.326 1.00 0.00 C ATOM 0 H ALA A 4 123.457 29.218 -15.241 1.00 0.00 H new ATOM 0 HA ALA A 4 122.794 27.320 -17.237 1.00 0.00 H new ATOM 0 HB1 ALA A 4 122.976 28.759 -19.273 1.00 0.00 H new ATOM 0 HB2 ALA A 4 121.586 29.271 -18.287 1.00 0.00 H new ATOM 0 HB3 ALA A 4 123.099 30.206 -18.244 1.00 0.00 H new ATOM 59 N ALA A 5 125.255 27.080 -17.064 1.00 0.00 N ATOM 60 CA ALA A 5 126.741 26.946 -17.073 1.00 0.00 C ATOM 61 C ALA A 5 127.142 25.515 -17.443 1.00 0.00 C ATOM 62 O ALA A 5 127.845 24.846 -16.710 1.00 0.00 O ATOM 63 CB ALA A 5 127.178 27.283 -15.645 1.00 0.00 C ATOM 0 H ALA A 5 124.740 26.206 -16.960 1.00 0.00 H new ATOM 0 HA ALA A 5 127.212 27.602 -17.805 1.00 0.00 H new ATOM 0 HB1 ALA A 5 128.263 27.207 -15.569 1.00 0.00 H new ATOM 0 HB2 ALA A 5 126.867 28.299 -15.400 1.00 0.00 H new ATOM 0 HB3 ALA A 5 126.716 26.584 -14.948 1.00 0.00 H new ATOM 69 N GLY A 6 126.699 25.043 -18.577 1.00 0.00 N ATOM 70 CA GLY A 6 127.049 23.656 -19.000 1.00 0.00 C ATOM 71 C GLY A 6 126.164 23.243 -20.176 1.00 0.00 C ATOM 72 O GLY A 6 125.148 23.854 -20.440 1.00 0.00 O ATOM 0 H GLY A 6 126.109 25.559 -19.230 1.00 0.00 H new ATOM 0 HA2 GLY A 6 128.099 23.606 -19.286 1.00 0.00 H new ATOM 0 HA3 GLY A 6 126.912 22.965 -18.168 1.00 0.00 H new ATOM 76 N SER A 7 126.541 22.212 -20.884 1.00 0.00 N ATOM 77 CA SER A 7 125.718 21.761 -22.044 1.00 0.00 C ATOM 78 C SER A 7 124.742 20.657 -21.617 1.00 0.00 C ATOM 79 O SER A 7 123.963 20.169 -22.412 1.00 0.00 O ATOM 80 CB SER A 7 126.725 21.225 -23.059 1.00 0.00 C ATOM 81 OG SER A 7 127.495 20.192 -22.459 1.00 0.00 O ATOM 0 H SER A 7 127.383 21.663 -20.710 1.00 0.00 H new ATOM 0 HA SER A 7 125.113 22.569 -22.455 1.00 0.00 H new ATOM 0 HB2 SER A 7 126.205 20.843 -23.937 1.00 0.00 H new ATOM 0 HB3 SER A 7 127.377 22.029 -23.400 1.00 0.00 H new ATOM 0 HG SER A 7 128.141 19.845 -23.110 1.00 0.00 H new ATOM 87 N SER A 8 124.775 20.261 -20.370 1.00 0.00 N ATOM 88 CA SER A 8 123.844 19.194 -19.903 1.00 0.00 C ATOM 89 C SER A 8 122.476 19.801 -19.576 1.00 0.00 C ATOM 90 O SER A 8 122.302 20.448 -18.561 1.00 0.00 O ATOM 91 CB SER A 8 124.491 18.622 -18.642 1.00 0.00 C ATOM 92 OG SER A 8 124.804 19.688 -17.754 1.00 0.00 O ATOM 0 H SER A 8 125.405 20.630 -19.658 1.00 0.00 H new ATOM 0 HA SER A 8 123.683 18.425 -20.659 1.00 0.00 H new ATOM 0 HB2 SER A 8 123.814 17.917 -18.159 1.00 0.00 H new ATOM 0 HB3 SER A 8 125.395 18.070 -18.900 1.00 0.00 H new ATOM 0 HG SER A 8 124.055 20.319 -17.724 1.00 0.00 H new ATOM 98 N MET A 9 121.509 19.603 -20.433 1.00 0.00 N ATOM 99 CA MET A 9 120.148 20.171 -20.185 1.00 0.00 C ATOM 100 C MET A 9 119.623 19.739 -18.813 1.00 0.00 C ATOM 101 O MET A 9 118.993 18.708 -18.677 1.00 0.00 O ATOM 102 CB MET A 9 119.270 19.596 -21.296 1.00 0.00 C ATOM 103 CG MET A 9 118.162 20.593 -21.641 1.00 0.00 C ATOM 104 SD MET A 9 117.255 20.011 -23.095 1.00 0.00 S ATOM 105 CE MET A 9 115.819 19.350 -22.215 1.00 0.00 C ATOM 0 H MET A 9 121.602 19.070 -21.298 1.00 0.00 H new ATOM 0 HA MET A 9 120.156 21.261 -20.188 1.00 0.00 H new ATOM 0 HB2 MET A 9 119.874 19.387 -22.179 1.00 0.00 H new ATOM 0 HB3 MET A 9 118.835 18.649 -20.976 1.00 0.00 H new ATOM 0 HG2 MET A 9 117.482 20.704 -20.796 1.00 0.00 H new ATOM 0 HG3 MET A 9 118.591 21.576 -21.836 1.00 0.00 H new ATOM 0 HE1 MET A 9 115.114 18.931 -22.933 1.00 0.00 H new ATOM 0 HE2 MET A 9 116.142 18.570 -21.526 1.00 0.00 H new ATOM 0 HE3 MET A 9 115.335 20.150 -21.655 1.00 0.00 H new ATOM 115 N GLU A 10 119.880 20.523 -17.795 1.00 0.00 N ATOM 116 CA GLU A 10 119.401 20.170 -16.422 1.00 0.00 C ATOM 117 C GLU A 10 119.767 18.719 -16.080 1.00 0.00 C ATOM 118 O GLU A 10 119.014 17.809 -16.367 1.00 0.00 O ATOM 119 CB GLU A 10 117.881 20.338 -16.472 1.00 0.00 C ATOM 120 CG GLU A 10 117.535 21.802 -16.765 1.00 0.00 C ATOM 121 CD GLU A 10 116.869 21.909 -18.139 1.00 0.00 C ATOM 122 OE1 GLU A 10 116.169 20.983 -18.510 1.00 0.00 O ATOM 123 OE2 GLU A 10 117.070 22.919 -18.794 1.00 0.00 O ATOM 0 H GLU A 10 120.403 21.396 -17.856 1.00 0.00 H new ATOM 0 HA GLU A 10 119.858 20.800 -15.658 1.00 0.00 H new ATOM 0 HB2 GLU A 10 117.459 19.693 -17.242 1.00 0.00 H new ATOM 0 HB3 GLU A 10 117.440 20.032 -15.523 1.00 0.00 H new ATOM 0 HG2 GLU A 10 116.867 22.189 -15.995 1.00 0.00 H new ATOM 0 HG3 GLU A 10 118.438 22.412 -16.739 1.00 0.00 H new ATOM 130 N PRO A 11 120.916 18.548 -15.477 1.00 0.00 N ATOM 131 CA PRO A 11 121.376 17.188 -15.102 1.00 0.00 C ATOM 132 C PRO A 11 120.577 16.681 -13.899 1.00 0.00 C ATOM 133 O PRO A 11 121.008 16.787 -12.768 1.00 0.00 O ATOM 134 CB PRO A 11 122.843 17.392 -14.735 1.00 0.00 C ATOM 135 CG PRO A 11 122.946 18.829 -14.330 1.00 0.00 C ATOM 136 CD PRO A 11 121.883 19.584 -15.087 1.00 0.00 C ATOM 0 HA PRO A 11 121.243 16.452 -15.895 1.00 0.00 H new ATOM 0 HB2 PRO A 11 123.142 16.731 -13.922 1.00 0.00 H new ATOM 0 HB3 PRO A 11 123.495 17.173 -15.580 1.00 0.00 H new ATOM 0 HG2 PRO A 11 122.802 18.937 -13.255 1.00 0.00 H new ATOM 0 HG3 PRO A 11 123.936 19.223 -14.560 1.00 0.00 H new ATOM 0 HD2 PRO A 11 121.418 20.349 -14.465 1.00 0.00 H new ATOM 0 HD3 PRO A 11 122.298 20.090 -15.959 1.00 0.00 H new ATOM 144 N SER A 12 119.409 16.141 -14.135 1.00 0.00 N ATOM 145 CA SER A 12 118.576 15.643 -13.002 1.00 0.00 C ATOM 146 C SER A 12 118.303 14.142 -13.139 1.00 0.00 C ATOM 147 O SER A 12 118.761 13.347 -12.344 1.00 0.00 O ATOM 148 CB SER A 12 117.265 16.428 -13.092 1.00 0.00 C ATOM 149 OG SER A 12 117.504 17.689 -13.707 1.00 0.00 O ATOM 0 H SER A 12 118.998 16.024 -15.061 1.00 0.00 H new ATOM 0 HA SER A 12 119.078 15.784 -12.045 1.00 0.00 H new ATOM 0 HB2 SER A 12 116.531 15.865 -13.668 1.00 0.00 H new ATOM 0 HB3 SER A 12 116.846 16.572 -12.096 1.00 0.00 H new ATOM 0 HG SER A 12 116.663 18.189 -13.765 1.00 0.00 H new ATOM 155 N ALA A 13 117.541 13.753 -14.131 1.00 0.00 N ATOM 156 CA ALA A 13 117.215 12.304 -14.309 1.00 0.00 C ATOM 157 C ALA A 13 116.679 11.720 -12.999 1.00 0.00 C ATOM 158 O ALA A 13 116.736 10.529 -12.769 1.00 0.00 O ATOM 159 CB ALA A 13 118.535 11.630 -14.687 1.00 0.00 C ATOM 0 H ALA A 13 117.130 14.377 -14.826 1.00 0.00 H new ATOM 0 HA ALA A 13 116.450 12.151 -15.070 1.00 0.00 H new ATOM 0 HB1 ALA A 13 118.370 10.563 -14.833 1.00 0.00 H new ATOM 0 HB2 ALA A 13 118.916 12.068 -15.610 1.00 0.00 H new ATOM 0 HB3 ALA A 13 119.261 11.779 -13.888 1.00 0.00 H new ATOM 165 N ASP A 14 116.161 12.556 -12.138 1.00 0.00 N ATOM 166 CA ASP A 14 115.623 12.061 -10.842 1.00 0.00 C ATOM 167 C ASP A 14 114.100 11.944 -10.902 1.00 0.00 C ATOM 168 O ASP A 14 113.459 11.612 -9.925 1.00 0.00 O ATOM 169 CB ASP A 14 116.046 13.102 -9.801 1.00 0.00 C ATOM 170 CG ASP A 14 115.480 14.480 -10.170 1.00 0.00 C ATOM 171 OD1 ASP A 14 115.510 14.820 -11.341 1.00 0.00 O ATOM 172 OD2 ASP A 14 115.033 15.173 -9.272 1.00 0.00 O ATOM 0 H ASP A 14 116.088 13.564 -12.279 1.00 0.00 H new ATOM 0 HA ASP A 14 116.003 11.069 -10.598 1.00 0.00 H new ATOM 0 HB2 ASP A 14 115.689 12.806 -8.814 1.00 0.00 H new ATOM 0 HB3 ASP A 14 117.134 13.150 -9.745 1.00 0.00 H new ATOM 177 N TRP A 15 113.509 12.203 -12.042 1.00 0.00 N ATOM 178 CA TRP A 15 112.024 12.091 -12.151 1.00 0.00 C ATOM 179 C TRP A 15 111.571 10.699 -11.694 1.00 0.00 C ATOM 180 O TRP A 15 110.431 10.499 -11.322 1.00 0.00 O ATOM 181 CB TRP A 15 111.715 12.303 -13.635 1.00 0.00 C ATOM 182 CG TRP A 15 111.514 13.761 -13.909 1.00 0.00 C ATOM 183 CD1 TRP A 15 112.019 14.770 -13.164 1.00 0.00 C ATOM 184 CD2 TRP A 15 110.762 14.387 -14.987 1.00 0.00 C ATOM 185 NE1 TRP A 15 111.626 15.977 -13.716 1.00 0.00 N ATOM 186 CE2 TRP A 15 110.848 15.792 -14.841 1.00 0.00 C ATOM 187 CE3 TRP A 15 110.019 13.876 -16.066 1.00 0.00 C ATOM 188 CZ2 TRP A 15 110.221 16.660 -15.736 1.00 0.00 C ATOM 189 CZ3 TRP A 15 109.385 14.746 -16.968 1.00 0.00 C ATOM 190 CH2 TRP A 15 109.487 16.136 -16.803 1.00 0.00 C ATOM 0 H TRP A 15 113.988 12.486 -12.897 1.00 0.00 H new ATOM 0 HA TRP A 15 111.504 12.817 -11.525 1.00 0.00 H new ATOM 0 HB2 TRP A 15 112.533 11.919 -14.244 1.00 0.00 H new ATOM 0 HB3 TRP A 15 110.821 11.745 -13.913 1.00 0.00 H new ATOM 0 HD1 TRP A 15 112.630 14.653 -12.281 1.00 0.00 H new ATOM 0 HE1 TRP A 15 111.880 16.890 -13.338 1.00 0.00 H new ATOM 0 HE3 TRP A 15 109.935 12.808 -16.202 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 110.303 17.729 -15.605 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 108.816 14.343 -17.793 1.00 0.00 H new ATOM 0 HH2 TRP A 15 108.998 16.800 -17.500 1.00 0.00 H new ATOM 201 N LEU A 16 112.464 9.742 -11.704 1.00 0.00 N ATOM 202 CA LEU A 16 112.096 8.371 -11.257 1.00 0.00 C ATOM 203 C LEU A 16 112.002 8.342 -9.722 1.00 0.00 C ATOM 204 O LEU A 16 111.096 7.760 -9.159 1.00 0.00 O ATOM 205 CB LEU A 16 113.236 7.486 -11.789 1.00 0.00 C ATOM 206 CG LEU A 16 113.563 6.366 -10.800 1.00 0.00 C ATOM 207 CD1 LEU A 16 112.323 5.493 -10.582 1.00 0.00 C ATOM 208 CD2 LEU A 16 114.700 5.509 -11.361 1.00 0.00 C ATOM 0 H LEU A 16 113.433 9.854 -12.003 1.00 0.00 H new ATOM 0 HA LEU A 16 111.128 8.030 -11.624 1.00 0.00 H new ATOM 0 HB2 LEU A 16 112.951 7.057 -12.750 1.00 0.00 H new ATOM 0 HB3 LEU A 16 114.124 8.094 -11.962 1.00 0.00 H new ATOM 0 HG LEU A 16 113.869 6.800 -9.848 1.00 0.00 H new ATOM 0 HD11 LEU A 16 112.559 4.696 -9.877 1.00 0.00 H new ATOM 0 HD12 LEU A 16 111.514 6.104 -10.182 1.00 0.00 H new ATOM 0 HD13 LEU A 16 112.013 5.057 -11.532 1.00 0.00 H new ATOM 0 HD21 LEU A 16 114.935 4.710 -10.658 1.00 0.00 H new ATOM 0 HD22 LEU A 16 114.393 5.076 -12.313 1.00 0.00 H new ATOM 0 HD23 LEU A 16 115.583 6.130 -11.513 1.00 0.00 H new ATOM 220 N ALA A 17 112.929 8.974 -9.048 1.00 0.00 N ATOM 221 CA ALA A 17 112.889 8.993 -7.554 1.00 0.00 C ATOM 222 C ALA A 17 111.832 9.990 -7.074 1.00 0.00 C ATOM 223 O ALA A 17 111.048 9.703 -6.189 1.00 0.00 O ATOM 224 CB ALA A 17 114.287 9.443 -7.120 1.00 0.00 C ATOM 0 H ALA A 17 113.711 9.477 -9.467 1.00 0.00 H new ATOM 0 HA ALA A 17 112.630 8.021 -7.135 1.00 0.00 H new ATOM 0 HB1 ALA A 17 114.335 9.481 -6.032 1.00 0.00 H new ATOM 0 HB2 ALA A 17 115.029 8.736 -7.492 1.00 0.00 H new ATOM 0 HB3 ALA A 17 114.493 10.433 -7.527 1.00 0.00 H new ATOM 230 N THR A 18 111.806 11.159 -7.659 1.00 0.00 N ATOM 231 CA THR A 18 110.803 12.198 -7.259 1.00 0.00 C ATOM 232 C THR A 18 109.402 11.583 -7.170 1.00 0.00 C ATOM 233 O THR A 18 108.744 11.656 -6.151 1.00 0.00 O ATOM 234 CB THR A 18 110.847 13.240 -8.379 1.00 0.00 C ATOM 235 OG1 THR A 18 111.205 12.605 -9.596 1.00 0.00 O ATOM 236 CG2 THR A 18 111.870 14.326 -8.037 1.00 0.00 C ATOM 0 H THR A 18 112.442 11.444 -8.404 1.00 0.00 H new ATOM 0 HA THR A 18 111.027 12.627 -6.283 1.00 0.00 H new ATOM 0 HB THR A 18 109.865 13.701 -8.486 1.00 0.00 H new ATOM 0 HG1 THR A 18 112.180 12.609 -9.692 1.00 0.00 H new ATOM 0 HG21 THR A 18 111.897 15.065 -8.838 1.00 0.00 H new ATOM 0 HG22 THR A 18 111.586 14.812 -7.104 1.00 0.00 H new ATOM 0 HG23 THR A 18 112.856 13.875 -7.926 1.00 0.00 H new ATOM 244 N ALA A 19 108.944 10.981 -8.234 1.00 0.00 N ATOM 245 CA ALA A 19 107.588 10.360 -8.221 1.00 0.00 C ATOM 246 C ALA A 19 107.506 9.295 -7.125 1.00 0.00 C ATOM 247 O ALA A 19 106.546 9.224 -6.385 1.00 0.00 O ATOM 248 CB ALA A 19 107.425 9.724 -9.601 1.00 0.00 C ATOM 0 H ALA A 19 109.452 10.892 -9.114 1.00 0.00 H new ATOM 0 HA ALA A 19 106.804 11.089 -8.016 1.00 0.00 H new ATOM 0 HB1 ALA A 19 106.448 9.245 -9.668 1.00 0.00 H new ATOM 0 HB2 ALA A 19 107.505 10.494 -10.368 1.00 0.00 H new ATOM 0 HB3 ALA A 19 108.205 8.978 -9.752 1.00 0.00 H new ATOM 254 N ALA A 20 108.509 8.464 -7.017 1.00 0.00 N ATOM 255 CA ALA A 20 108.488 7.400 -5.968 1.00 0.00 C ATOM 256 C ALA A 20 108.245 8.017 -4.590 1.00 0.00 C ATOM 257 O ALA A 20 107.351 7.619 -3.868 1.00 0.00 O ATOM 258 CB ALA A 20 109.877 6.755 -6.024 1.00 0.00 C ATOM 0 H ALA A 20 109.340 8.475 -7.608 1.00 0.00 H new ATOM 0 HA ALA A 20 107.693 6.674 -6.138 1.00 0.00 H new ATOM 0 HB1 ALA A 20 109.940 5.961 -5.280 1.00 0.00 H new ATOM 0 HB2 ALA A 20 110.044 6.336 -7.016 1.00 0.00 H new ATOM 0 HB3 ALA A 20 110.637 7.508 -5.816 1.00 0.00 H new ATOM 264 N ALA A 21 109.043 8.979 -4.217 1.00 0.00 N ATOM 265 CA ALA A 21 108.874 9.620 -2.880 1.00 0.00 C ATOM 266 C ALA A 21 107.472 10.219 -2.748 1.00 0.00 C ATOM 267 O ALA A 21 106.925 10.312 -1.667 1.00 0.00 O ATOM 268 CB ALA A 21 109.930 10.725 -2.830 1.00 0.00 C ATOM 0 H ALA A 21 109.807 9.351 -4.781 1.00 0.00 H new ATOM 0 HA ALA A 21 108.992 8.904 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 21 109.868 11.244 -1.873 1.00 0.00 H new ATOM 0 HB2 ALA A 21 110.921 10.286 -2.942 1.00 0.00 H new ATOM 0 HB3 ALA A 21 109.754 11.434 -3.639 1.00 0.00 H new ATOM 274 N ARG A 22 106.892 10.628 -3.842 1.00 0.00 N ATOM 275 CA ARG A 22 105.526 11.225 -3.783 1.00 0.00 C ATOM 276 C ARG A 22 104.456 10.138 -3.939 1.00 0.00 C ATOM 277 O ARG A 22 103.338 10.410 -4.331 1.00 0.00 O ATOM 278 CB ARG A 22 105.477 12.215 -4.953 1.00 0.00 C ATOM 279 CG ARG A 22 105.180 13.619 -4.423 1.00 0.00 C ATOM 280 CD ARG A 22 104.700 14.509 -5.570 1.00 0.00 C ATOM 281 NE ARG A 22 105.323 15.838 -5.310 1.00 0.00 N ATOM 282 CZ ARG A 22 105.947 16.469 -6.270 1.00 0.00 C ATOM 283 NH1 ARG A 22 105.520 16.374 -7.499 1.00 0.00 N ATOM 284 NH2 ARG A 22 106.997 17.194 -5.999 1.00 0.00 N ATOM 0 H ARG A 22 107.303 10.575 -4.774 1.00 0.00 H new ATOM 0 HA ARG A 22 105.330 11.714 -2.829 1.00 0.00 H new ATOM 0 HB2 ARG A 22 106.427 12.210 -5.487 1.00 0.00 H new ATOM 0 HB3 ARG A 22 104.709 11.914 -5.666 1.00 0.00 H new ATOM 0 HG2 ARG A 22 104.420 13.571 -3.644 1.00 0.00 H new ATOM 0 HG3 ARG A 22 106.075 14.044 -3.969 1.00 0.00 H new ATOM 0 HD2 ARG A 22 105.009 14.110 -6.536 1.00 0.00 H new ATOM 0 HD3 ARG A 22 103.612 14.579 -5.587 1.00 0.00 H new ATOM 0 HE ARG A 22 105.262 16.256 -4.381 1.00 0.00 H new ATOM 0 HH11 ARG A 22 104.699 15.807 -7.711 1.00 0.00 H new ATOM 0 HH12 ARG A 22 106.007 16.867 -8.248 1.00 0.00 H new ATOM 0 HH21 ARG A 22 107.331 17.269 -5.038 1.00 0.00 H new ATOM 0 HH22 ARG A 22 107.484 17.686 -6.748 1.00 0.00 H new ATOM 298 N GLY A 23 104.788 8.911 -3.620 1.00 0.00 N ATOM 299 CA GLY A 23 103.798 7.800 -3.729 1.00 0.00 C ATOM 300 C GLY A 23 103.123 7.817 -5.103 1.00 0.00 C ATOM 301 O GLY A 23 101.922 7.670 -5.214 1.00 0.00 O ATOM 0 H GLY A 23 105.711 8.632 -3.286 1.00 0.00 H new ATOM 0 HA2 GLY A 23 104.297 6.844 -3.574 1.00 0.00 H new ATOM 0 HA3 GLY A 23 103.046 7.897 -2.946 1.00 0.00 H new ATOM 305 N ARG A 24 103.884 7.993 -6.148 1.00 0.00 N ATOM 306 CA ARG A 24 103.281 8.016 -7.511 1.00 0.00 C ATOM 307 C ARG A 24 103.669 6.749 -8.277 1.00 0.00 C ATOM 308 O ARG A 24 104.706 6.683 -8.905 1.00 0.00 O ATOM 309 CB ARG A 24 103.868 9.258 -8.182 1.00 0.00 C ATOM 310 CG ARG A 24 102.958 10.461 -7.919 1.00 0.00 C ATOM 311 CD ARG A 24 102.743 11.243 -9.219 1.00 0.00 C ATOM 312 NE ARG A 24 103.220 12.623 -8.926 1.00 0.00 N ATOM 313 CZ ARG A 24 102.848 13.616 -9.687 1.00 0.00 C ATOM 314 NH1 ARG A 24 101.762 14.281 -9.404 1.00 0.00 N ATOM 315 NH2 ARG A 24 103.558 13.940 -10.732 1.00 0.00 N ATOM 0 H ARG A 24 104.895 8.122 -6.118 1.00 0.00 H new ATOM 0 HA ARG A 24 102.192 8.048 -7.485 1.00 0.00 H new ATOM 0 HB2 ARG A 24 104.868 9.454 -7.796 1.00 0.00 H new ATOM 0 HB3 ARG A 24 103.967 9.092 -9.255 1.00 0.00 H new ATOM 0 HG2 ARG A 24 102.000 10.124 -7.524 1.00 0.00 H new ATOM 0 HG3 ARG A 24 103.404 11.108 -7.164 1.00 0.00 H new ATOM 0 HD2 ARG A 24 103.302 10.799 -10.043 1.00 0.00 H new ATOM 0 HD3 ARG A 24 101.693 11.243 -9.510 1.00 0.00 H new ATOM 0 HE ARG A 24 103.837 12.792 -8.131 1.00 0.00 H new ATOM 0 HH11 ARG A 24 101.205 14.025 -8.589 1.00 0.00 H new ATOM 0 HH12 ARG A 24 101.470 15.057 -9.998 1.00 0.00 H new ATOM 0 HH21 ARG A 24 104.405 13.417 -10.955 1.00 0.00 H new ATOM 0 HH22 ARG A 24 103.266 14.716 -11.326 1.00 0.00 H new ATOM 329 N VAL A 25 102.839 5.742 -8.224 1.00 0.00 N ATOM 330 CA VAL A 25 103.149 4.473 -8.943 1.00 0.00 C ATOM 331 C VAL A 25 102.922 4.649 -10.449 1.00 0.00 C ATOM 332 O VAL A 25 103.738 4.252 -11.257 1.00 0.00 O ATOM 333 CB VAL A 25 102.175 3.444 -8.357 1.00 0.00 C ATOM 334 CG1 VAL A 25 101.994 2.272 -9.329 1.00 0.00 C ATOM 335 CG2 VAL A 25 102.734 2.922 -7.031 1.00 0.00 C ATOM 0 H VAL A 25 101.957 5.744 -7.712 1.00 