USER MOD reduce.3.24.130724 H: found=0, std=0, add=1355, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1354 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 41 ASN : amide:sc= -0.0856 X(o=-0.086,f=-0.17) USER MOD Set 1.2: B1346 GLN : amide:sc= 0 X(o=-0.086,f=-0.099) USER MOD Set 2.1: A 56 HIS : no HD1:sc= -0.181 K(o=-0.73,f=-3.9) USER MOD Set 2.2: A 63 HIS : no HD1:sc= -0.547 K(o=-0.73,f=-3.6) USER MOD Set 3.1: A 37 ASN : amide:sc= 0.878 K(o=1.9,f=-8!) USER MOD Set 3.2: A 39 SER OG : rot -52:sc= 1.05 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= -0.0671 USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 MET CE :methyl -154:sc= -0.244 (180deg=-1.33!) USER MOD Single : A -3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A -4 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -6 GLY N :NH3+ -168:sc= 0 (180deg=-0.0191) USER MOD Single : A 10 ASN : amide:sc= -0.264 X(o=-0.26,f=-0.7) USER MOD Single : A 15 LYS NZ :NH3+ -154:sc= 0.00507 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 TYR OH : rot 180:sc= 0 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot -72:sc= -1.56 USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 30 HIS : no HD1:sc= 0.812 K(o=0.81,f=-3.3!) USER MOD Single : A 34 TYR OH : rot 0:sc= -1.25 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot -88:sc= 0.364 USER MOD Single : A 55 TYR OH : rot 167:sc= 0.167 USER MOD Single : A 58 ASN : amide:sc= -0.167 X(o=-0.17,f=0) USER MOD Single : A 64 SER OG : rot 9:sc= 0.297 USER MOD Single : A 68 ASN : amide:sc= -0.018 K(o=-0.018,f=-0.95) USER MOD Single : A 69 ASN : amide:sc= -1.33 K(o=-1.3,f=-7.8!) USER MOD Single : A 72 ASN : amide:sc= -0.0568 K(o=-0.057,f=-1.6) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 50:sc= 0.137 USER MOD Single : A 75 SER OG : rot 180:sc= 0.034 USER MOD Single : A 81 THR OG1 : rot 180:sc= -0.686 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 87 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 89 GLN : amide:sc= -2.21 K(o=-2.2,f=-2.9!) USER MOD Single : A 95 TYR OH : rot -42:sc= -0.678 USER MOD Single : A 97 ASN : amide:sc= -1.34 X(o=-1.3,f=-0.96) USER MOD Single : A 100 SER OG : rot 180:sc= -1.57 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 ASN : amide:sc= -0.851 K(o=-0.85,f=-10!) USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 113 CYS SG : rot 94:sc= 0.16 USER MOD Single : A 117 SER OG : rot 81:sc= -0.814! USER MOD Single : A 121 ASN : amide:sc= -2.52! X(o=-2.5!,f=-2.9) USER MOD Single : A 125 LYS NZ :NH3+ 149:sc= -0.24 (180deg=-1.17!) USER MOD Single : A 126 SER OG : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ -116:sc= 0.089 (180deg=-0.632) USER MOD Single : B1320 GLN : amide:sc= -0.115 X(o=-0.11,f=-0.12) USER MOD Single : B1325 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B1326 GLN : amide:sc= -0.187 X(o=-0.19,f=-0.35) USER MOD Single : B1327 GLN : amide:sc= -0.832 X(o=-0.83,f=-0.5) USER MOD Single : B1334 GLN : amide:sc= 0 X(o=0,f=-0.0025) USER MOD Single : B1335 MET CE :methyl 137:sc= -0.588 (180deg=-3.53!) USER MOD Single : B1337 ASN : amide:sc= -0.271 X(o=-0.27,f=0) USER MOD Single : B1340 LYS NZ :NH3+ 164:sc= -0.601 (180deg=-1.21) USER MOD Single : B1347 GLN : amide:sc= 0 X(o=0,f=-0.06) USER MOD Single : B1350 GLN : amide:sc=-0.00161 K(o=-0.0016,f=-1.3) USER MOD Single : B1351 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B1352 GLN : amide:sc= 0 K(o=0,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -6 139.637 -25.369 -29.835 1.00 15.46 N ATOM 2 CA GLY A -6 140.624 -25.535 -28.730 1.00 15.25 C ATOM 3 C GLY A -6 140.453 -24.402 -27.716 1.00 14.89 C ATOM 4 O GLY A -6 139.828 -24.606 -26.674 1.00 15.06 O ATOM 0 H1 GLY A -6 139.612 -26.235 -30.411 1.00 15.46 H new ATOM 0 H2 GLY A -6 138.694 -25.192 -29.434 1.00 15.46 H new ATOM 0 H3 GLY A -6 139.916 -24.564 -30.432 1.00 15.46 H new ATOM 0 HA2 GLY A -6 140.480 -26.499 -28.242 1.00 15.25 H new ATOM 0 HA3 GLY A -6 141.638 -25.529 -29.130 1.00 15.25 H new ATOM 10 N PRO A -5 140.982 -23.223 -27.981 1.00 14.57 N ATOM 11 CA PRO A -5 140.848 -22.078 -27.029 1.00 14.41 C ATOM 12 C PRO A -5 139.405 -21.878 -26.573 1.00 14.11 C ATOM 13 O PRO A -5 138.466 -22.069 -27.346 1.00 13.67 O ATOM 14 CB PRO A -5 141.336 -20.867 -27.824 1.00 14.29 C ATOM 15 CG PRO A -5 142.260 -21.418 -28.855 1.00 14.26 C ATOM 16 CD PRO A -5 141.762 -22.826 -29.175 1.00 14.52 C ATOM 0 HA PRO A -5 141.419 -22.246 -26.116 1.00 14.41 H new ATOM 0 HB2 PRO A -5 140.502 -20.338 -28.286 1.00 14.29 H new ATOM 0 HB3 PRO A -5 141.848 -20.153 -27.178 1.00 14.29 H new ATOM 0 HG2 PRO A -5 142.260 -20.794 -29.749 1.00 14.26 H new ATOM 0 HG3 PRO A -5 143.285 -21.444 -28.484 1.00 14.26 H new ATOM 0 HD2 PRO A -5 141.145 -22.834 -30.073 1.00 14.52 H new ATOM 0 HD3 PRO A -5 142.592 -23.510 -29.352 1.00 14.52 H new ATOM 24 N HIS A -4 139.238 -21.493 -25.311 1.00 14.53 N ATOM 25 CA HIS A -4 137.906 -21.269 -24.757 1.00 14.51 C ATOM 26 C HIS A -4 137.885 -20.004 -23.906 1.00 13.48 C ATOM 27 O HIS A -4 138.820 -19.737 -23.151 1.00 13.38 O ATOM 28 CB HIS A -4 137.490 -22.467 -23.901 1.00 15.28 C ATOM 29 CG HIS A -4 136.108 -22.337 -23.322 1.00 16.32 C ATOM 30 ND1 HIS A -4 134.973 -22.306 -24.117 1.00 16.97 N ATOM 31 CD2 HIS A -4 135.662 -22.229 -22.028 1.00 16.97 C ATOM 32 CE1 HIS A -4 133.910 -22.183 -23.303 1.00 17.91 C ATOM 33 NE2 HIS A -4 134.272 -22.131 -22.018 1.00 17.96 N ATOM 0 H HIS A -4 140.003 -21.330 -24.656 1.00 14.53 H new ATOM 0 HA HIS A -4 137.205 -21.150 -25.583 1.00 14.51 H new ATOM 0 HB2 HIS A -4 137.538 -23.371 -24.507 1.00 15.28 H new ATOM 0 HB3 HIS A -4 138.206 -22.590 -23.088 1.00 15.28 H new ATOM 0 HD2 HIS A -4 136.293 -22.221 -21.151 1.00 16.97 H new ATOM 0 HE1 HIS A -4 132.887 -22.132 -23.646 1.00 17.91 H new ATOM 0 HE2 HIS A -4 133.663 -22.039 -21.205 1.00 17.96 H new ATOM 41 N MET A -3 136.813 -19.228 -24.034 1.00 12.88 N ATOM 42 CA MET A -3 136.677 -17.990 -23.272 1.00 12.01 C ATOM 43 C MET A -3 135.715 -18.183 -22.104 1.00 10.88 C ATOM 44 O MET A -3 134.714 -18.891 -22.222 1.00 10.70 O ATOM 45 CB MET A -3 136.159 -16.874 -24.183 1.00 12.15 C ATOM 46 CG MET A -3 137.194 -16.579 -25.269 1.00 12.97 C ATOM 47 SD MET A -3 136.631 -15.182 -26.275 1.00 13.28 S ATOM 48 CE MET A -3 137.972 -15.223 -27.490 1.00 13.70 C ATOM 0 H MET A -3 136.030 -19.432 -24.654 1.00 12.88 H new ATOM 0 HA MET A -3 137.656 -17.716 -22.879 1.00 12.01 H new ATOM 0 HB2 MET A -3 135.214 -17.171 -24.638 1.00 12.15 H new ATOM 0 HB3 MET A -3 135.963 -15.975 -23.599 1.00 12.15 H new ATOM 0 HG2 MET A -3 138.158 -16.349 -24.815 1.00 12.97 H new ATOM 0 HG3 MET A -3 137.339 -17.458 -25.897 1.00 12.97 H new ATOM 0 HE1 MET A -3 137.824 -14.430 -28.222 1.00 13.70 H new ATOM 0 HE2 MET A -3 138.926 -15.076 -26.984 1.00 13.70 H new ATOM 0 HE3 MET A -3 137.975 -16.188 -27.996 1.00 13.70 H new ATOM 58 N ALA A -2 136.026 -17.549 -20.978 1.00 10.30 N ATOM 59 CA ALA A -2 135.179 -17.655 -19.795 1.00 9.32 C ATOM 60 C ALA A -2 133.842 -16.961 -20.029 1.00 8.29 C ATOM 61 O ALA A -2 133.756 -16.000 -20.794 1.00 8.43 O ATOM 62 CB ALA A -2 135.882 -17.022 -18.593 1.00 9.59 C ATOM 0 H ALA A -2 136.851 -16.961 -20.860 1.00 10.30 H new ATOM 0 HA ALA A -2 134.996 -18.711 -19.595 1.00 9.32 H new ATOM 0 HB1 ALA A -2 135.244 -17.105 -17.713 1.00 9.59 H new ATOM 0 HB2 ALA A -2 136.824 -17.539 -18.408 1.00 9.59 H new ATOM 0 HB3 ALA A -2 136.080 -15.970 -18.800 1.00 9.59 H new ATOM 68 N ASP A -1 132.800 -17.453 -19.367 1.00 7.47 N ATOM 69 CA ASP A -1 131.469 -16.875 -19.517 1.00 6.62 C ATOM 70 C ASP A -1 131.396 -15.514 -18.833 1.00 6.22 C ATOM 71 O ASP A -1 131.739 -15.379 -17.659 1.00 6.12 O ATOM 72 CB ASP A -1 130.420 -17.810 -18.911 1.00 6.18 C ATOM 73 CG ASP A -1 130.358 -19.113 -19.702 1.00 6.24 C ATOM 74 OD1 ASP A -1 131.396 -19.551 -20.171 1.00 6.63 O ATOM 75 OD2 ASP A -1 129.272 -19.656 -19.824 1.00 6.23 O ATOM 0 H ASP A -1 132.850 -18.245 -18.726 1.00 7.47 H new ATOM 0 HA ASP A -1 131.268 -16.746 -20.581 1.00 6.62 H new ATOM 0 HB2 ASP A -1 130.666 -18.019 -17.870 1.00 6.18 H new ATOM 0 HB3 ASP A -1 129.444 -17.326 -18.916 1.00 6.18 H new ATOM 80 N LEU A 0 130.946 -14.507 -19.576 1.00 6.27 N ATOM 81 CA LEU A 0 130.832 -13.159 -19.033 1.00 6.33 C ATOM 82 C LEU A 0 129.714 -13.077 -17.995 1.00 5.45 C ATOM 83 O LEU A 0 129.845 -12.386 -16.984 1.00 5.75 O ATOM 84 CB LEU A 0 130.553 -12.164 -20.160 1.00 6.73 C ATOM 85 CG LEU A 0 131.807 -12.006 -21.024 1.00 7.46 C ATOM 86 CD1 LEU A 0 131.875 -13.149 -22.040 1.00 8.19 C ATOM 87 CD2 LEU A 0 131.749 -10.669 -21.766 1.00 8.05 C ATOM 0 H LEU A 0 130.656 -14.599 -20.550 1.00 6.27 H new ATOM 0 HA LEU A 0 131.776 -12.910 -18.547 1.00 6.33 H new ATOM 0 HB2 LEU A 0 129.720 -12.513 -20.770 1.00 6.73 H new ATOM 0 HB3 LEU A 0 130.261 -11.200 -19.744 1.00 6.73 H new ATOM 0 HG LEU A 0 132.692 -12.032 -20.388 1.00 7.46 H new ATOM 0 HD11 LEU A 0 132.768 -13.036 -22.655 1.00 8.19 H new ATOM 0 HD12 LEU A 0 131.915 -14.102 -21.513 1.00 8.19 H new ATOM 0 HD13 LEU A 0 130.990 -13.123 -22.676 1.00 8.19 H new ATOM 0 HD21 LEU A 0 132.641 -10.555 -22.381 1.00 8.05 H new ATOM 0 HD22 LEU A 0 130.864 -10.644 -22.402 1.00 8.05 H new ATOM 0 HD23 LEU A 0 131.700 -9.854 -21.044 1.00 8.05 H new ATOM 99 N MET A 1 128.616 -13.784 -18.247 1.00 4.62 N ATOM 100 CA MET A 1 127.478 -13.760 -17.336 1.00 3.90 C ATOM 101 C MET A 1 127.735 -14.653 -16.125 1.00 3.17 C ATOM 102 O MET A 1 128.274 -15.752 -16.255 1.00 3.20 O ATOM 103 CB MET A 1 126.218 -14.234 -18.064 1.00 3.84 C ATOM 104 CG MET A 1 125.868 -13.242 -19.175 1.00 4.58 C ATOM 105 SD MET A 1 124.323 -13.747 -19.971 1.00 5.13 S ATOM 106 CE MET A 1 124.302 -12.471 -21.253 1.00 5.58 C ATOM 0 H MET A 1 128.491 -14.376 -19.068 1.00 4.62 H new ATOM 0 HA MET A 1 127.337 -12.736 -16.991 1.00 3.90 H new ATOM 0 HB2 MET A 1 126.380 -15.226 -18.485 1.00 3.84 H new ATOM 0 HB3 MET A 1 125.389 -14.317 -17.362 1.00 3.84 H new ATOM 0 HG2 MET A 1 125.766 -12.238 -18.762 1.00 4.58 H new ATOM 0 HG3 MET A 1 126.672 -13.204 -19.910 1.00 4.58 H new ATOM 0 HE1 MET A 1 123.415 -12.594 -21.875 1.00 5.58 H new ATOM 0 HE2 MET A 1 124.284 -11.486 -20.786 1.00 5.58 H new ATOM 0 HE3 MET A 1 125.195 -12.562 -21.872 1.00 5.58 H new ATOM 116 N ALA A 2 127.343 -14.172 -14.949 1.00 2.92 N ATOM 117 CA ALA A 2 127.530 -14.930 -13.717 1.00 2.36 C ATOM 118 C ALA A 2 126.212 -15.555 -13.268 1.00 1.75 C ATOM 119 O ALA A 2 125.136 -15.037 -13.564 1.00 2.08 O ATOM 120 CB ALA A 2 128.062 -14.011 -12.615 1.00 2.98 C ATOM 0 H ALA A 2 126.895 -13.264 -14.824 1.00 2.92 H new ATOM 0 HA ALA A 2 128.251 -15.725 -13.907 1.00 2.36 H new ATOM 0 HB1 ALA A 2 128.199 -14.584 -11.698 1.00 2.98 H new ATOM 0 HB2 ALA A 2 129.017 -13.587 -12.924 1.00 2.98 H new ATOM 0 HB3 ALA A 2 127.349 -13.206 -12.437 1.00 2.98 H new ATOM 126 N ASP A 3 126.307 -16.670 -12.550 1.00 1.21 N ATOM 127 CA ASP A 3 125.116 -17.357 -12.067 1.00 0.81 C ATOM 128 C ASP A 3 124.416 -16.532 -10.991 1.00 0.68 C ATOM 129 O ASP A 3 125.066 -15.907 -10.154 1.00 0.65 O ATOM 130 CB ASP A 3 125.496 -18.725 -11.497 1.00 1.12 C ATOM 131 CG ASP A 3 126.007 -19.636 -12.609 1.00 1.71 C ATOM 132 OD1 ASP A 3 126.648 -19.130 -13.515 1.00 2.24 O ATOM 133 OD2 ASP A 3 125.747 -20.826 -12.538 1.00 2.25 O ATOM 0 H ASP A 3 127.189 -17.113 -12.292 1.00 1.21 H new ATOM 0 HA ASP A 3 124.433 -17.490 -12.906 1.00 0.81 H new ATOM 0 HB2 ASP A 3 126.263 -18.608 -10.732 1.00 1.12 H new ATOM 0 HB3 ASP A 3 124.631 -19.179 -11.014 1.00 1.12 H new ATOM 138 N GLU A 4 123.087 -16.537 -11.021 1.00 0.65 N ATOM 139 CA GLU A 4 122.305 -15.794 -10.039 1.00 0.57 C ATOM 140 C GLU A 4 122.541 -16.315 -8.621 1.00 0.50 C ATOM 141 O GLU A 4 122.529 -15.546 -7.659 1.00 0.45 O ATOM 142 CB GLU A 4 120.816 -15.899 -10.377 1.00 0.60 C ATOM 143 CG GLU A 4 120.551 -15.240 -11.734 1.00 1.35 C ATOM 144 CD GLU A 4 119.057 -15.235 -12.064 1.00 1.90 C ATOM 145 OE1 GLU A 4 118.332 -16.056 -11.524 1.00 2.07 O ATOM 146 OE2 GLU A 4 118.657 -14.400 -12.858 1.00 2.69 O ATOM 0 H GLU A 4 122.532 -17.044 -11.710 1.00 0.65 H new ATOM 0 HA GLU A 4 122.625 -14.753 -10.077 1.00 0.57 H new ATOM 0 HB2 GLU A 4 120.511 -16.945 -10.403 1.00 0.60 H new ATOM 0 HB3 GLU A 4 120.222 -15.413 -9.603 1.00 0.60 H new ATOM 0 HG2 GLU A 4 120.927 -14.217 -11.724 1.00 1.35 H new ATOM 0 HG3 GLU A 4 121.096 -15.773 -12.513 1.00 1.35 H new ATOM 153 N SER A 5 122.772 -17.620 -8.489 1.00 0.52 N ATOM 154 CA SER A 5 122.968 -18.223 -7.175 1.00 0.49 C ATOM 155 C SER A 5 124.113 -17.539 -6.432 1.00 0.45 C ATOM 156 O SER A 5 124.022 -17.279 -5.233 1.00 0.41 O ATOM 157 CB SER A 5 123.275 -19.713 -7.325 1.00 0.55 C ATOM 158 OG SER A 5 124.541 -19.868 -7.951 1.00 1.49 O ATOM 0 H SER A 5 122.827 -18.274 -9.270 1.00 0.52 H new ATOM 0 HA SER A 5 122.051 -18.096 -6.600 1.00 0.49 H new ATOM 0 HB2 SER A 5 123.277 -20.196 -6.348 1.00 0.55 H new ATOM 0 HB3 SER A 5 122.500 -20.198 -7.919 1.00 0.55 H new ATOM 0 HG SER A 5 124.743 -20.822 -8.048 1.00 1.49 H new ATOM 164 N ILE A 6 125.177 -17.218 -7.159 1.00 0.47 N ATOM 165 CA ILE A 6 126.341 -16.584 -6.549 1.00 0.44 C ATOM 166 C ILE A 6 125.945 -15.253 -5.918 1.00 0.39 C ATOM 167 O ILE A 6 126.296 -14.965 -4.773 1.00 0.36 O ATOM 168 CB ILE A 6 127.434 -16.356 -7.602 1.00 0.49 C ATOM 169 CG1 ILE A 6 127.784 -17.674 -8.310 1.00 0.54 C ATOM 170 CG2 ILE A 6 128.690 -15.788 -6.934 1.00 0.48 C ATOM 171 CD1 ILE A 6 128.253 -18.751 -7.319 1.00 0.54 C ATOM 0 H ILE A 6 125.259 -17.384 -8.162 1.00 0.47 H new ATOM 0 HA ILE A 6 126.729 -17.244 -5.773 1.00 0.44 H new ATOM 0 HB ILE A 6 127.060 -15.647 -8.340 1.00 0.49 H new ATOM 0 HG12 ILE A 6 126.912 -18.037 -8.854 1.00 0.54 H new ATOM 0 HG13 ILE A 6 128.567 -17.493 -9.047 1.00 0.54 H new ATOM 0 HG21 ILE A 6 129.462 -15.628 -7.687 1.00 0.48 H new ATOM 0 HG22 ILE A 6 128.450 -14.839 -6.454 1.00 0.48 H new ATOM 0 HG23 ILE A 6 129.054 -16.492 -6.185 1.00 0.48 H new ATOM 0 HD11 ILE A 6 128.490 -19.666 -7.862 1.00 0.54 H new ATOM 0 HD12 ILE A 6 129.141 -18.400 -6.794 1.00 0.54 H new ATOM 0 HD13 ILE A 6 127.461 -18.952 -6.598 1.00 0.54 H new ATOM 183 N THR A 7 125.184 -14.454 -6.658 1.00 0.40 N ATOM 184 CA THR A 7 124.783 -13.138 -6.175 1.00 0.37 C ATOM 185 C THR A 7 124.006 -13.266 -4.868 1.00 0.33 C ATOM 186 O THR A 7 124.253 -12.534 -3.911 1.00 0.30 O ATOM 187 CB THR A 7 123.916 -12.439 -7.223 1.00 0.40 C ATOM 188 OG1 THR A 7 124.603 -12.419 -8.466 1.00 0.44 O ATOM 189 CG2 THR A 7 123.625 -11.006 -6.775 1.00 0.39 C ATOM 0 H THR A 7 124.835 -14.692 -7.587 1.00 0.40 H new ATOM 0 HA THR A 7 125.680 -12.545 -5.996 1.00 0.37 H new ATOM 0 HB THR A 7 122.976 -12.979 -7.336 1.00 0.40 H new ATOM 0 HG1 THR A 7 124.048 -11.973 -9.139 1.00 0.44 H new ATOM 0 HG21 THR A 7 123.007 -10.509 -7.523 1.00 0.39 H new ATOM 0 HG22 THR A 7 123.097 -11.023 -5.821 1.00 0.39 H new ATOM 0 HG23 THR A 7 124.563 -10.463 -6.661 1.00 0.39 H new ATOM 197 N ARG A 8 123.078 -14.214 -4.831 1.00 0.34 N ATOM 198 CA ARG A 8 122.250 -14.408 -3.646 1.00 0.32 C ATOM 199 C ARG A 8 123.117 -14.719 -2.431 1.00 0.30 C ATOM 200 O ARG A 8 122.932 -14.143 -1.360 1.00 0.28 O ATOM 201 CB ARG A 8 121.262 -15.552 -3.882 1.00 0.36 C ATOM 202 CG ARG A 8 120.296 -15.648 -2.699 1.00 1.30 C ATOM 203 CD ARG A 8 119.349 -16.831 -2.908 1.00 1.59 C ATOM 204 NE ARG A 8 118.342 -16.868 -1.843 1.00 2.28 N ATOM 205 CZ ARG A 8 117.315 -17.732 -1.827 1.00 2.67 C ATOM 206 NH1 ARG A 8 117.132 -18.621 -2.774 1.00 2.69 N ATOM 207 NH2 ARG A 8 116.470 -17.688 -0.833 1.00 3.48 N ATOM 0 H ARG A 8 122.880 -14.855 -5.599 1.00 0.34 H new ATOM 0 HA ARG A 8 121.698 -13.487 -3.455 1.00 0.32 H new ATOM 0 HB2 ARG A 8 120.707 -15.382 -4.805 1.00 0.36 H new ATOM 0 HB3 ARG A 8 121.800 -16.492 -4.002 1.00 0.36 H new ATOM 0 HG2 ARG A 8 120.853 -15.774 -1.770 1.00 1.30 H new ATOM 0 HG3 ARG A 8 119.726 -14.724 -2.606 1.00 1.30 H new ATOM 0 HD2 ARG A 8 118.860 -16.747 -3.878 1.00 1.59 H new ATOM 0 HD3 ARG A 8 119.915 -17.762 -2.916 1.00 1.59 H new ATOM 0 HE ARG A 8 118.426 -16.203 -1.074 1.00 2.28 H new ATOM 0 HH11 ARG A 8 117.783 -18.672 -3.558 1.00 2.69 H new ATOM 0 HH12 ARG A 8 116.339 -19.261 -2.726 1.00 2.69 H new ATOM 0 HH21 ARG A 8 116.596 -17.005 -0.086 1.00 3.48 H new ATOM 0 HH22 ARG A 8 115.683 -18.336 -0.803 1.00 3.48 H new ATOM 221 N MET A 9 124.086 -15.610 -2.610 1.00 0.31 N ATOM 222 CA MET A 9 124.950 -16.010 -1.505 1.00 0.30 C ATOM 223 C MET A 9 125.664 -14.795 -0.921 1.00 0.26 C ATOM 224 O MET A 9 125.737 -14.626 0.297 1.00 0.24 O ATOM 225 CB MET A 9 125.986 -17.028 -1.989 1.00 0.33 C ATOM 226 CG MET A 9 125.292 -18.328 -2.404 1.00 0.97 C ATOM 227 SD MET A 9 124.514 -19.107 -0.965 1.00 1.22 S ATOM 228 CE MET A 9 126.029 -19.499 -0.057 1.00 1.56 C ATOM 0 H MET A 9 124.292 -16.065 -3.499 1.00 0.31 H new ATOM 0 HA MET A 9 124.331 -16.464 -0.731 1.00 0.30 H new ATOM 0 HB2 MET A 9 126.543 -16.619 -2.832 1.00 0.33 H new ATOM 0 HB3 MET A 9 126.708 -17.229 -1.197 1.00 0.33 H new ATOM 0 HG2 MET A 9 124.540 -18.121 -3.166 1.00 0.97 H new ATOM 0 HG3 MET A 9 126.017 -19.010 -2.849 1.00 0.97 H new ATOM 0 HE1 MET A 9 125.850 -20.352 0.598 1.00 1.56 H new ATOM 0 HE2 MET A 9 126.823 -19.743 -0.763 1.00 1.56 H new ATOM 0 HE3 MET A 9 126.327 -18.638 0.542 1.00 1.56 H new ATOM 238 N ASN A 10 126.160 -13.930 -1.798 1.00 0.26 N ATOM 239 CA ASN A 10 126.892 -12.752 -1.350 1.00 0.23 C ATOM 240 C ASN A 10 126.001 -11.881 -0.472 1.00 0.20 C ATOM 241 O ASN A 10 126.382 -11.505 0.634 1.00 0.17 O ATOM 242 CB ASN A 10 127.383 -11.944 -2.555 1.00 0.25 C ATOM 243 CG ASN A 10 128.321 -12.796 -3.404 1.00 0.30 C ATOM 244 OD1 ASN A 10 128.185 -12.836 -4.628 1.00 1.04 O ATOM 245 ND2 ASN A 10 129.268 -13.483 -2.827 1.00 1.03 N ATOM 0 H ASN A 10 126.071 -14.020 -2.810 1.00 0.26 H new ATOM 0 HA ASN A 10 127.753 -13.079 -0.768 1.00 0.23 H new ATOM 0 HB2 ASN A 10 126.534 -11.616 -3.154 1.00 0.25 H new ATOM 0 HB3 ASN A 10 127.900 -11.046 -2.216 1.00 0.25 H new ATOM 0 HD21 ASN A 10 129.898 -14.055 -3.389 1.00 1.03 H new ATOM 0 HD22 ASN A 10 129.378 -13.448 -1.814 1.00 1.03 H new ATOM 252 N LEU A 11 124.797 -11.596 -0.954 1.00 0.22 N ATOM 253 CA LEU A 11 123.870 -10.756 -0.194 1.00 0.22 C ATOM 254 C LEU A 11 123.513 -11.395 1.152 1.00 0.20 C ATOM 255 O LEU A 11 123.258 -10.688 2.125 1.00 0.19 O ATOM 256 CB LEU A 11 122.607 -10.477 -1.015 1.00 0.26 C ATOM 257 CG LEU A 11 121.769 -9.377 -0.349 1.00 0.17 C ATOM 258 CD1 LEU A 11 122.380 -7.995 -0.618 1.00 0.26 C ATOM 259 CD2 LEU A 11 120.348 -9.413 -0.917 1.00 0.17 C ATOM 0 H LEU A 11 124.441 -11.926 -1.851 1.00 0.22 H new ATOM 0 HA LEU A 11 124.367 -9.808 0.013 1.00 0.22 H new ATOM 0 HB2 LEU A 11 122.882 -10.173 -2.025 1.00 0.26 H new ATOM 0 HB3 LEU A 11 122.016 -11.388 -1.106 1.00 0.26 H new ATOM 0 HG LEU A 11 121.752 -9.553 0.727 1.00 0.17 H new ATOM 0 HD11 LEU A 11 121.772 -7.229 -0.138 1.00 0.26 H new ATOM 0 HD12 LEU A 11 123.392 -7.960 -0.215 1.00 0.26 H new ATOM 0 HD13 LEU A 11 122.411 -7.814 -1.692 1.00 0.26 H new ATOM 0 HD21 LEU A 11 119.748 -8.633 -0.447 1.00 0.17 H new ATOM 0 HD22 LEU A 11 120.382 -9.245 -1.993 1.00 0.17 H new ATOM 0 HD23 LEU A 11 119.900 -10.386 -0.715 1.00 0.17 H new ATOM 271 N ALA A 12 123.514 -12.726 1.220 1.00 0.22 N ATOM 272 CA ALA A 12 123.230 -13.420 2.472 1.00 0.23 C ATOM 273 C ALA A 12 124.290 -13.089 3.521 1.00 0.21 C ATOM 274 O ALA A 12 123.963 -12.715 4.647 1.00 0.22 O ATOM 275 CB ALA A 12 123.198 -14.931 2.235 1.00 0.26 C ATOM 0 H ALA A 12 123.707 -13.340 0.429 1.00 0.22 H new ATOM 0 HA ALA A 12 122.258 -13.089 2.837 1.00 0.23 H new ATOM 0 HB1 ALA A 12 122.986 -15.442 3.174 1.00 0.26 H new ATOM 0 HB2 ALA A 12 122.421 -15.169 1.508 1.00 0.26 H new ATOM 0 HB3 ALA A 12 124.165 -15.260 1.853 1.00 0.26 H new ATOM 281 N ALA A 13 125.559 -13.229 3.145 1.00 0.20 N ATOM 282 CA ALA A 13 126.651 -12.914 4.066 1.00 0.20 C ATOM 283 C ALA A 13 126.550 -11.465 4.534 1.00 0.18 C ATOM 284 O ALA A 13 126.754 -11.161 5.710 1.00 0.20 O ATOM 285 CB ALA A 13 128.008 -13.132 3.391 1.00 0.19 C ATOM 0 H ALA A 13 125.855 -13.553 2.224 1.00 0.20 H new ATOM 0 HA ALA A 13 126.568 -13.580 4.925 1.00 0.20 H new ATOM 0 HB1 ALA A 13 128.806 -12.892 4.093 1.00 0.19 H new ATOM 0 HB2 ALA A 13 128.097 -14.173 3.082 1.00 0.19 H new ATOM 0 HB3 ALA A 13 128.087 -12.486 2.517 1.00 0.19 H new ATOM 291 N ILE A 14 126.236 -10.577 3.596 1.00 0.16 N ATOM 292 CA ILE A 14 126.080 -9.158 3.893 1.00 0.16 C ATOM 293 C ILE A 14 125.073 -8.951 5.029 1.00 0.19 C ATOM 294 O ILE A 14 125.394 -8.314 6.029 1.00 0.20 O ATOM 295 CB ILE A 14 125.641 -8.449 2.599 1.00 0.16 C ATOM 296 CG1 ILE A 14 126.799 -8.521 1.593 1.00 0.15 C ATOM 297 CG2 ILE A 14 125.274 -6.978 2.846 1.00 0.18 C ATOM 298 CD1 ILE A 14 126.343 -8.115 0.185 1.00 0.17 C ATOM 0 H ILE A 14 126.084 -10.818 2.617 1.00 0.16 H new ATOM 0 HA ILE A 14 127.023 -8.732 4.235 1.00 0.16 H new ATOM 0 HB ILE A 14 124.752 -8.949 2.214 1.00 0.16 H new ATOM 0 HG12 ILE A 14 127.607 -7.866 1.918 1.00 0.15 H new ATOM 0 HG13 ILE A 14 127.200 -9.534 1.569 1.00 0.15 H new ATOM 0 HG21 ILE A 14 124.970 -6.516 1.907 1.00 0.18 H new ATOM 0 HG22 ILE A 14 124.452 -6.923 3.560 1.00 0.18 H new ATOM 0 HG23 ILE A 14 126.139 -6.450 3.247 1.00 0.18 H new ATOM 0 HD11 ILE A 14 127.186 -8.177 -0.503 1.00 0.17 H new ATOM 0 HD12 ILE A 14 125.552 -8.787 -0.149 1.00 0.17 H new ATOM 0 HD13 ILE A 14 125.966 -7.093 0.205 1.00 0.17 H new ATOM 310 N LYS A 15 123.878 -9.515 4.894 1.00 0.20 N ATOM 311 CA LYS A 15 122.844 -9.346 5.915 1.00 0.23 C ATOM 312 C LYS A 15 123.335 -9.722 7.316 1.00 0.25 C ATOM 313 O LYS A 15 122.820 -9.212 8.311 1.00 0.29 O ATOM 314 CB LYS A 15 121.619 -10.191 5.559 1.00 0.26 C ATOM 315 CG LYS A 15 120.961 -9.628 4.297 1.00 0.26 C ATOM 316 CD LYS A 15 119.672 -10.398 4.006 1.00 0.31 C ATOM 317 CE LYS A 15 119.080 -9.921 2.678 1.00 1.08 C ATOM 318 NZ LYS A 15 118.273 -8.689 2.909 1.00 1.46 N ATOM 0 H LYS A 15 123.600 -10.088 4.097 1.00 0.20 H new ATOM 0 HA LYS A 15 122.581 -8.288 5.933 1.00 0.23 H new ATOM 0 HB2 LYS A 15 121.914 -11.228 5.397 1.00 0.26 H new ATOM 0 HB3 LYS A 15 120.908 -10.187 6.385 1.00 0.26 H new ATOM 0 HG2 LYS A 15 120.742 -8.569 4.430 1.00 0.26 H new ATOM 0 HG3 LYS A 15 121.644 -9.708 3.451 1.00 0.26 H new ATOM 0 HD2 LYS A 15 119.877 -11.468 3.961 1.00 0.31 H new ATOM 0 HD3 LYS A 15 118.954 -10.244 4.812 1.00 0.31 H new ATOM 0 HE2 LYS A 15 119.878 -9.718 1.964 1.00 1.08 H new ATOM 0 HE3 LYS A 15 118.455 -10.702 2.244 1.00 1.08 H new ATOM 0 HZ1 LYS A 15 117.543 -8.609 2.173 1.00 1.46 H new ATOM 0 HZ2 LYS A 15 117.818 -8.742 3.843 1.00 1.46 H new ATOM 0 HZ3 LYS A 15 118.894 -7.855 2.873 1.00 1.46 H new ATOM 332 N LYS A 16 124.324 -10.609 7.400 1.00 0.25 N ATOM 333 CA LYS A 16 124.815 -11.077 8.694 1.00 0.28 C ATOM 334 C LYS A 16 125.343 -9.927 9.554 1.00 0.26 C ATOM 335 O LYS A 16 125.228 -9.957 10.779 1.00 0.29 O ATOM 336 CB LYS A 16 125.929 -12.105 8.484 1.00 0.30 C ATOM 337 CG LYS A 16 126.305 -12.734 9.827 1.00 1.21 C ATOM 338 CD LYS A 16 127.476 -13.699 9.632 1.00 1.55 C ATOM 339 CE LYS A 16 127.750 -14.443 10.940 1.00 2.44 C ATOM 340 NZ LYS A 16 128.798 -15.477 10.714 1.00 3.34 N ATOM 0 H LYS A 16 124.798 -11.016 6.594 1.00 0.25 H new ATOM 0 HA LYS A 16 123.976 -11.533 9.219 1.00 0.28 H new ATOM 0 HB2 LYS A 16 125.599 -12.877 7.789 1.00 0.30 H new ATOM 0 HB3 LYS A 16 126.801 -11.626 8.038 1.00 0.30 H new ATOM 0 HG2 LYS A 16 126.577 -11.956 10.541 1.00 1.21 H new ATOM 0 HG3 LYS A 16 125.449 -13.265 10.244 1.00 1.21 H new ATOM 0 HD2 LYS A 16 127.246 -14.410 8.838 1.00 1.55 H new ATOM 0 HD3 LYS A 16 128.365 -13.150 9.321 1.00 1.55 H new ATOM 0 HE2 LYS A 16 128.076 -13.742 11.708 1.00 2.44 H new ATOM 0 HE3 LYS A 16 126.835 -14.911 11.303 1.00 2.44 H new ATOM 0 HZ1 LYS A 16 128.984 -15.983 11.603 1.00 3.34 H new ATOM 0 HZ2 LYS A 16 128.470 -16.152 9.994 1.00 3.34 H new ATOM 0 HZ3 LYS A 16 129.673 -15.019 10.387 1.00 3.34 H new ATOM 354 N ILE A 17 125.920 -8.915 8.912 1.00 0.24 N ATOM 355 CA ILE A 17 126.517 -7.794 9.629 1.00 0.25 C ATOM 356 C ILE A 17 125.609 -6.571 9.539 1.00 0.25 C ATOM 357 O ILE A 17 125.387 -5.871 10.527 1.00 0.30 O ATOM 358 CB ILE A 17 127.885 -7.462 9.017 1.00 0.26 C ATOM 359 CG1 ILE A 17 128.797 -8.700 9.025 1.00 0.29 C ATOM 360 CG2 ILE A 17 128.555 -6.314 9.779 1.00 0.30 C ATOM 361 CD1 ILE A 17 129.020 -9.219 10.451 1.00 0.32 C ATOM 0 H ILE A 17 125.986 -8.849 7.896 1.00 0.24 H new ATOM 0 HA ILE A 17 126.642 -8.069 10.676 1.00 0.25 H new ATOM 0 HB ILE A 17 127.726 -7.150 7.985 1.00 0.26 H new ATOM 0 HG12 ILE A 17 128.352 -9.486 8.415 1.00 0.29 H new ATOM 0 HG13 ILE A 17 129.757 -8.450 8.572 1.00 0.29 H new ATOM 0 HG21 ILE A 17 129.523 -6.095 9.329 1.00 0.30 H new ATOM 0 HG22 ILE A 17 127.923 -5.427 9.730 1.00 0.30 H new ATOM 0 HG23 ILE A 17 128.696 -6.602 10.821 1.00 0.30 H new ATOM 0 HD11 ILE A 17 129.669 -10.094 10.422 1.00 0.32 H new ATOM 0 HD12 ILE A 17 129.488 -8.440 11.053 1.00 0.32 H new ATOM 0 HD13 ILE A 17 128.062 -9.492 10.893 1.00 0.32 H new ATOM 373 N ASP A 18 125.097 -6.320 8.338 1.00 0.22 N ATOM 374 CA ASP A 18 124.273 -5.142 8.081 1.00 0.24 C ATOM 375 C ASP A 18 122.841 -5.563 7.728 1.00 0.27 C ATOM 376 O ASP A 18 122.508 -5.678 6.550 1.00 0.23 O ATOM 377 CB ASP A 18 124.892 -4.346 6.927 1.00 0.23 C ATOM 378 CG ASP A 18 124.554 -2.865 7.049 1.00 0.28 C ATOM 379 OD1 ASP A 18 124.481 -2.379 8.165 1.00 0.32 O ATOM 380 OD2 ASP A 18 124.376 -2.235 6.019 1.00 0.32 O ATOM 0 H ASP A 18 125.239 -6.919 7.524 1.00 0.22 H new ATOM 0 HA ASP A 18 124.235 -4.520 8.975 1.00 0.24 H new ATOM 0 HB2 ASP A 18 125.974 -4.478 6.927 1.00 0.23 H new ATOM 0 HB3 ASP A 18 124.524 -4.730 5.976 1.00 0.23 H new ATOM 385 N PRO A 19 121.983 -5.784 8.704 1.00 0.37 N ATOM 386 CA PRO A 19 120.596 -6.274 8.427 1.00 0.46 C ATOM 387 C PRO A 19 119.849 -5.431 7.395 1.00 0.45 C ATOM 388 O PRO A 19 118.895 -5.908 6.780 1.00 0.49 O ATOM 389 CB PRO A 19 119.888 -6.208 9.783 1.00 0.59 C ATOM 390 CG PRO A 19 120.974 -6.265 10.800 1.00 0.57 C ATOM 391 CD PRO A 19 122.198 -5.617 10.157 1.00 0.44 C ATOM 0 HA PRO A 19 120.623 -7.276 7.998 1.00 0.46 H new ATOM 0 HB2 PRO A 19 119.308 -5.290 9.879 1.00 0.59 H new ATOM 0 HB3 PRO A 19 119.193 -7.039 9.904 1.00 0.59 H new ATOM 0 HG2 PRO A 19 120.685 -5.735 11.707 1.00 0.57 H new ATOM 0 HG3 PRO A 19 121.185 -7.295 11.086 1.00 0.57 H new ATOM 0 HD2 PRO A 19 122.279 -4.564 10.428 1.00 0.44 H new ATOM 0 HD3 PRO A 19 123.120 -6.101 10.480 1.00 0.44 H new ATOM 399 N TYR A 20 120.272 -4.182 7.200 1.00 0.42 N ATOM 400 CA TYR A 20 119.538 -3.269 6.318 1.00 0.45 C ATOM 401 C TYR A 20 120.160 -3.141 4.923 1.00 0.42 C ATOM 402 O TYR A 20 119.844 -2.199 4.195 1.00 0.56 O ATOM 403 CB TYR A 20 119.433 -1.887 6.968 1.00 0.50 C ATOM 404 CG TYR A 20 120.759 -1.204 7.213 1.00 0.52 C ATOM 405 CD1 TYR A 20 121.472 -0.644 6.144 1.00 1.28 C ATOM 406 CD2 TYR A 20 121.265 -1.112 8.514 1.00 1.06 C ATOM 407 CE1 TYR A 20 122.689 0.005 6.379 1.00 1.35 C ATOM 408 CE2 TYR A 20 122.485 -0.465 8.748 1.00 1.02 C ATOM 409 CZ TYR A 20 123.196 0.094 7.681 1.00 0.60 C ATOM 410 OH TYR A 20 124.397 0.734 7.911 1.00 0.67 O ATOM 0 H TYR A 20 121.105 -3.782 7.632 1.00 0.42 H new ATOM 0 HA TYR A 20 118.546 -3.700 6.181 1.00 0.45 H new ATOM 0 HB2 TYR A 20 118.821 -1.247 6.332 1.00 0.50 H new ATOM 0 HB3 TYR A 20 118.909 -1.986 7.919 1.00 0.50 H new ATOM 0 HD1 TYR A 20 121.082 -0.713 5.139 1.00 1.28 H new ATOM 0 HD2 TYR A 20 120.714 -1.540 9.339 1.00 1.06 H new ATOM 0 HE1 TYR A 20 123.238 0.438 5.555 1.00 1.35 H new ATOM 0 HE2 TYR A 20 122.877 -0.398 9.752 1.00 1.02 H new ATOM 0 HH TYR A 20 124.604 0.707 8.869 1.00 0.67 H new ATOM 420 N ALA A 21 121.028 -4.076 4.537 1.00 0.26 N ATOM 421 CA ALA A 21 121.548 -4.107 3.175 1.00 0.23 C ATOM 422 C ALA A 21 120.694 -5.054 2.336 1.00 0.24 C ATOM 423 O ALA A 21 120.608 -6.244 2.637 1.00 0.35 O ATOM 424 CB ALA A 21 123.004 -4.584 3.179 1.00 0.30 C ATOM 0 H ALA A 21 121.382 -4.815 5.144 1.00 0.26 H new ATOM 0 HA ALA A 21 121.510 -3.104 2.749 1.00 0.23 H new ATOM 0 HB1 ALA A 21 123.383 -4.604 2.157 1.00 0.30 H new ATOM 0 HB2 ALA A 21 123.609 -3.902 3.777 1.00 0.30 H new ATOM 0 HB3 ALA A 21 123.058 -5.586 3.605 1.00 0.30 H new ATOM 430 N LYS A 22 120.058 -4.532 1.287 1.00 0.22 N ATOM 431 CA LYS A 22 119.086 -5.321 0.531 1.00 0.32 C ATOM 432 C LYS A 22 119.622 -5.699 -0.845 1.00 0.22 C ATOM 433 O LYS A 22 119.367 -6.797 -1.338 1.00 0.27 O ATOM 434 CB LYS A 22 117.792 -4.520 0.364 1.00 0.46 C ATOM 435 CG LYS A 22 116.715 -5.415 -0.248 1.00 1.26 C ATOM 436 CD LYS A 22 115.446 -4.596 -0.494 1.00 1.70 C ATOM 437 CE LYS A 22 114.321 -5.524 -0.957 1.00 2.50 C ATOM 438 NZ LYS A 22 113.219 -4.712 -1.545 1.00 2.95 N ATOM 0 H LYS A 22 120.195 -3.581 0.945 1.00 0.22 H new ATOM 0 HA LYS A 22 118.893 -6.238 1.088 1.00 0.32 H new ATOM 0 HB2 LYS A 22 117.459 -4.141 1.330 1.00 0.46 H new ATOM 0 HB3 LYS A 22 117.967 -3.655 -0.275 1.00 0.46 H new ATOM 0 HG2 LYS A 22 117.072 -5.842 -1.185 1.00 1.26 H new ATOM 0 HG3 LYS A 22 116.498 -6.249 0.420 1.00 1.26 H new ATOM 0 HD2 LYS A 22 115.152 -4.078 0.419 1.00 1.70 H new ATOM 0 HD3 LYS A 22 115.634 -3.831 -1.248 1.00 1.70 H new ATOM 0 HE2 LYS A 22 114.699 -6.232 -1.695 1.00 2.50 H new ATOM 0 HE3 LYS A 22 113.948 -6.109 -0.116 1.00 2.50 H new ATOM 0 HZ1 LYS A 22 112.454 -5.342 -1.860 1.00 2.95 H new ATOM 0 HZ2 LYS A 22 112.853 -4.053 -0.828 1.00 2.95 H new ATOM 0 HZ3 LYS A 22 113.580 -4.173 -2.358 1.00 2.95 H new ATOM 452 N GLU A 23 120.351 -4.781 -1.470 1.00 0.16 N ATOM 453 CA GLU A 23 120.858 -5.005 -2.822 1.00 0.25 C ATOM 454 C GLU A 23 122.361 -4.742 -2.893 1.00 0.15 C ATOM 455 O GLU A 23 122.885 -3.887 -2.185 1.00 0.17 O ATOM 456 CB GLU A 23 120.113 -4.076 -3.788 1.00 0.48 C ATOM 457 CG GLU A 23 120.596 -4.293 -5.229 1.00 0.80 C ATOM 458 CD GLU A 23 119.891 -3.358 -6.217 1.00 0.88 C ATOM 459 OE1 GLU A 23 119.140 -2.493 -5.790 1.00 0.94 O ATOM 460 OE2 GLU A 23 120.118 -3.522 -7.404 1.00 1.78 O ATOM 0 H GLU A 23 120.604 -3.879 -1.066 1.00 0.16 H new ATOM 0 HA GLU A 23 120.689 -6.045 -3.100 1.00 0.25 H new ATOM 0 HB2 GLU A 23 119.041 -4.263 -3.726 1.00 0.48 H new ATOM 0 HB3 GLU A 23 120.273 -3.038 -3.498 1.00 0.48 H new ATOM 0 HG2 GLU A 23 121.672 -4.129 -5.279 1.00 0.80 H new ATOM 0 HG3 GLU A 23 120.418 -5.328 -5.519 1.00 0.80 H new ATOM 467 N ILE A 24 123.042 -5.482 -3.763 1.00 0.15 N ATOM 468 CA ILE A 24 124.459 -5.233 -4.023 1.00 0.12 C ATOM 469 C ILE A 24 124.623 -4.500 -5.351 1.00 0.13 C ATOM 470 O ILE A 24 124.042 -4.893 -6.364 1.00 0.16 O ATOM 471 CB ILE A 24 125.249 -6.547 -4.076 1.00 0.16 C ATOM 472 CG1 ILE A 24 125.001 -7.364 -2.805 1.00 0.23 C ATOM 473 CG2 ILE A 24 126.744 -6.231 -4.181 1.00 0.18 C ATOM 474 CD1 ILE A 24 125.627 -8.751 -2.957 1.00 0.25 C ATOM 0 H ILE A 24 122.641 -6.253 -4.297 1.00 0.15 H new ATOM 0 HA ILE A 24 124.847 -4.621 -3.209 1.00 0.12 H new ATOM 0 HB ILE A 24 124.923 -7.123 -4.942 1.00 0.16 H new ATOM 0 HG12 ILE A 24 125.429 -6.853 -1.943 1.00 0.23 H new ATOM 0 HG13 ILE A 24 123.930 -7.455 -2.622 1.00 0.23 H new ATOM 0 HG21 ILE A 24 127.311 -7.161 -4.219 1.00 0.18 H new ATOM 0 HG22 ILE A 24 126.931 -5.655 -5.087 1.00 0.18 H new ATOM 0 HG23 ILE A 24 127.055 -5.652 -3.312 1.00 0.18 H new ATOM 0 HD11 ILE A 24 125.450 -9.331 -2.052 1.00 0.25 H new ATOM 0 HD12 ILE A 24 125.178 -9.261 -3.809 1.00 0.25 H new ATOM 0 HD13 ILE A 24 126.700 -8.650 -3.119 1.00 0.25 H new ATOM 486 N VAL A 25 125.414 -3.432 -5.342 1.00 0.12 N ATOM 487 CA VAL A 25 125.653 -2.658 -6.556 1.00 0.13 C ATOM 488 C VAL A 25 126.897 -3.180 -7.273 1.00 0.12 C ATOM 489 O VAL A 25 126.884 -3.398 -8.484 1.00 0.13 O ATOM 490 CB VAL A 25 125.830 -1.174 -6.213 1.00 0.14 C ATOM 491 CG1 VAL A 25 125.992 -0.356 -7.498 1.00 0.16 C ATOM 492 CG2 VAL A 25 124.599 -0.668 -5.454 1.00 0.16 C ATOM 0 H VAL A 25 125.898 -3.084 -4.514 1.00 0.12 H new ATOM 0 HA VAL A 25 124.792 -2.766 -7.215 1.00 0.13 H new ATOM 0 HB VAL A 25 126.719 -1.061 -5.593 1.00 0.14 H new ATOM 0 HG11 VAL A 25 126.117 0.697 -7.246 1.00 0.16 H new ATOM 0 HG12 VAL A 25 126.869 -0.705 -8.043 1.00 0.16 H new ATOM 0 HG13 VAL A 25 125.105 -0.477 -8.121 1.00 0.16 H new ATOM 0 HG21 VAL A 25 124.729 0.387 -5.212 1.00 0.16 H new ATOM 0 HG22 VAL A 25 123.712 -0.791 -6.076 1.00 0.16 H new ATOM 0 HG23 VAL A 25 124.479 -1.239 -4.533 1.00 0.16 H new ATOM 502 N ASP A 26 127.969 -3.378 -6.512 1.00 0.10 N ATOM 503 CA ASP A 26 129.206 -3.913 -7.070 1.00 0.10 C ATOM 504 C ASP A 26 130.026 -4.584 -5.975 1.00 0.09 C ATOM 505 O ASP A 26 129.882 -4.257 -4.799 1.00 0.11 O ATOM 506 CB ASP A 26 130.031 -2.791 -7.707 1.00 0.10 C ATOM 507 CG ASP A 26 130.861 -3.337 -8.865 1.00 0.12 C ATOM 508 OD1 ASP A 26 131.301 -4.472 -8.771 1.00 0.12 O ATOM 509 OD2 ASP A 26 131.047 -2.611 -9.828 1.00 0.13 O ATOM 0 H ASP A 26 128.006 -3.177 -5.513 1.00 0.10 H new ATOM 0 HA ASP A 26 128.951 -4.648 -7.834 1.00 0.10 H new ATOM 0 HB2 ASP A 26 129.370 -2.002 -8.065 1.00 0.10 H new ATOM 0 HB3 ASP A 26 130.686 -2.343 -6.960 1.00 0.10 H new ATOM 514 N SER A 27 130.891 -5.511 -6.370 1.00 0.09 N ATOM 515 CA SER A 27 131.744 -6.197 -5.407 1.00 0.09 C ATOM 516 C SER A 27 133.130 -6.440 -5.996 1.00 0.09 C ATOM 517 O SER A 27 133.264 -6.917 -7.123 1.00 0.10 O ATOM 518 CB SER A 27 131.114 -7.531 -5.008 1.00 0.09 C ATOM 519 OG SER A 27 130.878 -8.306 -6.175 1.00 0.15 O ATOM 0 H SER A 27 131.020 -5.802 -7.339 1.00 0.09 H new ATOM 0 HA SER A 27 131.844 -5.566 -4.524 1.00 0.09 H new ATOM 0 HB2 SER A 27 131.774 -8.069 -4.327 1.00 0.09 H new ATOM 0 HB3 SER A 27 130.178 -7.360 -4.476 1.00 0.09 H new ATOM 0 HG SER A 27 130.475 -9.163 -5.923 1.00 0.15 H new ATOM 525 N SER A 28 134.157 -6.103 -5.223 1.00 0.10 N ATOM 526 CA SER A 28 135.536 -6.332 -5.637 1.00 0.10 C ATOM 527 C SER A 28 136.125 -7.496 -4.849 1.00 0.10 C ATOM 528 O SER A 28 136.078 -7.507 -3.616 1.00 0.10 O ATOM 529 CB SER A 28 136.374 -5.076 -5.403 1.00 0.11 C ATOM 530 OG SER A 28 137.693 -5.301 -5.883 1.00 0.19 O ATOM 0 H SER A 28 134.060 -5.670 -4.305 1.00 0.10 H new ATOM 0 HA SER A 28 135.548 -6.572 -6.700 1.00 0.10 H new ATOM 0 HB2 SER A 28 135.927 -4.225 -5.916 1.00 0.11 H new ATOM 0 HB3 SER A 28 136.397 -4.832 -4.341 1.00 0.11 H new ATOM 0 HG SER A 28 138.159 -5.920 -5.282 1.00 0.19 H new ATOM 536 N SER A 29 136.719 -8.440 -5.572 1.00 0.11 N ATOM 537 CA SER A 29 137.188 -9.686 -4.974 1.00 0.12 C ATOM 538 C SER A 29 138.118 -9.418 -3.797 1.00 0.10 C ATOM 539 O SER A 29 138.067 -10.122 -2.788 1.00 0.11 O ATOM 540 CB SER A 29 137.922 -10.520 -6.025 1.00 0.13 C ATOM 541 OG SER A 29 137.064 -10.734 -7.137 1.00 1.31 O ATOM 0 H SER A 29 136.887 -8.366 -6.575 1.00 0.11 H new ATOM 0 HA SER A 29 136.319 -10.233 -4.607 1.00 0.12 H new ATOM 0 HB2 SER A 29 138.829 -10.007 -6.344 1.00 0.13 H new ATOM 0 HB3 SER A 29 138.229 -11.475 -5.599 1.00 0.13 H new ATOM 0 HG SER A 29 137.532 -11.267 -7.813 1.00 1.31 H new ATOM 547 N HIS A 30 138.963 -8.401 -3.931 1.00 0.09 N ATOM 548 CA HIS A 30 139.911 -8.080 -2.868 1.00 0.09 C ATOM 549 C HIS A 30 140.286 -6.603 -2.878 1.00 0.09 C ATOM 550 O HIS A 30 140.710 -6.059 -3.900 1.00 0.09 O ATOM 551 CB HIS A 30 141.172 -8.933 -3.016 1.00 0.10 C ATOM 552 CG HIS A 30 142.188 -8.694 -1.931 1.00 0.16 C ATOM 553 ND1 HIS A 30 143.245 -7.811 -2.089 1.00 0.25 N ATOM 554 CD2 HIS A 30 142.322 -9.216 -0.668 1.00 0.23 C ATOM 555 CE1 HIS A 30 143.962 -7.827 -0.952 1.00 0.30 C ATOM 556 NE2 HIS A 30 143.444 -8.667 -0.051 1.00 0.29 N ATOM 0 H HIS A 30 139.012 -7.794 -4.749 1.00 0.09 H new ATOM 0 HA HIS A 30 139.429 -8.300 -1.916 1.00 0.09 H new ATOM 0 HB2 HIS A 30 140.891 -9.986 -3.015 1.00 0.10 H new ATOM 0 HB3 HIS A 30 141.630 -8.726 -3.984 1.00 0.10 H new ATOM 0 HD2 HIS A 30 141.659 -9.942 -0.221 1.00 0.23 H new ATOM 0 HE1 HIS A 30 144.849 -7.233 -0.787 1.00 0.30 H new ATOM 0 HE2 HIS A 30 143.795 -8.864 0.886 1.00 0.29 H new ATOM 564 N VAL A 31 140.144 -5.979 -1.712 1.00 0.08 N ATOM 565 CA VAL A 31 140.411 -4.557 -1.551 1.00 0.08 C ATOM 566 C VAL A 31 141.002 -4.301 -0.162 1.00 0.09 C ATOM 567 O VAL A 31 140.628 -4.958 0.811 1.00 0.09 O ATOM 568 CB VAL A 31 139.090 -3.803 -1.734 1.00 0.08 C ATOM 569 CG1 VAL A 31 139.262 -2.301 -1.496 1.00 0.09 C ATOM 570 CG2 VAL A 31 138.581 -4.025 -3.160 1.00 0.08 C ATOM 0 H VAL A 31 139.842 -6.445 -0.856 1.00 0.08 H new ATOM 0 HA VAL A 31 141.132 -4.210 -2.291 1.00 0.08 H new ATOM 0 HB VAL A 31 138.377 -4.185 -1.004 1.00 0.08 H new ATOM 0 HG11 VAL A 31 138.305 -1.799 -1.635 1.00 0.09 H new ATOM 0 HG12 VAL A 31 139.617 -2.132 -0.479 1.00 0.09 H new ATOM 0 HG13 VAL A 31 139.987 -1.901 -2.204 1.00 0.09 H new ATOM 0 HG21 VAL A 31 137.641 -3.491 -3.298 1.00 0.08 H new ATOM 0 HG22 VAL A 31 139.318 -3.652 -3.871 1.00 0.08 H new ATOM 0 HG23 VAL A 31 138.422 -5.090 -3.328 1.00 0.08 H new ATOM 580 N ALA A 32 141.932 -3.356 -0.077 1.00 0.10 N ATOM 581 CA ALA A 32 142.590 -3.047 1.192 1.00 0.12 C ATOM 582 C ALA A 32 142.590 -1.545 1.459 1.00 0.13 C ATOM 583 O ALA A 32 142.630 -0.743 0.526 1.00 0.13 O ATOM 584 CB ALA A 32 144.029 -3.557 1.157 1.00 0.13 C ATOM 0 H ALA A 32 142.248 -2.792 -0.866 1.00 0.10 H new ATOM 0 HA ALA A 32 142.039 -3.539 1.993 1.00 0.12 H new ATOM 0 HB1 ALA A 32 144.520 -3.327 2.103 1.00 0.13 H new ATOM 0 HB2 ALA A 32 144.029 -4.636 1.001 1.00 0.13 H new ATOM 0 HB3 ALA A 32 144.567 -3.073 0.342 1.00 0.13 H new ATOM 590 N PHE A 33 142.562 -1.175 2.736 1.00 0.14 N ATOM 591 CA PHE A 33 142.497 0.233 3.118 1.00 0.16 C ATOM 592 C PHE A 33 143.875 0.775 3.497 1.00 0.17 C ATOM 593 O PHE A 33 144.604 0.173 4.287 1.00 0.20 O ATOM 594 CB PHE A 33 141.534 0.392 4.296 1.00 0.18 C ATOM 595 CG PHE A 33 141.003 1.796 4.465 1.00 0.35 C ATOM 596 CD1 PHE A 33 139.830 2.182 3.804 1.00 1.18 C ATOM 597 CD2 PHE A 33 141.676 2.708 5.284 1.00 1.33 C ATOM 598 CE1 PHE A 33 139.332 3.480 3.963 1.00 1.22 C ATOM 599 CE2 PHE A 33 141.179 4.007 5.443 1.00 1.47 C ATOM 600 CZ PHE A 33 140.006 4.393 4.782 1.00 0.79 C ATOM 0 H PHE A 33 142.583 -1.826 3.521 1.00 0.14 H new ATOM 0 HA PHE A 33 142.139 0.805 2.262 1.00 0.16 H new ATOM 0 HB2 PHE A 33 140.694 -0.290 4.161 1.00 0.18 H new ATOM 0 HB3 PHE A 33 142.043 0.094 5.212 1.00 0.18 H new ATOM 0 HD1 PHE A 33 139.310 1.478 3.172 1.00 1.18 H new ATOM 0 HD2 PHE A 33 142.580 2.410 5.794 1.00 1.33 H new ATOM 0 HE1 PHE A 33 138.427 3.777 3.454 1.00 1.22 H new ATOM 0 HE2 PHE A 33 141.700 4.711 6.075 1.00 1.47 H new ATOM 0 HZ PHE A 33 139.622 5.395 4.904 1.00 0.79 H new ATOM 610 N TYR A 34 144.222 1.932 2.933 1.00 0.16 N ATOM 611 CA TYR A 34 145.512 2.563 3.205 1.00 0.17 C ATOM 612 C TYR A 34 145.325 4.012 3.645 1.00 0.17 C ATOM 613 O TYR A 34 144.451 4.715 3.140 1.00 0.17 O ATOM 614 CB TYR A 34 146.381 2.529 1.947 1.00 0.17 C ATOM 615 CG TYR A 34 147.073 1.205 1.727 1.00 0.21 C ATOM 616 CD1 TYR A 34 146.440 0.197 0.990 1.00 0.23 C ATOM 617 CD2 TYR A 34 148.344 0.984 2.269 1.00 0.24 C ATOM 618 CE1 TYR A 34 147.080 -1.032 0.794 1.00 0.27 C ATOM 619 CE2 TYR A 34 148.983 -0.246 2.075 1.00 0.29 C ATOM 620 CZ TYR A 34 148.351 -1.253 1.337 1.00 0.30 C ATOM 621 OH TYR A 34 148.980 -2.465 1.145 1.00 0.35 O ATOM 0 H TYR A 34 143.628 2.450 2.286 1.00 0.16 H new ATOM 0 HA TYR A 34 145.999 2.010 4.008 1.00 0.17 H new ATOM 0 HB2 TYR A 34 145.760 2.753 1.080 1.00 0.17 H new ATOM 0 HB3 TYR A 34 147.132 3.316 2.013 1.00 0.17 H new ATOM 0 HD1 TYR A 34 145.458 0.368 0.573 1.00 0.23 H new ATOM 0 HD2 TYR A 34 148.832 1.762 2.837 1.00 0.24 H new ATOM 0 HE1 TYR A 34 146.593 -1.810 0.224 1.00 0.27 H new ATOM 0 HE2 TYR A 34 149.963 -0.418 2.495 1.00 0.29 H new ATOM 0 HH TYR A 34 148.403 -3.052 0.613 1.00 0.35 H new ATOM 631 N THR A 35 146.170 4.455 4.570 1.00 0.18 N ATOM 632 CA THR A 35 146.140 5.834 5.051 1.00 0.19 C ATOM 633 C THR A 35 147.503 6.482 4.808 1.00 0.19 C ATOM 634 O THR A 35 148.525 5.804 4.845 1.00 0.21 O ATOM 635 CB THR A 35 145.802 5.832 6.549 1.00 0.22 C ATOM 636 OG1 THR A 35 144.507 5.277 6.734 1.00 0.24 O ATOM 637 CG2 THR A 35 145.829 7.255 7.118 1.00 0.25 C ATOM 0 H THR A 35 146.889 3.876 5.005 1.00 0.18 H new ATOM 0 HA THR A 35 145.381 6.406 4.517 1.00 0.19 H new ATOM 0 HB THR A 35 146.548 5.235 7.074 1.00 0.22 H new ATOM 0 HG1 THR A 35 144.287 5.272 7.689 1.00 0.24 H new ATOM 0 HG21 THR A 35 145.586 7.227 8.180 1.00 0.25 H new ATOM 0 HG22 THR A 35 146.823 7.682 6.984 1.00 0.25 H new ATOM 0 HG23 THR A 35 145.097 7.870 6.595 1.00 0.25 H new ATOM 645 N PHE A 36 147.521 7.792 4.563 1.00 0.19 N ATOM 646 CA PHE A 36 148.784 8.510 4.396 1.00 0.21 C ATOM 647 C PHE A 36 149.039 9.424 5.590 1.00 0.23 C ATOM 648 O PHE A 36 148.159 10.174 6.014 1.00 0.25 O ATOM 649 CB PHE A 36 148.758 9.335 3.105 1.00 0.22 C ATOM 650 CG PHE A 36 150.014 10.147 2.880 1.00 0.25 C ATOM 651 CD1 PHE A 36 151.136 9.556 2.288 1.00 1.05 C ATOM 652 CD2 PHE A 36 150.055 11.489 3.276 1.00 1.11 C ATOM 653 CE1 PHE A 36 152.302 10.307 2.095 1.00 1.07 C ATOM 654 CE2 PHE A 36 151.220 12.241 3.080 1.00 1.11 C ATOM 655 CZ PHE A 36 152.342 11.650 2.490 1.00 0.33 C ATOM 0 H PHE A 36 146.686 8.372 4.477 1.00 0.19 H new ATOM 0 HA PHE A 36 149.590 7.779 4.334 1.00 0.21 H new ATOM 0 HB2 PHE A 36 148.612 8.664 2.258 1.00 0.22 H new ATOM 0 HB3 PHE A 36 147.900 10.007 3.131 1.00 0.22 H new ATOM 0 HD1 PHE A 36 151.103 8.521 1.980 1.00 1.05 H new ATOM 0 HD2 PHE A 36 149.189 11.944 3.732 1.00 1.11 H new ATOM 0 HE1 PHE A 36 153.170 9.851 1.642 1.00 1.07 H new ATOM 0 HE2 PHE A 36 151.252 13.277 3.384 1.00 1.11 H new ATOM 0 HZ PHE A 36 153.240 12.230 2.339 1.00 0.33 H new ATOM 665 N ASN A 37 150.253 9.352 6.127 1.00 0.26 N ATOM 666 CA ASN A 37 150.652 10.225 7.225 1.00 0.30 C ATOM 667 C ASN A 37 151.564 11.330 6.699 1.00 0.33 C ATOM 668 O ASN A 37 152.675 11.065 6.237 1.00 0.33 O ATOM 669 CB ASN A 37 151.382 9.420 8.301 1.00 0.33 C ATOM 670 CG ASN A 37 151.429 10.219 9.599 1.00 0.39 C ATOM 671 OD1 ASN A 37 151.484 11.448 9.565 1.00 0.41 O ATOM 672 ND2 ASN A 37 151.411 9.593 10.743 1.00 0.44 N ATOM 0 H ASN A 37 150.975 8.700 5.821 1.00 0.26 H new ATOM 0 HA ASN A 37 149.760 10.672 7.664 1.00 0.30 H new ATOM 0 HB2 ASN A 37 150.873 8.470 8.466 1.00 0.33 H new ATOM 0 HB3 ASN A 37 152.394 9.186 7.970 1.00 0.33 H new ATOM 0 HD21 ASN A 37 151.443 10.122 11.614 1.00 0.44 H new ATOM 0 HD22 ASN A 37 151.365 8.574 10.766 1.00 0.44 H new ATOM 679 N SER A 38 151.077 12.567 6.766 1.00 0.35 N ATOM 680 CA SER A 38 151.813 13.709 6.229 1.00 0.39 C ATOM 681 C SER A 38 153.071 14.019 7.041 1.00 0.43 C ATOM 682 O SER A 38 154.057 14.514 6.494 1.00 0.45 O ATOM 683 CB SER A 38 150.908 14.940 6.211 1.00 0.43 C ATOM 684 OG SER A 38 150.631 15.336 7.548 1.00 1.36 O ATOM 0 H SER A 38 150.178 12.804 7.186 1.00 0.35 H new ATOM 0 HA SER A 38 152.125 13.450 5.217 1.00 0.39 H new ATOM 0 HB2 SER A 38 151.392 15.754 5.671 1.00 0.43 H new ATOM 0 HB3 SER A 38 149.980 14.716 5.686 1.00 0.43 H new ATOM 0 HG SER A 38 150.052 16.127 7.542 1.00 1.36 H new ATOM 690 N SER A 39 153.041 13.731 8.340 1.00 0.45 N ATOM 691 CA SER A 39 154.175 14.039 9.206 1.00 0.49 C ATOM 692 C SER A 39 155.418 13.267 8.772 1.00 0.50 C ATOM 693 O SER A 39 156.529 13.798 8.799 1.00 0.54 O ATOM 694 CB SER A 39 153.835 13.686 10.654 1.00 0.53 C ATOM 695 OG SER A 39 153.709 12.275 10.773 1.00 1.47 O ATOM 0 H SER A 39 152.252 13.289 8.812 1.00 0.45 H new ATOM 0 HA SER A 39 154.383 15.106 9.128 1.00 0.49 H new ATOM 0 HB2 SER A 39 154.614 14.051 11.323 1.00 0.53 H new ATOM 0 HB3 SER A 39 152.906 14.173 10.951 1.00 0.53 H new ATOM 0 HG SER A 39 153.083 11.944 10.096 1.00 1.47 H new ATOM 701 N GLN A 40 155.226 12.014 8.372 1.00 0.47 N ATOM 702 CA GLN A 40 156.344 11.173 7.950 1.00 0.49 C ATOM 703 C GLN A 40 156.561 11.199 6.433 1.00 0.45 C ATOM 704 O GLN A 40 157.652 10.875 5.964 1.00 0.47 O ATOM 705 CB GLN A 40 156.099 9.731 8.400 1.00 0.52 C ATOM 706 CG GLN A 40 156.056 9.672 9.928 1.00 0.79 C ATOM 707 CD GLN A 40 155.724 8.258 10.397 1.00 1.26 C ATOM 708 OE1 GLN A 40 155.163 7.462 9.642 1.00 1.70 O ATOM 709 NE2 GLN A 40 156.039 7.895 11.611 1.00 2.00 N ATOM 0 H GLN A 40 154.314 11.560 8.331 1.00 0.47 H new ATOM 0 HA GLN A 40 157.243 11.574 8.417 1.00 0.49 H new ATOM 0 HB2 GLN A 40 155.160 9.364 7.985 1.00 0.52 H new ATOM 0 HB3 GLN A 40 156.889 9.082 8.023 1.00 0.52 H new ATOM 0 HG2 GLN A 40 157.018 9.981 10.337 1.00 0.79 H new ATOM 0 HG3 GLN A 40 155.310 10.371 10.304 1.00 0.79 H new ATOM 0 HE21 GLN A 40 156.503 8.554 12.236 1.00 2.00 H new ATOM 0 HE22 GLN A 40 155.821 6.953 11.934 1.00 2.00 H new ATOM 718 N ASN A 41 155.531 11.567 5.666 1.00 0.40 N ATOM 719 CA ASN A 41 155.614 11.581 4.206 1.00 0.40 C ATOM 720 C ASN A 41 155.683 10.149 3.682 1.00 0.39 C ATOM 721 O ASN A 41 156.476 9.827 2.796 1.00 0.43 O ATOM 722 CB ASN A 41 156.827 12.389 3.727 1.00 0.46 C ATOM 723 CG ASN A 41 156.664 12.751 2.254 1.00 0.48 C ATOM 724 OD1 ASN A 41 157.329 12.172 1.395 1.00 0.99 O ATOM 725 ND2 ASN A 41 155.814 13.679 1.911 1.00 1.30 N ATOM 0 H ASN A 41 154.627 11.860 6.036 1.00 0.40 H new ATOM 0 HA ASN A 41 154.720 12.064 3.812 1.00 0.40 H new ATOM 0 HB2 ASN A 41 156.929 13.295 4.324 1.00 0.46 H new ATOM 0 HB3 ASN A 41 157.739 11.810 3.869 1.00 0.46 H new ATOM 0 HD21 ASN A 41 155.699 13.927 0.928 1.00 1.30 H new ATOM 0 HD22 ASN A 41 155.265 14.157 2.625 1.00 1.30 H new ATOM 732 N GLU A 42 154.832 9.291 4.239 1.00 0.35 N ATOM 733 CA GLU A 42 154.834 7.880 3.867 1.00 0.35 C ATOM 734 C GLU A 42 153.440 7.275 4.001 1.00 0.32 C ATOM 735 O GLU A 42 152.578 7.816 4.693 1.00 0.34 O ATOM 736 CB GLU A 42 155.808 7.103 4.755 1.00 0.40 C ATOM 737 CG GLU A 42 157.236 7.610 4.530 1.00 1.16 C ATOM 738 CD GLU A 42 158.251 6.749 5.284 1.00 1.26 C ATOM 739 OE1 GLU A 42 157.876 6.119 6.262 1.00 1.15 O ATOM 740 OE2 GLU A 42 159.397 6.731 4.869 1.00 1.93 O ATOM 0 H GLU A 42 154.139 9.545 4.943 1.00 0.35 H new ATOM 0 HA GLU A 42 155.148 7.809 2.826 1.00 0.35 H new ATOM 0 HB2 GLU A 42 155.532 7.221 5.803 1.00 0.40 H new ATOM 0 HB3 GLU A 42 155.751 6.038 4.528 1.00 0.40 H new ATOM 0 HG2 GLU A 42 157.465 7.599 3.464 1.00 1.16 H new ATOM 0 HG3 GLU A 42 157.314 8.645 4.862 1.00 1.16 H new ATOM 747 N TRP A 43 153.227 6.144 3.335 1.00 0.28 N ATOM 748 CA TRP A 43 151.950 5.444 3.422 1.00 0.26 C ATOM 749 C TRP A 43 152.010 4.361 4.494 1.00 0.27 C ATOM 750 O TRP A 43 153.023 3.678 4.641 1.00 0.30 O ATOM 751 CB TRP A 43 151.609 4.794 2.080 1.00 0.24 C ATOM 752 CG TRP A 43 151.073 5.747 1.060 1.00 0.23 C ATOM 753 CD1 TRP A 43 151.801 6.311 0.069 1.00 0.26 C ATOM 754 CD2 TRP A 43 149.711 6.244 0.899 1.00 0.20 C ATOM 755 NE1 TRP A 43 150.984 7.137 -0.678 1.00 0.25 N ATOM 756 CE2 TRP A 43 149.683 7.129 -0.208 1.00 0.21 C ATOM 757 CE3 TRP A 43 148.513 6.020 1.601 1.00 0.19 C ATOM 758 CZ2 TRP A 43 148.503 7.768 -0.601 1.00 0.20 C ATOM 759 CZ3 TRP A 43 147.329 6.658 1.207 1.00 0.19 C ATOM 760 CH2 TRP A 43 147.324 7.530 0.110 1.00 0.19 C ATOM 0 H TRP A 43 153.917 5.695 2.733 1.00 0.28 H new ATOM 0 HA TRP A 43 151.182 6.172 3.682 1.00 0.26 H new ATOM 0 HB2 TRP A 43 152.504 4.317 1.681 1.00 0.24 H new ATOM 0 HB3 TRP A 43 150.875 4.005 2.246 1.00 0.24 H new ATOM 0 HD1 TRP A 43 152.853 6.142 -0.109 1.00 0.26 H new ATOM 0 HE1 TRP A 43 151.301 7.685 -1.478 1.00 0.25 H new ATOM 0 HE3 TRP A 43 148.505 5.352 2.449 1.00 0.19 H new ATOM 0 HZ2 TRP A 43 148.503 8.440 -1.447 1.00 0.20 H new ATOM 0 HZ3 TRP A 43 146.415 6.476 1.752 1.00 0.19 H new ATOM 0 HH2 TRP A 43 146.408 8.019 -0.186 1.00 0.19 H new ATOM 771 N GLU A 44 150.921 4.211 5.240 1.00 0.26 N ATOM 772 CA GLU A 44 150.831 3.167 6.257 1.00 0.28 C ATOM 773 C GLU A 44 149.625 2.274 5.984 1.00 0.26 C ATOM 774 O GLU A 44 148.516 2.764 5.781 1.00 0.24 O ATOM 775 CB GLU A 44 150.693 3.802 7.643 1.00 0.30 C ATOM 776 CG GLU A 44 151.932 4.650 7.943 1.00 1.20 C ATOM 777 CD GLU A 44 153.194 3.787 7.965 1.00 1.54 C ATOM 778 OE1 GLU A 44 153.087 2.600 8.233 1.00 1.71 O ATOM 779 OE2 GLU A 44 154.256 4.330 7.710 1.00 2.30 O ATOM 0 H GLU A 44 150.090 4.797 5.161 1.00 0.26 H new ATOM 0 HA GLU A 44 151.738 2.564 6.224 1.00 0.28 H new ATOM 0 HB2 GLU A 44 149.797 4.422 7.683 1.00 0.30 H new ATOM 0 HB3 GLU A 44 150.578 3.026 8.400 1.00 0.30 H new ATOM 0 HG2 GLU A 44 152.034 5.431 7.189 1.00 1.20 H new ATOM 0 HG3 GLU A 44 151.812 5.149 8.905 1.00 1.20 H new ATOM 786 N LYS A 45 149.852 0.965 5.963 1.00 0.27 N ATOM 787 CA LYS A 45 148.764 0.021 5.742 1.00 0.27 C ATOM 788 C LYS A 45 147.939 -0.129 7.015 1.00 0.29 C ATOM 789 O LYS A 45 148.488 -0.165 8.116 1.00 0.32 O ATOM 790 CB LYS A 45 149.324 -1.343 5.331 1.00 0.31 C ATOM 791 CG LYS A 45 148.170 -2.279 4.962 1.00 1.30 C ATOM 792 CD LYS A 45 148.720 -3.670 4.643 1.00 1.34 C ATOM 793 CE LYS A 45 147.583 -4.568 4.152 1.00 2.00 C ATOM 794 NZ LYS A 45 148.149 -5.701 3.366 1.00 2.60 N ATOM 0 H LYS A 45 150.769 0.538 6.095 1.00 0.27 H new ATOM 0 HA LYS A 45 148.128 0.401 4.943 1.00 0.27 H new ATOM 0 HB2 LYS A 45 150.000 -1.230 4.483 1.00 0.31 H new ATOM 0 HB3 LYS A 45 149.906 -1.770 6.148 1.00 0.31 H new ATOM 0 HG2 LYS A 45 147.459 -2.338 5.786 1.00 1.30 H new ATOM 0 HG3 LYS A 45 147.629 -1.885 4.102 1.00 1.30 H new ATOM 0 HD2 LYS A 45 149.497 -3.600 3.882 1.00 1.34 H new ATOM 0 HD3 LYS A 45 149.182 -4.102 5.531 1.00 1.34 H new ATOM 0 HE2 LYS A 45 147.014 -4.948 5.000 1.00 2.00 H new ATOM 0 HE3 LYS A 45 146.892 -3.993 3.536 1.00 2.00 H new ATOM 0 HZ1 LYS A 45 147.376 -6.312 3.032 1.00 2.60 H new ATOM 0 HZ2 LYS A 45 148.674 -5.329 2.549 1.00 2.60 H new ATOM 0 HZ3 LYS A 45 148.792 -6.254 3.968 1.00 2.60 H new ATOM 808 N THR A 46 146.620 -0.217 6.861 1.00 0.27 N ATOM 809 CA THR A 46 145.742 -0.353 8.018 1.00 0.29 C ATOM 810 C THR A 46 145.485 -1.826 8.311 1.00 0.32 C ATOM 811 O THR A 46 145.931 -2.703 7.571 1.00 0.32 O ATOM 812 CB THR A 46 144.408 0.353 7.759 1.00 0.28 C ATOM 813 OG1 THR A 46 143.739 -0.298 6.690 1.00 0.26 O ATOM 814 CG2 THR A 46 144.648 1.821 7.395 1.00 0.27 C ATOM 0 H THR A 46 146.142 -0.197 5.960 1.00 0.27 H new ATOM 0 HA THR A 46 146.231 0.107 8.877 1.00 0.29 H new ATOM 0 HB THR A 46 143.797 0.310 8.661 1.00 0.28 H new ATOM 0 HG1 THR A 46 144.020 0.098 5.839 1.00 0.26 H new ATOM 0 HG21 THR A 46 143.692 2.312 7.213 1.00 0.27 H new ATOM 0 HG22 THR A 46 145.162 2.320 8.216 1.00 0.27 H new ATOM 0 HG23 THR A 46 145.261 1.877 6.496 1.00 0.27 H new ATOM 822 N ASP A 47 144.764 -2.092 9.394 1.00 0.38 N ATOM 823 CA ASP A 47 144.453 -3.470 9.769 1.00 0.41 C ATOM 824 C ASP A 47 143.193 -4.002 9.072 1.00 0.36 C ATOM 825 O ASP A 47 142.670 -5.046 9.461 1.00 0.45 O ATOM 826 CB ASP A 47 144.262 -3.558 11.285 1.00 0.49 C ATOM 827 CG ASP A 47 145.577 -3.261 12.000 1.00 1.33 C ATOM 828 OD1 ASP A 47 146.324 -2.433 11.506 1.00 2.17 O ATOM 829 OD2 ASP A 47 145.816 -3.867 13.031 1.00 1.56 O ATOM 0 H ASP A 47 144.387 -1.383 10.022 1.00 0.38 H new ATOM 0 HA ASP A 47 145.292 -4.087 9.448 1.00 0.41 H new ATOM 0 HB2 ASP A 47 143.498 -2.849 11.604 1.00 0.49 H new ATOM 0 HB3 ASP A 47 143.908 -4.552 11.557 1.00 0.49 H new ATOM 