0.00 H new ATOM 0 HA VAL A 25 104.187 4.164 -8.820 1.00 0.00 H new ATOM 0 HB VAL A 25 101.208 3.920 -8.193 1.00 0.00 H new ATOM 0 HG11 VAL A 25 101.300 1.548 -8.901 1.00 0.00 H new ATOM 0 HG12 VAL A 25 101.596 2.641 -10.274 1.00 0.00 H new ATOM 0 HG13 VAL A 25 102.957 1.792 -9.504 1.00 0.00 H new ATOM 0 HG21 VAL A 25 102.046 2.190 -6.609 1.00 0.00 H new ATOM 0 HG22 VAL A 25 103.702 2.452 -7.204 1.00 0.00 H new ATOM 0 HG23 VAL A 25 102.853 3.752 -6.334 1.00 0.00 H new ATOM 345 N GLU A 26 101.817 5.228 -10.830 1.00 0.00 N ATOM 346 CA GLU A 26 101.535 5.414 -12.284 1.00 0.00 C ATOM 347 C GLU A 26 102.626 6.260 -12.938 1.00 0.00 C ATOM 348 O GLU A 26 102.963 6.070 -14.091 1.00 0.00 O ATOM 349 CB GLU A 26 100.180 6.131 -12.344 1.00 0.00 C ATOM 350 CG GLU A 26 99.186 5.299 -13.163 1.00 0.00 C ATOM 351 CD GLU A 26 98.507 6.190 -14.208 1.00 0.00 C ATOM 352 OE1 GLU A 26 97.713 7.029 -13.815 1.00 0.00 O ATOM 353 OE2 GLU A 26 98.793 6.016 -15.380 1.00 0.00 O ATOM 0 H GLU A 26 101.097 5.581 -10.199 1.00 0.00 H new ATOM 0 HA GLU A 26 101.514 4.465 -12.820 1.00 0.00 H new ATOM 0 HB2 GLU A 26 99.795 6.285 -11.336 1.00 0.00 H new ATOM 0 HB3 GLU A 26 100.300 7.117 -12.793 1.00 0.00 H new ATOM 0 HG2 GLU A 26 99.704 4.475 -13.654 1.00 0.00 H new ATOM 0 HG3 GLU A 26 98.437 4.858 -12.505 1.00 0.00 H new ATOM 360 N GLU A 27 103.188 7.188 -12.215 1.00 0.00 N ATOM 361 CA GLU A 27 104.262 8.034 -12.804 1.00 0.00 C ATOM 362 C GLU A 27 105.552 7.223 -12.923 1.00 0.00 C ATOM 363 O GLU A 27 106.206 7.237 -13.943 1.00 0.00 O ATOM 364 CB GLU A 27 104.443 9.198 -11.829 1.00 0.00 C ATOM 365 CG GLU A 27 105.193 10.337 -12.527 1.00 0.00 C ATOM 366 CD GLU A 27 104.220 11.474 -12.848 1.00 0.00 C ATOM 367 OE1 GLU A 27 103.317 11.697 -12.061 1.00 0.00 O ATOM 368 OE2 GLU A 27 104.398 12.104 -13.878 1.00 0.00 O ATOM 0 H GLU A 27 102.951 7.397 -11.245 1.00 0.00 H new ATOM 0 HA GLU A 27 104.010 8.387 -13.804 1.00 0.00 H new ATOM 0 HB2 GLU A 27 103.472 9.548 -11.480 1.00 0.00 H new ATOM 0 HB3 GLU A 27 104.997 8.868 -10.951 1.00 0.00 H new ATOM 0 HG2 GLU A 27 105.996 10.702 -11.887 1.00 0.00 H new ATOM 0 HG3 GLU A 27 105.657 9.972 -13.444 1.00 0.00 H new ATOM 375 N VAL A 28 105.918 6.516 -11.886 1.00 0.00 N ATOM 376 CA VAL A 28 107.169 5.702 -11.944 1.00 0.00 C ATOM 377 C VAL A 28 107.033 4.588 -12.984 1.00 0.00 C ATOM 378 O VAL A 28 107.918 4.378 -13.792 1.00 0.00 O ATOM 379 CB VAL A 28 107.333 5.113 -10.538 1.00 0.00 C ATOM 380 CG1 VAL A 28 108.427 4.038 -10.552 1.00 0.00 C ATOM 381 CG2 VAL A 28 107.730 6.225 -9.564 1.00 0.00 C ATOM 0 H VAL A 28 105.407 6.467 -11.004 1.00 0.00 H new ATOM 0 HA VAL A 28 108.033 6.300 -12.235 1.00 0.00 H new ATOM 0 HB VAL A 28 106.390 4.667 -10.222 1.00 0.00 H new ATOM 0 HG11 VAL A 28 108.541 3.622 -9.551 1.00 0.00 H new ATOM 0 HG12 VAL A 28 108.149 3.245 -11.246 1.00 0.00 H new ATOM 0 HG13 VAL A 28 109.370 4.483 -10.869 1.00 0.00 H new ATOM 0 HG21 VAL A 28 107.847 5.808 -8.564 1.00 0.00 H new ATOM 0 HG22 VAL A 28 108.672 6.670 -9.884 1.00 0.00 H new ATOM 0 HG23 VAL A 28 106.954 6.990 -9.550 1.00 0.00 H new ATOM 391 N ARG A 29 105.939 3.868 -12.979 1.00 0.00 N ATOM 392 CA ARG A 29 105.775 2.774 -13.981 1.00 0.00 C ATOM 393 C ARG A 29 105.952 3.343 -15.396 1.00 0.00 C ATOM 394 O ARG A 29 106.670 2.800 -16.216 1.00 0.00 O ATOM 395 CB ARG A 29 104.353 2.248 -13.773 1.00 0.00 C ATOM 396 CG ARG A 29 104.244 1.606 -12.386 1.00 0.00 C ATOM 397 CD ARG A 29 105.104 0.341 -12.330 1.00 0.00 C ATOM 398 NE ARG A 29 104.560 -0.547 -13.398 1.00 0.00 N ATOM 399 CZ ARG A 29 103.718 -1.496 -13.093 1.00 0.00 C ATOM 400 NH1 ARG A 29 102.499 -1.197 -12.731 1.00 0.00 N ATOM 401 NH2 ARG A 29 104.092 -2.746 -13.154 1.00 0.00 N ATOM 0 H ARG A 29 105.161 3.989 -12.331 1.00 0.00 H new ATOM 0 HA ARG A 29 106.511 1.979 -13.861 1.00 0.00 H new ATOM 0 HB2 ARG A 29 103.635 3.063 -13.866 1.00 0.00 H new ATOM 0 HB3 ARG A 29 104.107 1.518 -14.544 1.00 0.00 H new ATOM 0 HG2 ARG A 29 104.570 2.312 -11.622 1.00 0.00 H new ATOM 0 HG3 ARG A 29 103.204 1.360 -12.170 1.00 0.00 H new ATOM 0 HD2 ARG A 29 106.155 0.571 -12.506 1.00 0.00 H new ATOM 0 HD3 ARG A 29 105.041 -0.135 -11.352 1.00 0.00 H new ATOM 0 HE ARG A 29 104.846 -0.412 -14.368 1.00 0.00 H new ATOM 0 HH11 ARG A 29 102.205 -0.221 -12.687 1.00 0.00 H new ATOM 0 HH12 ARG A 29 101.841 -1.939 -12.493 1.00 0.00 H new ATOM 0 HH21 ARG A 29 105.043 -2.981 -13.440 1.00 0.00 H new ATOM 0 HH22 ARG A 29 103.434 -3.488 -12.915 1.00 0.00 H new ATOM 415 N ALA A 30 105.315 4.449 -15.677 1.00 0.00 N ATOM 416 CA ALA A 30 105.447 5.071 -17.026 1.00 0.00 C ATOM 417 C ALA A 30 106.793 5.793 -17.152 1.00 0.00 C ATOM 418 O ALA A 30 107.416 5.784 -18.197 1.00 0.00 O ATOM 419 CB ALA A 30 104.292 6.069 -17.116 1.00 0.00 C ATOM 0 H ALA A 30 104.707 4.949 -15.028 1.00 0.00 H new ATOM 0 HA ALA A 30 105.411 4.331 -17.825 1.00 0.00 H new ATOM 0 HB1 ALA A 30 104.319 6.571 -18.083 1.00 0.00 H new ATOM 0 HB2 ALA A 30 103.345 5.540 -17.008 1.00 0.00 H new ATOM 0 HB3 ALA A 30 104.387 6.809 -16.321 1.00 0.00 H new ATOM 425 N LEU A 31 107.247 6.421 -16.098 1.00 0.00 N ATOM 426 CA LEU A 31 108.554 7.145 -16.161 1.00 0.00 C ATOM 427 C LEU A 31 109.689 6.173 -16.479 1.00 0.00 C ATOM 428 O LEU A 31 110.351 6.287 -17.493 1.00 0.00 O ATOM 429 CB LEU A 31 108.761 7.745 -14.769 1.00 0.00 C ATOM 430 CG LEU A 31 108.113 9.130 -14.689 1.00 0.00 C ATOM 431 CD1 LEU A 31 108.313 9.697 -13.283 1.00 0.00 C ATOM 432 CD2 LEU A 31 108.770 10.064 -15.711 1.00 0.00 C ATOM 0 H LEU A 31 106.771 6.464 -15.197 1.00 0.00 H new ATOM 0 HA LEU A 31 108.550 7.907 -16.940 1.00 0.00 H new ATOM 0 HB2 LEU A 31 108.328 7.089 -14.014 1.00 0.00 H new ATOM 0 HB3 LEU A 31 109.827 7.821 -14.552 1.00 0.00 H new ATOM 0 HG LEU A 31 107.048 9.048 -14.906 1.00 0.00 H new ATOM 0 HD11 LEU A 31 107.854 10.683 -13.220 1.00 0.00 H new ATOM 0 HD12 LEU A 31 107.849 9.033 -12.554 1.00 0.00 H new ATOM 0 HD13 LEU A 31 109.379 9.779 -13.072 1.00 0.00 H new ATOM 0 HD21 LEU A 31 108.308 11.049 -15.653 1.00 0.00 H new ATOM 0 HD22 LEU A 31 109.835 10.149 -15.494 1.00 0.00 H new ATOM 0 HD23 LEU A 31 108.635 9.659 -16.714 1.00 0.00 H new ATOM 444 N LEU A 32 109.932 5.224 -15.608 1.00 0.00 N ATOM 445 CA LEU A 32 111.040 4.244 -15.844 1.00 0.00 C ATOM 446 C LEU A 32 110.951 3.666 -17.257 1.00 0.00 C ATOM 447 O LEU A 32 111.944 3.538 -17.949 1.00 0.00 O ATOM 448 CB LEU A 32 110.826 3.147 -14.798 1.00 0.00 C ATOM 449 CG LEU A 32 111.907 3.248 -13.717 1.00 0.00 C ATOM 450 CD1 LEU A 32 111.474 2.455 -12.485 1.00 0.00 C ATOM 451 CD2 LEU A 32 113.219 2.669 -14.241 1.00 0.00 C ATOM 0 H LEU A 32 109.411 5.085 -14.742 1.00 0.00 H new ATOM 0 HA LEU A 32 112.023 4.706 -15.757 1.00 0.00 H new ATOM 0 HB2 LEU A 32 109.838 3.247 -14.349 1.00 0.00 H new ATOM 0 HB3 LEU A 32 110.863 2.166 -15.272 1.00 0.00 H new ATOM 0 HG LEU A 32 112.048 4.296 -13.453 1.00 0.00 H new ATOM 0 HD11 LEU A 32 112.244 2.527 -11.717 1.00 0.00 H new ATOM 0 HD12 LEU A 32 110.538 2.862 -12.101 1.00 0.00 H new ATOM 0 HD13 LEU A 32 111.331 1.409 -12.757 1.00 0.00 H new ATOM 0 HD21 LEU A 32 113.984 2.744 -13.468 1.00 0.00 H new ATOM 0 HD22 LEU A 32 113.074 1.622 -14.508 1.00 0.00 H new ATOM 0 HD23 LEU A 32 113.537 3.227 -15.121 1.00 0.00 H new ATOM 463 N GLU A 33 109.770 3.322 -17.692 1.00 0.00 N ATOM 464 CA GLU A 33 109.617 2.759 -19.063 1.00 0.00 C ATOM 465 C GLU A 33 109.839 3.854 -20.116 1.00 0.00 C ATOM 466 O GLU A 33 109.998 3.576 -21.290 1.00 0.00 O ATOM 467 CB GLU A 33 108.181 2.234 -19.115 1.00 0.00 C ATOM 468 CG GLU A 33 108.185 0.732 -18.816 1.00 0.00 C ATOM 469 CD GLU A 33 106.769 0.274 -18.462 1.00 0.00 C ATOM 470 OE1 GLU A 33 106.019 1.080 -17.936 1.00 0.00 O ATOM 471 OE2 GLU A 33 106.458 -0.876 -18.724 1.00 0.00 O ATOM 0 H GLU A 33 108.905 3.406 -17.158 1.00 0.00 H new ATOM 0 HA GLU A 33 110.343 1.974 -19.273 1.00 0.00 H new ATOM 0 HB2 GLU A 33 107.562 2.760 -18.389 1.00 0.00 H new ATOM 0 HB3 GLU A 33 107.748 2.421 -20.098 1.00 0.00 H new ATOM 0 HG2 GLU A 33 108.551 0.180 -19.682 1.00 0.00 H new ATOM 0 HG3 GLU A 33 108.864 0.517 -17.991 1.00 0.00 H new ATOM 478 N ALA A 34 109.849 5.098 -19.706 1.00 0.00 N ATOM 479 CA ALA A 34 110.060 6.212 -20.677 1.00 0.00 C ATOM 480 C ALA A 34 111.545 6.582 -20.762 1.00 0.00 C ATOM 481 O ALA A 34 111.954 7.335 -21.625 1.00 0.00 O ATOM 482 CB ALA A 34 109.258 7.385 -20.111 1.00 0.00 C ATOM 0 H ALA A 34 109.720 5.389 -18.737 1.00 0.00 H new ATOM 0 HA ALA A 34 109.744 5.939 -21.684 1.00 0.00 H new ATOM 0 HB1 ALA A 34 109.361 8.248 -20.769 1.00 0.00 H new ATOM 0 HB2 ALA A 34 108.207 7.106 -20.040 1.00 0.00 H new ATOM 0 HB3 ALA A 34 109.634 7.638 -19.120 1.00 0.00 H new ATOM 488 N GLY A 35 112.357 6.062 -19.879 1.00 0.00 N ATOM 489 CA GLY A 35 113.809 6.389 -19.921 1.00 0.00 C ATOM 490 C GLY A 35 114.303 6.800 -18.529 1.00 0.00 C ATOM 491 O GLY A 35 115.476 7.056 -18.336 1.00 0.00 O ATOM 0 H GLY A 35 112.076 5.426 -19.133 1.00 0.00 H new ATOM 0 HA2 GLY A 35 114.373 5.526 -20.274 1.00 0.00 H new ATOM 0 HA3 GLY A 35 113.986 7.197 -20.630 1.00 0.00 H new ATOM 495 N ALA A 36 113.428 6.865 -17.555 1.00 0.00 N ATOM 496 CA ALA A 36 113.872 7.258 -16.182 1.00 0.00 C ATOM 497 C ALA A 36 115.028 6.360 -15.731 1.00 0.00 C ATOM 498 O ALA A 36 114.834 5.218 -15.364 1.00 0.00 O ATOM 499 CB ALA A 36 112.653 7.052 -15.283 1.00 0.00 C ATOM 0 H ALA A 36 112.432 6.664 -17.650 1.00 0.00 H new ATOM 0 HA ALA A 36 114.227 8.288 -16.145 1.00 0.00 H new ATOM 0 HB1 ALA A 36 112.907 7.322 -14.258 1.00 0.00 H new ATOM 0 HB2 ALA A 36 111.834 7.681 -15.631 1.00 0.00 H new ATOM 0 HB3 ALA A 36 112.348 6.006 -15.318 1.00 0.00 H new ATOM 505 N LEU A 37 116.228 6.872 -15.763 1.00 0.00 N ATOM 506 CA LEU A 37 117.409 6.057 -15.346 1.00 0.00 C ATOM 507 C LEU A 37 117.159 5.410 -13.976 1.00 0.00 C ATOM 508 O LEU A 37 116.882 6.100 -13.014 1.00 0.00 O ATOM 509 CB LEU A 37 118.558 7.063 -15.262 1.00 0.00 C ATOM 510 CG LEU A 37 119.889 6.317 -15.159 1.00 0.00 C ATOM 511 CD1 LEU A 37 120.226 5.677 -16.510 1.00 0.00 C ATOM 512 CD2 LEU A 37 120.992 7.305 -14.772 1.00 0.00 C ATOM 0 H LEU A 37 116.444 7.823 -16.061 1.00 0.00 H new ATOM 0 HA LEU A 37 117.619 5.244 -16.041 1.00 0.00 H new ATOM 0 HB2 LEU A 37 118.557 7.705 -16.143 1.00 0.00 H new ATOM 0 HB3 LEU A 37 118.425 7.710 -14.395 1.00 0.00 H new ATOM 0 HG LEU A 37 119.813 5.538 -14.401 1.00 0.00 H new ATOM 0 HD11 LEU A 37 121.175 5.146 -16.434 1.00 0.00 H new ATOM 0 HD12 LEU A 37 119.439 4.976 -16.787 1.00 0.00 H new ATOM 0 HD13 LEU A 37 120.304 6.453 -17.271 1.00 0.00 H new ATOM 0 HD21 LEU A 37 121.943 6.778 -14.697 1.00 0.00 H new ATOM 0 HD22 LEU A 37 121.067 8.083 -15.532 1.00 0.00 H new ATOM 0 HD23 LEU A 37 120.753 7.759 -13.811 1.00 0.00 H new ATOM 524 N PRO A 38 117.264 4.102 -13.926 1.00 0.00 N ATOM 525 CA PRO A 38 117.042 3.380 -12.649 1.00 0.00 C ATOM 526 C PRO A 38 118.155 3.704 -11.650 1.00 0.00 C ATOM 527 O PRO A 38 117.901 3.945 -10.490 1.00 0.00 O ATOM 528 CB PRO A 38 117.071 1.908 -13.055 1.00 0.00 C ATOM 529 CG PRO A 38 117.865 1.876 -14.319 1.00 0.00 C ATOM 530 CD PRO A 38 117.596 3.180 -15.024 1.00 0.00 C ATOM 0 HA PRO A 38 116.110 3.656 -12.156 1.00 0.00 H new ATOM 0 HB2 PRO A 38 117.533 1.294 -12.282 1.00 0.00 H new ATOM 0 HB3 PRO A 38 116.064 1.521 -13.211 1.00 0.00 H new ATOM 0 HG2 PRO A 38 118.928 1.761 -14.107 1.00 0.00 H new ATOM 0 HG3 PRO A 38 117.571 1.030 -14.941 1.00 0.00 H new ATOM 0 HD2 PRO A 38 118.467 3.520 -15.584 1.00 0.00 H new ATOM 0 HD3 PRO A 38 116.775 3.090 -15.735 1.00 0.00 H new ATOM 538 N ASN A 39 119.386 3.722 -12.090 1.00 0.00 N ATOM 539 CA ASN A 39 120.505 4.043 -11.155 1.00 0.00 C ATOM 540 C ASN A 39 120.777 5.549 -11.169 1.00 0.00 C ATOM 541 O ASN A 39 121.888 5.987 -11.396 1.00 0.00 O ATOM 542 CB ASN A 39 121.713 3.269 -11.691 1.00 0.00 C ATOM 543 CG ASN A 39 121.422 1.765 -11.656 1.00 0.00 C ATOM 544 OD1 ASN A 39 121.743 1.052 -12.587 1.00 0.00 O ATOM 545 ND2 ASN A 39 120.830 1.247 -10.613 1.00 0.00 N ATOM 0 H ASN A 39 119.664 3.529 -13.052 1.00 0.00 H new ATOM 0 HA ASN A 39 120.278 3.767 -10.125 1.00 0.00 H new ATOM 0 HB2 ASN A 39 121.934 3.582 -12.711 1.00 0.00 H new ATOM 0 HB3 ASN A 39 122.595 3.492 -11.091 1.00 0.00 H new ATOM 0 HD21 ASN A 39 120.638 0.246 -10.581 1.00 0.00 H new ATOM 0 HD22 ASN A 39 120.560 1.844 -9.831 1.00 0.00 H new ATOM 552 N ALA A 40 119.766 6.343 -10.930 1.00 0.00 N ATOM 553 CA ALA A 40 119.955 7.824 -10.934 1.00 0.00 C ATOM 554 C ALA A 40 119.962 8.371 -9.502 1.00 0.00 C ATOM 555 O ALA A 40 118.921 8.668 -8.951 1.00 0.00 O ATOM 556 CB ALA A 40 118.750 8.371 -11.699 1.00 0.00 C ATOM 0 H ALA A 40 118.816 6.029 -10.732 1.00 0.00 H new ATOM 0 HA ALA A 40 120.903 8.113 -11.388 1.00 0.00 H new ATOM 0 HB1 ALA A 40 118.813 9.458 -11.747 1.00 0.00 H new ATOM 0 HB2 ALA A 40 118.745 7.962 -12.710 1.00 0.00 H new ATOM 0 HB3 ALA A 40 117.832 8.083 -11.186 1.00 0.00 H new ATOM 562 N PRO A 41 121.139 8.502 -8.945 1.00 0.00 N ATOM 563 CA PRO A 41 121.262 9.037 -7.567 1.00 0.00 C ATOM 564 C PRO A 41 120.891 10.524 -7.546 1.00 0.00 C ATOM 565 O PRO A 41 121.699 11.378 -7.854 1.00 0.00 O ATOM 566 CB PRO A 41 122.739 8.833 -7.233 1.00 0.00 C ATOM 567 CG PRO A 41 123.426 8.786 -8.560 1.00 0.00 C ATOM 568 CD PRO A 41 122.448 8.177 -9.528 1.00 0.00 C ATOM 0 HA PRO A 41 120.602 8.548 -6.851 1.00 0.00 H new ATOM 0 HB2 PRO A 41 123.122 9.647 -6.618 1.00 0.00 H new ATOM 0 HB3 PRO A 41 122.895 7.910 -6.674 1.00 0.00 H new ATOM 0 HG2 PRO A 41 123.718 9.786 -8.881 1.00 0.00 H new ATOM 0 HG3 PRO A 41 124.337 8.191 -8.504 1.00 0.00 H new ATOM 0 HD2 PRO A 41 122.558 8.598 -10.527 1.00 0.00 H new ATOM 0 HD3 PRO A 41 122.591 7.100 -9.618 1.00 0.00 H new ATOM 576 N ASN A 42 119.672 10.838 -7.191 1.00 0.00 N ATOM 577 CA ASN A 42 119.246 12.270 -7.158 1.00 0.00 C ATOM 578 C ASN A 42 120.055 13.042 -6.109 1.00 0.00 C ATOM 579 O ASN A 42 121.151 12.655 -5.753 1.00 0.00 O ATOM 580 CB ASN A 42 117.758 12.235 -6.789 1.00 0.00 C ATOM 581 CG ASN A 42 117.572 11.590 -5.413 1.00 0.00 C ATOM 582 OD1 ASN A 42 118.529 11.183 -4.783 1.00 0.00 O ATOM 583 ND2 ASN A 42 116.371 11.480 -4.916 1.00 0.00 N ATOM 0 H ASN A 42 118.953 10.166 -6.923 1.00 0.00 H new ATOM 0 HA ASN A 42 119.412 12.774 -8.110 1.00 0.00 H new ATOM 0 HB2 ASN A 42 117.353 13.247 -6.783 1.00 0.00 H new ATOM 0 HB3 ASN A 42 117.202 11.674 -7.540 1.00 0.00 H new ATOM 0 HD21 ASN A 42 116.235 11.053 -4.000 1.00 0.00 H new ATOM 0 HD22 ASN A 42 115.567 11.821 -5.444 1.00 0.00 H new ATOM 590 N SER A 43 119.528 14.132 -5.618 1.00 0.00 N ATOM 591 CA SER A 43 120.273 14.928 -4.598 1.00 0.00 C ATOM 592 C SER A 43 119.849 14.513 -3.186 1.00 0.00 C ATOM 593 O SER A 43 119.755 15.332 -2.292 1.00 0.00 O ATOM 594 CB SER A 43 119.883 16.383 -4.865 1.00 0.00 C ATOM 595 OG SER A 43 121.052 17.198 -4.917 1.00 0.00 O ATOM 0 H SER A 43 118.615 14.506 -5.878 1.00 0.00 H new ATOM 0 HA SER A 43 121.350 14.774 -4.665 1.00 0.00 H new ATOM 0 HB2 SER A 43 119.337 16.455 -5.805 1.00 0.00 H new ATOM 0 HB3 SER A 43 119.215 16.739 -4.080 1.00 0.00 H new ATOM 0 HG SER A 43 120.795 18.128 -5.090 1.00 0.00 H new ATOM 601 N TYR A 44 119.586 13.251 -2.978 1.00 0.00 N ATOM 602 CA TYR A 44 119.162 12.795 -1.622 1.00 0.00 C ATOM 603 C TYR A 44 120.029 11.627 -1.137 1.00 0.00 C ATOM 604 O TYR A 44 119.924 11.205 -0.001 1.00 0.00 O ATOM 605 CB TYR A 44 117.710 12.346 -1.796 1.00 0.00 C ATOM 606 CG TYR A 44 116.796 13.340 -1.124 1.00 0.00 C ATOM 607 CD1 TYR A 44 116.679 13.352 0.270 1.00 0.00 C ATOM 608 CD2 TYR A 44 116.073 14.254 -1.896 1.00 0.00 C ATOM 609 CE1 TYR A 44 115.835 14.278 0.892 1.00 0.00 C ATOM 610 CE2 TYR A 44 115.229 15.180 -1.275 1.00 0.00 C ATOM 611 CZ TYR A 44 115.111 15.193 0.120 1.00 0.00 C ATOM 612 OH TYR A 44 114.280 16.107 0.731 1.00 0.00 O ATOM 0 H TYR A 44 119.646 12.518 -3.685 1.00 0.00 H new ATOM 0 HA TYR A 44 119.267 13.585 -0.878 1.00 0.00 H new ATOM 0 HB2 TYR A 44 117.466 12.269 -2.855 1.00 0.00 H new ATOM 0 HB3 TYR A 44 117.569 11.355 -1.363 1.00 0.00 H new ATOM 0 HD1 TYR A 44 117.240 12.647 0.865 1.00 0.00 H new ATOM 0 HD2 TYR A 44 116.166 14.245 -2.972 1.00 0.00 H new ATOM 0 HE1 TYR A 44 115.742 14.287 1.968 1.00 0.00 H new ATOM 0 HE2 TYR A 