834 N VAL A 48 142.699 -3.298 8.050 1.00 0.28 N ATOM 835 CA VAL A 48 141.507 -3.737 7.331 1.00 0.23 C ATOM 836 C VAL A 48 141.885 -4.273 5.952 1.00 0.18 C ATOM 837 O VAL A 48 142.215 -3.508 5.044 1.00 0.17 O ATOM 838 CB VAL A 48 140.521 -2.570 7.180 1.00 0.26 C ATOM 839 CG1 VAL A 48 139.230 -3.055 6.514 1.00 0.25 C ATOM 840 CG2 VAL A 48 140.179 -1.994 8.558 1.00 0.33 C ATOM 0 H VAL A 48 143.105 -2.428 7.706 1.00 0.28 H new ATOM 0 HA VAL A 48 141.033 -4.535 7.903 1.00 0.23 H new ATOM 0 HB VAL A 48 140.986 -1.801 6.563 1.00 0.26 H new ATOM 0 HG11 VAL A 48 138.537 -2.220 6.412 1.00 0.25 H new ATOM 0 HG12 VAL A 48 139.459 -3.460 5.528 1.00 0.25 H new ATOM 0 HG13 VAL A 48 138.774 -3.832 7.128 1.00 0.25 H new ATOM 0 HG21 VAL A 48 139.479 -1.166 8.443 1.00 0.33 H new ATOM 0 HG22 VAL A 48 139.725 -2.770 9.174 1.00 0.33 H new ATOM 0 HG23 VAL A 48 141.089 -1.635 9.038 1.00 0.33 H new ATOM 850 N GLU A 49 141.823 -5.594 5.808 1.00 0.16 N ATOM 851 CA GLU A 49 142.037 -6.239 4.518 1.00 0.14 C ATOM 852 C GLU A 49 140.896 -7.216 4.269 1.00 0.11 C ATOM 853 O GLU A 49 140.761 -8.220 4.972 1.00 0.11 O ATOM 854 CB GLU A 49 143.375 -6.981 4.507 1.00 0.17 C ATOM 855 CG GLU A 49 143.685 -7.455 3.082 1.00 0.18 C ATOM 856 CD GLU A 49 144.990 -8.257 3.014 1.00 0.24 C ATOM 857 OE1 GLU A 49 145.654 -8.408 4.031 1.00 0.29 O ATOM 858 OE2 GLU A 49 145.311 -8.714 1.930 1.00 0.23 O ATOM 0 H GLU A 49 141.625 -6.240 6.572 1.00 0.16 H new ATOM 0 HA GLU A 49 142.061 -5.485 3.731 1.00 0.14 H new ATOM 0 HB2 GLU A 49 144.169 -6.326 4.865 1.00 0.17 H new ATOM 0 HB3 GLU A 49 143.336 -7.834 5.185 1.00 0.17 H new ATOM 0 HG2 GLU A 49 142.862 -8.070 2.718 1.00 0.18 H new ATOM 0 HG3 GLU A 49 143.755 -6.592 2.420 1.00 0.18 H new ATOM 865 N GLY A 50 140.069 -6.921 3.273 1.00 0.10 N ATOM 866 CA GLY A 50 138.818 -7.654 3.117 1.00 0.09 C ATOM 867 C GLY A 50 138.219 -7.487 1.730 1.00 0.08 C ATOM 868 O GLY A 50 138.759 -6.782 0.880 1.00 0.09 O ATOM 0 H GLY A 50 140.236 -6.196 2.575 1.00 0.10 H new ATOM 0 HA2 GLY A 50 138.994 -8.712 3.309 1.00 0.09 H new ATOM 0 HA3 GLY A 50 138.102 -7.309 3.863 1.00 0.09 H new ATOM 872 N ALA A 51 137.117 -8.189 1.502 1.00 0.08 N ATOM 873 CA ALA A 51 136.373 -8.042 0.258 1.00 0.08 C ATOM 874 C ALA A 51 135.520 -6.782 0.339 1.00 0.08 C ATOM 875 O ALA A 51 134.889 -6.526 1.363 1.00 0.08 O ATOM 876 CB ALA A 51 135.479 -9.262 0.028 1.00 0.09 C ATOM 0 H ALA A 51 136.720 -8.862 2.158 1.00 0.08 H new ATOM 0 HA ALA A 51 137.071 -7.963 -0.576 1.00 0.08 H new ATOM 0 HB1 ALA A 51 134.929 -9.139 -0.905 1.00 0.09 H new ATOM 0 HB2 ALA A 51 136.095 -10.159 -0.030 1.00 0.09 H new ATOM 0 HB3 ALA A 51 134.775 -9.358 0.855 1.00 0.09 H new ATOM 882 N PHE A 52 135.500 -5.994 -0.731 1.00 0.08 N ATOM 883 CA PHE A 52 134.796 -4.710 -0.708 1.00 0.08 C ATOM 884 C PHE A 52 133.453 -4.827 -1.424 1.00 0.08 C ATOM 885 O PHE A 52 133.390 -5.271 -2.566 1.00 0.09 O ATOM 886 CB PHE A 52 135.684 -3.626 -1.348 1.00 0.09 C ATOM 887 CG PHE A 52 134.999 -2.313 -1.672 1.00 0.09 C ATOM 888 CD1 PHE A 52 134.160 -2.203 -2.791 1.00 0.09 C ATOM 889 CD2 PHE A 52 135.213 -1.201 -0.850 1.00 0.09 C ATOM 890 CE1 PHE A 52 133.540 -0.984 -3.082 1.00 0.09 C ATOM 891 CE2 PHE A 52 134.592 0.017 -1.145 1.00 0.10 C ATOM 892 CZ PHE A 52 133.755 0.126 -2.260 1.00 0.10 C ATOM 0 H PHE A 52 135.956 -6.215 -1.616 1.00 0.08 H new ATOM 0 HA PHE A 52 134.593 -4.424 0.324 1.00 0.08 H new ATOM 0 HB2 PHE A 52 136.517 -3.422 -0.675 1.00 0.09 H new ATOM 0 HB3 PHE A 52 136.109 -4.028 -2.268 1.00 0.09 H new ATOM 0 HD1 PHE A 52 133.993 -3.059 -3.427 1.00 0.09 H new ATOM 0 HD2 PHE A 52 135.858 -1.283 0.012 1.00 0.09 H new ATOM 0 HE1 PHE A 52 132.894 -0.900 -3.943 1.00 0.09 H new ATOM 0 HE2 PHE A 52 134.759 0.875 -0.511 1.00 0.10 H new ATOM 0 HZ PHE A 52 133.275 1.067 -2.486 1.00 0.10 H new ATOM 902 N PHE A 53 132.382 -4.420 -0.747 1.00 0.08 N ATOM 903 CA PHE A 53 131.053 -4.432 -1.351 1.00 0.08 C ATOM 904 C PHE A 53 130.358 -3.090 -1.148 1.00 0.09 C ATOM 905 O PHE A 53 130.487 -2.467 -0.095 1.00 0.11 O ATOM 906 CB PHE A 53 130.192 -5.524 -0.715 1.00 0.08 C ATOM 907 CG PHE A 53 130.586 -6.932 -1.095 1.00 0.07 C ATOM 908 CD1 PHE A 53 131.876 -7.404 -0.820 1.00 0.07 C ATOM 909 CD2 PHE A 53 129.653 -7.769 -1.716 1.00 0.07 C ATOM 910 CE1 PHE A 53 132.230 -8.713 -1.169 1.00 0.07 C ATOM 911 CE2 PHE A 53 130.006 -9.077 -2.063 1.00 0.08 C ATOM 912 CZ PHE A 53 131.295 -9.549 -1.790 1.00 0.07 C ATOM 0 H PHE A 53 132.408 -4.080 0.214 1.00 0.08 H new ATOM 0 HA PHE A 53 131.173 -4.625 -2.417 1.00 0.08 H new ATOM 0 HB2 PHE A 53 130.245 -5.425 0.369 1.00 0.08 H new ATOM 0 HB3 PHE A 53 129.152 -5.362 -1.000 1.00 0.08 H new ATOM 0 HD1 PHE A 53 132.597 -6.759 -0.339 1.00 0.07 H new ATOM 0 HD2 PHE A 53 128.659 -7.405 -1.928 1.00 0.07 H new ATOM 0 HE1 PHE A 53 133.225 -9.078 -0.959 1.00 0.07 H new ATOM 0 HE2 PHE A 53 129.284 -9.723 -2.541 1.00 0.08 H new ATOM 0 HZ PHE A 53 131.568 -10.559 -2.059 1.00 0.07 H new ATOM 922 N ILE A 54 129.620 -2.652 -2.161 1.00 0.08 N ATOM 923 CA ILE A 54 128.772 -1.472 -2.022 1.00 0.09 C ATOM 924 C ILE A 54 127.326 -1.913 -1.823 1.00 0.10 C ATOM 925 O ILE A 54 126.787 -2.668 -2.630 1.00 0.11 O ATOM 926 CB ILE A 54 128.870 -0.590 -3.274 1.00 0.10 C ATOM 927 CG1 ILE A 54 130.332 -0.204 -3.525 1.00 0.13 C ATOM 928 CG2 ILE A 54 128.044 0.684 -3.077 1.00 0.11 C ATOM 929 CD1 ILE A 54 130.477 0.422 -4.916 1.00 0.16 C ATOM 0 H ILE A 54 129.590 -3.091 -3.081 1.00 0.08 H new ATOM 0 HA ILE A 54 129.107 -0.895 -1.160 1.00 0.09 H new ATOM 0 HB ILE A 54 128.486 -1.147 -4.129 1.00 0.10 H new ATOM 0 HG12 ILE A 54 130.667 0.500 -2.763 1.00 0.13 H new ATOM 0 HG13 ILE A 54 130.968 -1.085 -3.446 1.00 0.13 H new ATOM 0 HG21 ILE A 54 128.117 1.307 -3.969 1.00 0.11 H new ATOM 0 HG22 ILE A 54 127.001 0.418 -2.904 1.00 0.11 H new ATOM 0 HG23 ILE A 54 128.425 1.235 -2.217 1.00 0.11 H new ATOM 0 HD11 ILE A 54 131.519 0.693 -5.086 1.00 0.16 H new ATOM 0 HD12 ILE A 54 130.161 -0.296 -5.673 1.00 0.16 H new ATOM 0 HD13 ILE A 54 129.855 1.315 -4.980 1.00 0.16 H new ATOM 941 N TYR A 55 126.688 -1.414 -0.766 1.00 0.12 N ATOM 942 CA TYR A 55 125.319 -1.822 -0.451 1.00 0.15 C ATOM 943 C TYR A 55 124.328 -0.698 -0.732 1.00 0.15 C ATOM 944 O TYR A 55 124.580 0.465 -0.413 1.00 0.14 O ATOM 945 CB TYR A 55 125.193 -2.199 1.029 1.00 0.21 C ATOM 946 CG TYR A 55 126.140 -3.272 1.530 1.00 0.16 C ATOM 947 CD1 TYR A 55 126.743 -4.193 0.658 1.00 0.19 C ATOM 948 CD2 TYR A 55 126.403 -3.344 2.903 1.00 0.15 C ATOM 949 CE1 TYR A 55 127.605 -5.175 1.163 1.00 0.15 C ATOM 950 CE2 TYR A 55 127.263 -4.325 3.405 1.00 0.18 C ATOM 951 CZ TYR A 55 127.866 -5.241 2.536 1.00 0.15 C ATOM 952 OH TYR A 55 128.716 -6.206 3.033 1.00 0.18 O ATOM 0 H TYR A 55 127.090 -0.735 -0.120 1.00 0.12 H new ATOM 0 HA TYR A 55 125.092 -2.681 -1.082 1.00 0.15 H new ATOM 0 HB2 TYR A 55 125.347 -1.300 1.626 1.00 0.21 H new ATOM 0 HB3 TYR A 55 124.171 -2.531 1.212 1.00 0.21 H new ATOM 0 HD1 TYR A 55 126.542 -4.144 -0.402 1.00 0.19 H new ATOM 0 HD2 TYR A 55 125.940 -2.639 3.577 1.00 0.15 H new ATOM 0 HE1 TYR A 55 128.069 -5.882 0.491 1.00 0.15 H new ATOM 0 HE2 TYR A 55 127.462 -4.376 4.465 1.00 0.18 H new ATOM 0 HH TYR A 55 128.952 -5.989 3.959 1.00 0.18 H new ATOM 962 N HIS A 56 123.193 -1.072 -1.315 1.00 0.16 N ATOM 963 CA HIS A 56 122.106 -0.136 -1.573 1.00 0.16 C ATOM 964 C HIS A 56 120.907 -0.462 -0.685 1.00 0.16 C ATOM 965 O HIS A 56 120.631 -1.632 -0.398 1.00 0.18 O ATOM 966 CB HIS A 56 121.691 -0.210 -3.044 1.00 0.17 C ATOM 967 CG HIS A 56 120.565 0.724 -3.398 1.00 0.19 C ATOM 968 ND1 HIS A 56 120.637 2.089 -3.168 1.00 0.23 N ATOM 969 CD2 HIS A 56 119.335 0.504 -3.968 1.00 0.26 C ATOM 970 CE1 HIS A 56 119.483 2.633 -3.593 1.00 0.23 C ATOM 971 NE2 HIS A 56 118.653 1.711 -4.089 1.00 0.25 N ATOM 0 H HIS A 56 123.002 -2.027 -1.620 1.00 0.16 H new ATOM 0 HA HIS A 56 122.452 0.872 -1.347 1.00 0.16 H new ATOM 0 HB2 HIS A 56 122.554 0.021 -3.669 1.00 0.17 H new ATOM 0 HB3 HIS A 56 121.392 -1.232 -3.278 1.00 0.17 H new ATOM 0 HD2 HIS A 56 118.955 -0.459 -4.275 1.00 0.26 H new ATOM 0 HE1 HIS A 56 119.255 3.687 -3.540 1.00 0.23 H new ATOM 0 HE2 HIS A 56 117.720 1.860 -4.474 1.00 0.25 H new ATOM 979 N ARG A 57 120.220 0.584 -0.229 1.00 0.18 N ATOM 980 CA ARG A 57 119.029 0.411 0.594 1.00 0.21 C ATOM 981 C ARG A 57 117.959 1.420 0.183 1.00 0.22 C ATOM 982 O ARG A 57 118.269 2.538 -0.227 1.00 0.22 O ATOM 983 CB ARG A 57 119.385 0.596 2.074 1.00 0.26 C ATOM 984 CG ARG A 57 118.153 0.347 2.951 1.00 0.30 C ATOM 985 CD ARG A 57 118.499 0.629 4.413 1.00 1.29 C ATOM 986 NE ARG A 57 117.341 0.352 5.269 1.00 1.55 N ATOM 987 CZ ARG A 57 117.217 0.818 6.520 1.00 2.04 C ATOM 988 NH1 ARG A 57 118.135 1.567 7.082 1.00 2.62 N ATOM 989 NH2 ARG A 57 116.146 0.515 7.203 1.00 2.41 N ATOM 0 H ARG A 57 120.468 1.556 -0.416 1.00 0.18 H new ATOM 0 HA ARG A 57 118.639 -0.596 0.447 1.00 0.21 H new ATOM 0 HB2 ARG A 57 120.183 -0.092 2.352 1.00 0.26 H new ATOM 0 HB3 ARG A 57 119.761 1.605 2.241 1.00 0.26 H new ATOM 0 HG2 ARG A 57 117.331 0.987 2.631 1.00 0.30 H new ATOM 0 HG3 ARG A 57 117.816 -0.684 2.839 1.00 0.30 H new ATOM 0 HD2 ARG A 57 119.344 0.012 4.720 1.00 1.29 H new ATOM 0 HD3 ARG A 57 118.805 1.669 4.528 1.00 1.29 H new ATOM 0 HE ARG A 57 116.590 -0.226 4.893 1.00 1.55 H new ATOM 0 HH11 ARG A 57 118.979 1.814 6.565 1.00 2.62 H new ATOM 0 HH12 ARG A 57 118.005 1.903 8.036 1.00 2.62 H new ATOM 0 HH21 ARG A 57 115.421 -0.067 6.783 1.00 2.41 H new ATOM 0 HH22 ARG A 57 116.034 0.860 8.156 1.00 2.41 H new ATOM 1003 N ASN A 58 116.697 1.015 0.296 1.00 0.26 N ATOM 1004 CA ASN A 58 115.581 1.892 -0.055 1.00 0.28 C ATOM 1005 C ASN A 58 115.153 2.779 1.118 1.00 0.29 C ATOM 1006 O ASN A 58 113.990 3.173 1.208 1.00 0.32 O ATOM 1007 CB ASN A 58 114.388 1.047 -0.506 1.00 0.34 C ATOM 1008 CG ASN A 58 114.790 0.157 -1.678 1.00 0.40 C ATOM 1009 OD1 ASN A 58 114.486 -1.036 -1.686 1.00 1.06 O ATOM 1010 ND2 ASN A 58 115.461 0.670 -2.674 1.00 1.26 N ATOM 0 H ASN A 58 116.421 0.090 0.626 1.00 0.26 H new ATOM 0 HA ASN A 58 115.917 2.543 -0.862 1.00 0.28 H new ATOM 0 HB2 ASN A 58 114.033 0.433 0.322 1.00 0.34 H new ATOM 0 HB3 ASN A 58 113.562 1.696 -0.798 1.00 0.34 H new ATOM 0 HD21 ASN A 58 115.735 0.082 -3.461 1.00 1.26 H new ATOM 0 HD22 ASN A 58 115.711 1.659 -2.665 1.00 1.26 H new ATOM 1017 N ALA A 59 116.087 3.093 2.014 1.00 0.28 N ATOM 1018 CA ALA A 59 115.791 3.944 3.159 1.00 0.31 C ATOM 1019 C ALA A 59 117.077 4.578 3.675 1.00 0.33 C ATOM 1020 O ALA A 59 118.171 4.092 3.385 1.00 0.30 O ATOM 1021 CB ALA A 59 115.134 3.125 4.271 1.00 0.36 C ATOM 0 H ALA A 59 117.053 2.770 1.967 1.00 0.28 H new ATOM 0 HA ALA A 59 115.102 4.729 2.847 1.00 0.31 H new ATOM 0 HB1 ALA A 59 114.918 3.773 5.121 1.00 0.36 H new ATOM 0 HB2 ALA A 59 114.206 2.689 3.902 1.00 0.36 H new ATOM 0 HB3 ALA A 59 115.809 2.329 4.584 1.00 0.36 H new ATOM 1027 N GLU A 60 116.948 5.658 4.437 1.00 0.44 N ATOM 1028 CA GLU A 60 118.120 6.375 4.924 1.00 0.52 C ATOM 1029 C GLU A 60 118.938 5.472 5.866 1.00 0.55 C ATOM 1030 O GLU A 60 118.348 4.875 6.765 1.00 0.62 O ATOM 1031 CB GLU A 60 117.677 7.624 5.689 1.00 0.70 C ATOM 1032 CG GLU A 60 118.879 8.545 5.907 1.00 1.20 C ATOM 1033 CD GLU A 60 118.516 9.663 6.879 1.00 1.63 C ATOM 1034 OE1 GLU A 60 117.748 9.404 7.791 1.00 1.69 O ATOM 1035 OE2 GLU A 60 119.013 10.762 6.697 1.00 2.53 O ATOM 0 H GLU A 60 116.054 6.053 4.728 1.00 0.44 H new ATOM 0 HA GLU A 60 118.736 6.662 4.072 1.00 0.52 H new ATOM 0 HB2 GLU A 60 116.901 8.148 5.131 1.00 0.70 H new ATOM 0 HB3 GLU A 60 117.244 7.341 6.648 1.00 0.70 H new ATOM 0 HG2 GLU A 60 119.720 7.972 6.298 1.00 1.20 H new ATOM 0 HG3 GLU A 60 119.198 8.970 4.955 1.00 1.20 H new ATOM 1042 N PRO A 61 120.244 5.327 5.729 1.00 0.54 N ATOM 1043 CA PRO A 61 121.076 5.961 4.657 1.00 0.47 C ATOM 1044 C PRO A 61 120.823 5.318 3.296 1.00 0.37 C ATOM 1045 O PRO A 61 120.675 4.101 3.193 1.00 0.34 O ATOM 1046 CB PRO A 61 122.519 5.731 5.108 1.00 0.49 C ATOM 1047 CG PRO A 61 122.469 4.520 5.970 1.00 0.61 C ATOM 1048 CD PRO A 61 121.087 4.509 6.622 1.00 0.63 C ATOM 0 HA PRO A 61 120.840 7.018 4.531 1.00 0.47 H new ATOM 0 HB2 PRO A 61 123.179 5.580 4.254 1.00 0.49 H new ATOM 0 HB3 PRO A 61 122.902 6.591 5.658 1.00 0.49 H new ATOM 0 HG2 PRO A 61 122.627 3.617 5.380 1.00 0.61 H new ATOM 0 HG3 PRO A 61 123.254 4.549 6.725 1.00 0.61 H new ATOM 0 HD2 PRO A 61 120.700 3.494 6.712 1.00 0.63 H new ATOM 0 HD3 PRO A 61 121.121 4.928 7.628 1.00 0.63 H new ATOM 1056 N PHE A 62 120.789 6.141 2.254 1.00 0.34 N ATOM 1057 CA PHE A 62 120.501 5.648 0.911 1.00 0.26 C ATOM 1058 C PHE A 62 121.584 4.687 0.436 1.00 0.21 C ATOM 1059 O PHE A 62 121.287 3.652 -0.165 1.00 0.18 O ATOM 1060 CB PHE A 62 120.397 6.823 -0.063 1.00 0.32 C ATOM 1061 CG PHE A 62 119.224 7.733 0.216 1.00 0.38 C ATOM 1062 CD1 PHE A 62 119.374 8.825 1.079 1.00 1.23 C ATOM 1063 CD2 PHE A 62 117.986 7.485 -0.391 1.00 1.31 C ATOM 1064 CE1 PHE A 62 118.287 9.668 1.337 1.00 1.24 C ATOM 1065 CE2 PHE A 62 116.899 8.328 -0.133 1.00 1.34 C ATOM 1066 CZ PHE A 62 117.050 9.420 0.731 1.00 0.50 C ATOM 0 H PHE A 62 120.956 7.146 2.311 1.00 0.34 H new ATOM 0 HA PHE A 62 119.553 5.111 0.943 1.00 0.26 H new ATOM 0 HB2 PHE A 62 121.317 7.405 -0.018 1.00 0.32 H new ATOM 0 HB3 PHE A 62 120.314 6.437 -1.079 1.00 0.32 H new ATOM 0 HD1 PHE A 62 120.329 9.017 1.546 1.00 1.23 H new ATOM 0 HD2 PHE A 62 117.870 6.643 -1.058 1.00 1.31 H new ATOM 0 HE1 PHE A 62 118.403 10.510 2.004 1.00 1.24 H new ATOM 0 HE2 PHE A 62 115.944 8.137 -0.600 1.00 1.34 H new ATOM 0 HZ PHE A 62 116.211 10.071 0.930 1.00 0.50 H new ATOM 1076 N HIS A 63 122.836 5.016 0.736 1.00 0.20 N ATOM 1077 CA HIS A 63 123.956 4.207 0.267 1.00 0.17 C ATOM 1078 C HIS A 63 125.053 4.126 1.323 1.00 0.17 C ATOM 1079 O HIS A 63 125.383 5.110 1.988 1.00 0.18 O ATOM 1080 CB HIS A 63 124.526 4.801 -1.021 1.00 0.21 C ATOM 1081 CG HIS A 63 123.550 4.797 -2.167 1.00 0.24 C ATOM 1082 ND1 HIS A 63 122.575 5.772 -2.311 1.00 0.28 N ATOM 1083 CD2 HIS A 63 123.388 3.945 -3.232 1.00 0.26 C ATOM 1084 CE1 HIS A 63 121.877 5.486 -3.423 1.00 0.30 C ATOM 1085 NE2 HIS A 63 122.330 4.382 -4.024 1.00 0.29 N ATOM 0 H HIS A 63 123.099 5.827 1.295 1.00 0.20 H new ATOM 0 HA HIS A 63 123.588 3.199 0.073 1.00 0.17 H new ATOM 0 HB2 HIS A 63 124.845 5.826 -0.829 1.00 0.21 H new ATOM 0 HB3 HIS A 63 125.415 4.239 -1.309 1.00 0.21 H new ATOM 0 HD2 HIS A 63 123.990 3.069 -3.425 1.00 0.26 H new ATOM 0 HE1 HIS A 63 121.050 6.077 -3.787 1.00 0.30 H new ATOM 0 HE2 HIS A 63 121.977 3.952 -4.879 1.00 0.29 H new ATOM 1093 N SER A 64 125.655 2.947 1.436 1.00 0.15 N ATOM 1094 CA SER A 64 126.699 2.729 2.429 1.00 0.16 C ATOM 1095 C SER A 64 127.699 1.701 1.917 1.00 0.15 C ATOM 1096 O SER A 64 127.356 0.828 1.124 1.00 0.14 O ATOM 1097 CB SER A 64 126.089 2.247 3.744 1.00 0.17 C ATOM 1098 OG SER A 64 127.055 2.367 4.780 1.00 0.19 O ATOM 0 H SER A 64 125.440 2.135 0.858 1.00 0.15 H new ATOM 0 HA SER A 64 127.214 3.673 2.605 1.00 0.16 H new ATOM 0 HB2 SER A 64 125.204 2.836 3.986 1.00 0.17 H new ATOM 0 HB3 SER A 64 125.766 1.210 3.650 1.00 0.17 H new ATOM 0 HG SER A 64 127.832 2.863 4.447 1.00 0.19 H new ATOM 1104 N ILE A 65 128.942 1.811 2.375 1.00 0.15 N ATOM 1105 CA ILE A 65 130.005 0.926 1.910 1.00 0.14 C ATOM 1106 C ILE A 65 130.510 0.069 3.067 1.00 0.12 C ATOM 1107 O ILE A 65 130.657 0.548 4.189 1.00 0.13 O ATOM 1108 CB ILE A 65 131.157 1.753 1.327 1.00 0.14 C ATOM 1109 CG1 ILE A 65 130.646 2.646 0.192 1.00 0.18 C ATOM 1110 CG2 ILE A 65 132.222 0.817 0.756 1.00 0.14 C ATOM 1111 CD1 ILE A 65 131.676 3.740 -0.096 1.00 0.20 C ATOM 0 H ILE A 65 129.238 2.501 3.065 1.00 0.15 H new ATOM 0 HA ILE A 65 129.610 0.273 1.132 1.00 0.14 H new ATOM 0 HB ILE A 65 131.577 2.369 2.122 1.00 0.14 H new ATOM 0 HG12 ILE A 65 130.472 2.050 -0.704 1.00 0.18 H new ATOM 0 HG13 ILE A 65 129.691 3.094 0.468 1.00 0.18 H new ATOM 0 HG21 ILE A 65 133.040 1.406 0.342 1.00 0.14 H new ATOM 0 HG22 ILE A 65 132.603 0.173 1.549 1.00 0.14 H new ATOM 0 HG23 ILE A 65 131.783 0.203 -0.030 1.00 0.14 H new ATOM 0 HD11 ILE A 65 131.314 4.377 -0.903 1.00 0.20 H new ATOM 0 HD12 ILE A 65 131.828 4.342 0.800 1.00 0.20 H new ATOM 0 HD13 ILE A 65 132.620 3.282 -0.390 1.00 0.20 H new ATOM 1123 N PHE A 66 130.759 -1.203 2.778 1.00 0.12 N ATOM 1124 CA PHE A 66 131.203 -2.146 3.797 1.00 0.13 C ATOM 1125 C PHE A 66 132.410 -2.945 3.317 1.00 0.11 C ATOM 1126 O PHE A 66 132.491 -3.319 2.149 1.00 0.11 O ATOM 1127 CB PHE A 66 130.077 -3.126 4.118 1.00 0.17 C ATOM 1128 CG PHE A 66 130.431 -4.108 5.208 1.00 0.21 C ATOM 1129 CD1 PHE A 66 130.502 -3.680 6.539 1.00 1.20 C ATOM 1130 CD2 PHE A 66 130.699 -5.444 4.887 1.00 1.25 C ATOM 1131 CE1 PHE A 66 130.840 -4.587 7.548 1.00 1.21 C ATOM 1132 CE2 PHE A 66 131.036 -6.353 5.897 1.00 1.27 C ATOM 1133 CZ PHE A 66 131.108 -5.925 7.227 1.00 0.33 C ATOM 0 H PHE A 66 130.661 -1.605 1.846 1.00 0.12 H new ATOM 0 HA PHE A 66 131.479 -1.574 4.683 1.00 