44 114.668 15.885 -1.871 1.00 0.00 H new ATOM 0 HH TYR A 44 113.854 16.668 0.050 1.00 0.00 H new ATOM 622 N GLY A 45 120.877 11.094 -1.982 1.00 0.00 N ATOM 623 CA GLY A 45 121.735 9.951 -1.561 1.00 0.00 C ATOM 624 C GLY A 45 120.854 8.847 -0.974 1.00 0.00 C ATOM 625 O GLY A 45 121.295 8.038 -0.181 1.00 0.00 O ATOM 0 H GLY A 45 121.010 11.403 -2.945 1.00 0.00 H new ATOM 0 HA2 GLY A 45 122.296 9.569 -2.414 1.00 0.00 H new ATOM 0 HA3 GLY A 45 122.464 10.282 -0.822 1.00 0.00 H new ATOM 629 N ARG A 46 119.607 8.816 -1.359 1.00 0.00 N ATOM 630 CA ARG A 46 118.683 7.777 -0.831 1.00 0.00 C ATOM 631 C ARG A 46 118.272 6.844 -1.963 1.00 0.00 C ATOM 632 O ARG A 46 117.174 6.331 -1.992 1.00 0.00 O ATOM 633 CB ARG A 46 117.472 8.552 -0.300 1.00 0.00 C ATOM 634 CG ARG A 46 117.351 8.361 1.214 1.00 0.00 C ATOM 635 CD ARG A 46 115.874 8.231 1.593 1.00 0.00 C ATOM 636 NE ARG A 46 115.805 8.622 3.028 1.00 0.00 N ATOM 637 CZ ARG A 46 114.720 8.385 3.716 1.00 0.00 C ATOM 638 NH1 ARG A 46 113.550 8.626 3.189 1.00 0.00 N ATOM 639 NH2 ARG A 46 114.805 7.907 4.929 1.00 0.00 N ATOM 0 H ARG A 46 119.188 9.470 -2.020 1.00 0.00 H new ATOM 0 HA ARG A 46 119.137 7.164 -0.053 1.00 0.00 H new ATOM 0 HB2 ARG A 46 117.577 9.611 -0.534 1.00 0.00 H new ATOM 0 HB3 ARG A 46 116.563 8.205 -0.792 1.00 0.00 H new ATOM 0 HG2 ARG A 46 117.897 7.470 1.524 1.00 0.00 H new ATOM 0 HG3 ARG A 46 117.799 9.207 1.735 1.00 0.00 H new ATOM 0 HD2 ARG A 46 115.251 8.880 0.977 1.00 0.00 H new ATOM 0 HD3 ARG A 46 115.517 7.212 1.445 1.00 0.00 H new ATOM 0 HE ARG A 46 116.604 9.074 3.473 1.00 0.00 H new ATOM 0 HH11 ARG A 46 113.484 8.999 2.242 1.00 0.00 H new ATOM 0 HH12 ARG A 46 112.702 8.442 3.725 1.00 0.00 H new ATOM 0 HH21 ARG A 46 115.719 7.718 5.340 1.00 0.00 H new ATOM 0 HH22 ARG A 46 113.957 7.722 5.465 1.00 0.00 H new ATOM 653 N ARG A 47 119.152 6.627 -2.903 1.00 0.00 N ATOM 654 CA ARG A 47 118.826 5.725 -4.052 1.00 0.00 C ATOM 655 C ARG A 47 117.469 6.120 -4.665 1.00 0.00 C ATOM 656 O ARG A 47 116.838 7.053 -4.213 1.00 0.00 O ATOM 657 CB ARG A 47 118.775 4.313 -3.446 1.00 0.00 C ATOM 658 CG ARG A 47 120.021 4.060 -2.581 1.00 0.00 C ATOM 659 CD ARG A 47 121.297 4.285 -3.407 1.00 0.00 C ATOM 660 NE ARG A 47 122.029 5.372 -2.697 1.00 0.00 N ATOM 661 CZ ARG A 47 123.315 5.524 -2.874 1.00 0.00 C ATOM 662 NH1 ARG A 47 123.758 6.200 -3.900 1.00 0.00 N ATOM 663 NH2 ARG A 47 124.156 5.006 -2.021 1.00 0.00 N ATOM 0 H ARG A 47 120.086 7.036 -2.927 1.00 0.00 H new ATOM 0 HA ARG A 47 119.559 5.788 -4.856 1.00 0.00 H new ATOM 0 HB2 ARG A 47 117.875 4.201 -2.841 1.00 0.00 H new ATOM 0 HB3 ARG A 47 118.719 3.570 -4.241 1.00 0.00 H new ATOM 0 HG2 ARG A 47 120.015 4.727 -1.719 1.00 0.00 H new ATOM 0 HG3 ARG A 47 120.004 3.041 -2.196 1.00 0.00 H new ATOM 0 HD2 ARG A 47 121.897 3.376 -3.463 1.00 0.00 H new ATOM 0 HD3 ARG A 47 121.059 4.573 -4.431 1.00 0.00 H new ATOM 0 HE ARG A 47 121.525 5.999 -2.071 1.00 0.00 H new ATOM 0 HH11 ARG A 47 123.100 6.610 -4.563 1.00 0.00 H new ATOM 0 HH12 ARG A 47 124.762 6.318 -4.038 1.00 0.00 H new ATOM 0 HH21 ARG A 47 123.810 4.483 -1.217 1.00 0.00 H new ATOM 0 HH22 ARG A 47 125.160 5.124 -2.159 1.00 0.00 H new ATOM 677 N PRO A 48 117.065 5.412 -5.685 1.00 0.00 N ATOM 678 CA PRO A 48 115.782 5.718 -6.347 1.00 0.00 C ATOM 679 C PRO A 48 114.615 5.002 -5.648 1.00 0.00 C ATOM 680 O PRO A 48 113.464 5.316 -5.878 1.00 0.00 O ATOM 681 CB PRO A 48 115.986 5.184 -7.759 1.00 0.00 C ATOM 682 CG PRO A 48 117.032 4.112 -7.642 1.00 0.00 C ATOM 683 CD PRO A 48 117.746 4.285 -6.322 1.00 0.00 C ATOM 0 HA PRO A 48 115.529 6.778 -6.323 1.00 0.00 H new ATOM 0 HB2 PRO A 48 115.057 4.782 -8.163 1.00 0.00 H new ATOM 0 HB3 PRO A 48 116.311 5.976 -8.434 1.00 0.00 H new ATOM 0 HG2 PRO A 48 116.572 3.125 -7.698 1.00 0.00 H new ATOM 0 HG3 PRO A 48 117.740 4.181 -8.468 1.00 0.00 H new ATOM 0 HD2 PRO A 48 117.678 3.384 -5.713 1.00 0.00 H new ATOM 0 HD3 PRO A 48 118.806 4.492 -6.468 1.00 0.00 H new ATOM 691 N ILE A 49 114.896 4.046 -4.794 1.00 0.00 N ATOM 692 CA ILE A 49 113.792 3.327 -4.089 1.00 0.00 C ATOM 693 C ILE A 49 113.738 3.742 -2.614 1.00 0.00 C ATOM 694 O ILE A 49 112.677 3.965 -2.066 1.00 0.00 O ATOM 695 CB ILE A 49 114.121 1.837 -4.218 1.00 0.00 C ATOM 696 CG1 ILE A 49 113.943 1.409 -5.685 1.00 0.00 C ATOM 697 CG2 ILE A 49 113.181 1.027 -3.313 1.00 0.00 C ATOM 698 CD1 ILE A 49 113.813 -0.116 -5.784 1.00 0.00 C ATOM 0 H ILE A 49 115.838 3.735 -4.557 1.00 0.00 H new ATOM 0 HA ILE A 49 112.818 3.561 -4.519 1.00 0.00 H new ATOM 0 HB ILE A 49 115.151 1.654 -3.912 1.00 0.00 H new ATOM 0 HG12 ILE A 49 113.056 1.884 -6.104 1.00 0.00 H new ATOM 0 HG13 ILE A 49 114.795 1.747 -6.275 1.00 0.00 H new ATOM 0 HG21 ILE A 49 113.414 -0.034 -3.404 1.00 0.00 H new ATOM 0 HG22 ILE A 49 113.313 1.340 -2.277 1.00 0.00 H new ATOM 0 HG23 ILE A 49 112.148 1.199 -3.615 1.00 0.00 H new ATOM 0 HD11 ILE A 49 113.688 -0.403 -6.828 1.00 0.00 H new ATOM 0 HD12 ILE A 49 114.712 -0.585 -5.384 1.00 0.00 H new ATOM 0 HD13 ILE A 49 112.947 -0.445 -5.210 1.00 0.00 H new ATOM 710 N GLN A 50 114.873 3.841 -1.968 1.00 0.00 N ATOM 711 CA GLN A 50 114.887 4.238 -0.522 1.00 0.00 C ATOM 712 C GLN A 50 113.969 5.445 -0.291 1.00 0.00 C ATOM 713 O GLN A 50 113.412 5.617 0.775 1.00 0.00 O ATOM 714 CB GLN A 50 116.340 4.617 -0.226 1.00 0.00 C ATOM 715 CG GLN A 50 116.816 3.915 1.045 1.00 0.00 C ATOM 716 CD GLN A 50 118.329 4.106 1.186 1.00 0.00 C ATOM 717 OE1 GLN A 50 118.778 4.990 1.888 1.00 0.00 O ATOM 718 NE2 GLN A 50 119.138 3.310 0.541 1.00 0.00 N ATOM 0 H GLN A 50 115.791 3.665 -2.377 1.00 0.00 H new ATOM 0 HA GLN A 50 114.531 3.436 0.124 1.00 0.00 H new ATOM 0 HB2 GLN A 50 116.976 4.336 -1.066 1.00 0.00 H new ATOM 0 HB3 GLN A 50 116.426 5.697 -0.108 1.00 0.00 H new ATOM 0 HG2 GLN A 50 116.303 4.324 1.915 1.00 0.00 H new ATOM 0 HG3 GLN A 50 116.573 2.853 1.002 1.00 0.00 H new ATOM 0 HE21 GLN A 50 118.761 2.568 -0.048 1.00 0.00 H new ATOM 0 HE22 GLN A 50 120.147 3.430 0.626 1.00 0.00 H new ATOM 727 N VAL A 51 113.804 6.273 -1.287 1.00 0.00 N ATOM 728 CA VAL A 51 112.918 7.461 -1.133 1.00 0.00 C ATOM 729 C VAL A 51 111.642 7.278 -1.960 1.00 0.00 C ATOM 730 O VAL A 51 111.154 8.204 -2.576 1.00 0.00 O ATOM 731 CB VAL A 51 113.744 8.648 -1.645 1.00 0.00 C ATOM 732 CG1 VAL A 51 114.162 8.405 -3.097 1.00 0.00 C ATOM 733 CG2 VAL A 51 112.913 9.933 -1.561 1.00 0.00 C ATOM 0 H VAL A 51 114.245 6.177 -2.202 1.00 0.00 H new ATOM 0 HA VAL A 51 112.601 7.612 -0.101 1.00 0.00 H new ATOM 0 HB VAL A 51 114.636 8.752 -1.027 1.00 0.00 H new ATOM 0 HG11 VAL A 51 114.748 9.252 -3.454 1.00 0.00 H new ATOM 0 HG12 VAL A 51 114.763 7.498 -3.156 1.00 0.00 H new ATOM 0 HG13 VAL A 51 113.273 8.292 -3.718 1.00 0.00 H new ATOM 0 HG21 VAL A 51 113.504 10.773 -1.926 1.00 0.00 H new ATOM 0 HG22 VAL A 51 112.017 9.827 -2.172 1.00 0.00 H new ATOM 0 HG23 VAL A 51 112.626 10.114 -0.525 1.00 0.00 H new ATOM 743 N MET A 52 111.089 6.091 -1.974 1.00 0.00 N ATOM 744 CA MET A 52 109.839 5.874 -2.755 1.00 0.00 C ATOM 745 C MET A 52 108.633 5.918 -1.818 1.00 0.00 C ATOM 746 O MET A 52 107.629 5.270 -2.046 1.00 0.00 O ATOM 747 CB MET A 52 109.983 4.494 -3.416 1.00 0.00 C ATOM 748 CG MET A 52 110.021 3.393 -2.349 1.00 0.00 C ATOM 749 SD MET A 52 108.553 2.340 -2.491 1.00 0.00 S ATOM 750 CE MET A 52 109.340 0.775 -2.029 1.00 0.00 C ATOM 0 H MET A 52 111.447 5.272 -1.483 1.00 0.00 H new ATOM 0 HA MET A 52 109.686 6.646 -3.510 1.00 0.00 H new ATOM 0 HB2 MET A 52 109.150 4.321 -4.097 1.00 0.00 H new ATOM 0 HB3 MET A 52 110.894 4.463 -4.013 1.00 0.00 H new ATOM 0 HG2 MET A 52 110.923 2.792 -2.467 1.00 0.00 H new ATOM 0 HG3 MET A 52 110.064 3.839 -1.356 1.00 0.00 H new ATOM 0 HE1 MET A 52 108.867 -0.044 -2.571 1.00 0.00 H new ATOM 0 HE2 MET A 52 110.400 0.812 -2.281 1.00 0.00 H new ATOM 0 HE3 MET A 52 109.228 0.614 -0.957 1.00 0.00 H new ATOM 760 N MET A 53 108.733 6.684 -0.760 1.00 0.00 N ATOM 761 CA MET A 53 107.605 6.800 0.222 1.00 0.00 C ATOM 762 C MET A 53 107.337 5.461 0.924 1.00 0.00 C ATOM 763 O MET A 53 106.506 5.380 1.806 1.00 0.00 O ATOM 764 CB MET A 53 106.388 7.206 -0.614 1.00 0.00 C ATOM 765 CG MET A 53 105.346 7.880 0.282 1.00 0.00 C ATOM 766 SD MET A 53 104.087 6.672 0.769 1.00 0.00 S ATOM 767 CE MET A 53 103.411 6.359 -0.882 1.00 0.00 C ATOM 0 H MET A 53 109.556 7.241 -0.530 1.00 0.00 H new ATOM 0 HA MET A 53 107.834 7.522 1.006 1.00 0.00 H new ATOM 0 HB2 MET A 53 106.692 7.887 -1.409 1.00 0.00 H new ATOM 0 HB3 MET A 53 105.955 6.328 -1.094 1.00 0.00 H new ATOM 0 HG2 MET A 53 105.827 8.295 1.167 1.00 0.00 H new ATOM 0 HG3 MET A 53 104.881 8.712 -0.247 1.00 0.00 H new ATOM 0 HE1 MET A 53 102.549 5.697 -0.803 1.00 0.00 H new ATOM 0 HE2 MET A 53 103.104 7.302 -1.334 1.00 0.00 H new ATOM 0 HE3 MET A 53 104.173 5.889 -1.504 1.00 0.00 H new ATOM 777 N MET A 54 108.021 4.409 0.533 1.00 0.00 N ATOM 778 CA MET A 54 107.795 3.067 1.160 1.00 0.00 C ATOM 779 C MET A 54 106.298 2.807 1.358 1.00 0.00 C ATOM 780 O MET A 54 105.892 2.087 2.249 1.00 0.00 O ATOM 781 CB MET A 54 108.524 3.106 2.505 1.00 0.00 C ATOM 782 CG MET A 54 110.014 2.803 2.300 1.00 0.00 C ATOM 783 SD MET A 54 110.226 1.187 1.498 1.00 0.00 S ATOM 784 CE MET A 54 111.335 1.733 0.175 1.00 0.00 C ATOM 0 H MET A 54 108.731 4.424 -0.199 1.00 0.00 H new ATOM 0 HA MET A 54 108.170 2.262 0.528 1.00 0.00 H new ATOM 0 HB2 MET A 54 108.403 4.086 2.966 1.00 0.00 H new ATOM 0 HB3 MET A 54 108.086 2.377 3.187 1.00 0.00 H new ATOM 0 HG2 MET A 54 110.469 3.582 1.689 1.00 0.00 H new ATOM 0 HG3 MET A 54 110.529 2.810 3.261 1.00 0.00 H new ATOM 0 HE1 MET A 54 111.627 0.876 -0.432 1.00 0.00 H new ATOM 0 HE2 MET A 54 110.822 2.463 -0.451 1.00 0.00 H new ATOM 0 HE3 MET A 54 112.224 2.189 0.611 1.00 0.00 H new ATOM 794 N GLY A 55 105.481 3.386 0.522 1.00 0.00 N ATOM 795 CA GLY A 55 104.013 3.178 0.637 1.00 0.00 C ATOM 796 C GLY A 55 103.471 2.677 -0.704 1.00 0.00 C ATOM 797 O GLY A 55 102.277 2.550 -0.892 1.00 0.00 O ATOM 0 H GLY A 55 105.771 3.998 -0.241 1.00 0.00 H new ATOM 0 HA2 GLY A 55 103.796 2.455 1.424 1.00 0.00 H new ATOM 0 HA3 GLY A 55 103.522 4.110 0.916 1.00 0.00 H new ATOM 801 N SER A 56 104.341 2.388 -1.636 1.00 0.00 N ATOM 802 CA SER A 56 103.881 1.892 -2.963 1.00 0.00 C ATOM 803 C SER A 56 104.886 0.881 -3.525 1.00 0.00 C ATOM 804 O SER A 56 105.783 1.231 -4.267 1.00 0.00 O ATOM 805 CB SER A 56 103.821 3.135 -3.848 1.00 0.00 C ATOM 806 OG SER A 56 102.487 3.627 -3.876 1.00 0.00 O ATOM 0 H SER A 56 105.352 2.475 -1.533 1.00 0.00 H new ATOM 0 HA SER A 56 102.918 1.385 -2.905 1.00 0.00 H new ATOM 0 HB2 SER A 56 104.496 3.901 -3.465 1.00 0.00 H new ATOM 0 HB3 SER A 56 104.153 2.893 -4.858 1.00 0.00 H new ATOM 0 HG SER A 56 102.054 3.448 -3.015 1.00 0.00 H new ATOM 812 N ALA A 57 104.736 -0.373 -3.180 1.00 0.00 N ATOM 813 CA ALA A 57 105.673 -1.414 -3.700 1.00 0.00 C ATOM 814 C ALA A 57 105.718 -1.345 -5.225 1.00 0.00 C ATOM 815 O ALA A 57 106.726 -1.631 -5.842 1.00 0.00 O ATOM 816 CB ALA A 57 105.080 -2.747 -3.244 1.00 0.00 C ATOM 0 H ALA A 57 104.004 -0.721 -2.560 1.00 0.00 H new ATOM 0 HA ALA A 57 106.692 -1.280 -3.336 1.00 0.00 H new ATOM 0 HB1 ALA A 57 105.714 -3.564 -3.589 1.00 0.00 H new ATOM 0 HB2 ALA A 57 105.023 -2.766 -2.156 1.00 0.00 H new ATOM 0 HB3 ALA A 57 104.080 -2.862 -3.662 1.00 0.00 H new ATOM 822 N ARG A 58 104.630 -0.953 -5.835 1.00 0.00 N ATOM 823 CA ARG A 58 104.602 -0.849 -7.322 1.00 0.00 C ATOM 824 C ARG A 58 105.758 0.038 -7.788 1.00 0.00 C ATOM 825 O ARG A 58 106.391 -0.224 -8.793 1.00 0.00 O ATOM 826 CB ARG A 58 103.256 -0.203 -7.656 1.00 0.00 C ATOM 827 CG ARG A 58 102.367 -1.213 -8.385 1.00 0.00 C ATOM 828 CD ARG A 58 101.642 -2.108 -7.355 1.00 0.00 C ATOM 829 NE ARG A 58 100.480 -2.677 -8.094 1.00 0.00 N ATOM 830 CZ ARG A 58 99.432 -1.935 -8.331 1.00 0.00 C ATOM 831 NH1 ARG A 58 99.371 -1.222 -9.423 1.00 0.00 N ATOM 832 NH2 ARG A 58 98.447 -1.908 -7.479 1.00 0.00 N ATOM 0 H ARG A 58 103.760 -0.701 -5.367 1.00 0.00 H new ATOM 0 HA ARG A 58 104.711 -1.816 -7.814 1.00 0.00 H new ATOM 0 HB2 ARG A 58 102.767 0.134 -6.742 1.00 0.00 H new ATOM 0 HB3 ARG A 58 103.409 0.678 -8.279 1.00 0.00 H new ATOM 0 HG2 ARG A 58 101.638 -0.690 -9.004 1.00 0.00 H new ATOM 0 HG3 ARG A 58 102.970 -1.827 -9.054 1.00 0.00 H new ATOM 0 HD2 ARG A 58 102.298 -2.895 -6.984 1.00 0.00 H new ATOM 0 HD3 ARG A 58 101.316 -1.531 -6.490 1.00 0.00 H new ATOM 0 HE ARG A 58 100.503 -3.645 -8.414 1.00 0.00 H new ATOM 0 HH11 ARG A 58 100.142 -1.245 -10.091 1.00 0.00 H new ATOM 0 HH12 ARG A 58 98.553 -0.642 -9.609 1.00 0.00 H new ATOM 0 HH21 ARG A 58 98.494 -2.466 -6.627 1.00 0.00 H new ATOM 0 HH22 ARG A 58 97.628 -1.328 -7.664 1.00 0.00 H new ATOM 846 N VAL A 59 106.057 1.074 -7.047 1.00 0.00 N ATOM 847 CA VAL A 59 107.196 1.953 -7.436 1.00 0.00 C ATOM 848 C VAL A 59 108.466 1.105 -7.465 1.00 0.00 C ATOM 849 O VAL A 59 109.093 0.938 -8.494 1.00 0.00 O ATOM 850 CB VAL A 59 107.281 3.019 -6.344 1.00 0.00 C ATOM 851 CG1 VAL A 59 108.485 3.920 -6.613 1.00 0.00 C ATOM 852 CG2 VAL A 59 106.004 3.863 -6.352 1.00 0.00 C ATOM 0 H VAL A 59 105.565 1.346 -6.196 1.00 0.00 H new ATOM 0 HA VAL A 59 107.070 2.412 -8.417 1.00 0.00 H new ATOM 0 HB VAL A 59 107.391 2.538 -5.372 1.00 0.00 H new ATOM 0 HG11 VAL A 59 108.550 4.682 -5.836 1.00 0.00 H new ATOM 0 HG12 VAL A 59 109.396 3.321 -6.610 1.00 0.00 H new ATOM 0 HG13 VAL A 59 108.370 4.401 -7.584 1.00 0.00 H new ATOM 0 HG21 VAL A 59 106.065 4.623 -5.573 1.00 0.00 H new ATOM 0 HG22 VAL A 59 105.893 4.346 -7.323 1.00 0.00 H new ATOM 0 HG23 VAL A 59 105.143 3.221 -6.166 1.00 0.00 H new ATOM 862 N ALA A 60 108.830 0.541 -6.343 1.00 0.00 N ATOM 863 CA ALA A 60 110.037 -0.327 -6.305 1.00 0.00 C ATOM 864 C ALA A 60 109.898 -1.426 -7.364 1.00 0.00 C ATOM 865 O ALA A 60 110.873 -1.948 -7.860 1.00 0.00 O ATOM 866 CB ALA A 60 110.060 -0.927 -4.896 1.00 0.00 C ATOM 0 H ALA A 60 108.342 0.646 -5.453 1.00 0.00 H new ATOM 0 HA ALA A 60 110.957 0.218 -6.516 1.00 0.00 H new ATOM 0 HB1 ALA A 60 110.926 -1.581 -4.793 1.00 0.00 H new ATOM 0 HB2 ALA A 60 110.121 -0.125 -4.160 1.00 0.00 H new ATOM 0 HB3 ALA A 60 109.149 -1.502 -4.731 1.00 0.00 H new ATOM 872 N GLU A 61 108.682 -1.770 -7.724 1.00 0.00 N ATOM 873 CA GLU A 61 108.477 -2.829 -8.762 1.00 0.00 C ATOM 874 C GLU A 61 109.269 -2.484 -10.028 1.00 0.00 C ATOM 875 O GLU A 61 110.273 -3.106 -10.318 1.00 0.00 O ATOM 876 CB GLU A 61 106.973 -2.837 -9.045 1.00 0.00 C ATOM 877 CG GLU A 61 106.551 -4.225 -9.531 1.00 0.00 C ATOM 878 CD GLU A 61 107.172 -4.491 -10.904 1.00 0.00 C ATOM 879 OE1 GLU A 61 107.065 -3.625 -11.757 1.00 0.00 O ATOM 880 OE2 GLU A 61 107.742 -5.555 -11.077 1.00 0.00 O ATOM 0 H GLU A 61 107.827 -1.364 -7.345 1.00 0.00 H new ATOM 0 HA GLU A 61 108.824 -3.807 -8.427 1.00 0.00 H new ATOM 0 HB2 GLU A 61 106.421 -2.573 -8.143 1.00 0.00 H new ATOM 0 HB3 GLU A 61 106.730 -2.087 -9.798 1.00 0.00 H new ATOM 0 HG2 GLU A 61 106.874 -4.985 -8.820 1.00 0.00 H new ATOM 0 HG3 GLU A 61 105.464 -4.287 -9.593 1.00 0.00 H new ATOM 887 N LEU A 62 108.848 -1.496 -10.785 1.00 0.00 N ATOM 888 CA LEU A 62 109.618 -1.139 -12.011 1.00 0.00 C ATOM 889 C LEU A 62 111.054 -0.799 -11.626 1.00 0.00 C ATOM 890 O LEU A 62 111.985 -1.121 -12.329 1.00 0.00 O ATOM 891 CB LEU A 62 108.924 0.071 -12.624 1.00 0.00 C ATOM 892 CG LEU A 62 108.831 -0.138 -14.141 1.00 0.00 C ATOM 893 CD1 LEU A 62 108.381 1.155 -14.821 1.00 0.00 C ATOM 894 CD2 LEU A 62 110.201 -0.548 -14.694 1.00 0.00 C ATOM 0 H LEU A 62 108.017 -0.932 -10.607 1.00 0.00 H new ATOM 0 HA LEU A 62 109.650 -1.963 -12.724 1.00 0.00 H new ATOM 0 HB2 LEU A 62 107.929 0.194 -12.197 1.00 0.00 H new ATOM 0 HB3 LEU A 62 109.481 0.981 -12.400 1.00 0.00 H new ATOM 0 HG LEU A 62 108.104 -0.925 -14.343 1.00 0.00 H new ATOM 0 HD11 LEU A 62 108.318 0.997 -15.898 1.00 0.00 H new ATOM 0 HD12 LEU A 62 107.402 1.446 -14.439 1.00 0.00 H new ATOM 0 HD13 LEU A 62 109.101 1.946 -14.612 1.00 0.00 H new ATOM 0 HD21 LEU A 62 110.129 -0.695 -15.772 1.00 0.00 H new ATOM 0 HD22 LEU A 62 110.928 0.236 -14.482 1.00 0.00 H new ATOM 0 HD23 LEU A 62 110.521 -1.477 -14.222 1.00 0.00 H new ATOM 906 N LEU A 63 111.239 -0.167 -10.501 1.00 0.00 N ATOM 907 CA LEU A 63 