0.13 H new ATOM 0 HB2 PHE A 66 129.192 -2.565 4.418 1.00 0.17 H new ATOM 0 HB3 PHE A 66 129.815 -3.676 3.214 1.00 0.17 H new ATOM 0 HD1 PHE A 66 130.296 -2.649 6.786 1.00 1.20 H new ATOM 0 HD2 PHE A 66 130.646 -5.774 3.860 1.00 1.25 H new ATOM 0 HE1 PHE A 66 130.895 -4.257 8.575 1.00 1.21 H new ATOM 0 HE2 PHE A 66 131.240 -7.384 5.650 1.00 1.27 H new ATOM 0 HZ PHE A 66 131.370 -6.625 8.006 1.00 0.33 H new ATOM 1143 N ILE A 67 133.344 -3.208 4.226 1.00 0.12 N ATOM 1144 CA ILE A 67 134.447 -4.122 3.941 1.00 0.11 C ATOM 1145 C ILE A 67 134.418 -5.285 4.933 1.00 0.11 C ATOM 1146 O ILE A 67 134.317 -5.088 6.148 1.00 0.12 O ATOM 1147 CB ILE A 67 135.789 -3.381 3.997 1.00 0.13 C ATOM 1148 CG1 ILE A 67 135.758 -2.233 2.977 1.00 0.14 C ATOM 1149 CG2 ILE A 67 136.928 -4.350 3.651 1.00 0.13 C ATOM 1150 CD1 ILE A 67 137.072 -1.442 2.989 1.00 0.16 C ATOM 0 H ILE A 67 133.360 -2.804 5.162 1.00 0.12 H new ATOM 0 HA ILE A 67 134.332 -4.521 2.933 1.00 0.11 H new ATOM 0 HB ILE A 67 135.954 -2.984 4.999 1.00 0.13 H new ATOM 0 HG12 ILE A 67 135.582 -2.635 1.979 1.00 0.14 H new ATOM 0 HG13 ILE A 67 134.927 -1.565 3.203 1.00 0.14 H new ATOM 0 HG21 ILE A 67 137.880 -3.821 3.691 1.00 0.13 H new ATOM 0 HG22 ILE A 67 136.938 -5.171 4.368 1.00 0.13 H new ATOM 0 HG23 ILE A 67 136.776 -4.747 2.647 1.00 0.13 H new ATOM 0 HD11 ILE A 67 137.019 -0.637 2.256 1.00 0.16 H new ATOM 0 HD12 ILE A 67 137.234 -1.020 3.981 1.00 0.16 H new ATOM 0 HD13 ILE A 67 137.899 -2.106 2.738 1.00 0.16 H new ATOM 1162 N ASN A 68 134.469 -6.495 4.383 1.00 0.09 N ATOM 1163 CA ASN A 68 134.457 -7.718 5.176 1.00 0.09 C ATOM 1164 C ASN A 68 135.894 -8.174 5.417 1.00 0.10 C ATOM 1165 O ASN A 68 136.507 -8.787 4.541 1.00 0.10 O ATOM 1166 CB ASN A 68 133.685 -8.796 4.405 1.00 0.08 C ATOM 1167 CG ASN A 68 132.999 -9.774 5.354 1.00 0.09 C ATOM 1168 OD1 ASN A 68 133.391 -9.902 6.514 1.00 0.11 O ATOM 1169 ND2 ASN A 68 131.983 -10.474 4.918 1.00 0.09 N ATOM 0 H ASN A 68 134.520 -6.654 3.377 1.00 0.09 H new ATOM 0 HA ASN A 68 133.974 -7.542 6.137 1.00 0.09 H new ATOM 0 HB2 ASN A 68 132.940 -8.324 3.765 1.00 0.08 H new ATOM 0 HB3 ASN A 68 134.369 -9.339 3.752 1.00 0.08 H new ATOM 0 HD21 ASN A 68 131.511 -11.130 5.540 1.00 0.09 H new ATOM 0 HD22 ASN A 68 131.663 -10.363 3.956 1.00 0.09 H new ATOM 1176 N ASN A 69 136.416 -7.862 6.603 1.00 0.11 N ATOM 1177 CA ASN A 69 137.815 -8.130 6.928 1.00 0.13 C ATOM 1178 C ASN A 69 138.053 -9.624 7.135 1.00 0.14 C ATOM 1179 O ASN A 69 137.736 -10.182 8.184 1.00 0.16 O ATOM 1180 CB ASN A 69 138.193 -7.348 8.189 1.00 0.15 C ATOM 1181 CG ASN A 69 139.686 -7.472 8.478 1.00 0.17 C ATOM 1182 OD1 ASN A 69 140.343 -8.394 7.995 1.00 0.16 O ATOM 1183 ND2 ASN A 69 140.266 -6.587 9.240 1.00 0.19 N ATOM 0 H ASN A 69 135.888 -7.422 7.357 1.00 0.11 H new ATOM 0 HA ASN A 69 138.442 -7.809 6.096 1.00 0.13 H new ATOM 0 HB2 ASN A 69 137.928 -6.298 8.064 1.00 0.15 H new ATOM 0 HB3 ASN A 69 137.622 -7.722 9.039 1.00 0.15 H new ATOM 0 HD21 ASN A 69 141.264 -6.659 9.436 1.00 0.19 H new ATOM 0 HD22 ASN A 69 139.721 -5.823 9.640 1.00 0.19 H new ATOM 1190 N ARG A 70 138.696 -10.249 6.155 1.00 0.14 N ATOM 1191 CA ARG A 70 138.816 -11.703 6.139 1.00 0.17 C ATOM 1192 C ARG A 70 139.822 -12.186 7.178 1.00 0.20 C ATOM 1193 O ARG A 70 139.595 -13.188 7.855 1.00 0.25 O ATOM 1194 CB ARG A 70 139.252 -12.170 4.748 1.00 0.19 C ATOM 1195 CG ARG A 70 139.216 -13.698 4.683 1.00 1.18 C ATOM 1196 CD ARG A 70 139.750 -14.165 3.328 1.00 1.35 C ATOM 1197 NE ARG A 70 138.921 -13.628 2.245 1.00 2.01 N ATOM 1198 CZ ARG A 70 139.336 -13.528 0.973 1.00 2.39 C ATOM 1199 NH1 ARG A 70 140.535 -13.907 0.598 1.00 2.26 N ATOM 1200 NH2 ARG A 70 138.522 -13.037 0.081 1.00 3.41 N ATOM 0 H ARG A 70 139.139 -9.777 5.367 1.00 0.14 H new ATOM 0 HA ARG A 70 137.842 -12.126 6.383 1.00 0.17 H new ATOM 0 HB2 ARG A 70 138.593 -11.748 3.989 1.00 0.19 H new ATOM 0 HB3 ARG A 70 140.258 -11.811 4.532 1.00 0.19 H new ATOM 0 HG2 ARG A 70 139.817 -14.121 5.488 1.00 1.18 H new ATOM 0 HG3 ARG A 70 138.196 -14.055 4.826 1.00 1.18 H new ATOM 0 HD2 ARG A 70 140.782 -13.837 3.203 1.00 1.35 H new ATOM 0 HD3 ARG A 70 139.755 -15.254 3.286 1.00 1.35 H new ATOM 0 HE ARG A 70 137.977 -13.313 2.471 1.00 2.01 H new ATOM 0 HH11 ARG A 70 141.185 -14.292 1.283 1.00 2.26 H new ATOM 0 HH12 ARG A 70 140.817 -13.816 -0.378 1.00 2.26 H new ATOM 0 HH21 ARG A 70 137.587 -12.736 0.355 1.00 3.41 H new ATOM 0 HH22 ARG A 70 138.821 -12.954 -0.891 1.00 3.41 H new ATOM 1214 N LEU A 71 140.933 -11.470 7.300 1.00 0.18 N ATOM 1215 CA LEU A 71 142.008 -11.897 8.186 1.00 0.21 C ATOM 1216 C LEU A 71 141.620 -11.748 9.654 1.00 0.21 C ATOM 1217 O LEU A 71 141.852 -12.651 10.458 1.00 0.24 O ATOM 1218 CB LEU A 71 143.261 -11.064 7.910 1.00 0.22 C ATOM 1219 CG LEU A 71 143.690 -11.252 6.454 1.00 0.24 C ATOM 1220 CD1 LEU A 71 144.795 -10.250 6.116 1.00 0.26 C ATOM 1221 CD2 LEU A 71 144.215 -12.676 6.258 1.00 0.29 C ATOM 0 H LEU A 71 141.112 -10.598 6.801 1.00 0.18 H new ATOM 0 HA LEU A 71 142.203 -12.951 7.990 1.00 0.21 H new ATOM 0 HB2 LEU A 71 143.061 -10.011 8.108 1.00 0.22 H new ATOM 0 HB3 LEU A 71 144.066 -11.367 8.579 1.00 0.22 H new ATOM 0 HG LEU A 71 142.836 -11.086 5.798 1.00 0.24 H new ATOM 0 HD11 LEU A 71 145.102 -10.383 5.079 1.00 0.26 H new ATOM 0 HD12 LEU A 71 144.422 -9.236 6.257 1.00 0.26 H new ATOM 0 HD13 LEU A 71 145.650 -10.416 6.771 1.00 0.26 H new ATOM 0 HD21 LEU A 71 144.521 -12.811 5.221 1.00 0.29 H new ATOM 0 HD22 LEU A 71 145.070 -12.842 6.913 1.00 0.29 H new ATOM 0 HD23 LEU A 71 143.428 -13.390 6.500 1.00 0.29 H new ATOM 1233 N ASN A 72 141.030 -10.609 10.000 1.00 0.20 N ATOM 1234 CA ASN A 72 140.700 -10.331 11.398 1.00 0.23 C ATOM 1235 C ASN A 72 139.261 -10.699 11.778 1.00 0.27 C ATOM 1236 O ASN A 72 138.887 -10.567 12.944 1.00 0.32 O ATOM 1237 CB ASN A 72 140.925 -8.844 11.687 1.00 0.26 C ATOM 1238 CG ASN A 72 142.391 -8.462 11.483 1.00 1.12 C ATOM 1239 OD1 ASN A 72 143.248 -9.320 11.258 1.00 1.89 O ATOM 1240 ND2 ASN A 72 142.735 -7.206 11.555 1.00 1.29 N ATOM 0 H ASN A 72 140.772 -9.871 9.344 1.00 0.20 H new ATOM 0 HA ASN A 72 141.357 -10.959 12.000 1.00 0.23 H new ATOM 0 HB2 ASN A 72 140.294 -8.243 11.032 1.00 0.26 H new ATOM 0 HB3 ASN A 72 140.626 -8.620 12.711 1.00 0.26 H new ATOM 0 HD21 ASN A 72 143.710 -6.936 11.425 1.00 1.29 H new ATOM 0 HD22 ASN A 72 142.029 -6.494 11.741 1.00 1.29 H new ATOM 1247 N THR A 73 138.449 -11.156 10.822 1.00 0.26 N ATOM 1248 CA THR A 73 137.083 -11.575 11.125 1.00 0.30 C ATOM 1249 C THR A 73 136.315 -10.443 11.808 1.00 0.31 C ATOM 1250 O THR A 73 135.587 -10.653 12.778 1.00 0.35 O ATOM 1251 CB THR A 73 137.105 -12.817 12.021 1.00 0.33 C ATOM 1252 OG1 THR A 73 138.008 -13.771 11.480 1.00 1.15 O ATOM 1253 CG2 THR A 73 135.701 -13.422 12.094 1.00 1.18 C ATOM 0 H THR A 73 138.712 -11.244 9.841 1.00 0.26 H new ATOM 0 HA THR A 73 136.576 -11.820 10.191 1.00 0.30 H new ATOM 0 HB THR A 73 137.428 -12.538 13.024 1.00 0.33 H new ATOM 0 HG1 THR A 73 138.025 -14.566 12.052 1.00 1.15 H new ATOM 0 HG21 THR A 73 135.718 -14.306 12.732 1.00 1.18 H new ATOM 0 HG22 THR A 73 135.010 -12.688 12.509 1.00 1.18 H new ATOM 0 HG23 THR A 73 135.374 -13.703 11.093 1.00 1.18 H new ATOM 1261 N THR A 74 136.487 -9.236 11.279 1.00 0.30 N ATOM 1262 CA THR A 74 135.852 -8.051 11.850 1.00 0.33 C ATOM 1263 C THR A 74 135.081 -7.287 10.780 1.00 0.32 C ATOM 1264 O THR A 74 135.451 -7.295 9.606 1.00 0.39 O ATOM 1265 CB THR A 74 136.916 -7.136 12.463 1.00 0.35 C ATOM 1266 OG1 THR A 74 137.705 -7.880 13.380 1.00 0.37 O ATOM 1267 CG2 THR A 74 136.237 -5.977 13.194 1.00 0.39 C ATOM 0 H THR A 74 137.060 -9.051 10.456 1.00 0.30 H new ATOM 0 HA THR A 74 135.155 -8.372 12.624 1.00 0.33 H new ATOM 0 HB THR A 74 137.553 -6.739 11.673 1.00 0.35 H new ATOM 0 HG1 THR A 74 138.013 -8.706 12.952 1.00 0.37 H new ATOM 0 HG21 THR A 74 136.996 -5.327 13.630 1.00 0.39 H new ATOM 0 HG22 THR A 74 135.632 -5.407 12.489 1.00 0.39 H new ATOM 0 HG23 THR A 74 135.598 -6.370 13.985 1.00 0.39 H new ATOM 1275 N SER A 75 134.001 -6.633 11.193 1.00 0.27 N ATOM 1276 CA SER A 75 133.178 -5.865 10.266 1.00 0.27 C ATOM 1277 C SER A 75 133.490 -4.375 10.368 1.00 0.25 C ATOM 1278 O SER A 75 133.549 -3.821 11.465 1.00 0.31 O ATOM 1279 CB SER A 75 131.697 -6.089 10.579 1.00 0.40 C ATOM 1280 OG SER A 75 131.517 -6.214 11.984 1.00 0.61 O ATOM 0 H SER A 75 133.676 -6.619 12.160 1.00 0.27 H new ATOM 0 HA SER A 75 133.400 -6.204 9.254 1.00 0.27 H new ATOM 0 HB2 SER A 75 131.105 -5.256 10.200 1.00 0.40 H new ATOM 0 HB3 SER A 75 131.341 -6.988 10.076 1.00 0.40 H new ATOM 0 HG SER A 75 130.567 -6.356 12.181 1.00 0.61 H new ATOM 1286 N PHE A 76 133.691 -3.727 9.221 1.00 0.22 N ATOM 1287 CA PHE A 76 133.902 -2.280 9.197 1.00 0.28 C ATOM 1288 C PHE A 76 132.953 -1.625 8.195 1.00 0.20 C ATOM 1289 O PHE A 76 132.963 -1.959 7.012 1.00 0.14 O ATOM 1290 CB PHE A 76 135.357 -1.984 8.820 1.00 0.36 C ATOM 1291 CG PHE A 76 135.670 -0.512 8.689 1.00 0.40 C ATOM 1292 CD1 PHE A 76 136.102 0.216 9.804 1.00 1.38 C ATOM 1293 CD2 PHE A 76 135.522 0.125 7.451 1.00 1.15 C ATOM 1294 CE1 PHE A 76 136.386 1.581 9.681 1.00 1.34 C ATOM 1295 CE2 PHE A 76 135.805 1.491 7.328 1.00 1.25 C ATOM 1296 CZ PHE A 76 136.237 2.218 8.443 1.00 0.55 C ATOM 0 H PHE A 76 133.712 -4.175 8.305 1.00 0.22 H new ATOM 0 HA PHE A 76 133.696 -1.870 10.186 1.00 0.28 H new ATOM 0 HB2 PHE A 76 136.013 -2.419 9.574 1.00 0.36 H new ATOM 0 HB3 PHE A 76 135.585 -2.479 7.876 1.00 0.36 H new ATOM 0 HD1 PHE A 76 136.216 -0.276 10.759 1.00 1.38 H new ATOM 0 HD2 PHE A 76 135.190 -0.437 6.591 1.00 1.15 H new ATOM 0 HE1 PHE A 76 136.720 2.143 10.541 1.00 1.34 H new ATOM 0 HE2 PHE A 76 135.690 1.983 6.373 1.00 1.25 H new ATOM 0 HZ PHE A 76 136.456 3.271 8.349 1.00 0.55 H new ATOM 1306 N VAL A 77 132.137 -0.688 8.678 1.00 0.28 N ATOM 1307 CA VAL A 77 131.151 -0.017 7.832 1.00 0.24 C ATOM 1308 C VAL A 77 131.312 1.503 7.902 1.00 0.28 C ATOM 1309 O VAL A 77 131.740 2.043 8.922 1.00 0.40 O ATOM 1310 CB VAL A 77 129.739 -0.429 8.272 1.00 0.38 C ATOM 1311 CG1 VAL A 77 129.480 0.022 9.713 1.00 1.09 C ATOM 1312 CG2 VAL A 77 128.697 0.204 7.344 1.00 1.25 C ATOM 0 H VAL A 77 132.139 -0.377 9.649 1.00 0.28 H new ATOM 0 HA VAL A 77 131.310 -0.319 6.797 1.00 0.24 H new ATOM 0 HB VAL A 77 129.660 -1.515 8.218 1.00 0.38 H new ATOM 0 HG11 VAL A 77 128.475 -0.276 10.013 1.00 1.09 H new ATOM 0 HG12 VAL A 77 130.210 -0.443 10.376 1.00 1.09 H new ATOM 0 HG13 VAL A 77 129.571 1.106 9.777 1.00 1.09 H new ATOM 0 HG21 VAL A 77 127.698 -0.093 7.663 1.00 1.25 H new ATOM 0 HG22 VAL A 77 128.784 1.290 7.387 1.00 1.25 H new ATOM 0 HG23 VAL A 77 128.867 -0.134 6.322 1.00 1.25 H new ATOM 1322 N GLU A 78 130.968 2.185 6.812 1.00 0.23 N ATOM 1323 CA GLU A 78 130.978 3.646 6.807 1.00 0.30 C ATOM 1324 C GLU A 78 129.906 4.195 5.851 1.00 0.24 C ATOM 1325 O GLU A 78 129.755 3.661 4.752 1.00 0.21 O ATOM 1326 CB GLU A 78 132.354 4.149 6.364 1.00 0.37 C ATOM 1327 CG GLU A 78 132.418 5.669 6.520 1.00 0.46 C ATOM 1328 CD GLU A 78 133.804 6.179 6.134 1.00 1.05 C ATOM 1329 OE1 GLU A 78 134.767 5.477 6.396 1.00 1.81 O ATOM 1330 OE2 GLU A 78 133.881 7.265 5.582 1.00 1.27 O ATOM 0 H GLU A 78 130.682 1.757 5.932 1.00 0.23 H new ATOM 0 HA GLU A 78 130.761 3.996 7.816 1.00 0.30 H new ATOM 0 HB2 GLU A 78 133.134 3.679 6.962 1.00 0.37 H new ATOM 0 HB3 GLU A 78 132.537 3.872 5.326 1.00 0.37 H new ATOM 0 HG2 GLU A 78 131.661 6.139 5.892 1.00 0.46 H new ATOM 0 HG3 GLU A 78 132.194 5.946 7.550 1.00 0.46 H new ATOM 1337 N PRO A 79 129.152 5.216 6.217 1.00 0.23 N ATOM 1338 CA PRO A 79 128.123 5.802 5.301 1.00 0.20 C ATOM 1339 C PRO A 79 128.745 6.659 4.200 1.00 0.20 C ATOM 1340 O PRO A 79 129.810 7.244 4.397 1.00 0.22 O ATOM 1341 CB PRO A 79 127.246 6.651 6.221 1.00 0.22 C ATOM 1342 CG PRO A 79 128.144 7.070 7.332 1.00 0.28 C ATOM 1343 CD PRO A 79 129.189 5.965 7.492 1.00 0.26 C ATOM 0 HA PRO A 79 127.566 5.027 4.774 1.00 0.20 H new ATOM 0 HB2 PRO A 79 126.841 7.515 5.694 1.00 0.22 H new ATOM 0 HB3 PRO A 79 126.397 6.079 6.595 1.00 0.22 H new ATOM 0 HG2 PRO A 79 128.621 8.024 7.106 1.00 0.28 H new ATOM 0 HG3 PRO A 79 127.580 7.206 8.255 1.00 0.28 H new ATOM 0 HD2 PRO A 79 130.179 6.382 7.676 1.00 0.26 H new ATOM 0 HD3 PRO A 79 128.953 5.318 8.337 1.00 0.26 H new ATOM 1351 N ILE A 80 128.084 6.733 3.045 1.00 0.18 N ATOM 1352 CA ILE A 80 128.589 7.557 1.949 1.00 0.20 C ATOM 1353 C ILE A 80 128.042 8.979 2.054 1.00 0.21 C ATOM 1354 O ILE A 80 126.830 9.189 2.092 1.00 0.25 O ATOM 1355 CB ILE A 80 128.194 6.958 0.591 1.00 0.20 C ATOM 1356 CG1 ILE A 80 128.681 5.508 0.502 1.00 0.20 C ATOM 1357 CG2 ILE A 80 128.835 7.770 -0.541 1.00 0.24 C ATOM 1358 CD1 ILE A 80 128.173 4.860 -0.789 1.00 0.19 C ATOM 0 H ILE A 80 127.213 6.241 2.846 1.00 0.18 H new ATOM 0 HA ILE A 80 129.676 7.583 2.023 1.00 0.20 H new ATOM 0 HB ILE A 80 127.109 6.987 0.495 1.00 0.20 H new ATOM 0 HG12 ILE A 80 129.770 5.480 0.528 1.00 0.20 H new ATOM 0 HG13 ILE A 80 128.327 4.944 1.365 1.00 0.20 H new ATOM 0 HG21 ILE A 80 128.552 7.341 -1.502 1.00 0.24 H new ATOM 0 HG22 ILE A 80 128.490 8.803 -0.489 1.00 0.24 H new ATOM 0 HG23 ILE A 80 129.920 7.744 -0.438 1.00 0.24 H new ATOM 0 HD11 ILE A 80 128.525 3.830 -0.842 1.00 0.19 H new ATOM 0 HD12 ILE A 80 127.083 4.872 -0.798 1.00 0.19 H new ATOM 0 HD13 ILE A 80 128.549 5.416 -1.648 1.00 0.19 H new ATOM 1370 N THR A 81 128.948 9.952 2.101 1.00 0.32 N ATOM 1371 CA THR A 81 128.551 11.355 2.104 1.00 0.34 C ATOM 1372 C THR A 81 128.686 11.940 0.702 1.00 0.26 C ATOM 1373 O THR A 81 129.419 11.406 -0.131 1.00 0.27 O ATOM 1374 CB THR A 81 129.428 12.145 3.078 1.00 0.42 C ATOM 1375 OG1 THR A 81 130.797 11.928 2.764 1.00 0.40 O ATOM 1376 CG2 THR A 81 129.150 11.683 4.509 1.00 0.55 C ATOM 0 H THR A 81 129.955 9.796 2.137 1.00 0.32 H new ATOM 0 HA THR A 81 127.511 11.425 2.421 1.00 0.34 H new ATOM 0 HB THR A 81 129.200 13.207 2.992 1.00 0.42 H new ATOM 0 HG1 THR A 81 131.360 12.435 3.386 1.00 0.40 H new ATOM 0 HG21 THR A 81 129.775 12.247 5.201 1.00 0.55 H new ATOM 0 HG22 THR A 81 128.100 11.852 4.748 1.00 0.55 H new ATOM 0 HG23 THR A 81 129.376 10.620 4.599 1.00 0.55 H new ATOM 1384 N GLY A 82 127.981 13.036 0.442 1.00 0.31 N ATOM 1385 CA GLY A 82 128.011 13.654 -0.885 1.00 0.35 C ATOM 1386 C GLY A 82 128.972 14.845 -0.986 1.00 0.30 C ATOM 1387 O GLY A 82 128.986 15.537 -2.005 1.00 0.50 O ATOM 0 H GLY A 82 127.388 13.512 1.121 1.00 0.31 H new ATOM 0 HA2 GLY A 82 128.299 12.902 -1.620 1.00 0.35 H new ATOM 0 HA3 GLY A 82 127.006 13.986 -1.145 1.00 0.35 H new ATOM 1391 N SER A 83 129.773 15.090 0.049 1.00 0.25 N ATOM 1392 CA SER A 83 130.757 16.173 0.008 1.00 0.34 C ATOM 1393 C SER A 83 132.173 15.683 -0.335 1.00 0.33 C ATOM 1394 O SER A 83 133.081 16.497 -0.501 1.00 0.31 O ATOM 1395 CB SER A 83 130.787 16.886 1.360 1.00 0.46 C ATOM 1396 OG SER A 83 131.488 16.081 2.297 1.00 1.31 O ATOM 0 H SER A 83 129.762 14.559 0.920 1.00 0.25 H new ATOM 0 HA SER A 83 130.448 16.854 -0.785 1.00 0.34 H new ATOM 0 HB2 SER A 83 131.272 17.857 1.262 1.00 0.46 H new ATOM 0 HB3 SER A 83 129.771 17.071 1.710 1.00 0.46 H new ATOM 0 HG SER A 83 131.511 16.535 3.165 1.00 1.31 H new ATOM 1402 N LEU A 84 132.372 14.367 -0.444 1.00 0.38 N ATOM 1403 CA LEU A 84 133.697 13.819 -0.708 1.00 0.40 C ATOM 1404 C LEU A 84 134.168 14.153 -2.119 1.00 0.33 C ATOM 1405 O LEU A 84 133.383 14.135 -3.068 1.00 0.34 O ATOM 1406 CB LEU A 84 133.667 12.298 -0.535 1.00 0.49 C ATOM 1407 CG LEU A 84 133.229 11.951 0.889 1.00 0.59 C ATOM 1408 CD1 LEU A 84 133.022 10.439 1.005 1.00 0.89 C ATOM 1409 CD2 LEU A 84 134.313 12.392 1.875 1.00 0.70 C ATOM 0 H LEU A 84 131.635 13.668 -0.354 1.00 0.38 H new ATOM 0 HA LEU A 84 134.393 14.267 0.001 1.00 0.40 H new ATOM 0 HB2 LEU A 84 132.981 11.854 -1.256 1.00 0.49 H new ATOM 0 HB3 LEU A 84 134.654 11.880 -0.735 1.00 0.49 H new ATOM 0 HG LEU A 84 132.295 12.465 1.118 1.00 0.59 H new ATOM 0 HD11 LEU A 84 132.710 10.191 2.020 1.00 0.89 H new ATOM 0 HD12 LEU A 84 132.253 10.122 0.301 1.00 0.89 H new ATOM 0 HD13 LEU A 84 133.956 9.925 0.777 1.00 0.89 H new ATOM 0 HD21 LEU A 84 134.003 12.146 2.891 1.00 0.70 H new ATOM 0 HD22 LEU A 84 135.245 11.876 1.645 1.00 0.70 H new ATOM 0 HD23 LEU A 84 134.464 13.468 1.793 1.00 0.70 H new ATOM 1421 N GLU A 85 135.457 14.457 -2.249 1.00 0.31 N ATOM 1422 CA GLU A 85 136.062 14.694 -3.557 1.00 0.26 C ATOM 1423 C GLU A 85 137.046 13.574 -3.877 1.00 0.23 C ATOM 1424 O GLU A 85 137.839 13.175 -3.023 1.00 0.23 O ATOM 1425 CB GLU A 85 136.795 16.037 -3.566 1.00 0.28 C ATOM 1426 CG GLU A 85 137.307 16.330 -4.980 1.00 0.26 C ATOM 1427 CD GLU A 85 138.176 17.586 -4.989 1.00 0.43 C ATOM 1428 OE1 GLU A 85 138.807 17.859 -3.979 1.00 0.48 O ATOM 1429 OE2 GLU A 85 138.199 18.256 -6.007 1.00 0.66 O ATOM 0 H GLU A 85 136.103 14.545 -1.464 1.00 0.31 H new ATOM 0 HA GLU A 85 135.275 14.715 -4.311 1.00 0.26 H new ATOM 0 HB2 GLU A 85 136.124 16.832 -3.239 1.00 0.28 H new ATOM 0 HB3 GLU A 85 137.628 16.013 -2.864 1.00 0.28 H new ATOM 0 HG2 GLU A 85 137.883 15.480 -5.347 1.00 0.26 H new ATOM 0 HG3 GLU A 85 136.464 16.460 -5.658 1.00 0.26 H new ATOM 1436 N LEU A 86 136.998 13.077 -5.110 1.00 0.22 N ATOM 1437 CA LEU A 86 137.820 11.933 -5.504 1.00 0.20 C ATOM 1438 C LEU A 86 138.862 12.333 -6.547 1.00 0.20 C ATOM 1439 O LEU A 86 138.713 13.340 -7.239 1.00 0.23 O ATOM 1440 CB LEU A 86 136.937 10.826 -6.092 1.00 0.22 C ATOM 1441 CG LEU A 86 135.834 10.438 -5.101 1.00 0.23 C ATOM 1442 CD1 LEU A 86 134.909 9.405 -5.746 1.00 0.26 C ATOM 1443 CD2 LEU A 86 136.464 9.838 -3.844 1.00 0.21 C ATOM 0 H LEU A 86 136.402 13.445 -5.851 1.00 0.22 H new ATOM 0 HA LEU A 86 138.331 11.572 -4.611 1.00 0.20 H new ATOM 0 HB2 LEU A 86 136.491 11.166 -7.027 1.00 0.22 H new ATOM 0 HB3 LEU A 86 137.546 9.953 -6.328 1.00 0.22 H new ATOM 0 HG LEU A 86 135.260 11.325 -4.833 1.00 0.23 H new ATOM 0 HD11 LEU A 86 134.125 9.129 -5.041 1.00 0.26 H new ATOM 0 HD12 LEU A 86 134.458 9.830 -6.643 1.00 0.26 H new ATOM 0 HD13 LEU A 86 135.484 8.519 -6.014 1.00 0.26 H new ATOM 0 HD21 LEU A 86 135.679 9.562 -3.140 1.00 0.21 H new ATOM 0 HD22 LEU A 86 137.038 8.951 -4.113 1.00 0.21 H new ATOM 0 HD23 LEU A 86 137.124 10.572 -3.382 1.00 0.21 H new ATOM 1455 N GLN A 87 139.916 11.529 -6.642 1.00 0.17 N ATOM 1456 CA GLN A 87 140.955 11.727 -7.646 1.00 0.18 C ATOM 1457 C GLN A 87 141.531 10.369 -8.032 1.00 0.18 C ATOM 1458 O GLN A 87 141.628 9.477 -7.188 1.00 0.17 O ATOM 1459 CB GLN A 87 142.073 12.611 -7.088 1.00 0.19 C ATOM 1460 CG GLN A 87 141.496 13.950 -6.629 1.00 0.21 C ATOM 1461 CD GLN A 87 142.624 14.860 -6.153 1.00 0.27 C ATOM 1462 OE1 GLN A 87 143.252 15.545 -6.959 1.00 0.66 O ATOM 1463 NE2 GLN A 87 142.922 14.903 -4.883 1.00 0.42 N ATOM 0 H GLN A 87 140.073 10.728 -6.030 1.00 0.17 H new ATOM 0 HA GLN A 87 140.523 12.217 -8.519 1.00 0.18 H new ATOM 0 HB2 GLN A 87 142.562 12.110 -6.253 1.00 0.19 H new ATOM 0 HB3 GLN A 87 142.834 12.775 -7.851 1.00 0.19 H new ATOM 0 HG2 GLN A 87 140.955 14.424 -7.448 1.00 0.21 H new ATOM 0 HG3 GLN A 87 140.779 13.791 -5.823 1.00 0.21 H new ATOM 0 HE21 GLN A 87 142.400 14.334 -4.217 1.00 0.42 H new ATOM 0 HE22 GLN A 87 143.677 15.506 -4.557 1.00 0.42 H new ATOM 1472 N SER A 88 141.915 10.205 -9.295 1.00 0.19 N ATOM 1473 CA SER A 88 142.435 8.918 -9.757 1.00 0.21 C ATOM 1474 C SER A 88 143.902 9.022 -10.160 1.00 0.21 C ATOM 1475 O SER A 88 144.239 9.629 -11.177 1.00 0.25 O ATOM 1476 CB SER A 88 141.618 8.437 -10.956 1.00 0.27 C ATOM 1477 OG SER A 88 142.063 7.141 -11.334 1.00 0.30 O ATOM 0 H SER A 88 141.878 10.933 -10.008 1.00 0.19 H new ATOM 0 HA SER A 88 142.354 8.207 -8.935 1.00 0.21 H new ATOM 0 HB2 SER A 88 140.558 8.411 -10.703 1.00 0.27 H new ATOM 0 HB3 SER A 88 141.730 9.131 -11.789 1.00 0.27 H new ATOM 0 HG SER A 88 141.541 6.827 -12.102 1.00 0.30 H new ATOM 1483 N GLN A 89 144.769 8.422 -9.349 1.00 0.20 N ATOM 1484 CA GLN A 89 146.167 8.255 -9.725 1.00 0.25 C ATOM 1485 C GLN A 89 146.410 6.782 -10.068 1.00 0.27 C ATOM 1486 O GLN A 89 146.578 5.986 -9.144 1.00 0.31 O ATOM 1487 CB GLN A 89 147.070 8.632 -8.547 1.00 0.29 C ATOM 1488 CG GLN A 89 146.925 10.121 -8.214 1.00 0.44 C ATOM 1489 CD GLN A 89 148.226 10.654 -7.622 1.00 0.67 C ATOM 1490 OE1 GLN A 89 149.311 10.171 -7.945 1.00 1.29 O ATOM 1491 NE2 GLN A 89 148.176 11.627 -6.756 1.00 0.61 N ATOM 0 H GLN A 89 144.529 8.046 -8.432 1.00 0.20 H new ATOM 0 HA GLN A 89 146.391 8.894 -10.579 1.00 0.25 H new ATOM 0 HB2 GLN A 89 146.810 8.031 -7.675 1.00 0.29 H new ATOM 0 HB3 GLN A 89 148.108 8.407 -8.791 1.00 0.29 H new ATOM 0 HG2 GLN A 89 146.670 10.680 -9.114 1.00 0.44 H new ATOM 0 HG3 GLN A 89 146.108 10.266 -7.507 1.00 0.44 H new ATOM 0 HE21 GLN A 89 147.276 12.026 -6.489 1.00 0.61 H new ATOM 0 HE22 GLN A 89 149.037 11.989 -6.345 1.00 0.61 H new ATOM 1500 N PRO A 90 146.512 6.394 -11.322 1.00 0.33 N ATOM 1501 CA PRO A 90 146.559 4.938 -11.669 1.00 0.38 C ATOM 1502 C PRO A 90 147.788 4.253 -11.053 1.00 0.39 C ATOM 1503 O PRO A 90 148.854 4.868 -11.019 1.00 0.42 O ATOM 1504 CB PRO A 90 146.619 4.908 -13.200 1.00 0.47 C ATOM 1505 CG PRO A 90 147.091 6.261 -13.610 1.00 0.51 C ATOM 1506 CD PRO A 90 146.608 7.228 -12.533 1.00 0.42 C ATOM 0 HA PRO A 90 145.697 4.397 -11.278 1.00 0.38 H new ATOM 0 HB2 PRO A 90 147.300 4.133 -13.550 1.00 0.47 H new ATOM 0 HB3 PRO A 90 145.640 4.689 -13.626 1.00 0.47 H new ATOM 0 HG2 PRO A 90 148.177 6.285 -13.695 1.00 0.51 H new ATOM 0 HG3 PRO A 90 146.689 6.534 -14.586 1.00 0.51 H new ATOM 0 HD2 PRO A 90 147.307 8.053 -12.395 1.00 0.42 H new ATOM 0 HD3 PRO A 90 145.645 7.666 -12.793 1.00 0.42 H new ATOM 1514 N PRO A 91 147.715 3.028 -10.568 1.00 0.40 N ATOM 1515 CA PRO A 91 146.480 2.186 -10.480 1.00 0.39 C ATOM 1516 C PRO A 91 145.779 2.262 -9.117 1.00 0.34 C ATOM 1517 O PRO A 91 144.921 1.434 -8.812 1.00 0.36 O ATOM 1518 CB PRO A 91 147.034 0.780 -10.707 1.00 0.45 C ATOM 1519 CG PRO A 91 148.411 0.798 -10.129 1.00 0.45 C ATOM 1520 CD PRO A 91 148.859 2.261 -10.049 1.00 0.43 C ATOM 0 HA PRO A 91 145.718 2.507 -11.190 1.00 0.39 H new ATOM 0 HB2 PRO A 91 146.413 0.029 -10.219 1.00 0.45 H new ATOM 0 HB3 PRO A 91 147.057 0.533 -11.768 1.00 0.45 H new ATOM 0 HG2 PRO A 91 148.417 0.341 -9.140 1.00 0.45 H new ATOM 0 HG3 PRO A 91 149.095 0.221 -10.751 1.00 0.45 H new ATOM 0 HD2 PRO A 91 149.096 2.548 -9.024 1.00 0.43 H new ATOM 0 HD3 PRO A 91 149.755 2.434 -10.644 1.00 0.43 H new ATOM 1528 N PHE A 92 146.143 3.250 -8.301 1.00 0.28 N ATOM 1529 CA PHE A 92 145.611 3.365 -6.943 1.00 0.24 C ATOM 1530 C PHE A 92 144.621 4.524 -6.842 1.00 0.24 C ATOM 1531 O PHE A 92 144.887 5.613 -7.348 1.00 0.42 O ATOM 1532 CB PHE A 92 146.781 3.591 -5.983 1.00 0.30 C ATOM 1533 CG PHE A 92 146.395 3.611 -4.523 1.00 0.25 C ATOM 1534 CD1 PHE A 92 145.946 2.441 -3.900 1.00 1.14 C ATOM 1535 CD2 PHE A 92 146.504 4.798 -3.791 1.00 1.20 C ATOM 1536 CE1 PHE A 92 145.604 2.461 -2.542 1.00 1.29 C ATOM 1537 CE2 PHE A 92 146.161 4.818 -2.435 1.00 1.15 C ATOM 1538 CZ PHE A 92 145.711 3.649 -1.811 1.00 0.56 C ATOM 0 H PHE A 92 146.805 3.983 -8.556 1.00 0.28 H new ATOM 0 HA PHE A 92 145.080 2.449 -6.683 1.00 0.24 H new ATOM 0 HB2 PHE A 92 147.521 2.806 -6.140 1.00 0.30 H new ATOM 0 HB3 PHE A 92 147.262 4.537 -6.232 1.00 0.30 H new ATOM 0 HD1 PHE A 92 145.863 1.524 -4.465 1.00 1.14 H new ATOM 0 HD2 PHE A 92 146.853 5.699 -4.273 1.00 1.20 H new ATOM 0 HE1 PHE A 92 145.258 1.559 -2.059 1.00 1.29 H new ATOM 0 HE2 PHE A 92 146.243 5.735 -1.870 1.00 1.15 H new ATOM 0 HZ PHE A 92 145.446 3.664 -0.764 1.00 0.56 H new ATOM 1548 N LEU A 93 143.494 4.307 -6.163 1.00 0.17 N ATOM 1549 CA LEU A 93 142.463 5.343 -6.084 1.00 0.15 C ATOM 1550 C LEU A 93 142.654 6.197 -4.835 1.00 0.15 C ATOM 1551 O LEU A 93 142.883 5.672 -3.748 1.00 0.18 O ATOM 1552 CB LEU A 93 141.068 4.714 -6.081 1.00 0.17 C ATOM 1553 CG LEU A 93 140.004 5.815 -6.142 1.00 0.19 C ATOM 1554 CD1 LEU A 93 140.054 6.509 -7.506 1.00 0.19 C ATOM 1555 CD2 LEU A 93 138.621 5.194 -5.938 1.00 0.23 C ATOM 0 H LEU A 93 143.274 3.442 -5.669 1.00 0.17 H new ATOM 0 HA LEU A 93 142.557 5.983 -6.962 1.00 0.15 H new ATOM 0 HB2 LEU A 93 140.960 4.043 -6.933 1.00 0.17 H new ATOM 0 HB3 LEU A 93 140.932 4.113 -5.182 1.00 0.17 H new ATOM 0 HG LEU A 93 140.197 6.548 -5.359 1.00 0.19 H new ATOM 0 HD11 LEU A 93 139.296 7.291 -7.544 1.00 0.19 H new ATOM 0 HD12 LEU A 93 141.039 6.951 -7.653 1.00 0.19 H new ATOM 0 HD13 LEU A 93 139.863 5.779 -8.293 1.00 0.19 H new ATOM 0 HD21 LEU A 93 137.862 5.975 -5.981 1.00 0.23 H new ATOM 0 HD22 LEU A 93 138.432 4.461 -6.722 1.00 0.23 H new ATOM 0 HD23 LEU A 93 138.582 4.703 -4.965 1.00 0.23 H new ATOM 1567 N LEU A 94 142.515 7.512 -4.998 1.00 0.14 N ATOM 1568 CA LEU A 94 142.797 8.452 -3.919 1.00 0.16 C ATOM 1569 C LEU A 94 141.578 9.329 -3.648 1.00 0.15 C ATOM 1570 O LEU A 94 140.896 9.750 -4.577 1.00 0.15 O ATOM 1571 CB LEU A 94 143.975 9.339 -4.329 1.00 0.18 C ATOM 1572 CG LEU A 94 144.435 10.187 -3.140 1.00 0.21 C ATOM 1573 CD1 LEU A 94 145.427 9.386 -2.292 1.00 0.22 C ATOM 1574 CD2 LEU A 94 145.110 11.464 -3.651 1.00 0.26 C ATOM 0 H LEU A 94 142.209 7.949 -5.868 1.00 0.14 H new ATOM 0 HA LEU A 94 143.040 7.896 -3.014 1.00 0.16 H new ATOM 0 HB2 LEU A 94 144.799 8.721 -4.685 1.00 0.18 H new ATOM 0 HB3 LEU A 94 143.682 9.986 -5.156 1.00 0.18 H new ATOM 0 HG LEU A 94 143.572 10.454 -2.530 1.00 0.21 H new ATOM 0 HD11 LEU A 94 145.754 9.991 -1.446 1.00 0.22 H new ATOM 0 HD12 LEU A 94 144.944 8.480 -1.926 1.00 0.22 H new ATOM 0 HD13 LEU A 94 146.290 9.116 -2.900 1.00 0.22 H new ATOM 0 HD21 LEU A 94 145.437 12.067 -2.804 1.00 0.26 H new ATOM 0 HD22 LEU A 94 145.973 11.200 -4.263 1.00 0.26 H new ATOM 0 HD23 LEU A 94 144.401 12.035 -4.251 1.00 0.26 H new ATOM 1586 N TYR A 95 141.300 9.589 -2.375 1.00 0.17 N ATOM 1587 CA TYR A 95 140.207 10.483 -2.013 1.00 0.18 C ATOM 1588 C TYR A 95 140.571 11.303 -0.780 1.00 0.18 C ATOM 1589 O TYR A 95 141.384 10.878 0.044 1.00 0.21 O ATOM 1590 CB TYR A 95 138.932 9.681 -1.746 1.00 0.19 C ATOM 1591 CG TYR A 95 139.034 8.754 -0.559 1.00 0.20 C ATOM 1592 CD1 TYR A 95 139.713 7.537 -0.679 1.00 1.18 C ATOM 1593 CD2 TYR A 95 138.443 9.111 0.658 1.00 1.15 C ATOM 1594 CE1 TYR A 95 139.801 6.674 0.420 1.00 1.23 C ATOM 1595 CE2 TYR A 95 138.531 8.250 1.757 1.00 1.12 C ATOM 1596 CZ TYR A 95 139.210 7.031 1.639 1.00 0.30 C ATOM 1597 OH TYR A 95 139.297 6.181 2.723 1.00 0.36 O ATOM 0 H TYR A 95 141.811 9.198 -1.584 1.00 0.17 H new ATOM 0 HA TYR A 95 140.031 11.163 -2.846 1.00 0.18 H new ATOM 0 HB2 TYR A 95 138.105 10.373 -1.585 1.00 0.19 H new ATOM 0 HB3 TYR A 95 138.689 9.096 -2.633 1.00 0.19 H new ATOM 0 HD1 TYR A 95 140.169 7.263 -1.619 1.00 1.18 H new ATOM 0 HD2 TYR A 95 137.919 10.051 0.749 1.00 1.15 H new ATOM 0 HE1 TYR A 95 140.324 5.734 0.328 1.00 1.23 H new ATOM 0 HE2 TYR A 95 138.075 8.525 2.697 1.00 1.12 H new ATOM 0 HH TYR A 95 139.148 5.258 2.428 1.00 0.36 H new ATOM 1607 N ARG A 96 139.958 12.477 -0.656 1.00 0.19 N ATOM 1608 CA ARG A 96 140.259 13.369 0.464 1.00 0.20 C ATOM 1609 C ARG A 96 139.165 13.287 1.525 1.00 0.27 C ATOM 1610 O ARG A 96 137.992 13.089 1.209 1.00 0.32 O ATOM 1611 CB ARG A 96 140.389 14.817 -0.019 1.00 0.23 C ATOM 1612 CG ARG A 96 141.440 14.906 -1.132 1.00 0.27 C ATOM 1613 CD ARG A 96 141.851 16.364 -1.372 1.00 0.37 C ATOM 1614 NE ARG A 96 140.678 17.217 -1.590 1.00 0.48 N ATOM 1615 CZ ARG A 96 140.073 17.914 -0.618 1.00 1.11 C ATOM 1616 NH1 ARG A 96 140.464 17.871 0.633 1.00 1.56 N ATOM 1617 NH2 ARG A 96 139.051 18.660 -0.932 1.00 1.37 N ATOM 0 H ARG A 96 139.258 12.831 -1.308 1.00 0.19 H new ATOM 0 HA ARG A 96 141.206 13.050 0.900 1.00 0.20 H new ATOM 0 HB2 ARG A 96 139.427 15.174 -0.386 1.00 0.23 H new ATOM 0 HB3 ARG A 96 140.672 15.462 0.812 1.00 0.23 H new ATOM 0 HG2 ARG A 96 142.315 14.316 -0.861 1.00 0.27 H new ATOM 0 HG3 ARG A 96 141.040 14.479 -2.052 1.00 0.27 H new ATOM 0 HD2 ARG A 96 142.416 16.731 -0.515 1.00 0.37 H new ATOM 0 HD3 ARG A 96 142.511 16.421 -2.238 1.00 0.37 H new ATOM 0 HE ARG A 96 140.301 17.284 -2.535 1.00 0.48 H new ATOM 0 HH11 ARG A 96 141.259 17.290 0.899 1.00 1.56 H new ATOM 0 HH12 ARG A 96 139.973 18.419 1.340 1.00 1.56 H new ATOM 0 HH21 ARG A 96 138.729 18.703 -1.899 1.00 1.37 H new ATOM 0 HH22 ARG A 96 138.573 19.200 -0.211 1.00 1.37 H new ATOM 1631 N ASN A 97 139.560 13.444 2.787 1.00 0.29 N ATOM 1632 CA ASN A 97 138.622 13.338 3.901 1.00 0.39 C ATOM 1633 C ASN A 97 138.737 14.532 4.847 1.00 0.41 C ATOM 1634 O ASN A 97 139.700 15.302 4.804 1.00 0.36 O ATOM 1635 CB ASN A 97 138.895 12.048 4.679 1.00 0.44 C ATOM 1636 CG ASN A 97 137.677 11.671 5.513 1.00 0.88 C ATOM 1637 OD1 ASN A 97 136.630 11.329 4.964 1.00 1.54 O ATOM 1638 ND2 ASN A 97 137.750 11.714 6.816 1.00 1.66 N ATOM 0 H ASN A 97 140.521 13.645 3.063 1.00 0.29 H new ATOM 0 HA ASN A 97 137.612 13.325 3.490 1.00 0.39 H new ATOM 0 HB2 ASN A 97 139.135 11.241 3.987 1.00 0.44 H new ATOM 0 HB3 ASN A 97 139.762 12.181 5.327 1.00 0.44 H new ATOM 0 HD21 ASN A 97 136.938 11.464 7.381 1.00 1.66 H new ATOM 0 HD22 ASN A 97 138.619 11.998 7.269 1.00 1.66 H new ATOM 1645 N GLU A 98 137.766 14.644 5.752 1.00 0.51 N ATOM 1646 CA GLU A 98 137.696 15.768 6.686 1.00 0.56 C ATOM 1647 C GLU A 98 139.043 16.053 7.350 1.00 0.49 C ATOM 1648 O GLU A 98 139.832 15.143 7.604 1.00 0.46 O ATOM 1649 CB GLU A 98 136.653 15.477 7.765 1.00 0.67 C ATOM 1650 CG GLU A 98 135.272 15.325 7.117 1.00 1.29 C ATOM 1651 CD GLU A 98 134.183 15.130 8.174 1.00 1.68 C ATOM 1652 OE1 GLU A 98 134.499 14.704 9.274 1.00 1.70 O ATOM 1653 OE2 GLU A 98 133.038 15.415 7.864 1.00 2.32 O ATOM 0 H GLU A 98 137.012 13.965 5.859 1.00 0.51 H new ATOM 0 HA GLU A 98 137.414 16.651 6.112 1.00 0.56 H new ATOM 0 HB2 GLU A 98 136.916 14.566 8.303 1.00 0.67 H new ATOM 0 HB3 GLU A 98 136.636 16.285 8.496 1.00 0.67 H new ATOM 0 HG2 GLU A 98 135.048 16.209 6.520 1.00 1.29 H new ATOM 0 HG3 GLU A 98 135.278 14.474 6.436 1.00 1.29 H new ATOM 1660 N ARG A 99 139.288 17.334 7.604 1.00 0.50 N ATOM 1661 CA ARG A 99 140.521 17.786 8.243 1.00 0.45 C ATOM 1662 C ARG A 99 141.754 17.495 7.387 1.00 0.37 C ATOM 1663 O ARG A 99 142.843 17.271 7.918 1.00 0.34 O ATOM 1664 CB ARG A 99 140.679 17.126 9.616 1.00 0.48 C ATOM 1665 CG ARG A 99 139.462 17.450 10.486 1.00 1.14 C ATOM 1666 CD ARG A 99 139.637 16.815 11.867 1.00 1.29 C ATOM 1667 NE ARG A 99 140.705 17.495 12.606 1.00 2.13 N ATOM 1668 CZ ARG A 99 140.918 17.327 13.920 1.00 2.48 C ATOM 1669 NH1 ARG A 99 140.177 16.532 14.653 1.00 2.28 N ATOM 1670 NH2 ARG A 99 141.895 17.980 14.488 1.00 3.51 N ATOM 0 H ARG A 99 138.640 18.087 7.374 1.00 0.50 H new ATOM 0 HA ARG A 99 140.445 18.867 8.360 1.00 0.45 H new ATOM 0 HB2 ARG A 99 140.780 16.047 9.502 1.00 0.48 H new ATOM 0 HB3 ARG A 99 141.589 17.482 10.099 1.00 0.48 H new ATOM 0 HG2 ARG A 99 139.348 18.530 10.583 1.00 1.14 H new ATOM 0 HG3 ARG A 99 138.554 17.075 10.014 1.00 1.14 H new ATOM 0 HD2 ARG A 99 138.703 16.877 12.425 1.00 1.29 H new ATOM 0 HD3 ARG A 99 139.875 15.757 11.761 1.00 1.29 H new ATOM 0 HE ARG A 99 141.318 18.129 12.094 1.00 2.13 H new ATOM 0 HH11 ARG A 99 139.408 16.015 14.227 1.00 2.28 H new ATOM 0 HH12 ARG A 99 140.370 16.430 15.649 1.00 2.28 H new ATOM 0 HH21 ARG A 99 142.481 18.605 13.934 1.00 3.51 H new ATOM 0 HH22 ARG A 99 142.073 17.866 15.486 1.00 3.51 H new ATOM 1684 N SER A 100 141.593 17.503 6.063 1.00 0.36 N ATOM 1685 CA SER A 100 142.745 17.515 5.160 1.00 0.31 C ATOM 1686 C SER A 100 143.561 16.228 5.275 1.00 0.26 C ATOM 1687 O SER A 100 144.787 16.242 5.153 1.00 0.26 O ATOM 1688 CB SER A 100 143.639 18.726 5.447 1.00 0.35 C ATOM 1689 OG SER A 100 142.842 19.902 5.452 1.00 1.30 O ATOM 0 H SER A 100 140.686 17.501 5.596 1.00 0.36 H new ATOM 0 HA SER A 100 142.362 17.585 4.142 1.00 0.31 H new ATOM 0 HB2 SER A 100 144.138 18.606 6.409 1.00 0.35 H new ATOM 0 HB3 SER A 100 144.420 18.804 4.691 1.00 0.35 H new ATOM 0 HG SER A 100 143.408 20.680 5.637 1.00 1.30 H new ATOM 1695 N ARG A 101 142.876 15.112 5.503 1.00 0.26 N ATOM 1696 CA ARG A 101 143.550 13.825 5.616 1.00 0.27 C ATOM 1697 C ARG A 101 143.457 13.089 4.285 1.00 0.24 C ATOM 1698 O ARG A 101 142.509 13.297 3.530 1.00 0.23 O ATOM 1699 CB ARG A 101 142.902 12.988 6.721 1.00 0.35 C ATOM 1700 CG ARG A 101 143.041 13.717 8.059 1.00 0.42 C ATOM 1701 CD ARG A 101 142.419 12.871 9.171 1.00 0.84 C ATOM 1702 NE ARG A 101 143.230 11.675 9.413 1.00 1.36 N ATOM 1703 CZ ARG A 101 143.255 11.023 10.585 1.00 1.88 C ATOM 1704 NH1 ARG A 101 142.549 11.414 11.620 1.00 2.24 N ATOM 1705 NH2 ARG A 101 144.008 9.963 10.702 1.00 2.68 N ATOM 0 H ARG A 101 141.863 15.073 5.612 1.00 0.26 H new ATOM 0 HA ARG A 101 144.598 13.987 5.869 1.00 0.27 H new ATOM 0 HB2 ARG A 101 141.849 12.819 6.494 1.00 0.35 H new ATOM 0 HB3 ARG A 101 143.377 12.009 6.777 1.00 0.35 H new ATOM 0 HG2 ARG A 101 144.093 13.904 8.275 1.00 0.42 H new ATOM 0 HG3 ARG A 101 142.549 14.688 8.008 1.00 0.42 H new ATOM 0 HD2 ARG A 101 142.344 13.459 10.086 1.00 0.84 H new ATOM 0 HD3 ARG A 101 141.405 12.582 8.894 1.00 0.84 H new ATOM 0 HE ARG A 101 143.806 11.319 8.650 1.00 1.36 H new ATOM 0 HH11 ARG A 101 141.955 12.240 11.549 1.00 2.24 H new ATOM 0 HH12 ARG A 101 142.594 10.892 12.495 1.00 2.24 H new ATOM 0 HH21 ARG A 101 144.565 9.643 9.910 1.00 2.68 H new ATOM 0 HH22 ARG A 101 144.039 9.455 11.586 1.00 2.68 H new ATOM 1719 N ILE A 102 144.430 12.229 3.994 1.00 0.23 N ATOM 1720 CA ILE A 102 144.461 11.531 2.711 1.00 0.20 C ATOM 1721 C ILE A 102 144.332 10.028 2.930 1.00 0.20 C ATOM 1722 O ILE A 102 145.079 9.431 3.705 1.00 0.20 O ATOM 1723 CB ILE A 102 145.765 11.864 1.971 1.00 0.19 C ATOM 1724 CG1 ILE A 102 145.845 13.382 1.756 1.00 0.21 C ATOM 1725 CG2 ILE A 102 145.797 11.153 0.612 1.00 0.17 C ATOM 1726 CD1 ILE A 102 147.173 13.768 1.095 1.00 0.21 C ATOM 0 H ILE A 102 145.200 12.000 4.622 1.00 0.23 H new ATOM 0 HA ILE A 102 143.621 11.861 2.100 1.00 0.20 H new ATOM 0 