112.620 0.175 -10.061 1.00 0.00 C ATOM 908 C LEU A 63 113.452 -1.106 -9.951 1.00 0.00 C ATOM 909 O LEU A 63 114.414 -1.295 -10.670 1.00 0.00 O ATOM 910 CB LEU A 63 112.448 0.825 -8.689 1.00 0.00 C ATOM 911 CG LEU A 63 112.233 2.329 -8.858 1.00 0.00 C ATOM 912 CD1 LEU A 63 111.222 2.826 -7.822 1.00 0.00 C ATOM 913 CD2 LEU A 63 113.563 3.053 -8.658 1.00 0.00 C ATOM 0 H LEU A 63 110.495 0.127 -9.868 1.00 0.00 H new ATOM 0 HA LEU A 63 113.133 0.837 -10.758 1.00 0.00 H new ATOM 0 HB2 LEU A 63 111.598 0.382 -8.169 1.00 0.00 H new ATOM 0 HB3 LEU A 63 113.329 0.640 -8.075 1.00 0.00 H new ATOM 0 HG LEU A 63 111.851 2.531 -9.859 1.00 0.00 H new ATOM 0 HD11 LEU A 63 111.072 3.898 -7.946 1.00 0.00 H new ATOM 0 HD12 LEU A 63 110.273 2.308 -7.962 1.00 0.00 H new ATOM 0 HD13 LEU A 63 111.600 2.626 -6.819 1.00 0.00 H new ATOM 0 HD21 LEU A 63 113.415 4.126 -8.778 1.00 0.00 H new ATOM 0 HD22 LEU A 63 113.942 2.848 -7.657 1.00 0.00 H new ATOM 0 HD23 LEU A 63 114.283 2.702 -9.397 1.00 0.00 H new ATOM 925 N LEU A 64 113.078 -1.992 -9.067 1.00 0.00 N ATOM 926 CA LEU A 64 113.838 -3.268 -8.925 1.00 0.00 C ATOM 927 C LEU A 64 113.774 -4.042 -10.242 1.00 0.00 C ATOM 928 O LEU A 64 114.689 -4.754 -10.604 1.00 0.00 O ATOM 929 CB LEU A 64 113.132 -4.041 -7.808 1.00 0.00 C ATOM 930 CG LEU A 64 113.979 -3.991 -6.530 1.00 0.00 C ATOM 931 CD1 LEU A 64 113.074 -3.725 -5.324 1.00 0.00 C ATOM 932 CD2 LEU A 64 114.698 -5.329 -6.341 1.00 0.00 C ATOM 0 H LEU A 64 112.281 -1.888 -8.439 1.00 0.00 H new ATOM 0 HA LEU A 64 114.890 -3.106 -8.689 1.00 0.00 H new ATOM 0 HB2 LEU A 64 112.148 -3.611 -7.621 1.00 0.00 H new ATOM 0 HB3 LEU A 64 112.975 -5.076 -8.112 1.00 0.00 H new ATOM 0 HG LEU A 64 114.714 -3.191 -6.615 1.00 0.00 H new ATOM 0 HD11 LEU A 64 113.677 -3.690 -4.417 1.00 0.00 H new ATOM 0 HD12 LEU A 64 112.562 -2.772 -5.456 1.00 0.00 H new ATOM 0 HD13 LEU A 64 112.337 -4.524 -5.239 1.00 0.00 H new ATOM 0 HD21 LEU A 64 115.300 -5.294 -5.433 1.00 0.00 H new ATOM 0 HD22 LEU A 64 113.962 -6.129 -6.258 1.00 0.00 H new ATOM 0 HD23 LEU A 64 115.345 -5.519 -7.198 1.00 0.00 H new ATOM 944 N LEU A 65 112.695 -3.896 -10.962 1.00 0.00 N ATOM 945 CA LEU A 65 112.554 -4.604 -12.258 1.00 0.00 C ATOM 946 C LEU A 65 113.542 -4.017 -13.274 1.00 0.00 C ATOM 947 O LEU A 65 114.257 -4.735 -13.946 1.00 0.00 O ATOM 948 CB LEU A 65 111.104 -4.348 -12.689 1.00 0.00 C ATOM 949 CG LEU A 65 110.912 -4.725 -14.162 1.00 0.00 C ATOM 950 CD1 LEU A 65 111.131 -6.229 -14.337 1.00 0.00 C ATOM 951 CD2 LEU A 65 109.489 -4.363 -14.601 1.00 0.00 C ATOM 0 H LEU A 65 111.901 -3.311 -10.702 1.00 0.00 H new ATOM 0 HA LEU A 65 112.768 -5.670 -12.186 1.00 0.00 H new ATOM 0 HB2 LEU A 65 110.424 -4.930 -12.066 1.00 0.00 H new ATOM 0 HB3 LEU A 65 110.853 -3.298 -12.540 1.00 0.00 H new ATOM 0 HG LEU A 65 111.631 -4.179 -14.773 1.00 0.00 H new ATOM 0 HD11 LEU A 65 110.994 -6.497 -15.385 1.00 0.00 H new ATOM 0 HD12 LEU A 65 112.143 -6.488 -14.025 1.00 0.00 H new ATOM 0 HD13 LEU A 65 110.412 -6.775 -13.726 1.00 0.00 H new ATOM 0 HD21 LEU A 65 109.352 -4.631 -15.649 1.00 0.00 H new ATOM 0 HD22 LEU A 65 108.770 -4.909 -13.990 1.00 0.00 H new ATOM 0 HD23 LEU A 65 109.331 -3.292 -14.477 1.00 0.00 H new ATOM 963 N HIS A 66 113.584 -2.715 -13.387 1.00 0.00 N ATOM 964 CA HIS A 66 114.518 -2.075 -14.349 1.00 0.00 C ATOM 965 C HIS A 66 115.942 -2.067 -13.771 1.00 0.00 C ATOM 966 O HIS A 66 116.908 -1.889 -14.485 1.00 0.00 O ATOM 967 CB HIS A 66 113.976 -0.657 -14.529 1.00 0.00 C ATOM 968 CG HIS A 66 113.767 -0.373 -15.994 1.00 0.00 C ATOM 969 ND1 HIS A 66 112.883 0.596 -16.443 1.00 0.00 N ATOM 970 CD2 HIS A 66 114.313 -0.930 -17.121 1.00 0.00 C ATOM 971 CE1 HIS A 66 112.925 0.593 -17.788 1.00 0.00 C ATOM 972 NE2 HIS A 66 113.781 -0.319 -18.254 1.00 0.00 N ATOM 0 H HIS A 66 113.007 -2.068 -12.850 1.00 0.00 H new ATOM 0 HA HIS A 66 114.578 -2.603 -15.301 1.00 0.00 H new ATOM 0 HB2 HIS A 66 113.035 -0.546 -13.990 1.00 0.00 H new ATOM 0 HB3 HIS A 66 114.673 0.065 -14.105 1.00 0.00 H new ATOM 0 HD2 HIS A 66 115.046 -1.723 -17.129 1.00 0.00 H new ATOM 0 HE1 HIS A 66 112.338 1.249 -18.414 1.00 0.00 H new ATOM 0 HE2 HIS A 66 113.999 -0.524 -19.229 1.00 0.00 H new ATOM 980 N GLY A 67 116.080 -2.287 -12.484 1.00 0.00 N ATOM 981 CA GLY A 67 117.432 -2.327 -11.875 1.00 0.00 C ATOM 982 C GLY A 67 117.705 -1.082 -11.024 1.00 0.00 C ATOM 983 O GLY A 67 118.609 -0.320 -11.309 1.00 0.00 O ATOM 0 H GLY A 67 115.308 -2.440 -11.835 1.00 0.00 H new ATOM 0 HA2 GLY A 67 117.527 -3.219 -11.256 1.00 0.00 H new ATOM 0 HA3 GLY A 67 118.183 -2.403 -12.661 1.00 0.00 H new ATOM 987 N ALA A 68 116.961 -0.879 -9.963 1.00 0.00 N ATOM 988 CA ALA A 68 117.222 0.304 -9.091 1.00 0.00 C ATOM 989 C ALA A 68 118.407 -0.002 -8.171 1.00 0.00 C ATOM 990 O ALA A 68 119.324 -0.707 -8.545 1.00 0.00 O ATOM 991 CB ALA A 68 115.935 0.492 -8.282 1.00 0.00 C ATOM 0 H ALA A 68 116.190 -1.478 -9.667 1.00 0.00 H new ATOM 0 HA ALA A 68 117.471 1.203 -9.654 1.00 0.00 H new ATOM 0 HB1 ALA A 68 116.047 1.346 -7.614 1.00 0.00 H new ATOM 0 HB2 ALA A 68 115.101 0.669 -8.961 1.00 0.00 H new ATOM 0 HB3 ALA A 68 115.740 -0.405 -7.695 1.00 0.00 H new ATOM 997 N GLU A 69 118.394 0.511 -6.974 1.00 0.00 N ATOM 998 CA GLU A 69 119.514 0.238 -6.028 1.00 0.00 C ATOM 999 C GLU A 69 118.998 -0.524 -4.797 1.00 0.00 C ATOM 1000 O GLU A 69 119.192 -0.089 -3.679 1.00 0.00 O ATOM 1001 CB GLU A 69 120.026 1.620 -5.623 1.00 0.00 C ATOM 1002 CG GLU A 69 121.093 2.089 -6.614 1.00 0.00 C ATOM 1003 CD GLU A 69 122.489 1.838 -6.036 1.00 0.00 C ATOM 1004 OE1 GLU A 69 122.576 1.346 -4.922 1.00 0.00 O ATOM 1005 OE2 GLU A 69 123.452 2.144 -6.719 1.00 0.00 O ATOM 0 H GLU A 69 117.654 1.110 -6.607 1.00 0.00 H new ATOM 0 HA GLU A 69 120.295 -0.376 -6.476 1.00 0.00 H new ATOM 0 HB2 GLU A 69 119.200 2.331 -5.600 1.00 0.00 H new ATOM 0 HB3 GLU A 69 120.443 1.583 -4.617 1.00 0.00 H new ATOM 0 HG2 GLU A 69 120.981 1.559 -7.560 1.00 0.00 H new ATOM 0 HG3 GLU A 69 120.963 3.150 -6.826 1.00 0.00 H new ATOM 1012 N PRO A 70 118.352 -1.643 -5.038 1.00 0.00 N ATOM 1013 CA PRO A 70 117.806 -2.458 -3.920 1.00 0.00 C ATOM 1014 C PRO A 70 118.935 -3.130 -3.129 1.00 0.00 C ATOM 1015 O PRO A 70 118.723 -3.630 -2.042 1.00 0.00 O ATOM 1016 CB PRO A 70 116.949 -3.505 -4.626 1.00 0.00 C ATOM 1017 CG PRO A 70 117.534 -3.616 -5.996 1.00 0.00 C ATOM 1018 CD PRO A 70 118.069 -2.254 -6.345 1.00 0.00 C ATOM 0 HA PRO A 70 117.246 -1.863 -3.198 1.00 0.00 H new ATOM 0 HB2 PRO A 70 116.982 -4.461 -4.103 1.00 0.00 H new ATOM 0 HB3 PRO A 70 115.904 -3.199 -4.666 1.00 0.00 H new ATOM 0 HG2 PRO A 70 118.328 -4.362 -6.019 1.00 0.00 H new ATOM 0 HG3 PRO A 70 116.779 -3.932 -6.716 1.00 0.00 H new ATOM 0 HD2 PRO A 70 118.968 -2.322 -6.958 1.00 0.00 H new ATOM 0 HD3 PRO A 70 117.342 -1.671 -6.910 1.00 0.00 H new ATOM 1026 N ASN A 71 120.130 -3.153 -3.663 1.00 0.00 N ATOM 1027 CA ASN A 71 121.261 -3.801 -2.932 1.00 0.00 C ATOM 1028 C ASN A 71 122.171 -2.736 -2.311 1.00 0.00 C ATOM 1029 O ASN A 71 122.141 -2.501 -1.119 1.00 0.00 O ATOM 1030 CB ASN A 71 122.010 -4.609 -4.000 1.00 0.00 C ATOM 1031 CG ASN A 71 123.295 -5.203 -3.409 1.00 0.00 C ATOM 1032 OD1 ASN A 71 124.029 -4.533 -2.709 1.00 0.00 O ATOM 1033 ND2 ASN A 71 123.605 -6.443 -3.670 1.00 0.00 N ATOM 0 H ASN A 71 120.371 -2.753 -4.570 1.00 0.00 H new ATOM 0 HA ASN A 71 120.919 -4.434 -2.113 1.00 0.00 H new ATOM 0 HB2 ASN A 71 121.371 -5.408 -4.377 1.00 0.00 H new ATOM 0 HB3 ASN A 71 122.253 -3.968 -4.848 1.00 0.00 H new ATOM 0 HD21 ASN A 71 124.460 -6.846 -3.287 1.00 0.00 H new ATOM 0 HD22 ASN A 71 122.992 -7.009 -4.257 1.00 0.00 H new ATOM 1040 N CYS A 72 122.989 -2.103 -3.113 1.00 0.00 N ATOM 1041 CA CYS A 72 123.919 -1.062 -2.585 1.00 0.00 C ATOM 1042 C CYS A 72 123.188 -0.096 -1.647 1.00 0.00 C ATOM 1043 O CYS A 72 122.038 0.238 -1.855 1.00 0.00 O ATOM 1044 CB CYS A 72 124.423 -0.323 -3.829 1.00 0.00 C ATOM 1045 SG CYS A 72 126.175 -0.699 -4.098 1.00 0.00 S ATOM 0 H CYS A 72 123.052 -2.265 -4.118 1.00 0.00 H new ATOM 0 HA CYS A 72 124.730 -1.499 -2.003 1.00 0.00 H new ATOM 0 HB2 CYS A 72 123.840 -0.620 -4.701 1.00 0.00 H new ATOM 0 HB3 CYS A 72 124.287 0.751 -3.705 1.00 0.00 H new ATOM 0 HG CYS A 72 126.596 -0.071 -5.156 1.00 0.00 H new ATOM 1051 N ALA A 73 123.852 0.356 -0.617 1.00 0.00 N ATOM 1052 CA ALA A 73 123.206 1.302 0.339 1.00 0.00 C ATOM 1053 C ALA A 73 123.973 2.626 0.361 1.00 0.00 C ATOM 1054 O ALA A 73 124.652 2.970 -0.586 1.00 0.00 O ATOM 1055 CB ALA A 73 123.279 0.609 1.698 1.00 0.00 C ATOM 0 H ALA A 73 124.817 0.110 -0.396 1.00 0.00 H new ATOM 0 HA ALA A 73 122.178 1.535 0.063 1.00 0.00 H new ATOM 0 HB1 ALA A 73 122.822 1.245 2.456 1.00 0.00 H new ATOM 0 HB2 ALA A 73 122.745 -0.340 1.651 1.00 0.00 H new ATOM 0 HB3 ALA A 73 124.322 0.427 1.958 1.00 0.00 H new ATOM 1061 N ASP A 74 123.870 3.374 1.426 1.00 0.00 N ATOM 1062 CA ASP A 74 124.591 4.679 1.494 1.00 0.00 C ATOM 1063 C ASP A 74 125.846 4.553 2.368 1.00 0.00 C ATOM 1064 O ASP A 74 125.844 3.843 3.351 1.00 0.00 O ATOM 1065 CB ASP A 74 123.592 5.647 2.134 1.00 0.00 C ATOM 1066 CG ASP A 74 123.590 6.977 1.375 1.00 0.00 C ATOM 1067 OD1 ASP A 74 123.889 6.964 0.190 1.00 0.00 O ATOM 1068 OD2 ASP A 74 123.287 7.985 1.990 1.00 0.00 O ATOM 0 H ASP A 74 123.319 3.139 2.251 1.00 0.00 H new ATOM 0 HA ASP A 74 124.922 5.017 0.512 1.00 0.00 H new ATOM 0 HB2 ASP A 74 122.593 5.211 2.123 1.00 0.00 H new ATOM 0 HB3 ASP A 74 123.855 5.815 3.178 1.00 0.00 H new ATOM 1073 N PRO A 75 126.883 5.252 1.981 1.00 0.00 N ATOM 1074 CA PRO A 75 128.151 5.212 2.751 1.00 0.00 C ATOM 1075 C PRO A 75 127.994 5.967 4.074 1.00 0.00 C ATOM 1076 O PRO A 75 128.782 5.806 4.987 1.00 0.00 O ATOM 1077 CB PRO A 75 129.149 5.918 1.837 1.00 0.00 C ATOM 1078 CG PRO A 75 128.315 6.808 0.973 1.00 0.00 C ATOM 1079 CD PRO A 75 126.976 6.136 0.813 1.00 0.00 C ATOM 0 HA PRO A 75 128.463 4.201 3.012 1.00 0.00 H new ATOM 0 HB2 PRO A 75 129.874 6.493 2.413 1.00 0.00 H new ATOM 0 HB3 PRO A 75 129.713 5.202 1.239 1.00 0.00 H new ATOM 0 HG2 PRO A 75 128.201 7.792 1.429 1.00 0.00 H new ATOM 0 HG3 PRO A 75 128.789 6.959 0.003 1.00 0.00 H new ATOM 0 HD2 PRO A 75 126.164 6.863 0.796 1.00 0.00 H new ATOM 0 HD3 PRO A 75 126.920 5.574 -0.119 1.00 0.00 H new ATOM 1087 N ALA A 76 126.981 6.788 4.188 1.00 0.00 N ATOM 1088 CA ALA A 76 126.776 7.547 5.455 1.00 0.00 C ATOM 1089 C ALA A 76 126.448 6.576 6.591 1.00 0.00 C ATOM 1090 O ALA A 76 127.292 6.249 7.402 1.00 0.00 O ATOM 1091 CB ALA A 76 125.595 8.481 5.180 1.00 0.00 C ATOM 0 H ALA A 76 126.289 6.964 3.459 1.00 0.00 H new ATOM 0 HA ALA A 76 127.663 8.105 5.755 1.00 0.00 H new ATOM 0 HB1 ALA A 76 125.385 9.074 6.070 1.00 0.00 H new ATOM 0 HB2 ALA A 76 125.842 9.145 4.352 1.00 0.00 H new ATOM 0 HB3 ALA A 76 124.716 7.890 4.922 1.00 0.00 H new ATOM 1097 N THR A 77 125.230 6.106 6.656 1.00 0.00 N ATOM 1098 CA THR A 77 124.859 5.151 7.737 1.00 0.00 C ATOM 1099 C THR A 77 124.504 3.787 7.141 1.00 0.00 C ATOM 1100 O THR A 77 123.740 3.034 7.708 1.00 0.00 O ATOM 1101 CB THR A 77 123.644 5.769 8.425 1.00 0.00 C ATOM 1102 OG1 THR A 77 122.658 6.086 7.451 1.00 0.00 O ATOM 1103 CG2 THR A 77 124.066 7.038 9.163 1.00 0.00 C ATOM 0 H THR A 77 124.479 6.343 6.008 1.00 0.00 H new ATOM 0 HA THR A 77 125.679 4.988 8.437 1.00 0.00 H new ATOM 0 HB THR A 77 123.229 5.058 9.140 1.00 0.00 H new ATOM 0 HG1 THR A 77 122.053 5.324 7.338 1.00 0.00 H new ATOM 0 HG21 THR A 77 123.198 7.479 9.654 1.00 0.00 H new ATOM 0 HG22 THR A 77 124.819 6.790 9.911 1.00 0.00 H new ATOM 0 HG23 THR A 77 124.482 7.751 8.452 1.00 0.00 H new ATOM 1111 N LEU A 78 125.060 3.466 6.003 1.00 0.00 N ATOM 1112 CA LEU A 78 124.769 2.147 5.357 1.00 0.00 C ATOM 1113 C LEU A 78 123.264 1.855 5.351 1.00 0.00 C ATOM 1114 O LEU A 78 122.848 0.714 5.407 1.00 0.00 O ATOM 1115 CB LEU A 78 125.506 1.112 6.213 1.00 0.00 C ATOM 1116 CG LEU A 78 126.803 0.664 5.523 1.00 0.00 C ATOM 1117 CD1 LEU A 78 127.351 -0.570 6.242 1.00 0.00 C ATOM 1118 CD2 LEU A 78 126.531 0.305 4.058 1.00 0.00 C ATOM 0 H LEU A 78 125.707 4.063 5.488 1.00 0.00 H new ATOM 0 HA LEU A 78 125.092 2.131 4.316 1.00 0.00 H new ATOM 0 HB2 LEU A 78 125.736 1.537 7.190 1.00 0.00 H new ATOM 0 HB3 LEU A 78 124.862 0.249 6.384 1.00 0.00 H new ATOM 0 HG LEU A 78 127.525 1.479 5.563 1.00 0.00 H new ATOM 0 HD11 LEU A 78 128.272 -0.894 5.758 1.00 0.00 H new ATOM 0 HD12 LEU A 78 127.556 -0.323 7.284 1.00 0.00 H new ATOM 0 HD13 LEU A 78 126.616 -1.373 6.198 1.00 0.00 H new ATOM 0 HD21 LEU A 78 127.460 -0.011 3.582 1.00 0.00 H new ATOM 0 HD22 LEU A 78 125.805 -0.507 4.011 1.00 0.00 H new ATOM 0 HD23 LEU A 78 126.135 1.177 3.537 1.00 0.00 H new ATOM 1130 N THR A 79 122.447 2.871 5.276 1.00 0.00 N ATOM 1131 CA THR A 79 120.975 2.635 5.255 1.00 0.00 C ATOM 1132 C THR A 79 120.588 1.927 3.954 1.00 0.00 C ATOM 1133 O THR A 79 120.467 2.545 2.916 1.00 0.00 O ATOM 1134 CB THR A 79 120.342 4.031 5.333 1.00 0.00 C ATOM 1135 OG1 THR A 79 120.596 4.592 6.614 1.00 0.00 O ATOM 1136 CG2 THR A 79 118.828 3.942 5.111 1.00 0.00 C ATOM 0 H THR A 79 122.733 3.849 5.229 1.00 0.00 H new ATOM 0 HA THR A 79 120.638 2.002 6.076 1.00 0.00 H new ATOM 0 HB THR A 79 120.778 4.661 4.557 1.00 0.00 H new ATOM 0 HG1 THR A 79 120.910 3.890 7.222 1.00 0.00 H new ATOM 0 HG21 THR A 79 118.392 4.940 5.169 1.00 0.00 H new ATOM 0 HG22 THR A 79 118.629 3.516 4.128 1.00 0.00 H new ATOM 0 HG23 THR A 79 118.384 3.307 5.878 1.00 0.00 H new ATOM 1144 N ARG A 80 120.390 0.636 4.003 1.00 0.00 N ATOM 1145 CA ARG A 80 120.005 -0.107 2.765 1.00 0.00 C ATOM 1146 C ARG A 80 118.530 0.158 2.447 1.00 0.00 C ATOM 1147 O ARG A 80 117.796 0.639 3.287 1.00 0.00 O ATOM 1148 CB ARG A 80 120.219 -1.588 3.092 1.00 0.00 C ATOM 1149 CG ARG A 80 121.266 -2.183 2.141 1.00 0.00 C ATOM 1150 CD ARG A 80 121.025 -3.689 1.982 1.00 0.00 C ATOM 1151 NE ARG A 80 121.977 -4.135 0.920 1.00 0.00 N ATOM 1152 CZ ARG A 80 123.267 -4.003 1.091 1.00 0.00 C ATOM 1153 NH1 ARG A 80 123.828 -2.834 0.949 1.00 0.00 N ATOM 1154 NH2 ARG A 80 123.997 -5.041 1.397 1.00 0.00 N ATOM 0 H ARG A 80 120.478 0.065 4.843 1.00 0.00 H new ATOM 0 HA ARG A 80 120.592 0.201 1.899 1.00 0.00 H new ATOM 0 HB2 ARG A 80 120.548 -1.698 4.125 1.00 0.00 H new ATOM 0 HB3 ARG A 80 119.278 -2.131 2.998 1.00 0.00 H new ATOM 0 HG2 ARG A 80 121.210 -1.692 1.170 1.00 0.00 H new ATOM 0 HG3 ARG A 80 122.268 -2.005 2.531 1.00 0.00 H new ATOM 0 HD2 ARG A 80 121.206 -4.217 2.918 1.00 0.00 H new ATOM 0 HD3 ARG A 80 119.993 -3.893 1.695 1.00 0.00 H new ATOM 0 HE ARG A 80 121.619 -4.545 0.057 1.00 0.00 H new ATOM 0 HH11 ARG A 80 123.261 -2.022 0.705 1.00 0.00 H new ATOM 0 HH12 ARG A 80 124.834 -2.732 1.082 1.00 0.00 H new ATOM 0 HH21 ARG A 80 123.562 -5.957 1.503 1.00 0.00 H new ATOM 0 HH22 ARG A 80 125.003 -4.936 1.530 1.00 0.00 H new ATOM 1168 N PRO A 81 118.134 -0.181 1.247 1.00 0.00 N ATOM 1169 CA PRO A 81 116.725 0.015 0.838 1.00 0.00 C ATOM 1170 C PRO A 81 115.832 -0.999 1.564 1.00 0.00 C ATOM 1171 O PRO A 81 114.621 -0.893 1.552 1.00 0.00 O ATOM 1172 CB PRO A 81 116.746 -0.247 -0.665 1.00 0.00 C ATOM 1173 CG PRO A 81 117.929 -1.132 -0.880 1.00 0.00 C ATOM 1174 CD PRO A 81 118.943 -0.766 0.171 1.00 0.00 C ATOM 0 HA PRO A 81 116.333 1.003 1.079 1.00 0.00 H new ATOM 0 HB2 PRO A 81 115.826 -0.729 -0.996 1.00 0.00 H new ATOM 0 HB3 PRO A 81 116.839 0.682 -1.227 1.00 0.00 H new ATOM 0 HG2 PRO A 81 117.647 -2.182 -0.796 1.00 0.00 H new ATOM 0 HG3 PRO A 81 118.340 -0.991 -1.880 1.00 0.00 H new ATOM 0 HD2 PRO A 81 119.496 -1.640 0.516 1.00 0.00 H new ATOM 0 HD3 PRO A 81 119.676 -0.055 -0.210 1.00 0.00 H new ATOM 1182 N VAL A 82 116.426 -1.977 2.202 1.00 0.00 N ATOM 1183 CA VAL A 82 115.624 -2.996 2.936 1.00 0.00 C ATOM 1184 C VAL A 82 114.973 -2.360 4.167 1.00 0.00 C ATOM 1185 O VAL A 82 113.800 -2.548 4.425 1.00 0.00 O ATOM 1186 CB VAL A 82 116.636 -4.067 3.357 1.00 0.00 C ATOM 1187 CG1 VAL A 82 115.967 -5.081 4.288 1.00 0.00 C ATOM 1188 CG2 VAL A 82 117.161 -4.792 2.114 1.00 0.00 C ATOM 0 H VAL A 82 117.436 -2.111 2.244 1.00 0.00 H new ATOM 0 HA VAL A 82 114.821 -3.412 2.327 1.00 0.00 H new ATOM 0 HB VAL A 82 117.463 -3.588 3.881 1.00 0.00 H new ATOM 0 HG11 VAL A 82 116.693 -5.839 4.583 1.00 0.00 H new ATOM 0 HG12 VAL A 82 115.596 -4.570 5.176 1.00 0.00 H new ATOM 0 HG13 VAL A 82 115.135 -5.558 3.769 1.00 0.00 H new ATOM 0 HG21 VAL A 82 117.881 -5.554 2.414 1.00 0.00 H new ATOM 0 HG22 VAL A 82 116.330 -5.264 1.590 1.00 0.00 H new ATOM 0 HG23 VAL A 82 117.646 -4.075 1.452 1.00 0.00 H new ATOM 1198 N HIS A 83 115.727 -1.605 4.927 1.00 0.00 N ATOM 1199 CA HIS A 83 115.151 -0.956 6.143 1.00 0.00 C ATOM 1200 C HIS A 83 113.885 -0.195 5.763 1.00 0.00 C ATOM 1201 O HIS A 83 112.853 -0.339 6.381 1.00 0.00 O ATOM 1202 CB HIS A 83 116.221 0.020 6.635 1.00 0.00 C ATOM 1203 CG HIS A 83 117.391 -0.748 7.177 1.00 0.00 C ATOM 1204 ND1 HIS A 83 118.187 -1.560 6.365 1.00 0.00 N ATOM 1205 CD2 HIS A 83 117.920 -0.847 8.445 1.00 0.00 C ATOM 1206 CE1 HIS A 83 119.140 -2.103 7.143 1.00 0.00 C ATOM 1207 NE2 HIS A 83 119.006 -1.694 8.394 1.00 0.00 N ATOM 0 H HIS A 83 116.714 -1.411 4.758 1.00 0.00 H new ATOM 0 HA HIS A 83 114.887 -1.683 6.911 1.00 0.00 H new ATOM 0 HB2 HIS A 83 116.543 0.665 5.817 1.00 0.00 H new ATOM 0 HB3 HIS A 83 115.809 0.668 7.408 1.00 0.00 H new ATOM 0 HD2 HIS A 83 117.548 -0.347 9.327 1.00 0.00 H new ATOM 0 HE1 HIS A 83 119.907 -2.779 6.795 1.00 0.00 H new ATOM 0 HE2 HIS A 83 119.600 -1.958 9.180 1.00 0.00 H new ATOM 1215 N ASP A 84 113.972 0.610 4.739 1.00 0.00 N ATOM 1216 CA ASP A 84 112.796 1.404 4.275 1.00 0.00 C ATOM 1217 C ASP A 84 111.513 0.561 4.279 1.00 0.00 C ATOM 1218 O ASP A 84 110.524 0.932 4.881 1.00 0.00 O ATOM 1219 CB ASP A 84 113.164 1.826 2.854 1.00 0.00 C ATOM 1220 CG ASP A 84 114.405 2.719 2.895 1.00 0.00 C ATOM 1221 OD1 ASP A 84 115.500 2.180 2.915 1.00 0.00 O ATOM 1222 OD2 ASP A 84 114.241 3.928 2.906 1.00 0.00 O ATOM 0 H ASP A 84 114.823 0.754 4.195 1.00 0.00 H new ATOM 0 HA ASP A 84 112.592 2.254 4.927 1.00 0.00 H new ATOM 0 HB2 ASP A 84 113.356 0.946 2.240 1.00 0.00 H new ATOM 0 HB3 ASP A 84 112.333 2.361 2.395 1.00 0.00 H new ATOM 1227 N ALA A 85 111.518 -0.567 3.616 1.00 0.00 N ATOM 1228 CA ALA A 85 110.292 -1.423 3.589 1.00 0.00 C ATOM 1229 C ALA A 85 109.813 -1.707 5.021 1.00 0.00 C ATOM 1230 O ALA A 85 108.725 -1.329 5.411 1.00 0.00 O ATOM 1231 CB ALA A 85 110.727 -2.725 2.918 1.00 0.00 C ATOM 0 H ALA A 85 112.314 -0.932 3.094 1.00 0.00 H new ATOM 0 HA ALA A 85 109.470 -0.941 3.059 1.00 0.00 H new ATOM 0 HB1 ALA A 85 109.878 -3.407 2.862 1.00 0.00 H new ATOM 0 HB2 ALA A 85 111.089 -2.513 1.912 1.00 0.00 H new ATOM 0 HB3 ALA A 85 111.524 -3.186 3.501 1.00 0.00 H new ATOM 1237 N ALA A 86 110.626 -2.377 5.800 1.00 0.00 N ATOM 1238 CA ALA A 86 110.239 -2.700 7.204 1.00 0.00 C ATOM 1239 C ALA A 86 110.057 -1.418 8.024 1.00 0.00 C ATOM 1240 O ALA A 86 109.324 -1.393 8.990 1.00 0.00 O ATOM 1241 CB ALA A 86 111.401 -3.536 7.753 1.00 0.00 C ATOM 0 H ALA A 86 111.547 -2.715 5.520 1.00 0.00 H new ATOM 0 HA ALA A 86 109.291 -3.236 7.255 1.00 0.00 H new ATOM 0 HB1 ALA A 86 111.192 -3.815 8.786 1.00 0.00 H new ATOM 0 HB2 ALA A 86 111.518 -4.437 7.150 1.00 0.00 H new ATOM 0 HB3 ALA A 86 112.320 -2.952 7.713 1.00 0.00 H new ATOM 1247 N ARG A 87 110.716 -0.353 7.651 1.00 0.00 N ATOM 1248 CA ARG A 87 110.570 0.922 8.417 1.00 0.00 C ATOM 1249 C ARG A 87 109.120 1.407 8.352 1.00 0.00 C ATOM 1250 O ARG A 87 108.636 2.071 9.247 1.00 0.00 O ATOM 1251 CB ARG A 87 111.498 1.921 7.724 1.00 0.00 C ATOM 1252 CG ARG A 87 111.856 3.043 8.699 1.00 0.00 C ATOM 1253 CD ARG A 87 110.767 4.118 8.666 1.00 0.00 C ATOM 1254 NE ARG A 87 111.413 5.295 8.022 1.00 0.00 N ATOM 1255 CZ ARG A 87 111.157 5.578 6.773 1.00 0.00 C ATOM 1256 NH1 ARG A 87 111.669 4.847 5.819 1.00 0.00 N ATOM 1257 NH2 ARG A 87 110.389 6.590 6.479 1.00 0.00 N ATOM 0 H ARG A 87 111.348 -0.309 6.851 1.00 0.00 H new ATOM 0 HA ARG A 87 110.824 0.800 9.470 1.00 0.00 H new ATOM 0 HB2 ARG A 87 112.403 1.418 7.384 1.00 0.00 H new ATOM 0 HB3 ARG A 87 111.011 2.334 6.840 1.00 0.00 H new ATOM 0 HG2 ARG A 87 111.956 2.643 9.708 1.00 0.00 H new ATOM 0 HG3 ARG A 87 112.819 3.478 8.431 1.00 0.00 H new ATOM 0 HD2 ARG A 87 109.898 3.784 8.098 1.00 0.00 H new ATOM 0 HD3 ARG A 87 110.418 4.359 9.670 1.00 0.00 H new ATOM 0 HE ARG A 87 112.055 5.880 8.556 1.00 0.00 H new ATOM 0 HH11 ARG A 87 112.269 4.055 6.050 1.00 0.00 H new ATOM 0 HH12 ARG A 87 111.469 5.068 4.844 1.00 0.00 H new ATOM 0 HH21 ARG A 87 109.989 7.160 7.224 1.00 0.00 H new ATOM 0 HH22 ARG A 87 110.189 6.812 5.504 1.00 0.00 H new ATOM 1271 N GLU A 88 108.424 1.076 7.297 1.00 0.00 N ATOM 1272 CA GLU A 88 107.003 1.510 7.168 1.00 0.00 C ATOM 1273 C GLU A 88 106.070 0.309 7.331 1.00 0.00 C ATOM 1274 O GLU A 88 104.902 0.455 7.632 1.00 0.00 O ATOM 1275 CB GLU A 88 106.888 2.079 5.753 1.00 0.00 C ATOM 1276 CG GLU A 88 106.803 3.604 5.822 1.00 0.00 C ATOM 1277 CD GLU A 88 105.949 4.126 4.664 1.00 0.00 C ATOM 1278 OE1 GLU A 88 105.073 3.400 4.223 1.00 0.00 O ATOM 1279 OE2 GLU A 88 106.184 5.244 4.241 1.00 0.00 O ATOM 0 H GLU A 88 108.780 0.523 6.517 1.00 0.00 H new ATOM 0 HA GLU A 88 106.725 2.241 7.928 1.00 0.00 H new ATOM 0 HB2 GLU A 88 107.750 1.779 5.158 1.00 0.00 H new ATOM 0 HB3 GLU A 88 106.004 1.677 5.259 1.00 0.00 H new ATOM 0 HG2 GLU A 88 106.369 3.911 6.774 1.00 0.00 H new ATOM 0 HG3 GLU A 88 107.802 4.036 5.773 1.00 0.00 H new ATOM 1286 N GLY A 89 106.577 -0.877 7.131 1.00 0.00 N ATOM 1287 CA GLY A 89 105.725 -2.086 7.270 1.00 0.00 C ATOM 1288 C GLY A 89 105.178 -2.467 5.895 1.00 0.00 C ATOM 1289 O GLY A 89 104.080 -2.975 5.770 1.00 0.00 O ATOM 0 H GLY A 89 107.548 -1.058 6.877 1.00 0.00 H new ATOM 0 HA2 GLY A 89 106.305 -2.910 7.686 1.00 0.00 H new ATOM 0 HA3 GLY A 89 104.905 -1.892 7.961 1.00 0.00 H new ATOM 1293 N PHE A 90 105.936 -2.222 4.859 1.00 0.00 N ATOM 1294 CA PHE A 90 105.460 -2.563 3.491 1.00 0.00 C ATOM 1295 C PHE A 90 106.068 -3.886 3.030 1.00 0.00 C ATOM 1296 O PHE A 90 107.105 -3.923 2.398 1.00 0.00 O ATOM 1297 CB PHE A 90 105.920 -1.410 2.602 1.00 0.00 C ATOM 1298 CG PHE A 90 104.813 -1.078 1.634 1.00 0.00 C ATOM 1299 CD1 PHE A 90 104.625 -1.871 0.499 1.00 0.00 C ATOM 1300 CD2 PHE A 90 103.971 0.012 1.874 1.00 0.00 C ATOM 1301 CE1 PHE A 90 103.594 -1.575 -0.398 1.00 0.00 C ATOM 1302 CE2 PHE A 90 102.940 0.309 0.976 1.00 0.00 C ATOM 1303 CZ PHE A 90 102.752 -0.484 -0.160 1.00 0.00 C ATOM 0 H PHE A 90 106.864 -1.800 4.903 1.00 0.00 H new ATOM 0 HA PHE A 90 104.378 -2.688 3.454 1.00 0.00 H new ATOM 0 HB2 PHE A 90 106.166 -0.539 3.209 1.00 0.00 H new ATOM 0 HB3 PHE A 90 106.825 -1.687 2.061 1.00 0.00 H new ATOM 0 HD1 PHE A 90 105.276 -2.713 0.315 1.00 0.00 H new ATOM 0 HD2 PHE A 90 104.116 0.624 2.752 1.00 0.00 H new ATOM 0 HE1 PHE A 90 103.448 -2.189 -1.275 1.00 0.00 H new ATOM 0 HE2 PHE A 90 102.289 1.151 1.160 1.00 0.00 H new ATOM 0 HZ PHE A 90 101.957 -0.254 -0.854 1.00 0.00 H new ATOM 1313 N LEU A 91 105.422 -4.974 3.342 1.00 0.00 N ATOM 1314 CA LEU A 91 105.946 -6.306 2.930 1.00 0.00 C ATOM 1315 C LEU A 91 106.039 -6.395 1.407 1.00 0.00 C ATOM 1316 O LEU A 91 106.971 -6.960 0.867 1.00 0.00 O ATOM 1317 CB LEU A 91 104.924 -7.315 3.454 1.00 0.00 C ATOM 1318 CG LEU A 91 105.643 -8.559 3.979 1.00 0.00 C ATOM 1319 CD1 LEU A 91 106.638 -9.074 2.935 1.00 0.00 C ATOM 1320 CD2 LEU A 91 106.385 -8.209 5.265 1.00 0.00 C ATOM 0 H LEU A 91 104.548 -4.998 3.868 1.00 0.00 H new ATOM 0 HA LEU A 91 106.946 -6.489 3.323 1.00 0.00 H new ATOM 0 HB2 LEU A 91 104.330 -6.865 4.249 1.00 0.00 H new ATOM 0 HB3 LEU A 91 104.233 -7.592 2.658 1.00 0.00 H new ATOM 0 HG LEU A 91 104.908 -9.338 4.180 1.00 0.00 H new ATOM 0 HD11 LEU A 91 107.144 -9.960 3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 91 106.105 -9.330 2.019 1.00 0.00 H new ATOM 0 HD13 LEU A 91 107.375 -8.300 2.721 1.00 0.00 H new ATOM 0 HD21 LEU A 91 106.898 -9.094 5.641 1.00 0.00 H new ATOM 0 HD22 LEU A 91 107.115 -7.425 5.062 1.00 0.00 H new ATOM 0 HD23 LEU A 91 105.673 -7.858 6.012 1.00 0.00 H new ATOM 1332 N ASP A 92 105.074 -5.850 0.712 1.00 0.00 N ATOM 1333 CA ASP A 92 105.092 -5.905 -0.780 1.00 0.00 C ATOM 1334 C ASP A 92 106.478 -5.516 -1.304 1.00 0.00 C ATOM 1335 O ASP A 92 107.039 -6.175 -2.155 1.00 0.00 O ATOM 1336 CB ASP A 92 104.032 -4.892 -1.231 1.00 0.00 C ATOM 1337 CG ASP A 92 102.674 -5.252 -0.616 1.00 0.00 C ATOM 1338 OD1 ASP A 92 102.572 -6.315 -0.024 1.00 0.00 O ATOM 1339 OD2 ASP A 92 101.759 -4.455 -0.744 1.00 0.00 O ATOM 0 H ASP A 92 104.271 -5.367 1.116 1.00 0.00 H new ATOM 0 HA ASP A 92 104.880 -6.904 -1.161 1.00 0.00 H new ATOM 0 HB2 ASP A 92 104.324 -3.887 -0.927 1.00 0.00 H new ATOM 0 HB3 ASP A 92 103.959 -4.888 -2.319 1.00 0.00 H new ATOM 1344 N THR A 93 107.034 -4.456 -0.784 1.00 0.00 N ATOM 1345 CA THR A 93 108.387 -4.017 -1.230 1.00 0.00 C ATOM 1346 C THR A 93 109.421 -5.110 -0.928 1.00 0.00 C ATOM 1347 O THR A 93 110.235 -5.452 -1.761 1.00 0.00 O ATOM 1348 CB THR A 93 108.665 -2.749 -0.412 1.00 0.00 C ATOM 1349 OG1 THR A 93 107.756 -1.730 -0.809 1.00 0.00 O ATOM 1350 CG2 THR A 93 110.099 -2.268 -0.648 1.00 0.00 C ATOM 0 H THR A 93 106.607 -3.872 -0.065 1.00 0.00 H new ATOM 0 HA THR A 93 108.442 -3.829 -2.302 1.00 0.00 H new ATOM 0 HB THR A 93 108.537 -2.973 0.647 1.00 0.00 H new ATOM 0 HG1 THR A 93 106.891 -1.875 -0.372 1.00 0.00 H new ATOM 0 HG21 THR A 93 110.282 -1.368 -0.061 1.00 0.00 H new ATOM 0 HG22 THR A 93 110.799 -3.047 -0.345 1.00 0.00 H new ATOM 0 HG23 THR A 93 110.239 -2.046 -1.706 1.00 0.00 H new ATOM 1358 N LEU A 94 109.390 -5.658 0.259 1.00 0.00 N ATOM 1359 CA LEU A 94 110.368 -6.731 0.628 1.00 0.00 C ATOM 1360 C LEU A 94 110.377 -7.836 -0.433 1.00 0.00 C ATOM 1361 O LEU A 94 111.396 -8.135 -1.024 1.00 0.00 O ATOM 1362 CB LEU A 94 109.865 -7.276 1.970 1.00 0.00 C ATOM 1363 CG LEU A 94 110.934 -7.090 3.055 1.00 0.00 C ATOM 1364 CD1 LEU A 94 111.288 -5.607 3.193 1.00 0.00 C ATOM 1365 CD2 LEU A 94 110.388 -7.602 4.392 1.00 0.00 C ATOM 0 H LEU A 94 108.727 -5.409 0.993 1.00 0.00 H new ATOM 0 HA LEU A 94 111.388 -6.354 0.695 1.00 0.00 H new ATOM 0 HB2 LEU A 94 108.950 -6.760 2.260 1.00 0.00 H new ATOM 0 HB3 LEU A 94 109.617 -8.333 1.871 1.00 0.00 H new ATOM 0 HG LEU A 94 111.828 -7.648 2.777 1.00 0.00 H new ATOM 0 HD11 LEU A 94 112.047 -5.485 3.965 1.00 0.00 H new ATOM 0 HD12 LEU A 94 111.673 -5.235 2.243 1.00 0.00 H new ATOM 0 HD13 LEU A 94 110.396 -5.044 3.469 1.00 0.00 H new ATOM 0 HD21 LEU A 94 111.143 -7.472 5.167 1.00 0.00 H new ATOM 0 HD22 LEU A 94 109.494 -7.039 4.659 1.00 0.00 H new ATOM 0 HD23 LEU A 94 110.138 -8.659 4.302 1.00 0.00 H new ATOM 1377 N VAL A 95 109.242 -8.439 -0.679 1.00 0.00 N ATOM 1378 CA VAL A 95 109.164 -9.524 -1.705 1.00 0.00 C ATOM 1379 C VAL A 95 109.867 -9.087 -2.995 1.00 0.00 C ATOM 1380 O VAL A 95 110.699 -9.792 -3.528 1.00 0.00 O ATOM 1381 CB VAL A 95 107.664 -9.715 -1.938 1.00 0.00 C ATOM 1382 CG1 VAL A 95 107.427 -10.625 -3.146 1.00 0.00 C ATOM 1383 CG2 VAL A 95 107.045 -10.348 -0.693 1.00 0.00 C ATOM 0 H VAL A 95 108.361 -8.226 -0.211 1.00 0.00 H new ATOM 0 HA VAL A 95 109.652 -10.445 -1.385 1.00 0.00 H new ATOM 0 HB VAL A 95 107.203 -8.747 -2.133 1.00 0.00 H new ATOM 0 HG11 VAL A 95 106.356 -10.753 -3.301 1.00 0.00 H new ATOM 0 HG12 VAL A 95 107.871 -10.174 -4.034 1.00 0.00 H new ATOM 0 HG13 VAL A 95 107.886 -11.597 -2.965 1.00 0.00 H new ATOM 0 HG21 VAL A 95 105.975 -10.488 -0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 95 107.514 -11.314 -0.505 1.00 0.00 H new ATOM 0 HG23 VAL A 95 107.204 -9.694 0.165 1.00 0.00 H new ATOM 1393 N VAL A 96 109.535 -7.927 -3.493 1.00 0.00 N ATOM 1394 CA VAL A 96 110.178 -7.431 -4.745 1.00 0.00 C ATOM 1395 C VAL A 96 111.705 -7.418 -4.592 1.00 0.00 C ATOM 1396 O VAL A 96 112.427 -7.934 -5.422 1.00 0.00 O ATOM 1397 CB VAL A 96 109.649 -6.007 -4.922 1.00 0.00 C ATOM 1398 CG1 VAL A 96 110.240 -5.397 -6.196 1.00 0.00 C ATOM 1399 CG2 VAL A 96 108.119 -6.033 -5.025 1.00 0.00 C ATOM 0 H VAL A 96 108.843 -7.298 -3.085 1.00 0.00 H new ATOM 0 HA VAL A 96 109.951 -8.064 -5.603 1.00 0.00 H new ATOM 0 HB VAL A 96 109.941 -5.404 -4.062 1.00 0.00 H new ATOM 0 HG11 VAL A 96 109.863 -4.382 -6.322 1.00 0.00 H new ATOM 0 HG12 VAL A 96 111.327 -5.373 -6.118 1.00 0.00 H new ATOM 0 HG13 VAL A 96 109.951 -6.001 -7.056 1.00 0.00 H new ATOM 0 HG21 VAL A 96 107.745 -5.017 -5.151 1.00 0.00 H new ATOM 0 HG22 VAL A 96 107.822 -6.638 -5.882 1.00 0.00 H new ATOM 0 HG23 VAL A 96 107.700 -6.463 -4.115 1.00 0.00 H new ATOM 1409 N LEU A 97 112.196 -6.823 -3.536 1.00 0.00 N ATOM 1410 CA LEU A 97 113.674 -6.763 -3.319 1.00 0.00 C ATOM 1411 C LEU A 97 114.299 -8.159 -3.435 1.00 0.00 C ATOM 1412 O LEU A 97 115.209 -8.380 -4.211 1.00 0.00 O ATOM 1413 CB LEU A 97 113.839 -6.221 -1.897 1.00 0.00 C ATOM 1414 CG LEU A 97 114.157 -4.724 -1.948 1.00 0.00 C ATOM 1415 CD1 LEU A 97 112.853 -3.927 -1.956 1.00 0.00 C ATOM 1416 CD2 LEU A 97 114.982 -4.332 -0.715 1.00 0.00 C ATOM 0 H LEU A 97 111.636 -6.374 -2.811 1.00 0.00 H new ATOM 0 HA LEU A 97 114.170 -6.138 -4.061 1.00 0.00 H new ATOM 0 HB2 LEU A 97 112.926 -6.389 -1.325 1.00 0.00 H new ATOM 0 HB3 LEU A 97 114.639 -6.755 -1.385 1.00 0.00 H new ATOM 0 HG LEU A 97 114.726 -4.506 -2.852 1.00 0.00 H new ATOM 0 HD11 LEU A 97 113.078 -2.861 -1.992 1.00 0.00 H new ATOM 0 HD12 LEU A 97 112.263 -4.203 -2.830 1.00 0.00 H new ATOM 0 HD13 LEU A 97 112.286 -4.147 -1.051 1.00 0.00 H new ATOM 0 HD21 LEU A 97 115.208 -3.266 -0.752 1.00 0.00 H new ATOM 0 HD22 LEU A 97 114.413 -4.551 0.188 1.00 0.00 H new ATOM 0 HD23 LEU A 97 115.912 -4.900 -0.704 1.00 0.00 H new ATOM 1428 N HIS A 98 113.821 -9.098 -2.662 1.00 0.00 N ATOM 1429 CA HIS A 98 114.389 -10.481 -2.713 1.00 0.00 C ATOM 1430 C HIS A 98 113.987 -11.189 -4.011 1.00 0.00 C ATOM 1431 O HIS A 98 114.782 -11.864 -4.636 1.00 0.00 O ATOM 1432 CB HIS A 98 113.777 -11.197 -1.509 1.00 0.00 C ATOM 1433 CG HIS A 98 114.650 -12.353 -1.105 1.00 0.00 C ATOM 1434 ND1 HIS A 98 114.366 -13.137 0.000 1.00 0.00 N ATOM 1435 CD2 HIS A 98 115.800 -12.871 -1.648 1.00 0.00 C ATOM 1436 CE1 HIS A 98 115.325 -14.078 0.088 1.00 0.00 C ATOM 1437 NE2 HIS A 98 116.225 -13.960 -0.892 1.00 0.00 N ATOM 0 H HIS A 98 113.060 -8.968 -1.995 1.00 0.00 H new ATOM 0 HA HIS A 98 115.479 -10.475 -2.686 1.00 0.00 H new ATOM 0 HB2 HIS A 98 113.671 -10.502 -0.676 1.00 0.00 H new ATOM 0 HB3 HIS A 98 112.777 -11.554 -1.756 1.00 0.00 H new ATOM 0 HD2 HIS A 98 116.299 -12.491 -2.528 1.00 0.00 H new ATOM 0 HE1 HIS A 98 115.362 -14.836 0.857 1.00 0.00 H new ATOM 0 HE2 HIS A 98 117.047 -14.543 -1.052 1.00 0.00 H new ATOM 1445 N ARG A 99 112.754 -11.045 -4.412 1.00 0.00 N ATOM 1446 CA ARG A 99 112.274 -11.715 -5.660 1.00 0.00 C ATOM 1447 C ARG A 99 113.007 -11.198 -6.900 1.00 0.00 C ATOM 1448 O ARG A 99 112.833 -11.718 -7.986 1.00 0.00 O ATOM 1449 CB ARG A 99 110.784 -11.377 -5.737 1.00 0.00 C ATOM 1450 CG ARG A 99 110.118 -12.212 -6.834 1.00 0.00 C ATOM 1451 CD ARG A 99 109.199 -11.317 -7.672 1.00 0.00 C ATOM 1452 NE ARG A 99 109.764 -11.361 -9.049 1.00 0.00 N ATOM 1453 CZ ARG A 99 109.536 -10.379 -9.878 1.00 0.00 C ATOM 1454 NH1 ARG A 99 108.313 -9.979 -10.093 1.00 0.00 N ATOM 1455 NH2 ARG A 99 110.532 -9.796 -10.486 1.00 0.00 N ATOM 0 H ARG A 99 112.051 -10.488 -3.927 1.00 0.00 H new ATOM 0 HA ARG A 99 112.460 -12.789 -5.632 1.00 0.00 H new ATOM 0 HB2 ARG A 99 110.307 -11.574 -4.777 1.00 0.00 H new ATOM 0 HB3 ARG A 99 110.653 -10.315 -5.946 1.00 0.00 H new ATOM 0 HG2 ARG A 99 110.877 -12.668 -7.470 1.00 0.00 H new ATOM 0 HG3 ARG A 99 109.544 -13.025 -6.389 1.00 0.00 H new ATOM 0 HD2 ARG A 99 108.172 -11.682 -7.656 1.00 0.00 H new ATOM 0 HD3 ARG A 99 109.182 -10.298 -7.285 1.00 0.00 H new ATOM 0 HE ARG A 99 110.329 -12.158 -9.344 1.00 0.00 H new ATOM 0 HH11 ARG A 99 107.536 -10.434 -9.613 1.00 0.00 H new ATOM 0 HH12 ARG A 99 108.134 -9.212 -10.741 1.00 0.00 H new ATOM 0 HH21 ARG A 99 111.488 -10.108 -10.313 1.00 0.00 H new ATOM 0 HH22 ARG A 99 110.355 -9.028 -11.134 1.00 0.00 H new ATOM 1469 N ALA A 100 113.812 -10.183 -6.765 1.00 0.00 N ATOM 1470 CA ALA A 100 114.526 -9.654 -7.953 1.00 0.00 C ATOM 1471 C ALA A 100 116.012 -9.444 -7.644 1.00 0.00 C ATOM 1472 O ALA A 100 116.874 -10.015 -8.286 1.00 0.00 O ATOM 1473 CB ALA A 100 113.831 -8.332 -8.247 1.00 0.00 C ATOM 0 H ALA A 100 114.004 -9.700 -5.887 1.00 0.00 H new ATOM 0 HA ALA A 100 114.492 -10.336 -8.803 1.00 0.00 H new ATOM 0 HB1 ALA A 100 114.293 -7.863 -9.116 1.00 0.00 H new ATOM 0 HB2 ALA A 100 112.776 -8.513 -8.451 1.00 0.00 H new ATOM 0 HB3 ALA A 100 113.926 -7.672 -7.385 1.00 0.00 H new ATOM 1479 N GLY A 101 116.322 -8.629 -6.672 1.00 0.00 N ATOM 1480 CA GLY A 101 117.749 -8.384 -6.329 1.00 0.00 C ATOM 1481 C GLY A 101 117.831 -7.542 -5.057 1.00 0.00 C ATOM 1482 O GLY A 101 117.517 -6.370 -5.060 1.00 0.00 O ATOM 0 H GLY A 101 115.646 -8.122 -6.101 1.00 0.00 H new ATOM 0 HA2 GLY A 101 118.267 -9.332 -6.184 1.00 0.00 H new ATOM 0 HA3 GLY A 101 118.248 -7.870 -7.151 1.00 0.00 H new ATOM 1486 N ALA A 102 118.248 -8.130 -3.964 1.00 0.00 N ATOM 1487 CA ALA A 102 118.343 -7.356 -2.690 1.00 0.00 C ATOM 1488 C ALA A 102 119.011 -8.189 -1.593 1.00 0.00 C ATOM 1489 O ALA A 102 118.677 -9.338 -1.378 1.00 0.00 O ATOM 1490 CB ALA A 102 116.894 -7.052 -2.309 1.00 0.00 C ATOM 0 H ALA A 102 118.526 -9.109 -3.899 1.00 0.00 H new ATOM 0 HA ALA A 102 118.944 -6.454 -2.808 1.00 0.00 H new ATOM 0 HB1 ALA A 102 116.874 -6.483 -1.380 1.00 0.00 H new ATOM 0 HB2 ALA A 102 116.424 -6.469 -3.101 1.00 0.00 H new ATOM 0 HB3 ALA A 102 116.350 -7.987 -2.174 1.00 0.00 H new ATOM 1496 N ARG A 103 119.944 -7.609 -0.888 1.00 0.00 N ATOM 1497 CA ARG A 103 120.628 -8.353 0.207 1.00 0.00 C ATOM 1498 C ARG A 103 119.978 -8.004 1.550 1.00 0.00 C ATOM 1499 O ARG A 103 120.474 -7.181 2.294 1.00 0.00 O ATOM 1500 CB ARG A 103 122.083 -7.875 0.163 1.00 0.00 C ATOM 1501 CG ARG A 103 122.849 -8.421 1.373 1.00 0.00 C ATOM 1502 CD ARG A 103 124.242 -8.879 0.930 1.00 0.00 C ATOM 1503 NE ARG A 103 124.964 -9.194 2.194 1.00 0.00 N ATOM 1504 CZ ARG A 103 126.269 -9.182 2.218 1.00 0.00 C ATOM 1505 NH1 ARG A 103 126.944 -10.004 1.466 1.00 0.00 N ATOM 1506 NH2 ARG A 103 126.899 -8.347 2.996 1.00 0.00 N ATOM 0 H ARG A 103 120.262 -6.650 -1.024 1.00 0.00 H new ATOM 0 HA ARG A 103 120.559 -9.434 0.089 1.00 0.00 H new ATOM 0 HB2 ARG A 103 122.557 -8.210 -0.760 1.00 0.00 H new ATOM 0 HB3 ARG A 103 122.117 -6.786 0.162 1.00 0.00 H new ATOM 0 HG2 ARG A 103 122.934 -7.652 2.141 1.00 0.00 H new ATOM 0 HG3 ARG A 103 122.304 -9.255 1.816 1.00 0.00 H new ATOM 0 HD2 ARG A 103 124.182 -9.753 0.281 1.00 0.00 H new ATOM 0 HD3 ARG A 103 124.754 -8.098 0.367 1.00 0.00 H new ATOM 0 HE ARG A 103 124.440 -9.419 3.039 1.00 0.00 H new ATOM 0 HH11 ARG A 103 126.453 -10.658 0.857 1.00 0.00 H new ATOM 0 HH12 ARG A 103 127.964 -9.993 1.486 1.00 0.00 H new ATOM 0 HH21 ARG A 103 126.372 -7.703 3.586 1.00 0.00 H new ATOM 0 HH22 ARG A 103 127.919 -8.338 3.015 1.00 0.00 H new ATOM 1520 N LEU A 104 118.869 -8.622 1.859 1.00 0.00 N ATOM 1521 CA LEU A 104 118.180 -8.327 3.151 1.00 0.00 C ATOM 1522 C LEU A 104 119.003 -8.873 4.320 1.00 0.00 C ATOM 1523 O LEU A 104 118.598 -9.802 4.986 1.00 0.00 O ATOM 1524 CB LEU A 104 116.834 -9.056 3.062 1.00 0.00 C ATOM 1525 CG LEU A 104 116.067 -8.587 1.818 1.00 0.00 C ATOM 1526 CD1 LEU A 104 115.921 -9.749 0.829 1.00 0.00 C ATOM 1527 CD2 LEU A 104 114.675 -8.094 2.225 1.00 0.00 C ATOM 0 H LEU A 104 118.410 -9.319 1.273 1.00 0.00 H new ATOM 0 HA LEU A 104 118.054 -7.257 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 104 116.996 -10.133 3.015 1.00 0.00 H new ATOM 0 HB3 LEU A 104 116.245 -8.861 3.958 1.00 0.00 H new ATOM 0 HG LEU A 104 116.619 -7.775 1.346 1.00 0.00 H new ATOM 0 HD11 LEU A 104 115.376 -9.411 -0.052 1.00 0.00 H new ATOM 0 HD12 LEU A 104 116.909 -10.100 0.532 1.00 0.00 H new ATOM 0 HD13 LEU A 104 115.374 -10.564 1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 104 114.133 -7.762 1.339 1.00 0.00 H new ATOM 0 HD22 LEU A 104 114.127 -8.906 2.702 1.00 0.00 H new ATOM 0 HD23 LEU A 104 114.773 -7.263 2.923 1.00 0.00 H new ATOM 1539 N ASP A 105 120.155 -8.306 4.573 1.00 0.00 N ATOM 1540 CA ASP A 105 121.002 -8.805 5.699 1.00 0.00 C ATOM 1541 C ASP A 105 122.141 -7.818 5.991 1.00 0.00 C ATOM 1542 O ASP A 105 123.226 -8.205 6.376 1.00 0.00 O ATOM 1543 CB ASP A 105 121.556 -10.146 5.205 1.00 0.00 C ATOM 1544 CG ASP A 105 122.533 -10.726 6.234 1.00 0.00 C ATOM 1545 OD1 ASP A 105 122.358 -10.451 7.411 1.00 0.00 O ATOM 1546 OD2 ASP A 105 123.443 -11.429 5.826 1.00 0.00 O ATOM 0 H ASP A 105 120.545 -7.522 4.051 1.00 0.00 H new ATOM 0 HA ASP A 105 120.440 -8.912 6.627 1.00 0.00 H new ATOM 0 HB2 ASP A 105 120.738 -10.846 5.035 1.00 0.00 H new ATOM 0 HB3 ASP A 105 122.062 -10.009 4.249 1.00 0.00 H new ATOM 1551 N VAL A 106 121.905 -6.545 5.818 1.00 0.00 N ATOM 1552 CA VAL A 106 122.978 -5.550 6.097 1.00 0.00 C ATOM 1553 C VAL A 106 122.679 -4.810 7.404 1.00 0.00 C ATOM 1554 O VAL A 106 121.789 -5.176 8.144 1.00 0.00 O ATOM 1555 CB VAL A 106 122.970 -4.596 4.890 1.00 0.00 C ATOM 1556 CG1 VAL A 106 121.944 -3.477 5.087 1.00 0.00 C ATOM 1557 CG2 VAL A 106 124.361 -3.987 4.714 1.00 0.00 C ATOM 0 H VAL A 106 121.020 -6.153 5.497 1.00 0.00 H new ATOM 0 HA VAL A 106 123.957 -6.013 6.223 1.00 0.00 H new ATOM 0 HB VAL A 106 122.697 -5.164 4.000 1.00 0.00 H new ATOM 0 HG11 VAL A 106 121.957 -2.815 4.221 1.00 0.00 H new ATOM 0 HG12 VAL A 106 120.950 -3.910 5.198 1.00 0.00 H new ATOM 0 HG13 VAL A 106 122.194 -2.908 5.982 1.00 0.00 H new ATOM 0 HG21 VAL A 106 124.357 -3.311 3.859 1.00 0.00 H new ATOM 0 HG22 VAL A 106 124.632 -3.434 5.613 1.00 0.00 H new ATOM 0 HG23 VAL A 106 125.087 -4.782 4.544 1.00 0.00 H new ATOM 1567 N ARG A 107 123.416 -3.775 7.688 1.00 0.00 N ATOM 1568 CA ARG A 107 123.180 -3.008 8.942 1.00 0.00 C ATOM 1569 C ARG A 107 123.108 -1.513 8.647 1.00 0.00 C ATOM 1570 O ARG A 107 123.780 -1.014 7.766 1.00 0.00 O ATOM 1571 CB ARG A 107 124.398 -3.300 9.814 1.00 0.00 C ATOM 1572 CG ARG A 107 124.160 -4.572 10.626 1.00 0.00 C ATOM 1573 CD ARG A 107 125.488 -5.045 11.222 1.00 0.00 C ATOM 1574 NE ARG A 107 125.248 -6.456 11.634 1.00 0.00 N ATOM 1575 CZ ARG A 107 125.897 -6.965 12.651 1.00 0.00 C ATOM 1576 NH1 ARG A 107 127.075 -6.502 12.978 1.00 0.00 N ATOM 1577 NH2 ARG A 107 125.368 -7.939 13.338 1.00 0.00 N ATOM 0 H ARG A 107 124.175 -3.425 7.103 1.00 0.00 H new ATOM 0 HA ARG A 107 122.242 -3.290 9.421 1.00 0.00 H new ATOM 0 HB2 ARG A 107 125.284 -3.416 9.190 1.00 0.00 H new ATOM 0 HB3 ARG A 107 124.587 -2.461 10.483 1.00 0.00 H new ATOM 0 HG2 ARG A 107 123.439 -4.381 11.421 1.00 0.00 H new ATOM 0 HG3 ARG A 107 123.736 -5.349 9.991 1.00 0.00 H new ATOM 0 HD2 ARG A 107 126.294 -4.979 10.491 1.00 0.00 H new ATOM 0 HD3 ARG A 107 125.779 -4.430 12.073 1.00 0.00 H new ATOM 0 HE ARG A 107 124.576 -7.028 11.122 1.00 0.00 H new ATOM 0 HH11 ARG A 107 127.491 -5.742 12.440 1.00 0.00 H new ATOM 0 HH12 ARG A 107 127.578 -6.901 13.771 1.00 0.00 H new ATOM 0 HH21 ARG A 107 124.450 -8.303 13.083 1.00 0.00 H new ATOM 0 HH22 ARG A 107 125.872 -8.337 14.130 1.00 0.00 H new ATOM 1591 N ASP A 108 122.318 -0.787 9.391 1.00 0.00 N ATOM 1592 CA ASP A 108 122.231 0.684 9.165 1.00 0.00 C ATOM 1593 C ASP A 108 123.444 1.364 9.811 1.00 0.00 C ATOM 1594 O ASP A 108 123.306 2.255 10.623 1.00 0.00 O ATOM 1595 CB ASP A 108 120.933 1.116 9.857 1.00 0.00 C ATOM 1596 CG ASP A 108 120.541 2.522 9.394 1.00 0.00 C ATOM 1597 OD1 ASP A 108 121.429 3.274 9.026 1.00 0.00 O ATOM 1598 OD2 ASP A 108 119.359 2.821 9.419 1.00 0.00 O ATOM 0 H ASP A 108 121.731 -1.148 10.143 1.00 0.00 H new ATOM 0 HA ASP A 108 122.228 0.954 8.109 1.00 0.00 H new ATOM 0 HB2 ASP A 108 120.135 0.411 9.625 1.00 0.00 H new ATOM 0 HB3 ASP A 108 121.065 1.103 10.939 1.00 0.00 H new ATOM 1603 N ALA A 109 124.634 0.933 9.452 1.00 0.00 N ATOM 1604 CA ALA A 109 125.885 1.522 10.032 1.00 0.00 C ATOM 1605 C ALA A 109 125.896 1.372 11.554 1.00 0.00 C ATOM 1606 O ALA A 109 126.679 0.621 12.103 1.00 0.00 O ATOM 1607 CB ALA A 109 125.876 3.000 9.642 1.00 0.00 C ATOM 0 H ALA A 109 124.792 0.188 8.773 1.00 0.00 H new ATOM 0 HA ALA A 109 126.773 1.015 9.655 1.00 0.00 H new ATOM 0 HB1 ALA A 109 126.768 3.486 10.038 1.00 0.00 H new ATOM 0 HB2 ALA A 109 125.866 3.090 8.556 1.00 0.00 H new ATOM 0 HB3 ALA A 109 124.988 3.480 10.054 1.00 0.00 H new ATOM 1613 N TRP A 110 125.035 2.082 12.234 1.00 0.00 N ATOM 1614 CA TRP A 110 124.976 2.001 13.726 1.00 0.00 C ATOM 1615 C TRP A 110 125.130 0.546 14.198 1.00 0.00 C ATOM 1616 O TRP A 110 125.913 0.250 15.079 1.00 0.00 O ATOM 1617 CB TRP A 110 123.587 2.525 14.084 1.00 0.00 C ATOM 1618 CG TRP A 110 123.423 3.955 13.657 1.00 0.00 C ATOM 1619 CD1 TRP A 110 122.267 4.648 13.770 1.00 0.00 C ATOM 1620 CD2 TRP A 110 124.392 4.878 13.058 1.00 0.00 C ATOM 1621 NE1 TRP A 110 122.457 5.928 13.289 1.00 0.00 N ATOM 1622 CE2 TRP A 110 123.745 6.120 12.839 1.00 0.00 C ATOM 1623 CE3 TRP A 110 125.747 4.770 12.687 1.00 0.00 C ATOM 1624 CZ2 TRP A 110 124.413 7.208 12.278 1.00 0.00 C ATOM 1625 CZ3 TRP A 110 126.420 5.864 12.119 1.00 0.00 C ATOM 1626 CH2 TRP A 110 125.755 7.080 11.916 1.00 0.00 C ATOM 0 H TRP A 110 124.361 2.723 11.815 1.00 0.00 H new ATOM 0 HA TRP A 110 125.775 2.571 14.200 1.00 0.00 H new ATOM 0 HB2 TRP A 110 122.827 1.909 13.603 1.00 0.00 H new ATOM 0 HB3 TRP A 110 123.430 2.443 15.159 1.00 0.00 H new ATOM 0 HD1 TRP A 110 121.342 4.261 14.173 1.00 0.00 H new ATOM 0 HE1 TRP A 110 121.732 6.645 13.269 1.00 0.00 H new ATOM 0 HE3 TRP A 110 126.272 3.839 12.841 1.00 0.00 H new ATOM 0 HZ2 TRP A 110 123.895 8.143 12.125 1.00 0.00 H new ATOM 0 HZ3 TRP A 110 127.458 5.767 11.837 1.00 0.00 H new ATOM 0 HH2 TRP A 110 126.280 7.917 11.480 1.00 0.00 H new ATOM 1637 N GLY A 111 124.388 -0.361 13.615 1.00 0.00 N ATOM 1638 CA GLY A 111 124.490 -1.783 14.022 1.00 0.00 C ATOM 1639 C GLY A 111 123.117 -2.450 13.924 1.00 0.00 C ATOM 1640 O GLY A 111 123.004 -3.620 13.611 1.00 0.00 O ATOM 0 H GLY A 111 123.715 -0.171 12.872 1.00 0.00 H new ATOM 0 HA2 GLY A 111 125.204 -2.303 13.383 1.00 0.00 H new ATOM 0 HA3 GLY A 111 124.866 -1.853 15.043 1.00 0.00 H new ATOM 1644 N ARG A 112 122.072 -1.714 14.195 1.00 0.00 N ATOM 1645 CA ARG A 112 120.698 -2.299 14.123 1.00 0.00 C ATOM 1646 C ARG A 112 120.441 -2.887 12.730 1.00 0.00 C ATOM 1647 O ARG A 112 121.063 -2.505 11.759 1.00 0.00 O ATOM 1648 CB ARG A 112 119.747 -1.131 14.405 1.00 0.00 C ATOM 1649 CG ARG A 112 119.997 0.003 13.405 1.00 0.00 C ATOM 1650 CD ARG A 112 120.572 1.226 14.135 1.00 0.00 C ATOM 1651 NE ARG A 112 119.554 1.595 15.162 1.00 0.00 N ATOM 1652 CZ ARG A 112 118.347 1.945 14.801 1.00 0.00 C ATOM 1653 NH1 ARG A 112 118.155 2.582 13.678 1.00 0.00 N ATOM 1654 NH2 ARG A 112 117.332 1.658 15.569 1.00 0.00 N ATOM 0 H ARG A 112 122.109 -0.731 14.464 1.00 0.00 H new ATOM 0 HA ARG A 112 120.560 -3.112 14.836 1.00 0.00 H new ATOM 0 HB2 ARG A 112 118.713 -1.468 14.334 1.00 0.00 H new ATOM 0 HB3 ARG A 112 119.895 -0.769 15.422 1.00 0.00 H new ATOM 0 HG2 ARG A 112 120.690 -0.329 12.631 1.00 0.00 H new ATOM 0 HG3 ARG A 112 119.066 0.271 12.906 1.00 0.00 H new ATOM 0 HD2 ARG A 112 121.530 0.991 14.599 1.00 0.00 H new ATOM 0 HD3 ARG A 112 120.747 2.050 13.443 1.00 0.00 H new ATOM 0 HE ARG A 112 119.801 1.574 16.151 1.00 0.00 H new ATOM 0 HH11 ARG A 112 118.948 2.809 13.078 1.00 0.00 H new ATOM 0 HH12 ARG A 112 117.212 2.853 13.400 1.00 0.00 H new ATOM 0 HH21 ARG A 112 117.482 1.162 16.448 1.00 0.00 H new ATOM 0 HH22 ARG A 112 116.389 1.929 15.291 1.00 0.00 H new ATOM 1668 N LEU A 113 119.531 -3.820 12.634 1.00 0.00 N ATOM 1669 CA LEU A 113 119.229 -4.450 11.313 1.00 0.00 C ATOM 1670 C LEU A 113 117.888 -3.941 10.772 1.00 0.00 C ATOM 1671 O LEU A 113 117.124 -3.331 11.493 1.00 0.00 O ATOM 1672 CB LEU A 113 119.134 -5.950 11.609 1.00 0.00 C ATOM 1673 CG LEU A 113 120.531 -6.536 11.840 1.00 0.00 C ATOM 1674 CD1 LEU A 113 120.423 -8.053 12.033 1.00 0.00 C ATOM 1675 CD2 LEU A 113 121.424 -6.244 10.628 1.00 0.00 C ATOM 0 H LEU A 113 118.981 -4.175 13.416 1.00 0.00 H new ATOM 0 HA LEU A 113 119.987 -4.217 10.565 1.00 0.00 H new ATOM 0 HB2 LEU A 113 118.513 -6.115 12.489 1.00 0.00 H new ATOM 0 HB3 LEU A 113 118.650 -6.462 10.777 1.00 0.00 H new ATOM 0 HG LEU A 113 120.967 -6.081 12.729 1.00 0.00 H new ATOM 0 HD11 LEU A 113 121.416 -8.471 12.197 1.00 0.00 H new ATOM 0 HD12 LEU A 113 119.792 -8.266 12.896 1.00 0.00 H new ATOM 0 HD13 LEU A 113 119.983 -8.503 11.143 1.00 0.00 H new ATOM 0 HD21 LEU A 113 122.416 -6.663 10.798 1.00 0.00 H new ATOM 0 HD22 LEU A 113 120.987 -6.695 9.737 1.00 0.00 H new ATOM 0 HD23 LEU A 113 121.505 -5.166 10.487 1.00 0.00 H new ATOM 1687 N PRO A 114 117.633 -4.231 9.520 1.00 0.00 N ATOM 1688 CA PRO A 114 116.355 -3.816 8.888 1.00 0.00 C ATOM 1689 C PRO A 114 115.184 -4.548 9.544 1.00 0.00 C ATOM 1690 O PRO A 114 114.076 -4.050 9.592 1.00 0.00 O ATOM 1691 CB PRO A 114 116.524 -4.230 7.428 1.00 0.00 C ATOM 1692 CG PRO A 114 117.546 -5.317 7.460 1.00 0.00 C ATOM 1693 CD PRO A 114 118.489 -4.966 8.579 1.00 0.00 C ATOM 0 HA PRO A 114 116.143 -2.752 8.993 1.00 0.00 H new ATOM 0 HB2 PRO A 114 115.584 -4.583 7.005 1.00 0.00 H new ATOM 0 HB3 PRO A 114 116.855 -3.392 6.814 1.00 0.00 H new ATOM 0 HG2 PRO A 114 117.079 -6.287 7.633 1.00 0.00 H new ATOM 0 HG3 PRO A 114 118.076 -5.383 6.510 1.00 0.00 H new ATOM 0 HD2 PRO A 114 118.920 -5.856 9.037 1.00 0.00 H new ATOM 0 HD3 PRO A 114 119.320 -4.354 8.228 1.00 0.00 H new ATOM 1701 N VAL A 115 115.428 -5.722 10.063 1.00 0.00 N ATOM 1702 CA VAL A 115 114.332 -6.483 10.734 1.00 0.00 C ATOM 1703 C VAL A 115 114.086 -5.910 12.133 1.00 0.00 C ATOM 1704 O VAL A 115 112.978 -5.921 12.629 1.00 0.00 O ATOM 1705 CB VAL A 115 114.816 -7.942 10.819 1.00 0.00 C ATOM 1706 CG1 VAL A 115 116.209 -8.010 11.456 1.00 0.00 C ATOM 1707 CG2 VAL A 115 113.835 -8.758 11.668 1.00 0.00 C ATOM 0 H VAL A 115 116.336 -6.187 10.052 1.00 0.00 H new ATOM 0 HA VAL A 115 113.393 -6.415 10.185 1.00 0.00 H new ATOM 0 HB VAL A 115 114.867 -8.351 9.810 1.00 0.00 H new ATOM 0 HG11 VAL A 115 116.535 -9.049 11.508 1.00 0.00 H new ATOM 0 HG12 VAL A 115 116.914 -7.438 10.852 1.00 0.00 H new ATOM 0 HG13 VAL A 115 116.170 -7.591 12.462 1.00 0.00 H new ATOM 0 HG21 VAL A 115 114.178 -9.791 11.728 1.00 0.00 H new ATOM 0 HG22 VAL A 115 113.782 -8.334 12.671 1.00 0.00 H new ATOM 0 HG23 VAL A 115 112.846 -8.730 11.210 1.00 0.00 H new ATOM 1717 N ASP A 116 115.113 -5.407 12.768 1.00 0.00 N ATOM 1718 CA ASP A 116 114.940 -4.834 14.135 1.00 0.00 C ATOM 1719 C ASP A 116 113.941 -3.672 14.099 1.00 0.00 C ATOM 1720 O ASP A 116 113.018 -3.613 14.887 1.00 0.00 O ATOM 1721 CB ASP A 116 116.331 -4.338 14.537 1.00 0.00 C ATOM 1722 CG ASP A 116 116.592 -4.674 16.009 1.00 0.00 C ATOM 1723 OD1 ASP A 116 115.632 -4.896 16.728 1.00 0.00 O ATOM 1724 OD2 ASP A 116 117.751 -4.703 16.392 1.00 0.00 O ATOM 0 H ASP A 116 116.063 -5.369 12.399 1.00 0.00 H new ATOM 0 HA ASP A 116 114.550 -5.565 14.843 1.00 0.00 H new ATOM 0 HB2 ASP A 116 117.090 -4.803 13.908 1.00 0.00 H new ATOM 0 HB3 ASP A 116 116.403 -3.262 14.381 1.00 0.00 H new ATOM 1729 N LEU A 117 114.116 -2.752 13.188 1.00 0.00 N ATOM 1730 CA LEU A 117 113.176 -1.592 13.099 1.00 0.00 C ATOM 1731 C LEU A 117 111.738 -2.085 12.895 1.00 0.00 C ATOM 1732 O LEU A 117 110.852 -1.777 13.668 1.00 0.00 O ATOM 1733 CB LEU A 117 113.640 -0.795 11.878 1.00 0.00 C ATOM 1734 CG LEU A 117 114.894 0.016 12.234 1.00 0.00 C ATOM 1735 CD1 LEU A 117 116.039 -0.361 11.290 1.00 0.00 C ATOM 1736 CD2 LEU A 117 114.594 1.513 12.097 1.00 0.00 C ATOM 0 H LEU A 117 114.869 -2.752 12.500 1.00 0.00 H new ATOM 0 HA LEU A 117 113.182 -0.991 14.008 1.00 0.00 H new ATOM 0 HB2 LEU A 117 113.856 -1.471 11.051 1.00 0.00 H new ATOM 0 HB3 LEU A 117 112.846 -0.127 11.545 1.00 0.00 H new ATOM 0 HG LEU A 117 115.184 -0.205 13.261 1.00 0.00 H new ATOM 0 HD11 LEU A 117 116.927 0.217 11.546 1.00 0.00 H new ATOM 0 HD12 LEU A 117 116.257 -1.424 11.389 1.00 0.00 H new ATOM 0 HD13 LEU A 117 115.749 -0.144 10.262 1.00 0.00 H new ATOM 0 HD21 LEU A 117 115.485 2.087 12.350 1.00 0.00 H new ATOM 0 HD22 LEU A 117 114.300 1.733 11.071 1.00 0.00 H new ATOM 0 HD23 LEU A 117 113.783 1.785 12.773 1.00 0.00 H new ATOM 1748 N ALA A 118 111.502 -2.845 11.855 1.00 0.00 N ATOM 1749 CA ALA A 118 110.120 -3.358 11.591 1.00 0.00 C ATOM 1750 C ALA A 118 109.549 -4.026 12.846 1.00 0.00 C ATOM 1751 O ALA A 118 108.484 -3.677 13.317 1.00 0.00 O ATOM 1752 CB ALA A 118 110.281 -4.382 10.463 1.00 0.00 C ATOM 0 H ALA A 