HB ILE A 102 146.614 11.527 2.566 1.00 0.19 H new ATOM 0 HG12 ILE A 102 145.014 13.710 1.132 1.00 0.21 H new ATOM 0 HG13 ILE A 102 145.747 13.895 2.713 1.00 0.21 H new ATOM 0 HG21 ILE A 102 146.726 11.396 0.096 1.00 0.17 H new ATOM 0 HG22 ILE A 102 145.738 10.075 0.764 1.00 0.17 H new ATOM 0 HG23 ILE A 102 144.950 11.482 0.009 1.00 0.17 H new ATOM 0 HD11 ILE A 102 147.208 14.848 0.952 1.00 0.21 H new ATOM 0 HD12 ILE A 102 148.001 13.459 1.734 1.00 0.21 H new ATOM 0 HD13 ILE A 102 147.256 13.271 0.128 1.00 0.21 H new ATOM 1738 N ARG A 103 143.378 9.425 2.231 1.00 0.20 N ATOM 1739 CA ARG A 103 143.157 7.989 2.325 1.00 0.20 C ATOM 1740 C ARG A 103 142.888 7.424 0.936 1.00 0.20 C ATOM 1741 O ARG A 103 142.376 8.126 0.066 1.00 0.22 O ATOM 1742 CB ARG A 103 141.974 7.702 3.252 1.00 0.25 C ATOM 1743 CG ARG A 103 142.344 8.096 4.684 1.00 0.28 C ATOM 1744 CD ARG A 103 141.216 7.693 5.636 1.00 0.65 C ATOM 1745 NE ARG A 103 141.482 8.204 6.984 1.00 0.94 N ATOM 1746 CZ ARG A 103 141.087 9.413 7.410 1.00 1.32 C ATOM 1747 NH1 ARG A 103 140.441 10.253 6.636 1.00 1.73 N ATOM 1748 NH2 ARG A 103 141.358 9.768 8.636 1.00 1.75 N ATOM 0 H ARG A 103 142.746 9.909 1.593 1.00 0.20 H new ATOM 0 HA ARG A 103 144.046 7.512 2.738 1.00 0.20 H new ATOM 0 HB2 ARG A 103 141.097 8.260 2.924 1.00 0.25 H new ATOM 0 HB3 ARG A 103 141.713 6.645 3.210 1.00 0.25 H new ATOM 0 HG2 ARG A 103 143.273 7.607 4.978 1.00 0.28 H new ATOM 0 HG3 ARG A 103 142.517 9.171 4.743 1.00 0.28 H new ATOM 0 HD2 ARG A 103 140.266 8.085 5.272 1.00 0.65 H new ATOM 0 HD3 ARG A 103 141.124 6.607 5.663 1.00 0.65 H new ATOM 0 HE ARG A 103 141.995 7.608 7.633 1.00 0.94 H new ATOM 0 HH11 ARG A 103 140.223 9.995 5.674 1.00 1.73 H new ATOM 0 HH12 ARG A 103 140.157 11.164 6.997 1.00 1.73 H new ATOM 0 HH21 ARG A 103 141.862 9.130 9.252 1.00 1.75 H new ATOM 0 HH22 ARG A 103 141.066 10.683 8.978 1.00 1.75 H new ATOM 1762 N GLY A 104 143.257 6.165 0.723 1.00 0.19 N ATOM 1763 CA GLY A 104 143.105 5.555 -0.593 1.00 0.20 C ATOM 1764 C GLY A 104 142.717 4.083 -0.494 1.00 0.18 C ATOM 1765 O GLY A 104 142.782 3.476 0.575 1.00 0.17 O ATOM 0 H GLY A 104 143.658 5.554 1.434 1.00 0.19 H new ATOM 0 HA2 GLY A 104 142.344 6.094 -1.158 1.00 0.20 H new ATOM 0 HA3 GLY A 104 144.039 5.648 -1.147 1.00 0.20 H new ATOM 1769 N PHE A 105 142.334 3.519 -1.635 1.00 0.19 N ATOM 1770 CA PHE A 105 141.935 2.117 -1.709 1.00 0.18 C ATOM 1771 C PHE A 105 142.757 1.389 -2.767 1.00 0.15 C ATOM 1772 O PHE A 105 142.966 1.904 -3.870 1.00 0.18 O ATOM 1773 CB PHE A 105 140.452 2.010 -2.066 1.00 0.22 C ATOM 1774 CG PHE A 105 139.520 2.334 -0.922 1.00 0.29 C ATOM 1775 CD1 PHE A 105 139.105 3.653 -0.710 1.00 1.06 C ATOM 1776 CD2 PHE A 105 139.064 1.313 -0.080 1.00 1.36 C ATOM 1777 CE1 PHE A 105 138.235 3.952 0.346 1.00 1.02 C ATOM 1778 CE2 PHE A 105 138.195 1.611 0.976 1.00 1.45 C ATOM 1779 CZ PHE A 105 137.780 2.931 1.188 1.00 0.51 C ATOM 0 H PHE A 105 142.291 4.014 -2.526 1.00 0.19 H new ATOM 0 HA PHE A 105 142.110 1.658 -0.736 1.00 0.18 H new ATOM 0 HB2 PHE A 105 140.239 2.683 -2.896 1.00 0.22 H new ATOM 0 HB3 PHE A 105 140.245 0.998 -2.415 1.00 0.22 H new ATOM 0 HD1 PHE A 105 139.455 4.441 -1.361 1.00 1.06 H new ATOM 0 HD2 PHE A 105 139.383 0.294 -0.245 1.00 1.36 H new ATOM 0 HE1 PHE A 105 137.915 4.970 0.511 1.00 1.02 H new ATOM 0 HE2 PHE A 105 137.845 0.823 1.627 1.00 1.45 H new ATOM 0 HZ PHE A 105 137.108 3.162 2.002 1.00 0.51 H new ATOM 1789 N TRP A 106 143.235 0.199 -2.417 1.00 0.13 N ATOM 1790 CA TRP A 106 143.989 -0.627 -3.353 1.00 0.12 C ATOM 1791 C TRP A 106 143.141 -1.811 -3.799 1.00 0.11 C ATOM 1792 O TRP A 106 142.555 -2.503 -2.967 1.00 0.13 O ATOM 1793 CB TRP A 106 145.264 -1.142 -2.684 1.00 0.16 C ATOM 1794 CG TRP A 106 146.269 -1.681 -3.654 1.00 0.24 C ATOM 1795 CD1 TRP A 106 147.235 -0.952 -4.257 1.00 0.44 C ATOM 1796 CD2 TRP A 106 146.422 -3.046 -4.140 1.00 0.36 C ATOM 1797 NE1 TRP A 106 147.971 -1.781 -5.082 1.00 0.49 N ATOM 1798 CE2 TRP A 106 147.509 -3.082 -5.045 1.00 0.43 C ATOM 1799 CE3 TRP A 106 145.730 -4.244 -3.887 1.00 0.58 C ATOM 1800 CZ2 TRP A 106 147.896 -4.267 -5.677 1.00 0.57 C ATOM 1801 CZ3 TRP A 106 146.116 -5.434 -4.520 1.00 0.78 C ATOM 1802 CH2 TRP A 106 147.195 -5.448 -5.412 1.00 0.74 C ATOM 0 H TRP A 106 143.114 -0.215 -1.493 1.00 0.13 H new ATOM 0 HA TRP A 106 144.254 -0.023 -4.221 1.00 0.12 H new ATOM 0 HB2 TRP A 106 145.719 -0.332 -2.114 1.00 0.16 H new ATOM 0 HB3 TRP A 106 145.001 -1.925 -1.972 1.00 0.16 H new ATOM 0 HD1 TRP A 106 147.404 0.105 -4.117 1.00 0.44 H new ATOM 0 HE1 TRP A 106 148.760 -1.470 -5.649 1.00 0.49 H new ATOM 0 HE3 TRP A 106 144.896 -4.247 -3.201 1.00 0.58 H new ATOM 0 HZ2 TRP A 106 148.729 -4.271 -6.364 1.00 0.57 H new ATOM 0 HZ3 TRP A 106 145.576 -6.347 -4.318 1.00 0.78 H new ATOM 0 HH2 TRP A 106 147.486 -6.369 -5.895 1.00 0.74 H new ATOM 1813 N PHE A 107 143.077 -2.040 -5.107 1.00 0.11 N ATOM 1814 CA PHE A 107 142.284 -3.139 -5.653 1.00 0.11 C ATOM 1815 C PHE A 107 143.180 -4.142 -6.371 1.00 0.12 C ATOM 1816 O PHE A 107 144.221 -3.778 -6.919 1.00 0.13 O ATOM 1817 CB PHE A 107 141.251 -2.599 -6.641 1.00 0.13 C ATOM 1818 CG PHE A 107 140.203 -1.720 -6.002 1.00 0.12 C ATOM 1819 CD1 PHE A 107 140.566 -0.494 -5.433 1.00 1.14 C ATOM 1820 CD2 PHE A 107 138.864 -2.131 -5.981 1.00 1.18 C ATOM 1821 CE1 PHE A 107 139.593 0.321 -4.845 1.00 1.14 C ATOM 1822 CE2 PHE A 107 137.891 -1.316 -5.392 1.00 1.18 C ATOM 1823 CZ PHE A 107 138.255 -0.090 -4.824 1.00 0.15 C ATOM 0 H PHE A 107 143.563 -1.481 -5.808 1.00 0.11 H new ATOM 0 HA PHE A 107 141.779 -3.637 -4.826 1.00 0.11 H new ATOM 0 HB2 PHE A 107 141.765 -2.031 -7.417 1.00 0.13 H new ATOM 0 HB3 PHE A 107 140.759 -3.438 -7.133 1.00 0.13 H new ATOM 0 HD1 PHE A 107 141.598 -0.177 -5.448 1.00 1.14 H new ATOM 0 HD2 PHE A 107 138.583 -3.077 -6.419 1.00 1.18 H new ATOM 0 HE1 PHE A 107 139.874 1.267 -4.407 1.00 1.14 H new ATOM 0 HE2 PHE A 107 136.859 -1.633 -5.376 1.00 1.18 H new ATOM 0 HZ PHE A 107 137.504 0.539 -4.370 1.00 0.15 H new ATOM 1833 N TYR A 108 142.768 -5.406 -6.363 1.00 0.11 N ATOM 1834 CA TYR A 108 143.502 -6.453 -7.071 1.00 0.13 C ATOM 1835 C TYR A 108 143.746 -6.074 -8.533 1.00 0.13 C ATOM 1836 O TYR A 108 144.806 -6.363 -9.087 1.00 0.15 O ATOM 1837 CB TYR A 108 142.718 -7.766 -7.012 1.00 0.14 C ATOM 1838 CG TYR A 108 143.414 -8.916 -7.701 1.00 0.16 C ATOM 1839 CD1 TYR A 108 143.181 -9.161 -9.060 1.00 1.14 C ATOM 1840 CD2 TYR A 108 144.292 -9.735 -6.982 1.00 1.20 C ATOM 1841 CE1 TYR A 108 143.826 -10.226 -9.699 1.00 1.14 C ATOM 1842 CE2 TYR A 108 144.938 -10.800 -7.622 1.00 1.21 C ATOM 1843 CZ TYR A 108 144.705 -11.045 -8.981 1.00 0.23 C ATOM 1844 OH TYR A 108 145.341 -12.095 -9.611 1.00 0.27 O ATOM 0 H TYR A 108 141.933 -5.731 -5.876 1.00 0.11 H new ATOM 0 HA TYR A 108 144.469 -6.573 -6.582 1.00 0.13 H new ATOM 0 HB2 TYR A 108 142.544 -8.030 -5.969 1.00 0.14 H new ATOM 0 HB3 TYR A 108 141.740 -7.617 -7.470 1.00 0.14 H new ATOM 0 HD1 TYR A 108 142.504 -8.528 -9.615 1.00 1.14 H new ATOM 0 HD2 TYR A 108 144.471 -9.546 -5.934 1.00 1.20 H new ATOM 0 HE1 TYR A 108 143.645 -10.416 -10.747 1.00 1.14 H new ATOM 0 HE2 TYR A 108 145.616 -11.432 -7.068 1.00 1.21 H new ATOM 0 HH TYR A 108 145.917 -12.561 -8.969 1.00 0.27 H new ATOM 1854 N ASN A 109 142.761 -5.425 -9.150 1.00 0.12 N ATOM 1855 CA ASN A 109 142.879 -5.011 -10.547 1.00 0.13 C ATOM 1856 C ASN A 109 142.479 -3.546 -10.707 1.00 0.13 C ATOM 1857 O ASN A 109 141.470 -3.105 -10.157 1.00 0.13 O ATOM 1858 CB ASN A 109 141.987 -5.892 -11.426 1.00 0.14 C ATOM 1859 CG ASN A 109 142.352 -5.708 -12.895 1.00 0.18 C ATOM 1860 OD1 ASN A 109 142.657 -4.596 -13.324 1.00 0.15 O ATOM 1861 ND2 ASN A 109 142.332 -6.735 -13.700 1.00 0.33 N ATOM 0 H ASN A 109 141.876 -5.175 -8.708 1.00 0.12 H new ATOM 0 HA ASN A 109 143.918 -5.124 -10.858 1.00 0.13 H new ATOM 0 HB2 ASN A 109 142.104 -6.938 -11.143 1.00 0.14 H new ATOM 0 HB3 ASN A 109 140.940 -5.634 -11.269 1.00 0.14 H new ATOM 0 HD21 ASN A 109 142.569 -6.616 -14.685 1.00 0.33 H new ATOM 0 HD22 ASN A 109 142.079 -7.657 -13.344 1.00 0.33 H new ATOM 1868 N SER A 110 143.277 -2.797 -11.463 1.00 0.15 N ATOM 1869 CA SER A 110 143.027 -1.371 -11.656 1.00 0.16 C ATOM 1870 C SER A 110 141.684 -1.137 -12.342 1.00 0.16 C ATOM 1871 O SER A 110 140.938 -0.231 -11.971 1.00 0.16 O ATOM 1872 CB SER A 110 144.144 -0.755 -12.498 1.00 0.19 C ATOM 1873 OG SER A 110 144.012 0.660 -12.486 1.00 1.38 O ATOM 0 H SER A 110 144.100 -3.152 -11.951 1.00 0.15 H new ATOM 0 HA SER A 110 143.002 -0.896 -10.675 1.00 0.16 H new ATOM 0 HB2 SER A 110 145.117 -1.045 -12.101 1.00 0.19 H new ATOM 0 HB3 SER A 110 144.093 -1.128 -13.521 1.00 0.19 H new ATOM 0 HG SER A 110 144.727 1.060 -13.024 1.00 1.38 H new ATOM 1879 N GLU A 111 141.385 -1.954 -13.346 1.00 0.17 N ATOM 1880 CA GLU A 111 140.124 -1.837 -14.072 1.00 0.18 C ATOM 1881 C GLU A 111 138.949 -2.031 -13.117 1.00 0.15 C ATOM 1882 O GLU A 111 137.969 -1.286 -13.145 1.00 0.15 O ATOM 1883 CB GLU A 111 140.062 -2.895 -15.177 1.00 0.21 C ATOM 1884 CG GLU A 111 141.249 -2.717 -16.130 1.00 0.25 C ATOM 1885 CD GLU A 111 141.161 -1.383 -16.873 1.00 0.66 C ATOM 1886 OE1 GLU A 111 140.064 -0.870 -17.027 1.00 0.97 O ATOM 1887 OE2 GLU A 111 142.202 -0.891 -17.278 1.00 0.76 O ATOM 0 H GLU A 111 141.995 -2.702 -13.675 1.00 0.17 H new ATOM 0 HA GLU A 111 140.065 -0.843 -14.516 1.00 0.18 H new ATOM 0 HB2 GLU A 111 140.081 -3.893 -14.739 1.00 0.21 H new ATOM 0 HB3 GLU A 111 139.125 -2.806 -15.727 1.00 0.21 H new ATOM 0 HG2 GLU A 111 142.181 -2.763 -15.567 1.00 0.25 H new ATOM 0 HG3 GLU A 111 141.269 -3.537 -16.848 1.00 0.25 H new ATOM 1894 N GLU A 112 139.071 -3.032 -12.251 1.00 0.14 N ATOM 1895 CA GLU A 112 138.045 -3.316 -11.253 1.00 0.13 C ATOM 1896 C GLU A 112 137.792 -2.077 -10.397 1.00 0.12 C ATOM 1897 O GLU A 112 136.649 -1.689 -10.150 1.00 0.12 O ATOM 1898 CB GLU A 112 138.532 -4.472 -10.379 1.00 0.14 C ATOM 1899 CG GLU A 112 137.415 -4.969 -9.460 1.00 0.13 C ATOM 1900 CD GLU A 112 137.969 -6.024 -8.504 1.00 0.14 C ATOM 1901 OE1 GLU A 112 139.113 -5.893 -8.100 1.00 0.14 O ATOM 1902 OE2 GLU A 112 137.249 -6.958 -8.195 1.00 0.14 O ATOM 0 H GLU A 112 139.873 -3.662 -12.220 1.00 0.14 H new ATOM 0 HA GLU A 112 137.110 -3.589 -11.743 1.00 0.13 H new ATOM 0 HB2 GLU A 112 138.880 -5.289 -11.011 1.00 0.14 H new ATOM 0 HB3 GLU A 112 139.383 -4.147 -9.781 1.00 0.14 H new ATOM 0 HG2 GLU A 112 136.997 -4.136 -8.895 1.00 0.13 H new ATOM 0 HG3 GLU A 112 136.603 -5.391 -10.053 1.00 0.13 H new ATOM 1909 N CYS A 113 138.879 -1.436 -9.984 1.00 0.12 N ATOM 1910 CA CYS A 113 138.778 -0.208 -9.204 1.00 0.13 C ATOM 1911 C CYS A 113 138.030 0.869 -9.986 1.00 0.12 C ATOM 1912 O CYS A 113 137.234 1.613 -9.418 1.00 0.13 O ATOM 1913 CB CYS A 113 140.175 0.304 -8.850 1.00 0.16 C ATOM 1914 SG CYS A 113 140.031 1.689 -7.694 1.00 0.24 S ATOM 0 H CYS A 113 139.833 -1.743 -10.174 1.00 0.12 H new ATOM 0 HA CYS A 113 138.226 -0.430 -8.291 1.00 0.13 H new ATOM 0 HB2 CYS A 113 140.766 -0.496 -8.404 1.00 0.16 H new ATOM 0 HB3 CYS A 113 140.698 0.622 -9.752 1.00 0.16 H new ATOM 0 HG CYS A 113 140.129 1.249 -6.475 1.00 0.24 H new ATOM 1920 N ASP A 114 138.273 0.937 -11.291 1.00 0.13 N ATOM 1921 CA ASP A 114 137.654 1.964 -12.119 1.00 0.15 C ATOM 1922 C ASP A 114 136.134 1.863 -12.049 1.00 0.13 C ATOM 1923 O ASP A 114 135.443 2.861 -11.856 1.00 0.14 O ATOM 1924 CB ASP A 114 138.112 1.814 -13.570 1.00 0.18 C ATOM 1925 CG ASP A 114 137.694 3.035 -14.383 1.00 1.08 C ATOM 1926 OD1 ASP A 114 137.699 4.122 -13.831 1.00 1.63 O ATOM 1927 OD2 ASP A 114 137.375 2.864 -15.548 1.00 1.53 O ATOM 0 H ASP A 114 138.889 0.298 -11.794 1.00 0.13 H new ATOM 0 HA ASP A 114 137.960 2.940 -11.743 1.00 0.15 H new ATOM 0 HB2 ASP A 114 139.195 1.697 -13.607 1.00 0.18 H new ATOM 0 HB3 ASP A 114 137.679 0.913 -14.004 1.00 0.18 H new ATOM 1932 N ARG A 115 135.620 0.645 -12.181 1.00 0.12 N ATOM 1933 CA ARG A 115 134.177 0.436 -12.177 1.00 0.13 C ATOM 1934 C ARG A 115 133.567 0.928 -10.868 1.00 0.12 C ATOM 1935 O ARG A 115 132.605 1.700 -10.863 1.00 0.12 O ATOM 1936 CB ARG A 115 133.864 -1.051 -12.363 1.00 0.16 C ATOM 1937 CG ARG A 115 134.385 -1.515 -13.725 1.00 1.25 C ATOM 1938 CD ARG A 115 134.054 -2.995 -13.923 1.00 1.30 C ATOM 1939 NE ARG A 115 132.610 -3.170 -14.106 1.00 1.94 N ATOM 1940 CZ ARG A 115 131.989 -4.355 -13.997 1.00 2.36 C ATOM 1941 NH1 ARG A 115 132.635 -5.460 -13.714 1.00 2.29 N ATOM 1942 NH2 ARG A 115 130.698 -4.409 -14.181 1.00 3.38 N ATOM 0 H ARG A 115 136.174 -0.204 -12.291 1.00 0.12 H new ATOM 0 HA ARG A 115 133.744 1.004 -13.001 1.00 0.13 H new ATOM 0 HB2 ARG A 115 134.327 -1.634 -11.567 1.00 0.16 H new ATOM 0 HB3 ARG A 115 132.789 -1.219 -12.296 1.00 0.16 H new ATOM 0 HG2 ARG A 115 133.934 -0.921 -14.520 1.00 1.25 H new ATOM 0 HG3 ARG A 115 135.462 -1.362 -13.785 1.00 1.25 H new ATOM 0 HD2 ARG A 115 134.588 -3.382 -14.791 1.00 1.30 H new ATOM 0 HD3 ARG A 115 134.391 -3.569 -13.060 1.00 1.30 H new ATOM 0 HE ARG A 115 132.048 -2.348 -14.328 1.00 1.94 H new ATOM 0 HH11 ARG A 115 133.644 -5.438 -13.568 1.00 2.29 H new ATOM 0 HH12 ARG A 115 132.128 -6.342 -13.639 1.00 2.29 H new ATOM 0 HH21 ARG A 115 130.179 -3.560 -14.403 1.00 3.38 H new ATOM 0 HH22 ARG A 115 130.208 -5.300 -14.102 1.00 3.38 H new ATOM 1956 N ILE A 116 134.161 0.512 -9.753 1.00 0.11 N ATOM 1957 CA ILE A 116 133.639 0.894 -8.442 1.00 0.11 C ATOM 1958 C ILE A 116 133.615 2.418 -8.313 1.00 0.12 C ATOM 1959 O ILE A 116 132.620 3.012 -7.890 1.00 0.13 O ATOM 1960 CB ILE A 116 134.501 0.296 -7.321 1.00 0.12 C ATOM 1961 CG1 ILE A 116 134.655 -1.230 -7.489 1.00 0.13 C ATOM 1962 CG2 ILE A 116 133.881 0.629 -5.958 1.00 0.12 C ATOM 1963 CD1 ILE A 116 133.330 -1.982 -7.280 1.00 0.11 C ATOM 0 H ILE A 116 134.991 -0.080 -9.728 1.00 0.11 H new ATOM 0 HA ILE A 116 132.625 0.506 -8.350 1.00 0.11 H new ATOM 0 HB ILE A 116 135.497 0.736 -7.378 1.00 0.12 H new ATOM 0 HG12 ILE A 116 135.038 -1.446 -8.486 1.00 0.13 H new ATOM 0 HG13 ILE A 116 135.394 -1.598 -6.777 1.00 0.13 H new ATOM 0 HG21 ILE A 116 134.495 0.203 -5.165 1.00 0.12 H new ATOM 0 HG22 ILE A 116 133.830 1.711 -5.836 1.00 0.12 H new ATOM 0 HG23 ILE A 116 132.876 0.210 -5.903 1.00 0.12 H new ATOM 0 HD11 ILE A 116 133.494 -3.052 -7.410 1.00 0.11 H new ATOM 0 HD12 ILE A 116 132.958 -1.791 -6.273 1.00 0.11 H new ATOM 0 HD13 ILE A 116 132.597 -1.637 -8.009 1.00 0.11 H new ATOM 1975 N SER A 117 134.717 3.052 -8.699 1.00 0.13 N ATOM 1976 CA SER A 117 134.840 4.500 -8.581 1.00 0.15 C ATOM 1977 C SER A 117 133.736 5.200 -9.366 1.00 0.16 C ATOM 1978 O SER A 117 133.155 6.177 -8.899 1.00 0.17 O ATOM 1979 CB SER A 117 136.205 4.951 -9.103 1.00 0.17 C ATOM 1980 OG SER A 117 137.224 4.233 -8.423 1.00 0.76 O ATOM 0 H SER A 117 135.535 2.588 -9.095 1.00 0.13 H new ATOM 0 HA SER A 117 134.746 4.769 -7.529 1.00 0.15 H new ATOM 0 HB2 SER A 117 136.274 4.775 -10.177 1.00 0.17 H new ATOM 0 HB3 SER A 117 136.332 6.022 -8.947 1.00 0.17 H new ATOM 0 HG SER A 117 137.324 3.346 -8.827 1.00 0.76 H new ATOM 1986 N GLY A 118 133.437 4.686 -10.554 1.00 0.15 N ATOM 1987 CA GLY A 118 132.408 5.283 -11.397 1.00 0.16 C ATOM 1988 C GLY A 118 131.077 5.349 -10.657 1.00 0.16 C ATOM 1989 O GLY A 118 130.378 6.360 -10.695 1.00 0.18 O ATOM 0 H GLY A 118 133.889 3.863 -10.953 1.00 0.15 H new ATOM 0 HA2 GLY A 118 132.713 6.285 -11.697 1.00 0.16 H new ATOM 0 HA3 GLY A 118 132.294 4.698 -12.310 1.00 0.16 H new ATOM 1993 N LEU A 119 130.751 4.273 -9.950 1.00 0.14 N ATOM 1994 CA LEU A 119 129.498 4.218 -9.201 1.00 0.14 C ATOM 1995 C LEU A 119 129.429 5.366 -8.203 1.00 0.16 C ATOM 1996 O LEU A 119 128.447 6.104 -8.141 1.00 0.18 O ATOM 1997 CB LEU A 119 129.390 2.903 -8.427 1.00 0.13 C ATOM 1998 CG LEU A 119 129.509 1.704 -9.370 1.00 0.12 C ATOM 1999 CD1 LEU A 119 129.925 0.477 -8.557 1.00 0.11 C ATOM 2000 CD2 LEU A 119 128.156 1.435 -10.033 1.00 0.13 C ATOM 0 H LEU A 119 131.328 3.435 -9.879 1.00 0.14 H new ATOM 0 HA LEU A 119 128.679 4.293 -9.917 1.00 0.14 H new ATOM 0 HB2 LEU A 119 130.174 2.856 -7.671 1.00 0.13 H new ATOM 0 HB3 LEU A 119 128.437 2.863 -7.900 1.00 0.13 H new ATOM 0 HG LEU A 119 130.252 1.913 -10.140 1.00 0.12 H new ATOM 0 HD11 LEU A 119 130.013 -0.385 -9.218 1.00 0.11 H new ATOM 0 HD12 LEU A 119 130.886 0.667 -8.078 1.00 0.11 H new ATOM 0 HD13 LEU A 119 129.173 0.274 -7.795 1.00 0.11 H new ATOM 0 HD21 LEU A 119 128.243 0.581 -10.704 1.00 0.13 H new ATOM 0 HD22 LEU A 119 127.412 1.220 -9.266 1.00 0.13 H new ATOM 0 HD23 LEU A 119 127.848 2.313 -10.601 1.00 0.13 H new ATOM 2012 N VAL A 120 130.495 5.515 -7.428 1.00 0.16 N ATOM 2013 CA VAL A 120 130.534 6.545 -6.394 1.00 0.18 C ATOM 2014 C VAL A 120 130.331 7.925 -7.019 1.00 0.21 C ATOM 2015 O VAL A 120 129.568 8.744 -6.508 1.00 0.23 O ATOM 2016 CB VAL A 120 131.870 6.488 -5.642 1.00 0.18 C ATOM 2017 CG1 VAL A 120 131.891 7.532 -4.521 1.00 0.21 C ATOM 2018 CG2 VAL A 120 132.046 5.097 -5.026 1.00 0.17 C ATOM 0 H VAL A 