118 112.206 -3.133 11.176 1.00 0.00 H new ATOM 0 HA ALA A 118 109.432 -2.558 11.319 1.00 0.00 H new ATOM 0 HB1 ALA A 118 109.308 -4.804 10.213 1.00 0.00 H new ATOM 0 HB2 ALA A 118 110.701 -3.892 9.584 1.00 0.00 H new ATOM 0 HB3 ALA A 118 110.949 -5.180 10.788 1.00 0.00 H new ATOM 1758 N GLU A 119 110.251 -4.986 13.389 1.00 0.00 N ATOM 1759 CA GLU A 119 109.756 -5.685 14.618 1.00 0.00 C ATOM 1760 C GLU A 119 109.330 -4.668 15.681 1.00 0.00 C ATOM 1761 O GLU A 119 108.324 -4.836 16.345 1.00 0.00 O ATOM 1762 CB GLU A 119 110.950 -6.510 15.116 1.00 0.00 C ATOM 1763 CG GLU A 119 110.518 -7.961 15.350 1.00 0.00 C ATOM 1764 CD GLU A 119 110.715 -8.323 16.824 1.00 0.00 C ATOM 1765 OE1 GLU A 119 111.852 -8.324 17.267 1.00 0.00 O ATOM 1766 OE2 GLU A 119 109.725 -8.590 17.485 1.00 0.00 O ATOM 0 H GLU A 119 111.148 -5.319 13.035 1.00 0.00 H new ATOM 0 HA GLU A 119 108.885 -6.307 14.410 1.00 0.00 H new ATOM 0 HB2 GLU A 119 111.758 -6.475 14.385 1.00 0.00 H new ATOM 0 HB3 GLU A 119 111.338 -6.083 16.041 1.00 0.00 H new ATOM 0 HG2 GLU A 119 109.472 -8.090 15.070 1.00 0.00 H new ATOM 0 HG3 GLU A 119 111.102 -8.631 14.719 1.00 0.00 H new ATOM 1773 N GLU A 120 110.087 -3.618 15.848 1.00 0.00 N ATOM 1774 CA GLU A 120 109.727 -2.594 16.868 1.00 0.00 C ATOM 1775 C GLU A 120 108.641 -1.658 16.326 1.00 0.00 C ATOM 1776 O GLU A 120 107.869 -1.093 17.076 1.00 0.00 O ATOM 1777 CB GLU A 120 111.027 -1.838 17.138 1.00 0.00 C ATOM 1778 CG GLU A 120 111.927 -2.694 18.036 1.00 0.00 C ATOM 1779 CD GLU A 120 113.374 -2.199 17.954 1.00 0.00 C ATOM 1780 OE1 GLU A 120 113.655 -1.373 17.102 1.00 0.00 O ATOM 1781 OE2 GLU A 120 114.181 -2.659 18.748 1.00 0.00 O ATOM 0 H GLU A 120 110.939 -3.425 15.322 1.00 0.00 H new ATOM 0 HA GLU A 120 109.321 -3.036 17.778 1.00 0.00 H new ATOM 0 HB2 GLU A 120 111.535 -1.615 16.199 1.00 0.00 H new ATOM 0 HB3 GLU A 120 110.814 -0.883 17.619 1.00 0.00 H new ATOM 0 HG2 GLU A 120 111.576 -2.647 19.067 1.00 0.00 H new ATOM 0 HG3 GLU A 120 111.873 -3.738 17.728 1.00 0.00 H new ATOM 1788 N LEU A 121 108.568 -1.498 15.029 1.00 0.00 N ATOM 1789 CA LEU A 121 107.517 -0.610 14.447 1.00 0.00 C ATOM 1790 C LEU A 121 106.179 -1.353 14.359 1.00 0.00 C ATOM 1791 O LEU A 121 105.200 -0.825 13.867 1.00 0.00 O ATOM 1792 CB LEU A 121 108.012 -0.258 13.042 1.00 0.00 C ATOM 1793 CG LEU A 121 109.252 0.629 13.132 1.00 0.00 C ATOM 1794 CD1 LEU A 121 110.160 0.348 11.935 1.00 0.00 C ATOM 1795 CD2 LEU A 121 108.826 2.099 13.108 1.00 0.00 C ATOM 0 H LEU A 121 109.188 -1.942 14.351 1.00 0.00 H new ATOM 0 HA LEU A 121 107.356 0.277 15.059 1.00 0.00 H new ATOM 0 HB2 LEU A 121 108.246 -1.169 12.491 1.00 0.00 H new ATOM 0 HB3 LEU A 121 107.226 0.256 12.489 1.00 0.00 H new ATOM 0 HG LEU A 121 109.787 0.418 14.058 1.00 0.00 H new ATOM 0 HD11 LEU A 121 111.047 0.979 11.995 1.00 0.00 H new ATOM 0 HD12 LEU A 121 110.459 -0.700 11.943 1.00 0.00 H new ATOM 0 HD13 LEU A 121 109.622 0.564 11.012 1.00 0.00 H new ATOM 0 HD21 LEU A 121 109.709 2.735 13.172 1.00 0.00 H new ATOM 0 HD22 LEU A 121 108.295 2.309 12.180 1.00 0.00 H new ATOM 0 HD23 LEU A 121 108.171 2.302 13.955 1.00 0.00 H new ATOM 1807 N GLY A 122 106.126 -2.574 14.829 1.00 0.00 N ATOM 1808 CA GLY A 122 104.852 -3.345 14.770 1.00 0.00 C ATOM 1809 C GLY A 122 104.672 -3.943 13.371 1.00 0.00 C ATOM 1810 O GLY A 122 103.586 -4.339 12.994 1.00 0.00 O ATOM 0 H GLY A 122 106.912 -3.068 15.251 1.00 0.00 H new ATOM 0 HA2 GLY A 122 104.862 -4.139 15.516 1.00 0.00 H new ATOM 0 HA3 GLY A 122 104.011 -2.694 15.008 1.00 0.00 H new ATOM 1814 N HIS A 123 105.726 -4.012 12.597 1.00 0.00 N ATOM 1815 CA HIS A 123 105.618 -4.583 11.226 1.00 0.00 C ATOM 1816 C HIS A 123 105.995 -6.066 11.274 1.00 0.00 C ATOM 1817 O HIS A 123 106.856 -6.528 10.549 1.00 0.00 O ATOM 1818 CB HIS A 123 106.616 -3.776 10.389 1.00 0.00 C ATOM 1819 CG HIS A 123 106.312 -2.300 10.513 1.00 0.00 C ATOM 1820 ND1 HIS A 123 107.042 -1.338 9.839 1.00 0.00 N ATOM 1821 CD2 HIS A 123 105.369 -1.610 11.236 1.00 0.00 C ATOM 1822 CE1 HIS A 123 106.533 -0.137 10.166 1.00 0.00 C ATOM 1823 NE2 HIS A 123 105.510 -0.245 11.013 1.00 0.00 N ATOM 0 H HIS A 123 106.659 -3.695 12.860 1.00 0.00 H new ATOM 0 HA HIS A 123 104.614 -4.522 10.806 1.00 0.00 H new ATOM 0 HB2 HIS A 123 107.633 -3.977 10.726 1.00 0.00 H new ATOM 0 HB3 HIS A 123 106.560 -4.082 9.344 1.00 0.00 H new ATOM 0 HD1 HIS A 123 107.825 -1.509 9.208 1.00 0.00 H new ATOM 0 HD2 HIS A 123 104.629 -2.061 11.881 1.00 0.00 H new ATOM 0 HE1 HIS A 123 106.908 0.802 9.788 1.00 0.00 H new ATOM 1831 N ARG A 124 105.351 -6.804 12.144 1.00 0.00 N ATOM 1832 CA ARG A 124 105.640 -8.267 12.296 1.00 0.00 C ATOM 1833 C ARG A 124 105.873 -8.943 10.945 1.00 0.00 C ATOM 1834 O ARG A 124 106.917 -9.514 10.698 1.00 0.00 O ATOM 1835 CB ARG A 124 104.384 -8.838 12.954 1.00 0.00 C ATOM 1836 CG ARG A 124 104.387 -8.509 14.449 1.00 0.00 C ATOM 1837 CD ARG A 124 104.392 -9.808 15.257 1.00 0.00 C ATOM 1838 NE ARG A 124 103.020 -10.366 15.091 1.00 0.00 N ATOM 1839 CZ ARG A 124 102.767 -11.600 15.438 1.00 0.00 C ATOM 1840 NH1 ARG A 124 103.408 -12.145 16.437 1.00 0.00 N ATOM 1841 NH2 ARG A 124 101.875 -12.291 14.785 1.00 0.00 N ATOM 0 H ARG A 124 104.625 -6.450 12.766 1.00 0.00 H new ATOM 0 HA ARG A 124 106.546 -8.435 12.879 1.00 0.00 H new ATOM 0 HB2 ARG A 124 103.494 -8.422 12.482 1.00 0.00 H new ATOM 0 HB3 ARG A 124 104.346 -9.918 12.810 1.00 0.00 H new ATOM 0 HG2 ARG A 124 105.263 -7.910 14.699 1.00 0.00 H new ATOM 0 HG3 ARG A 124 103.510 -7.914 14.703 1.00 0.00 H new ATOM 0 HD2 ARG A 124 105.148 -10.501 14.887 1.00 0.00 H new ATOM 0 HD3 ARG A 124 104.618 -9.620 16.307 1.00 0.00 H new ATOM 0 HE ARG A 124 102.277 -9.783 14.706 1.00 0.00 H new ATOM 0 HH11 ARG A 124 104.108 -11.607 16.948 1.00 0.00 H new ATOM 0 HH12 ARG A 124 103.209 -13.108 16.706 1.00 0.00 H new ATOM 0 HH21 ARG A 124 101.375 -11.868 14.003 1.00 0.00 H new ATOM 0 HH22 ARG A 124 101.678 -13.254 15.056 1.00 0.00 H new ATOM 1855 N ASP A 125 104.904 -8.888 10.074 1.00 0.00 N ATOM 1856 CA ASP A 125 105.059 -9.533 8.734 1.00 0.00 C ATOM 1857 C ASP A 125 106.394 -9.132 8.100 1.00 0.00 C ATOM 1858 O ASP A 125 107.063 -9.935 7.480 1.00 0.00 O ATOM 1859 CB ASP A 125 103.890 -9.007 7.893 1.00 0.00 C ATOM 1860 CG ASP A 125 102.563 -9.315 8.592 1.00 0.00 C ATOM 1861 OD1 ASP A 125 102.512 -10.291 9.322 1.00 0.00 O ATOM 1862 OD2 ASP A 125 101.621 -8.566 8.387 1.00 0.00 O ATOM 0 H ASP A 125 104.009 -8.424 10.230 1.00 0.00 H new ATOM 0 HA ASP A 125 105.053 -10.621 8.804 1.00 0.00 H new ATOM 0 HB2 ASP A 125 103.992 -7.932 7.745 1.00 0.00 H new ATOM 0 HB3 ASP A 125 103.906 -9.467 6.905 1.00 0.00 H new ATOM 1867 N VAL A 126 106.782 -7.895 8.254 1.00 0.00 N ATOM 1868 CA VAL A 126 108.077 -7.435 7.658 1.00 0.00 C ATOM 1869 C VAL A 126 109.243 -7.844 8.560 1.00 0.00 C ATOM 1870 O VAL A 126 110.290 -8.244 8.087 1.00 0.00 O ATOM 1871 CB VAL A 126 107.983 -5.902 7.535 1.00 0.00 C ATOM 1872 CG1 VAL A 126 108.844 -5.450 6.358 1.00 0.00 C ATOM 1873 CG2 VAL A 126 106.532 -5.478 7.273 1.00 0.00 C ATOM 0 H VAL A 126 106.262 -7.182 8.765 1.00 0.00 H new ATOM 0 HA VAL A 126 108.253 -7.887 6.682 1.00 0.00 H new ATOM 0 HB VAL A 126 108.329 -5.447 8.463 1.00 0.00 H new ATOM 0 HG11 VAL A 126 108.786 -4.366 6.260 1.00 0.00 H new ATOM 0 HG12 VAL A 126 109.879 -5.744 6.531 1.00 0.00 H new ATOM 0 HG13 VAL A 126 108.482 -5.917 5.442 1.00 0.00 H new ATOM 0 HG21 VAL A 126 106.480 -4.393 7.188 1.00 0.00 H new ATOM 0 HG22 VAL A 126 106.182 -5.932 6.346 1.00 0.00 H new ATOM 0 HG23 VAL A 126 105.902 -5.808 8.099 1.00 0.00 H new ATOM 1883 N ALA A 127 109.072 -7.764 9.852 1.00 0.00 N ATOM 1884 CA ALA A 127 110.178 -8.167 10.769 1.00 0.00 C ATOM 1885 C ALA A 127 110.452 -9.667 10.614 1.00 0.00 C ATOM 1886 O ALA A 127 111.586 -10.106 10.625 1.00 0.00 O ATOM 1887 CB ALA A 127 109.672 -7.851 12.176 1.00 0.00 C ATOM 0 H ALA A 127 108.221 -7.439 10.310 1.00 0.00 H new ATOM 0 HA ALA A 127 111.110 -7.644 10.555 1.00 0.00 H new ATOM 0 HB1 ALA A 127 110.435 -8.122 12.906 1.00 0.00 H new ATOM 0 HB2 ALA A 127 109.457 -6.785 12.254 1.00 0.00 H new ATOM 0 HB3 ALA A 127 108.763 -8.420 12.372 1.00 0.00 H new ATOM 1893 N ARG A 128 109.420 -10.456 10.457 1.00 0.00 N ATOM 1894 CA ARG A 128 109.618 -11.928 10.289 1.00 0.00 C ATOM 1895 C ARG A 128 110.161 -12.223 8.887 1.00 0.00 C ATOM 1896 O ARG A 128 111.058 -13.024 8.716 1.00 0.00 O ATOM 1897 CB ARG A 128 108.230 -12.546 10.467 1.00 0.00 C ATOM 1898 CG ARG A 128 108.143 -13.242 11.829 1.00 0.00 C ATOM 1899 CD ARG A 128 106.824 -12.867 12.513 1.00 0.00 C ATOM 1900 NE ARG A 128 105.831 -13.868 12.025 1.00 0.00 N ATOM 1901 CZ ARG A 128 104.566 -13.731 12.323 1.00 0.00 C ATOM 1902 NH1 ARG A 128 103.803 -12.963 11.595 1.00 0.00 N ATOM 1903 NH2 ARG A 128 104.065 -14.363 13.348 1.00 0.00 N ATOM 0 H ARG A 128 108.449 -10.145 10.438 1.00 0.00 H new ATOM 0 HA ARG A 128 110.333 -12.333 11.005 1.00 0.00 H new ATOM 0 HB2 ARG A 128 107.465 -11.773 10.394 1.00 0.00 H new ATOM 0 HB3 ARG A 128 108.036 -13.263 9.669 1.00 0.00 H new ATOM 0 HG2 ARG A 128 108.204 -14.323 11.701 1.00 0.00 H new ATOM 0 HG3 ARG A 128 108.986 -12.947 12.454 1.00 0.00 H new ATOM 0 HD2 ARG A 128 106.919 -12.904 13.598 1.00 0.00 H new ATOM 0 HD3 ARG A 128 106.521 -11.853 12.254 1.00 0.00 H new ATOM 0 HE ARG A 128 106.139 -14.659 11.459 1.00 0.00 H new ATOM 0 HH11 ARG A 128 104.194 -12.469 10.793 1.00 0.00 H new ATOM 0 HH12 ARG A 128 102.816 -12.857 11.828 1.00 0.00 H new ATOM 0 HH21 ARG A 128 104.661 -14.964 13.917 1.00 0.00 H new ATOM 0 HH22 ARG A 128 103.078 -14.256 13.580 1.00 0.00 H new ATOM 1917 N TYR A 129 109.630 -11.573 7.882 1.00 0.00 N ATOM 1918 CA TYR A 129 110.127 -11.814 6.494 1.00 0.00 C ATOM 1919 C TYR A 129 111.615 -11.470 6.421 1.00 0.00 C ATOM 1920 O TYR A 129 112.392 -12.168 5.801 1.00 0.00 O ATOM 1921 CB TYR A 129 109.315 -10.876 5.597 1.00 0.00 C ATOM 1922 CG TYR A 129 109.544 -11.238 4.145 1.00 0.00 C ATOM 1923 CD1 TYR A 129 110.789 -10.996 3.547 1.00 0.00 C ATOM 1924 CD2 TYR A 129 108.509 -11.813 3.396 1.00 0.00 C ATOM 1925 CE1 TYR A 129 110.996 -11.329 2.202 1.00 0.00 C ATOM 1926 CE2 TYR A 129 108.719 -12.146 2.052 1.00 0.00 C ATOM 1927 CZ TYR A 129 109.961 -11.904 1.454 1.00 0.00 C ATOM 1928 OH TYR A 129 110.164 -12.232 0.127 1.00 0.00 O ATOM 0 H TYR A 129 108.877 -10.889 7.962 1.00 0.00 H new ATOM 0 HA TYR A 129 110.012 -12.853 6.187 1.00 0.00 H new ATOM 0 HB2 TYR A 129 108.255 -10.953 5.839 1.00 0.00 H new ATOM 0 HB3 TYR A 129 109.609 -9.841 5.775 1.00 0.00 H new ATOM 0 HD1 TYR A 129 111.588 -10.553 4.123 1.00 0.00 H new ATOM 0 HD2 TYR A 129 107.549 -11.999 3.855 1.00 0.00 H new ATOM 0 HE1 TYR A 129 111.955 -11.142 1.741 1.00 0.00 H new ATOM 0 HE2 TYR A 129 107.921 -12.590 1.476 1.00 0.00 H new ATOM 0 HH TYR A 129 109.344 -12.622 -0.243 1.00 0.00 H new ATOM 1938 N LEU A 130 112.016 -10.402 7.060 1.00 0.00 N ATOM 1939 CA LEU A 130 113.455 -10.020 7.038 1.00 0.00 C ATOM 1940 C LEU A 130 114.271 -11.049 7.823 1.00 0.00 C ATOM 1941 O LEU A 130 115.332 -11.461 7.404 1.00 0.00 O ATOM 1942 CB LEU A 130 113.531 -8.653 7.724 1.00 0.00 C ATOM 1943 CG LEU A 130 113.006 -7.553 6.794 1.00 0.00 C ATOM 1944 CD1 LEU A 130 113.291 -6.189 7.423 1.00 0.00 C ATOM 1945 CD2 LEU A 130 113.713 -7.628 5.439 1.00 0.00 C ATOM 0 H LEU A 130 111.409 -9.780 7.594 1.00 0.00 H new ATOM 0 HA LEU A 130 113.853 -9.982 6.024 1.00 0.00 H new ATOM 0 HB2 LEU A 130 112.946 -8.669 8.644 1.00 0.00 H new ATOM 0 HB3 LEU A 130 114.562 -8.438 8.005 1.00 0.00 H new ATOM 0 HG LEU A 130 111.934 -7.689 6.651 1.00 0.00 H new ATOM 0 HD11 LEU A 130 112.920 -5.401 6.767 1.00 0.00 H new ATOM 0 HD12 LEU A 130 112.791 -6.122 8.389 1.00 0.00 H new ATOM 0 HD13 LEU A 130 114.366 -6.070 7.562 1.00 0.00 H new ATOM 0 HD21 LEU A 130 113.333 -6.842 4.786 1.00 0.00 H new ATOM 0 HD22 LEU A 130 114.786 -7.495 5.580 1.00 0.00 H new ATOM 0 HD23 LEU A 130 113.525 -8.600 4.984 1.00 0.00 H new ATOM 1957 N ARG A 131 113.781 -11.467 8.962 1.00 0.00 N ATOM 1958 CA ARG A 131 114.533 -12.471 9.776 1.00 0.00 C ATOM 1959 C ARG A 131 114.762 -13.749 8.966 1.00 0.00 C ATOM 1960 O ARG A 131 115.649 -14.528 9.260 1.00 0.00 O ATOM 1961 CB ARG A 131 113.647 -12.755 10.995 1.00 0.00 C ATOM 1962 CG ARG A 131 114.457 -12.523 12.276 1.00 0.00 C ATOM 1963 CD ARG A 131 113.903 -13.396 13.410 1.00 0.00 C ATOM 1964 NE ARG A 131 114.628 -14.700 13.309 1.00 0.00 N ATOM 1965 CZ ARG A 131 115.934 -14.753 13.432 1.00 0.00 C ATOM 1966 NH1 ARG A 131 116.586 -13.781 14.015 1.00 0.00 N ATOM 1967 NH2 ARG A 131 116.586 -15.787 12.974 1.00 0.00 N ATOM 0 H ARG A 131 112.896 -11.158 9.363 1.00 0.00 H new ATOM 0 HA ARG A 131 115.516 -12.103 10.070 1.00 0.00 H new ATOM 0 HB2 ARG A 131 112.772 -12.105 10.982 1.00 0.00 H new ATOM 0 HB3 ARG A 131 113.282 -13.782 10.963 1.00 0.00 H new ATOM 0 HG2 ARG A 131 115.506 -12.761 12.101 1.00 0.00 H new ATOM 0 HG3 ARG A 131 114.412 -11.472 12.560 1.00 0.00 H new ATOM 0 HD2 ARG A 131 114.070 -12.929 14.381 1.00 0.00 H new ATOM 0 HD3 ARG A 131 112.827 -13.537 13.305 1.00 0.00 H new ATOM 0 HE ARG A 131 114.102 -15.558 13.143 1.00 0.00 H new ATOM 0 HH11 ARG A 131 116.080 -12.973 14.378 1.00 0.00 H new ATOM 0 HH12 ARG A 131 117.601 -13.830 14.106 1.00 0.00 H new ATOM 0 HH21 ARG A 131 116.081 -16.550 12.523 1.00 0.00 H new ATOM 0 HH22 ARG A 131 117.601 -15.832 13.067 1.00 0.00 H new ATOM 1981 N ALA A 132 113.977 -13.972 7.946 1.00 0.00 N ATOM 1982 CA ALA A 132 114.159 -15.198 7.118 1.00 0.00 C ATOM 1983 C ALA A 132 115.265 -14.969 6.085 1.00 0.00 C ATOM 1984 O ALA A 132 116.151 -15.784 5.919 1.00 0.00 O ATOM 1985 CB ALA A 132 112.813 -15.420 6.428 1.00 0.00 C ATOM 0 H ALA A 132 113.218 -13.358 7.651 1.00 0.00 H new ATOM 0 HA ALA A 132 114.452 -16.062 7.714 1.00 0.00 H new ATOM 0 HB1 ALA A 132 112.869 -16.308 5.798 1.00 0.00 H new ATOM 0 HB2 ALA A 132 112.037 -15.557 7.181 1.00 0.00 H new ATOM 0 HB3 ALA A 132 112.572 -14.553 5.812 1.00 0.00 H new ATOM 1991 N ALA A 133 115.219 -13.862 5.394 1.00 0.00 N ATOM 1992 CA ALA A 133 116.266 -13.572 4.374 1.00 0.00 C ATOM 1993 C ALA A 133 117.473 -12.882 5.022 1.00 0.00 C ATOM 1994 O ALA A 133 118.533 -12.790 4.435 1.00 0.00 O ATOM 1995 CB ALA A 133 115.588 -12.639 3.371 1.00 0.00 C ATOM 0 H ALA A 133 114.500 -13.145 5.492 1.00 0.00 H new ATOM 0 HA ALA A 133 116.643 -14.479 3.902 1.00 0.00 H new ATOM 0 HB1 ALA A 133 116.294 -12.376 2.583 1.00 0.00 H new ATOM 0 HB2 ALA A 133 114.726 -13.141 2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 133 115.260 -11.733 3.881 1.00 0.00 H new ATOM 2001 N ALA A 134 117.320 -12.392 6.226 1.00 0.00 N ATOM 2002 CA ALA A 134 118.459 -11.706 6.905 1.00 0.00 C ATOM 2003 C ALA A 134 119.096 -12.632 7.946 1.00 0.00 C ATOM 2004 O ALA A 134 120.244 -13.015 7.828 1.00 0.00 O ATOM 2005 CB ALA A 134 117.839 -10.479 7.584 1.00 0.00 C ATOM 0 H ALA A 134 116.456 -12.438 6.767 1.00 0.00 H new ATOM 0 HA ALA A 134 119.247 -11.429 6.205 1.00 0.00 H new ATOM 0 HB1 ALA A 134 118.616 -9.921 8.106 1.00 0.00 H new ATOM 0 HB2 ALA A 134 117.378 -9.841 6.831 1.00 0.00 H new ATOM 0 HB3 ALA A 134 117.082 -10.802 8.298 1.00 0.00 H new ATOM 2011 N GLY A 135 118.360 -12.994 8.963 1.00 0.00 N ATOM 2012 CA GLY A 135 118.922 -13.894 10.011 1.00 0.00 C ATOM 2013 C GLY A 135 119.996 -13.148 10.805 1.00 0.00 C ATOM 2014 O GLY A 135 120.021 -11.934 10.840 1.00 0.00 O ATOM 0 H GLY A 135 117.393 -12.705 9.113 1.00 0.00 H new ATOM 0 HA2 GLY A 135 118.129 -14.230 10.679 1.00 0.00 H new ATOM 0 HA3 GLY A 135 119.349 -14.784 9.549 1.00 0.00 H new ATOM 2018 N GLY A 136 120.882 -13.866 11.442 1.00 0.00 N ATOM 2019 CA GLY A 136 121.955 -13.203 12.236 1.00 0.00 C ATOM 2020 C GLY A 136 122.918 -14.262 12.779 1.00 0.00 C ATOM 2021 O GLY A 136 122.715 -14.810 13.844 1.00 0.00 O ATOM 0 H GLY A 136 120.908 -14.886 11.446 1.00 0.00 H new ATOM 0 HA2 GLY A 136 122.495 -12.490 11.613 1.00 0.00 H new ATOM 0 HA3 GLY A 136 121.517 -12.639 13.059 1.00 0.00 H new ATOM 2025 N THR A 137 123.966 -14.554 12.054 1.00 0.00 N ATOM 2026 CA THR A 137 124.945 -15.581 12.529 1.00 0.00 C ATOM 2027 C THR A 137 126.023 -14.937 13.410 1.00 0.00 C ATOM 2028 O THR A 137 127.089 -15.489 13.599 1.00 0.00 O ATOM 2029 CB THR A 137 125.576 -16.164 11.259 1.00 0.00 C ATOM 2030 OG1 THR A 137 126.341 -15.164 10.594 1.00 0.00 O ATOM 2031 CG2 THR A 137 124.479 -16.680 10.326 1.00 0.00 C ATOM 0 H THR A 137 124.188 -14.127 11.154 1.00 0.00 H new ATOM 0 HA THR A 137 124.459 -16.348 13.132 1.00 0.00 H new ATOM 0 HB THR A 137 126.232 -16.990 11.535 1.00 0.00 H new ATOM 0 HG1 THR A 137 126.743 -15.544 9.785 1.00 0.00 H new ATOM 0 HG21 THR A 137 124.932 -17.093 9.425 1.00 0.00 H new ATOM 0 HG22 THR A 137 123.906 -17.456 10.833 1.00 0.00 H new ATOM 0 HG23 THR A 137 123.816 -15.858 10.055 1.00 0.00 H new ATOM 2039 N ARG A 138 125.755 -13.779 13.958 1.00 0.00 N ATOM 2040 CA ARG A 138 126.765 -13.111 14.831 1.00 0.00 C ATOM 2041 C ARG A 138 126.254 -13.068 16.273 1.00 0.00 C ATOM 2042 O ARG A 138 125.929 -12.021 16.796 1.00 0.00 O ATOM 2043 CB ARG A 138 126.906 -11.696 14.268 1.00 0.00 C ATOM 2044 CG ARG A 138 128.296 -11.148 14.598 1.00 0.00 C ATOM 2045 CD ARG A 138 128.217 -10.253 15.840 1.00 0.00 C ATOM 2046 NE ARG A 138 129.023 -10.956 16.877 1.00 0.00 N ATOM 2047 CZ ARG A 138 128.751 -10.788 18.143 1.00 0.00 C ATOM 2048 NH1 ARG A 138 127.518 -10.872 18.562 1.00 0.00 N ATOM 2049 NH2 ARG A 138 129.713 -10.539 18.990 1.00 0.00 N ATOM 0 H ARG A 138 124.880 -13.268 13.838 1.00 0.00 H new ATOM 0 HA ARG A 138 127.720 -13.637 14.842 1.00 0.00 H new ATOM 0 HB2 ARG A 138 126.755 -11.707 13.189 1.00 0.00 H new ATOM 0 HB3 ARG A 138 126.139 -11.047 14.691 1.00 0.00 H new ATOM 0 HG2 ARG A 138 128.989 -11.970 14.774 1.00 0.00 H new ATOM 0 HG3 ARG A 138 128.684 -10.580 13.752 1.00 0.00 H new ATOM 0 HD2 ARG A 138 128.617 -9.260 15.636 1.00 0.00 H new ATOM 0 HD3 ARG A 138 127.185 -10.121 16.165 1.00 0.00 H new ATOM 0 HE ARG A 138 129.788 -11.570 16.598 1.00 0.00 H new ATOM 0 HH11 ARG A 138 126.767 -11.069 17.901 1.00 0.00 H new ATOM 0 HH12 ARG A 138 127.305 -10.741 19.551 1.00 0.00 H new ATOM 0 HH21 ARG A 138 130.677 -10.476 18.663 1.00 0.00 H new ATOM 0 HH22 ARG A 138 129.501 -10.408 19.979 1.00 0.00 H new ATOM 2063 N GLY A 139 126.178 -14.202 16.913 1.00 0.00 N ATOM 2064 CA GLY A 139 125.683 -14.239 18.318 1.00 0.00 C ATOM 2065 C GLY A 139 125.288 -15.671 18.677 1.00 0.00 C ATOM 2066 O GLY A 139 125.270 -16.548 17.835 1.00 0.00 O ATOM 0 H GLY A 139 126.438 -15.108 16.522 1.00 0.00 H new ATOM 0 HA2 GLY A 139 126.457 -13.882 18.998 1.00 0.00 H new ATOM 0 HA3 GLY A 139 124.827 -13.574 18.432 1.00 0.00 H new ATOM 2070 N SER A 140 124.966 -15.914 19.921 1.00 0.00 N ATOM 2071 CA SER A 140 124.568 -17.293 20.345 1.00 0.00 C ATOM 2072 C SER A 140 125.677 -18.297 20.017 1.00 0.00 C ATOM 2073 O SER A 140 126.618 -17.988 19.312 1.00 0.00 O ATOM 2074 CB SER A 140 123.302 -17.606 19.545 1.00 0.00 C ATOM 2075 OG SER A 140 122.414 -16.499 19.629 1.00 0.00 O ATOM 0 H SER A 140 124.961 -15.216 20.665 1.00 0.00 H new ATOM 0 HA SER A 140 124.397 -17.358 21.420 1.00 0.00 H new ATOM 0 HB2 SER A 140 123.555 -17.807 18.504 1.00 0.00 H new ATOM 0 HB3 SER A 140 122.822 -18.503 19.936 1.00 0.00 H new ATOM 0 HG SER A 140 121.601 -16.692 19.117 1.00 0.00 H new ATOM 2081 N ASN A 141 125.577 -19.498 20.524 1.00 0.00 N ATOM 2082 CA ASN A 141 126.628 -20.521 20.241 1.00 0.00 C ATOM 2083 C ASN A 141 126.279 -21.304 18.971 1.00 0.00 C ATOM 2084 O ASN A 141 126.295 -22.519 18.955 1.00 0.00 O ATOM 2085 CB ASN A 141 126.631 -21.444 21.464 1.00 0.00 C ATOM 2086 CG ASN A 141 127.945 -21.275 22.232 1.00 0.00 C ATOM 2087 OD1 ASN A 141 128.606 -20.260 22.114 1.00 0.00 O ATOM 2088 ND2 ASN A 141 128.356 -22.231 23.019 1.00 0.00 N ATOM 0 H ASN A 141 124.814 -19.815 21.122 1.00 0.00 H new ATOM 0 HA ASN A 141 127.606 -20.070 20.074 1.00 0.00 H new ATOM 0 HB2 ASN A 141 125.787 -21.209 22.112 1.00 0.00 H new ATOM 0 HB3 ASN A 141 126.512 -22.481 21.150 1.00 0.00 H new ATOM 0 HD21 ASN A 141 129.230 -22.127 23.534 1.00 0.00 H new ATOM 0 HD22 ASN A 141 127.803 -23.082 23.119 1.00 0.00 H new ATOM 2095 N HIS A 142 125.972 -20.614 17.905 1.00 0.00 N ATOM 2096 CA HIS A 142 125.629 -21.317 16.633 1.00 0.00 C ATOM 2097 C HIS A 142 126.279 -20.602 15.447 1.00 0.00 C ATOM 2098 O HIS A 142 127.154 -19.773 15.613 1.00 0.00 O ATOM 2099 CB HIS A 142 124.103 -21.244 16.533 1.00 0.00 C ATOM 2100 CG HIS A 142 123.563 -22.570 16.066 1.00 0.00 C ATOM 2101 ND1 HIS A 142 124.073 -23.522 15.218 1.00 0.00 N flip ATOM 2102 CD2 HIS A 142 122.337 -23.057 16.489 1.00 0.00 C flip ATOM 2103 CE1 HIS A 142 123.179 -24.583 15.116 1.00 0.00 C flip ATOM 2104 NE2 HIS A 142 122.151 -24.253 15.901 1.00 0.00 N flip ATOM 0 H HIS A 142 125.944 -19.595 17.859 1.00 0.00 H new ATOM 0 HA HIS A 142 125.986 -22.347 16.621 1.00 0.00 H new ATOM 0 HB2 HIS A 142 123.677 -20.988 17.503 1.00 0.00 H new ATOM 0 HB3 HIS A 142 123.811 -20.456 15.838 1.00 0.00 H new ATOM 0 HD2 HIS A 142 121.655 -22.566 17.167 1.00 0.00 H new ATOM 0 HE1 HIS A 142 123.292 -25.481 14.528 1.00 0.00 H new ATOM 0 HE2 HIS A 142 121.325 -24.836 16.038 1.00 0.00 H new ATOM 2112 N ALA A 143 125.858 -20.918 14.251 1.00 0.00 N ATOM 2113 CA ALA A 143 126.444 -20.263 13.043 1.00 0.00 C ATOM 2114 C ALA A 143 125.756 -20.784 11.780 1.00 0.00 C ATOM 2115 O ALA A 143 125.692 -21.975 11.545 1.00 0.00 O ATOM 2116 CB ALA A 143 127.926 -20.655 13.043 1.00 0.00 C ATOM 0 H ALA A 143 125.130 -21.605 14.057 1.00 0.00 H new ATOM 0 HA ALA A 143 126.314 -19.181 13.061 1.00 0.00 H new ATOM 0 HB1 ALA A 143 128.421 -20.208 12.181 1.00 0.00 H new ATOM 0 HB2 ALA A 143 128.397 -20.296 13.958 1.00 0.00 H new ATOM 0 HB3 ALA A 143 128.015 -21.740 12.990 1.00 0.00 H new ATOM 2122 N ARG A 144 125.245 -19.899 10.965 1.00 0.00 N ATOM 2123 CA ARG A 144 124.562 -20.334 9.708 1.00 0.00 C ATOM 2124 C ARG A 144 123.396 -21.283 10.015 1.00 0.00 C ATOM 2125 O ARG A 144 123.503 -22.483 9.848 1.00 0.00 O ATOM 2126 CB ARG A 144 125.639 -21.061 8.899 1.00 0.00 C ATOM 2127 CG ARG A 144 125.174 -21.209 7.450 1.00 0.00 C ATOM 2128 CD ARG A 144 125.270 -19.857 6.740 1.00 0.00 C ATOM 2129 NE ARG A 144 124.961 -20.150 5.313 1.00 0.00 N ATOM 2130 CZ ARG A 144 124.599 -19.189 4.507 1.00 0.00 C ATOM 2131 NH1 ARG A 144 125.177 -18.020 4.579 1.00 0.00 N ATOM 2132 NH2 ARG A 144 123.657 -19.395 3.629 1.00 0.00 N ATOM 0 H ARG A 144 125.271 -18.890 11.115 1.00 0.00 H new ATOM 0 HA ARG A 144 124.139 -19.487 9.167 1.00 0.00 H new ATOM 0 HB2 ARG A 144 126.575 -20.504 8.937 1.00 0.00 H new ATOM 0 HB3 ARG A 144 125.834 -22.042 9.332 1.00 0.00 H new ATOM 0 HG2 ARG A 144 125.788 -21.947 6.934 1.00 0.00 H new ATOM 0 HG3 ARG A 144 124.147 -21.574 7.422 1.00 0.00 H new ATOM 0 HD2 ARG A 144 124.563 -19.140 7.158 1.00 0.00 H new ATOM 0 HD3 ARG A 144 126.264 -19.424 6.848 1.00 0.00 H new ATOM 0 HE ARG A 144 125.033 -21.106 4.964 1.00 0.00 H new ATOM 0 HH11 ARG A 144 125.913 -17.856 5.266 1.00 0.00 H new ATOM 0 HH12 ARG A 144 124.892 -17.271 3.948 1.00 0.00 H new ATOM 0 HH21 ARG A 144 123.203 -20.307 3.572 1.00 0.00 H new ATOM 0 HH22 ARG A 144 123.374 -18.644 2.999 1.00 0.00 H new ATOM 2146 N ILE A 145 122.282 -20.758 10.454 1.00 0.00 N ATOM 2147 CA ILE A 145 121.112 -21.639 10.759 1.00 0.00 C ATOM 2148 C ILE A 145 120.429 -22.065 9.454 1.00 0.00 C ATOM 2149 O ILE A 145 120.562 -21.415 8.436 1.00 0.00 O ATOM 2150 CB ILE A 145 120.167 -20.786 11.614 1.00 0.00 C ATOM 2151 CG1 ILE A 145 119.652 -19.593 10.800 1.00 0.00 C ATOM 2152 CG2 ILE A 145 120.918 -20.272 12.846 1.00 0.00 C ATOM 2153 CD1 ILE A 145 118.408 -19.011 11.476 1.00 0.00 C ATOM 0 H ILE A 145 122.130 -19.762 10.614 1.00 0.00 H new ATOM 0 HA ILE A 145 121.406 -22.550 11.281 1.00 0.00 H new ATOM 0 HB ILE A 145 119.321 -21.398 11.926 1.00 0.00 H new ATOM 0 HG12 ILE A 145 120.427 -18.830 10.723 1.00 0.00 H new ATOM 0 HG13 ILE A 145 119.413 -19.908 9.784 1.00 0.00 H new ATOM 0 HG21 ILE A 145 120.247 -19.666 13.454 1.00 0.00 H new ATOM 0 HG22 ILE A 145 121.275 -21.118 13.433 1.00 0.00 H new ATOM 0 HG23 ILE A 145 121.767 -19.666 12.528 1.00 0.00 H new ATOM 0 HD11 ILE A 145 118.042 -18.163 10.897 1.00 0.00 H new ATOM 0 HD12 ILE A 145 117.632 -19.775 11.530 1.00 0.00 H new ATOM 0 HD13 ILE A 145 118.662 -18.680 12.483 1.00 0.00 H new ATOM 2165 N ASP A 146 119.699 -23.153 9.472 1.00 0.00 N ATOM 2166 CA ASP A 146 119.014 -23.618 8.228 1.00 0.00 C ATOM 2167 C ASP A 146 120.047 -23.871 7.124 1.00 0.00 C ATOM 2168 O ASP A 146 121.197 -23.502 7.247 1.00 0.00 O ATOM 2169 CB ASP A 146 118.068 -22.478 7.833 1.00 0.00 C ATOM 2170 CG ASP A 146 116.762 -23.058 7.283 1.00 0.00 C ATOM 2171 OD1 ASP A 146 116.088 -23.755 8.024 1.00 0.00 O ATOM 2172 OD2 ASP A 146 116.458 -22.790 6.132 1.00 0.00 O ATOM 0 H ASP A 146 119.548 -23.738 10.294 1.00 0.00 H new ATOM 0 HA ASP A 146 118.473 -24.552 8.381 1.00 0.00 H new ATOM 0 HB2 ASP A 146 117.861 -21.848 8.698 1.00 0.00 H new ATOM 0 HB3 ASP A 146 118.540 -21.844 7.082 1.00 0.00 H new ATOM 2177 N ALA A 147 119.644 -24.500 6.050 1.00 0.00 N ATOM 2178 CA ALA A 147 120.600 -24.788 4.933 1.00 0.00 C ATOM 2179 C ALA A 147 121.718 -25.717 5.418 1.00 0.00 C ATOM 2180 O ALA A 147 122.184 -25.615 6.536 1.00 0.00 O ATOM 2181 CB ALA A 147 121.170 -23.431 4.510 1.00 0.00 C ATOM 0 H ALA A 147 118.691 -24.829 5.896 1.00 0.00 H new ATOM 0 HA ALA A 147 120.108 -25.289 4.099 1.00 0.00 H new ATOM 0 HB1 ALA A 147 121.878 -23.572 3.694 1.00 0.00 H new ATOM 0 HB2 ALA A 147 120.359 -22.783 4.178 1.00 0.00 H new ATOM 0 HB3 ALA A 147 121.679 -22.970 5.357 1.00 0.00 H new ATOM 2187 N ALA A 148 122.142 -26.627 4.581 1.00 0.00 N ATOM 2188 CA ALA A 148 123.226 -27.581 4.973 1.00 0.00 C ATOM 2189 C ALA A 148 124.417 -26.844 5.594 1.00 0.00 C ATOM 2190 O ALA A 148 124.990 -25.954 4.997 1.00 0.00 O ATOM 2191 CB ALA A 148 123.646 -28.252 3.665 1.00 0.00 C ATOM 0 H ALA A 148 121.782 -26.753 3.635 1.00 0.00 H new ATOM 0 HA ALA A 148 122.882 -28.295 5.721 1.00 0.00 H new ATOM 0 HB1 ALA A 148 124.441 -28.970 3.864 1.00 0.00 H new ATOM 0 HB2 ALA A 148 122.791 -28.769 3.230 1.00 0.00 H new ATOM 0 HB3 ALA A 148 124.006 -27.496 2.967 1.00 0.00 H new ATOM 2197 N GLU A 149 124.796 -27.214 6.787 1.00 0.00 N ATOM 2198 CA GLU A 149 125.954 -26.546 7.448 1.00 0.00 C ATOM 2199 C GLU A 149 127.094 -27.550 7.641 1.00 0.00 C ATOM 2200 O GLU A 149 127.380 -27.975 8.743 1.00 0.00 O ATOM 2201 CB GLU A 149 125.420 -26.066 8.797 1.00 0.00 C ATOM 2202 CG GLU A 149 126.515 -25.293 9.535 1.00 0.00 C ATOM 2203 CD GLU A 149 126.194 -25.246 11.031 1.00 0.00 C ATOM 2204 OE1 GLU A 149 125.423 -26.078 11.481 1.00 0.00 O ATOM 2205 OE2 GLU A 149 126.729 -24.379 11.703 1.00 0.00 O ATOM 0 H GLU A 149 124.353 -27.952 7.334 1.00 0.00 H new ATOM 0 HA GLU A 149 126.352 -25.721 6.857 1.00 0.00 H new ATOM 0 HB2 GLU A 149 124.548 -25.429 8.649 1.00 0.00 H new ATOM 0 HB3 GLU A 149 125.095 -26.917 9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 149 127.482 -25.771 9.375 1.00 0.00 H new ATOM 0 HG3 GLU A 149 126.590 -24.281 9.137 1.00 0.00 H new ATOM 2212 N GLY A 150 127.742 -27.934 6.575 1.00 0.00 N ATOM 2213 CA GLY A 150 128.860 -28.915 6.691 1.00 0.00 C ATOM 2214 C GLY A 150 128.383 -30.290 6.204 1.00 0.00 C ATOM 2215 O GLY A 150 127.583 -30.377 5.292 1.00 0.00 O ATOM 0 H GLY A 150 127.546 -27.611 5.628 1.00 0.00 H new ATOM 0 HA2 GLY A 150 129.713 -28.583 6.099 1.00 0.00 H new ATOM 0 HA3 GLY A 150 129.196 -28.980 7.726 1.00 0.00 H new ATOM 2219 N PRO A 151 128.889 -31.328 6.827 1.00 0.00 N ATOM 2220 CA PRO A 151 128.500 -32.703 6.441 1.00 0.00 C ATOM 2221 C PRO A 151 127.146 -33.065 7.056 1.00 0.00 C ATOM 2222 O PRO A 151 126.855 -32.724 8.187 1.00 0.00 O ATOM 2223 CB PRO A 151 129.610 -33.569 7.024 1.00 0.00 C ATOM 2224 CG PRO A 151 130.175 -32.781 8.167 1.00 0.00 C ATOM 2225 CD PRO A 151 129.858 -31.322 7.931 1.00 0.00 C ATOM 0 HA PRO A 151 128.390 -32.831 5.364 1.00 0.00 H new ATOM 0 HB2 PRO A 151 129.221 -34.529 7.364 1.00 0.00 H new ATOM 0 HB3 PRO A 151 130.375 -33.781 6.277 1.00 0.00 H new ATOM 0 HG2 PRO A 151 129.745 -33.117 9.111 1.00 0.00 H new ATOM 0 HG3 PRO A 151 131.252 -32.930 8.237 1.00 0.00 H new ATOM 0 HD2 PRO A 151 129.439 -30.858 8.824 1.00 0.00 H new ATOM 0 HD3 PRO A 151 130.754 -30.759 7.669 1.00 0.00 H new ATOM 2233 N SER A 152 126.315 -33.753 6.320 1.00 0.00 N ATOM 2234 CA SER A 152 124.978 -34.134 6.859 1.00 0.00 C ATOM 2235 C SER A 152 125.069 -35.447 7.642 1.00 0.00 C ATOM 2236 O SER A 152 125.148 -36.517 7.072 1.00 0.00 O ATOM 2237 CB SER A 152 124.092 -34.307 5.625 1.00 0.00 C ATOM 2238 OG SER A 152 123.981 -33.060 4.947 1.00 0.00 O ATOM 0 H SER A 152 126.505 -34.068 5.368 1.00 0.00 H new ATOM 0 HA SER A 152 124.584 -33.386 7.547 1.00 0.00 H new ATOM 0 HB2 SER A 152 124.517 -35.059 4.960 1.00 0.00 H new ATOM 0 HB3 SER A 152 123.105 -34.663 5.919 1.00 0.00 H new ATOM 0 HG SER A 152 123.415 -33.168 4.154 1.00 0.00 H new ATOM 2244 N ASP A 153 125.054 -35.371 8.948 1.00 0.00 N ATOM 2245 CA ASP A 153 125.132 -36.614 9.772 1.00 0.00 C ATOM 2246 C ASP A 153 123.878 -37.459 9.550 1.00 0.00 C ATOM 2247 O ASP A 153 122.871 -37.267 10.200 1.00 0.00 O ATOM 2248 CB ASP A 153 125.192 -36.138 11.225 1.00 0.00 C ATOM 2249 CG ASP A 153 126.333 -35.132 11.399 1.00 0.00 C ATOM 2250 OD1 ASP A 153 127.470 -35.564 11.494 1.00 0.00 O ATOM 2251 OD2 ASP A 153 126.048 -33.947 11.435 1.00 0.00 O ATOM 0 H ASP A 153 124.991 -34.502 9.479 1.00 0.00 H new ATOM 0 HA ASP A 153 125.995 -37.226 9.510 1.00 0.00 H new ATOM 0 HB2 ASP A 153 124.244 -35.678 11.505 1.00 0.00 H new ATOM 0 HB3 ASP A 153 125.342 -36.989 11.889 1.00 0.00 H new ATOM 2256 N ILE A 154 123.927 -38.387 8.636 1.00 0.00 N ATOM 2257 CA ILE A 154 122.725 -39.230 8.374 1.00 0.00 C ATOM 2258 C ILE A 154 123.063 -40.720 8.551 1.00 0.00 C ATOM 2259 O ILE A 154 123.507 -41.372 7.627 1.00 0.00 O ATOM 2260 CB ILE A 154 122.332 -38.911 6.928 1.00 0.00 C ATOM 2261 CG1 ILE A 154 121.085 -39.721 6.542 1.00 0.00 C ATOM 2262 CG2 ILE A 154 123.488 -39.253 5.981 1.00 0.00 C ATOM 2263 CD1 ILE A 154 119.996 -38.771 6.040 1.00 0.00 C ATOM 0 H ILE A 154 124.742 -38.599 8.061 1.00 0.00 H new ATOM 0 HA ILE A 154 121.909 -39.023 9.067 1.00 0.00 H new ATOM 0 HB ILE A 154 122.111 -37.847 6.845 1.00 0.00 H new ATOM 0 HG12 ILE A 154 121.335 -40.447 5.768 1.00 0.00 H new ATOM 0 HG13 ILE A 154 120.723 -40.284 7.402 1.00 0.00 H new ATOM 0 HG21 ILE A 154 123.199 -39.023 4.956 1.00 0.00 H new ATOM 0 HG22 ILE A 154 124.366 -38.666 6.251 1.00 0.00 H new ATOM 0 HG23 ILE A 154 123.723 -40.314 6.062 1.00 0.00 H new ATOM 0 HD11 ILE A 154 119.111 -39.345 5.766 1.00 0.00 H new ATOM 0 HD12 ILE A 154 119.740 -38.063 6.828 1.00 0.00 H new ATOM 0 HD13 ILE A 154 120.361 -38.228 5.168 1.00 0.00 H new ATOM 2275 N PRO A 155 122.836 -41.214 9.745 1.00 0.00 N ATOM 2276 CA PRO A 155 123.120 -42.641 10.041 1.00 0.00 C ATOM 2277 C PRO A 155 122.160 -43.547 9.266 1.00 0.00 C ATOM 2278 O PRO A 155 120.969 -43.560 9.505 1.00 0.00 O ATOM 2279 CB PRO A 155 122.892 -42.749 11.548 1.00 0.00 C ATOM 2280 CG PRO A 155 121.964 -41.624 11.874 1.00 0.00 C ATOM 2281 CD PRO A 155 122.295 -40.510 10.917 1.00 0.00 C ATOM 0 HA PRO A 155 124.124 -42.951 9.750 1.00 0.00 H new ATOM 0 HB2 PRO A 155 122.456 -43.712 11.814 1.00 0.00 H new ATOM 0 HB3 PRO A 155 123.829 -42.661 12.097 1.00 0.00 H new ATOM 0 HG2 PRO A 155 120.925 -41.934 11.765 1.00 0.00 H new ATOM 0 HG3 PRO A 155 122.094 -41.300 12.907 1.00 0.00 H new ATOM 0 HD2 PRO A 155 121.412 -39.925 10.661 1.00 0.00 H new ATOM 0 HD3 PRO A 155 123.023 -39.819 11.342 1.00 0.00 H new ATOM 2289 N ASP A 156 122.679 -44.299 8.334 1.00 0.00 N ATOM 2290 CA ASP A 156 121.812 -45.206 7.526 1.00 0.00 C ATOM 2291 C ASP A 156 122.396 -46.621 7.518 1.00 0.00 C ATOM 2292 O ASP A 156 123.309 -46.868 8.287 1.00 0.00 O ATOM 2293 CB ASP A 156 121.826 -44.611 6.114 1.00 0.00 C ATOM 2294 CG ASP A 156 123.270 -44.474 5.624 1.00 0.00 C ATOM 2295 OD1 ASP A 156 124.009 -43.711 6.224 1.00 0.00 O ATOM 2296 OD2 ASP A 156 123.611 -45.133 4.656 1.00 0.00 O ATOM 2297 OXT ASP A 156 121.918 -47.432 6.743 1.00 0.00 O ATOM 0 H ASP A 156 123.670 -44.325 8.096 1.00 0.00 H new ATOM 0 HA ASP A 156 120.801 -45.281 7.927 1.00 0.00 H new ATOM 0 HB2 ASP A 156 121.261 -45.249 5.435 1.00 0.00 H new ATOM 0 HB3 ASP A 156 121.339 -43.636 6.115 1.00 0.00 H new TER 2302 ASP A 156