120 131.337 4.943 -7.493 1.00 0.16 H new ATOM 0 HA VAL A 120 129.728 6.363 -5.683 1.00 0.18 H new ATOM 0 HB VAL A 120 132.678 6.695 -6.343 1.00 0.18 H new ATOM 0 HG11 VAL A 120 132.844 7.482 -3.995 1.00 0.21 H new ATOM 0 HG12 VAL A 120 131.764 8.527 -4.948 1.00 0.21 H new ATOM 0 HG13 VAL A 120 131.079 7.331 -3.822 1.00 0.21 H new ATOM 0 HG21 VAL A 120 132.995 5.053 -4.491 1.00 0.17 H new ATOM 0 HG22 VAL A 120 131.229 4.900 -4.332 1.00 0.17 H new ATOM 0 HG23 VAL A 120 132.040 4.346 -5.816 1.00 0.17 H new ATOM 2028 N ASN A 121 130.997 8.166 -8.140 1.00 0.21 N ATOM 2029 CA ASN A 121 130.899 9.456 -8.814 1.00 0.24 C ATOM 2030 C ASN A 121 129.447 9.773 -9.160 1.00 0.26 C ATOM 2031 O ASN A 121 128.995 10.908 -9.007 1.00 0.29 O ATOM 2032 CB ASN A 121 131.740 9.445 -10.091 1.00 0.26 C ATOM 2033 CG ASN A 121 133.198 9.149 -9.756 1.00 0.27 C ATOM 2034 OD1 ASN A 121 133.830 8.322 -10.411 1.00 1.04 O ATOM 2035 ND2 ASN A 121 133.772 9.779 -8.767 1.00 1.03 N ATOM 0 H ASN A 121 131.607 7.491 -8.600 1.00 0.21 H new ATOM 0 HA ASN A 121 131.275 10.225 -8.139 1.00 0.24 H new ATOM 0 HB2 ASN A 121 131.357 8.693 -10.781 1.00 0.26 H new ATOM 0 HB3 ASN A 121 131.663 10.409 -10.595 1.00 0.26 H new ATOM 0 HD21 ASN A 121 134.747 9.586 -8.536 1.00 1.03 H new ATOM 0 HD22 ASN A 121 133.246 10.465 -8.225 1.00 1.03 H new ATOM 2042 N GLY A 122 128.722 8.762 -9.627 1.00 0.24 N ATOM 2043 CA GLY A 122 127.323 8.946 -9.996 1.00 0.26 C ATOM 2044 C GLY A 122 126.485 9.357 -8.791 1.00 0.26 C ATOM 2045 O GLY A 122 125.671 10.276 -8.873 1.00 0.29 O ATOM 0 H GLY A 122 129.076 7.814 -9.758 1.00 0.24 H new ATOM 0 HA2 GLY A 122 127.246 9.707 -10.773 1.00 0.26 H new ATOM 0 HA3 GLY A 122 126.930 8.020 -10.417 1.00 0.26 H new ATOM 2049 N LEU A 123 126.691 8.668 -7.675 1.00 0.24 N ATOM 2050 CA LEU A 123 125.943 8.959 -6.457 1.00 0.26 C ATOM 2051 C LEU A 123 126.144 10.413 -6.037 1.00 0.30 C ATOM 2052 O LEU A 123 125.202 11.087 -5.624 1.00 0.33 O ATOM 2053 CB LEU A 123 126.403 8.036 -5.328 1.00 0.25 C ATOM 2054 CG LEU A 123 126.171 6.578 -5.730 1.00 0.23 C ATOM 2055 CD1 LEU A 123 126.854 5.655 -4.720 1.00 0.27 C ATOM 2056 CD2 LEU A 123 124.668 6.288 -5.747 1.00 0.21 C ATOM 0 H LEU A 123 127.366 7.908 -7.588 1.00 0.24 H new ATOM 0 HA LEU A 123 124.885 8.792 -6.657 1.00 0.26 H new ATOM 0 HB2 LEU A 123 127.459 8.202 -5.117 1.00 0.25 H new ATOM 0 HB3 LEU A 123 125.856 8.263 -4.413 1.00 0.25 H new ATOM 0 HG LEU A 123 126.588 6.404 -6.722 1.00 0.23 H new ATOM 0 HD11 LEU A 123 126.689 4.616 -5.006 1.00 0.27 H new ATOM 0 HD12 LEU A 123 127.924 5.861 -4.704 1.00 0.27 H new ATOM 0 HD13 LEU A 123 126.437 5.829 -3.728 1.00 0.27 H new ATOM 0 HD21 LEU A 123 124.501 5.250 -6.033 1.00 0.21 H new ATOM 0 HD22 LEU A 123 124.253 6.462 -4.754 1.00 0.21 H new ATOM 0 HD23 LEU A 123 124.179 6.946 -6.466 1.00 0.21 H new ATOM 2068 N LEU A 124 127.381 10.884 -6.143 1.00 0.31 N ATOM 2069 CA LEU A 124 127.705 12.253 -5.759 1.00 0.39 C ATOM 2070 C LEU A 124 126.894 13.251 -6.580 1.00 0.43 C ATOM 2071 O LEU A 124 126.416 14.256 -6.053 1.00 0.46 O ATOM 2072 CB LEU A 124 129.198 12.516 -5.967 1.00 0.44 C ATOM 2073 CG LEU A 124 130.013 11.619 -5.033 1.00 0.44 C ATOM 2074 CD1 LEU A 124 131.495 11.715 -5.399 1.00 0.47 C ATOM 2075 CD2 LEU A 124 129.816 12.076 -3.587 1.00 0.55 C ATOM 0 H LEU A 124 128.172 10.342 -6.490 1.00 0.31 H new ATOM 0 HA LEU A 124 127.456 12.380 -4.706 1.00 0.39 H new ATOM 0 HB2 LEU A 124 129.471 12.321 -7.004 1.00 0.44 H new ATOM 0 HB3 LEU A 124 129.424 13.564 -5.770 1.00 0.44 H new ATOM 0 HG LEU A 124 129.678 10.587 -5.137 1.00 0.44 H new ATOM 0 HD11 LEU A 124 132.076 11.076 -4.734 1.00 0.47 H new ATOM 0 HD12 LEU A 124 131.637 11.390 -6.430 1.00 0.47 H new ATOM 0 HD13 LEU A 124 131.829 12.747 -5.294 1.00 0.47 H new ATOM 0 HD21 LEU A 124 130.396 11.437 -2.921 1.00 0.55 H new ATOM 0 HD22 LEU A 124 130.151 13.108 -3.483 1.00 0.55 H new ATOM 0 HD23 LEU A 124 128.760 12.009 -3.325 1.00 0.55 H new ATOM 2087 N LYS A 125 126.743 12.972 -7.871 1.00 0.45 N ATOM 2088 CA LYS A 125 126.010 13.879 -8.756 1.00 0.54 C ATOM 2089 C LYS A 125 124.525 13.512 -8.912 1.00 0.67 C ATOM 2090 O LYS A 125 123.784 14.230 -9.583 1.00 1.05 O ATOM 2091 CB LYS A 125 126.690 13.931 -10.132 1.00 0.48 C ATOM 2092 CG LYS A 125 126.566 12.588 -10.860 1.00 0.45 C ATOM 2093 CD LYS A 125 127.322 12.664 -12.189 1.00 0.49 C ATOM 2094 CE LYS A 125 126.857 11.538 -13.116 1.00 0.75 C ATOM 2095 NZ LYS A 125 125.400 11.689 -13.390 1.00 1.36 N ATOM 0 H LYS A 125 127.112 12.137 -8.326 1.00 0.45 H new ATOM 0 HA LYS A 125 126.037 14.863 -8.287 1.00 0.54 H new ATOM 0 HB2 LYS A 125 126.238 14.718 -10.735 1.00 0.48 H new ATOM 0 HB3 LYS A 125 127.743 14.187 -10.011 1.00 0.48 H new ATOM 0 HG2 LYS A 125 126.972 11.787 -10.242 1.00 0.45 H new ATOM 0 HG3 LYS A 125 125.517 12.353 -11.038 1.00 0.45 H new ATOM 0 HD2 LYS A 125 127.149 13.631 -12.661 1.00 0.49 H new ATOM 0 HD3 LYS A 125 128.395 12.583 -12.013 1.00 0.49 H new ATOM 0 HE2 LYS A 125 127.418 11.566 -14.050 1.00 0.75 H new ATOM 0 HE3 LYS A 125 127.053 10.570 -12.656 1.00 0.75 H new ATOM 0 HZ1 LYS A 125 125.186 11.326 -14.341 1.00 1.36 H new ATOM 0 HZ2 LYS A 125 124.857 11.153 -12.684 1.00 1.36 H new ATOM 0 HZ3 LYS A 125 125.139 12.694 -13.337 1.00 1.36 H new ATOM 2109 N SER A 126 124.083 12.408 -8.307 1.00 0.48 N ATOM 2110 CA SER A 126 122.686 11.992 -8.408 1.00 0.59 C ATOM 2111 C SER A 126 122.121 11.668 -7.029 1.00 0.73 C ATOM 2112 O SER A 126 122.764 10.990 -6.227 1.00 0.95 O ATOM 2113 CB SER A 126 122.574 10.761 -9.308 1.00 0.78 C ATOM 2114 OG SER A 126 121.201 10.455 -9.510 1.00 1.56 O ATOM 0 H SER A 126 124.669 11.790 -7.746 1.00 0.48 H new ATOM 0 HA SER A 126 122.112 12.813 -8.839 1.00 0.59 H new ATOM 0 HB2 SER A 126 123.062 10.949 -10.264 1.00 0.78 H new ATOM 0 HB3 SER A 126 123.085 9.913 -8.851 1.00 0.78 H new ATOM 0 HG SER A 126 121.123 9.667 -10.088 1.00 1.56 H new ATOM 2120 N LYS A 127 120.913 12.152 -6.761 1.00 0.81 N ATOM 2121 CA LYS A 127 120.271 11.908 -5.475 1.00 1.07 C ATOM 2122 C LYS A 127 118.785 12.244 -5.544 1.00 1.54 C ATOM 2123 O LYS A 127 118.019 11.598 -4.848 1.00 2.33 O ATOM 2124 CB LYS A 127 120.938 12.756 -4.390 1.00 1.49 C ATOM 2125 CG LYS A 127 120.370 12.373 -3.021 1.00 1.89 C ATOM 2126 CD LYS A 127 120.973 13.279 -1.946 1.00 2.34 C ATOM 2127 CE LYS A 127 120.531 12.797 -0.563 1.00 3.09 C ATOM 2128 NZ LYS A 127 121.120 11.455 -0.293 1.00 3.52 N ATOM 2129 OXT LYS A 127 118.435 13.141 -6.292 1.00 1.80 O ATOM 0 H LYS A 127 120.362 12.712 -7.412 1.00 0.81 H new ATOM 0 HA LYS A 127 120.381 10.852 -5.230 1.00 1.07 H new ATOM 0 HB2 LYS A 127 122.017 12.601 -4.404 1.00 1.49 H new ATOM 0 HB3 LYS A 127 120.766 13.815 -4.584 1.00 1.49 H new ATOM 0 HG2 LYS A 127 119.284 12.470 -3.026 1.00 1.89 H new ATOM 0 HG3 LYS A 127 120.596 11.330 -2.801 1.00 1.89 H new ATOM 0 HD2 LYS A 127 122.061 13.269 -2.016 1.00 2.34 H new ATOM 0 HD3 LYS A 127 120.653 14.309 -2.103 1.00 2.34 H new ATOM 0 HE2 LYS A 127 120.850 13.506 0.200 1.00 3.09 H new ATOM 0 HE3 LYS A 127 119.443 12.745 -0.515 1.00 3.09 H new ATOM 0 HZ1 LYS A 127 120.358 10.753 -0.205 1.00 3.52 H new ATOM 0 HZ2 LYS A 127 121.749 11.188 -1.077 1.00 3.52 H new ATOM 0 HZ3 LYS A 127 121.665 11.487 0.592 1.00 3.52 H new TER 2143 LYS A 127 ATOM 2144 N GLY B1318 161.332 -12.568 9.277 1.00 25.24 N ATOM 2145 CA GLY B1318 162.454 -13.516 9.534 1.00 24.84 C ATOM 2146 C GLY B1318 163.066 -13.957 8.203 1.00 23.85 C ATOM 2147 O GLY B1318 164.253 -13.718 7.969 1.00 23.29 O ATOM 0 HA2 GLY B1318 163.212 -13.039 10.154 1.00 24.84 H new ATOM 0 HA3 GLY B1318 162.092 -14.384 10.085 1.00 24.84 H new ATOM 2153 N PRO B1319 162.306 -14.589 7.332 1.00 23.71 N ATOM 2154 CA PRO B1319 162.848 -15.046 6.015 1.00 22.84 C ATOM 2155 C PRO B1319 163.599 -13.934 5.289 1.00 21.93 C ATOM 2156 O PRO B1319 163.186 -12.774 5.314 1.00 21.93 O ATOM 2157 CB PRO B1319 161.612 -15.471 5.222 1.00 23.04 C ATOM 2158 CG PRO B1319 160.589 -15.825 6.245 1.00 23.99 C ATOM 2159 CD PRO B1319 160.878 -14.952 7.466 1.00 24.41 C ATOM 0 HA PRO B1319 163.571 -15.852 6.137 1.00 22.84 H new ATOM 0 HB2 PRO B1319 161.261 -14.664 4.578 1.00 23.04 H new ATOM 0 HB3 PRO B1319 161.832 -16.321 4.576 1.00 23.04 H new ATOM 0 HG2 PRO B1319 159.583 -15.643 5.867 1.00 23.99 H new ATOM 0 HG3 PRO B1319 160.647 -16.883 6.502 1.00 23.99 H new ATOM 0 HD2 PRO B1319 160.243 -14.066 7.480 1.00 24.41 H new ATOM 0 HD3 PRO B1319 160.691 -15.493 8.394 1.00 24.41 H new ATOM 2167 N GLN B1320 164.705 -14.295 4.644 1.00 21.25 N ATOM 2168 CA GLN B1320 165.504 -13.320 3.910 1.00 20.42 C ATOM 2169 C GLN B1320 165.201 -13.396 2.418 1.00 19.75 C ATOM 2170 O GLN B1320 165.294 -14.463 1.811 1.00 19.77 O ATOM 2171 CB GLN B1320 166.993 -13.584 4.146 1.00 20.22 C ATOM 2172 CG GLN B1320 167.818 -12.452 3.530 1.00 20.43 C ATOM 2173 CD GLN B1320 167.706 -11.199 4.391 1.00 20.36 C ATOM 2174 OE1 GLN B1320 168.141 -11.193 5.542 1.00 20.09 O ATOM 2175 NE2 GLN B1320 167.145 -10.128 3.898 1.00 20.71 N ATOM 0 H GLN B1320 165.066 -15.249 4.615 1.00 21.25 H new ATOM 0 HA GLN B1320 165.251 -12.323 4.270 1.00 20.42 H new ATOM 0 HB2 GLN B1320 167.195 -13.655 5.215 1.00 20.22 H new ATOM 0 HB3 GLN B1320 167.278 -14.538 3.703 1.00 20.22 H new ATOM 0 HG2 GLN B1320 168.862 -12.755 3.447 1.00 20.43 H new ATOM 0 HG3 GLN B1320 167.466 -12.242 2.520 1.00 20.43 H new ATOM 0 HE21 GLN B1320 166.785 -10.134 2.944 1.00 20.71 H new ATOM 0 HE22 GLN B1320 167.067 -9.285 4.467 1.00 20.71 H new ATOM 2184 N ASP B1321 164.838 -12.260 1.833 1.00 19.27 N ATOM 2185 CA ASP B1321 164.525 -12.212 0.410 1.00 18.71 C ATOM 2186 C ASP B1321 165.784 -12.456 -0.425 1.00 18.06 C ATOM 2187 O ASP B1321 166.889 -12.172 0.042 1.00 17.94 O ATOM 2188 CB ASP B1321 163.928 -10.849 0.052 1.00 18.52 C ATOM 2189 CG ASP B1321 162.580 -10.667 0.743 1.00 19.24 C ATOM 2190 OD1 ASP B1321 162.436 -11.146 1.856 1.00 19.71 O ATOM 2191 OD2 ASP B1321 161.711 -10.053 0.147 1.00 19.41 O ATOM 0 H ASP B1321 164.754 -11.367 2.318 1.00 19.27 H new ATOM 0 HA ASP B1321 163.799 -12.995 0.190 1.00 18.71 H new ATOM 0 HB2 ASP B1321 164.610 -10.054 0.354 1.00 18.52 H new ATOM 0 HB3 ASP B1321 163.805 -10.770 -1.028 1.00 18.52 H new ATOM 2196 N PRO B1322 165.658 -12.967 -1.633 1.00 17.77 N ATOM 2197 CA PRO B1322 166.849 -13.229 -2.495 1.00 17.28 C ATOM 2198 C PRO B1322 167.367 -11.957 -3.157 1.00 16.65 C ATOM 2199 O PRO B1322 166.588 -11.111 -3.596 1.00 16.12 O ATOM 2200 CB PRO B1322 166.331 -14.216 -3.541 1.00 17.36 C ATOM 2201 CG PRO B1322 164.879 -13.910 -3.680 1.00 17.65 C ATOM 2202 CD PRO B1322 164.413 -13.354 -2.333 1.00 18.02 C ATOM 0 HA PRO B1322 167.692 -13.614 -1.922 1.00 17.28 H new ATOM 0 HB2 PRO B1322 166.852 -14.093 -4.490 1.00 17.36 H new ATOM 0 HB3 PRO B1322 166.488 -15.246 -3.222 1.00 17.36 H new ATOM 0 HG2 PRO B1322 164.711 -13.185 -4.476 1.00 17.65 H new ATOM 0 HG3 PRO B1322 164.318 -14.807 -3.943 1.00 17.65 H new ATOM 0 HD2 PRO B1322 163.751 -12.498 -2.466 1.00 18.02 H new ATOM 0 HD3 PRO B1322 163.857 -14.102 -1.767 1.00 18.02 H new ATOM 2210 N LEU B1323 168.689 -11.828 -3.226 1.00 16.84 N ATOM 2211 CA LEU B1323 169.298 -10.656 -3.845 1.00 16.45 C ATOM 2212 C LEU B1323 168.934 -10.580 -5.324 1.00 15.53 C ATOM 2213 O LEU B1323 168.641 -9.505 -5.846 1.00 15.06 O ATOM 2214 CB LEU B1323 170.820 -10.716 -3.693 1.00 17.04 C ATOM 2215 CG LEU B1323 171.203 -10.419 -2.243 1.00 17.34 C ATOM 2216 CD1 LEU B1323 171.075 -11.693 -1.407 1.00 17.84 C ATOM 2217 CD2 LEU B1323 172.648 -9.917 -2.190 1.00 17.75 C ATOM 0 H LEU B1323 169.353 -12.513 -2.865 1.00 16.84 H new ATOM 0 HA LEU B1323 168.918 -9.766 -3.344 1.00 16.45 H new ATOM 0 HB2 LEU B1323 171.186 -11.701 -3.982 1.00 17.04 H new ATOM 0 HB3 LEU B1323 171.291 -9.993 -4.359 1.00 17.04 H new ATOM 0 HG LEU B1323 170.537 -9.655 -1.842 1.00 17.34 H new ATOM 0 HD11 LEU B1323 171.348 -11.479 -0.374 1.00 17.84 H new ATOM 0 HD12 LEU B1323 170.046 -12.050 -1.443 1.00 17.84 H new ATOM 0 HD13 LEU B1323 171.739 -12.459 -1.807 1.00 17.84 H new ATOM 0 HD21 LEU B1323 172.922 -9.705 -1.156 1.00 17.75 H new ATOM 0 HD22 LEU B1323 173.313 -10.681 -2.592 1.00 17.75 H new ATOM 0 HD23 LEU B1323 172.739 -9.007 -2.783 1.00 17.75 H new ATOM 2229 N LEU B1324 168.955 -11.729 -5.995 1.00 15.40 N ATOM 2230 CA LEU B1324 168.612 -11.792 -7.413 1.00 14.67 C ATOM 2231 C LEU B1324 167.268 -12.485 -7.604 1.00 14.29 C ATOM 2232 O LEU B1324 166.991 -13.508 -6.976 1.00 14.76 O ATOM 2233 CB LEU B1324 169.695 -12.557 -8.179 1.00 14.99 C ATOM 2234 CG LEU B1324 171.048 -11.870 -7.983 1.00 14.93 C ATOM 2235 CD1 LEU B1324 172.147 -12.713 -8.631 1.00 14.99 C ATOM 2236 CD2 LEU B1324 171.018 -10.486 -8.638 1.00 15.19 C ATOM 0 H LEU B1324 169.205 -12.627 -5.581 1.00 15.40 H new ATOM 0 HA LEU B1324 168.545 -10.775 -7.799 1.00 14.67 H new ATOM 0 HB2 LEU B1324 169.745 -13.587 -7.826 1.00 14.99 H new ATOM 0 HB3 LEU B1324 169.446 -12.595 -9.239 1.00 14.99 H new ATOM 0 HG LEU B1324 171.250 -11.765 -6.917 1.00 14.93 H new ATOM 0 HD11 LEU B1324 173.111 -12.224 -8.491 1.00 14.99 H new ATOM 0 HD12 LEU B1324 172.170 -13.699 -8.167 1.00 14.99 H new ATOM 0 HD13 LEU B1324 171.944 -12.818 -9.697 1.00 14.99 H new ATOM 0 HD21 LEU B1324 171.982 -9.996 -8.498 1.00 15.19 H new ATOM 0 HD22 LEU B1324 170.816 -10.592 -9.704 1.00 15.19 H new ATOM 0 HD23 LEU B1324 170.235 -9.883 -8.179 1.00 15.19 H new ATOM 2248 N GLN B1325 166.434 -11.925 -8.477 1.00 13.59 N ATOM 2249 CA GLN B1325 165.115 -12.492 -8.747 1.00 13.34 C ATOM 2250 C GLN B1325 164.945 -12.766 -10.238 1.00 13.20 C ATOM 2251 O GLN B1325 165.274 -11.926 -11.075 1.00 12.81 O ATOM 2252 CB GLN B1325 164.028 -11.522 -8.280 1.00 12.88 C ATOM 2253 CG GLN B1325 164.174 -11.273 -6.777 1.00 13.20 C ATOM 2254 CD GLN B1325 163.020 -10.412 -6.277 1.00 13.23 C ATOM 2255 OE1 GLN B1325 161.916 -10.914 -6.067 1.00 13.01 O ATOM 2256 NE2 GLN B1325 163.211 -9.137 -6.070 1.00 13.63 N ATOM 0 H GLN B1325 166.647 -11.081 -9.009 1.00 13.59 H new ATOM 0 HA GLN B1325 165.025 -13.432 -8.203 1.00 13.34 H new ATOM 0 HB2 GLN B1325 164.108 -10.581 -8.824 1.00 12.88 H new ATOM 0 HB3 GLN B1325 163.042 -11.933 -8.497 1.00 12.88 H new ATOM 0 HG2 GLN B1325 164.188 -12.223 -6.242 1.00 13.20 H new ATOM 0 HG3 GLN B1325 165.123 -10.778 -6.573 1.00 13.20 H new ATOM 0 HE21 GLN B1325 164.127 -8.724 -6.245 1.00 13.63 H new ATOM 0 HE22 GLN B1325 162.444 -8.554 -5.733 1.00 13.63 H new ATOM 2265 N GLN B1326 164.429 -13.947 -10.562 1.00 13.69 N ATOM 2266 CA GLN B1326 164.202 -14.315 -11.954 1.00 13.82 C ATOM 2267 C GLN B1326 162.805 -13.888 -12.395 1.00 12.91 C ATOM 2268 O GLN B1326 162.650 -13.120 -13.345 1.00 12.77 O ATOM 2269 CB GLN B1326 164.354 -15.828 -12.127 1.00 14.72 C ATOM 2270 CG GLN B1326 165.752 -16.263 -11.680 1.00 15.53 C ATOM 2271 CD GLN B1326 166.815 -15.609 -12.558 1.00 16.34 C ATOM 2272 OE1 GLN B1326 166.721 -15.653 -13.784 1.00 16.36 O ATOM 2273 NE2 GLN B1326 167.826 -15.002 -12.000 1.00 17.12 N ATOM 0 H GLN B1326 164.162 -14.661 -9.884 1.00 13.69 H new ATOM 0 HA GLN B1326 164.941 -13.805 -12.572 1.00 13.82 H new ATOM 0 HB2 GLN B1326 163.596 -16.348 -11.541 1.00 14.72 H new ATOM 0 HB3 GLN B1326 164.194 -16.102 -13.170 1.00 14.72 H new ATOM 0 HG2 GLN B1326 165.911 -15.986 -10.638 1.00 15.53 H new ATOM 0 HG3 GLN B1326 165.839 -17.348 -11.739 1.00 15.53 H new ATOM 0 HE21 GLN B1326 167.902 -14.967 -10.983 1.00 17.12 H new ATOM 0 HE22 GLN B1326 168.541 -14.563 -12.580 1.00 17.12 H new ATOM 2282 N GLN B1327 161.791 -14.392 -11.697 1.00 12.42 N ATOM 2283 CA GLN B1327 160.405 -14.050 -12.005 1.00 11.61 C ATOM 2284 C GLN B1327 159.678 -13.602 -10.741 1.00 10.53 C ATOM 2285 O GLN B1327 160.074 -13.952 -9.629 1.00 10.47 O ATOM 2286 CB GLN B1327 159.690 -15.264 -12.604 1.00 11.97 C ATOM 2287 CG GLN B1327 160.423 -15.728 -13.865 1.00 12.59 C ATOM 2288 CD GLN B1327 160.396 -14.631 -14.925 1.00 13.03 C ATOM 2289 OE1 GLN B1327 159.337 -14.078 -15.221 1.00 13.18 O ATOM 2290 NE2 GLN B1327 161.505 -14.282 -15.519 1.00 13.41 N ATOM 0 H GLN B1327 161.902 -15.038 -10.915 1.00 12.42 H new ATOM 0 HA GLN B1327 160.399 -13.233 -12.727 1.00 11.61 H new ATOM 0 HB2 GLN B1327 159.655 -16.073 -11.874 1.00 11.97 H new ATOM 0 HB3 GLN B1327 158.659 -15.007 -12.846 1.00 11.97 H new ATOM 0 HG2 GLN B1327 161.454 -15.983 -13.622 1.00 12.59 H new ATOM 0 HG3 GLN B1327 159.955 -16.632 -14.255 1.00 12.59 H new ATOM 0 HE21 GLN B1327 162.382 -14.741 -15.273 1.00 13.41 H new ATOM 0 HE22 GLN B1327 161.495 -13.550 -16.229 1.00 13.41 H new ATOM 2299 N ARG B1328 158.614 -12.826 -10.919 1.00 9.79 N ATOM 2300 CA ARG B1328 157.848 -12.330 -9.781 1.00 8.77 C ATOM 2301 C ARG B1328 157.029 -13.455 -9.157 1.00 8.20 C ATOM 2302 O ARG B1328 156.082 -13.958 -9.762 1.00 8.30 O ATOM 2303 CB ARG B1328 156.915 -11.206 -10.232 1.00 8.43 C ATOM 2304 CG ARG B1328 156.230 -10.586 -9.013 1.00 8.17 C ATOM 2305 CD ARG B1328 155.241 -9.513 -9.473 1.00 8.16 C ATOM 2306 NE ARG B1328 154.664 -8.824 -8.315 1.00 8.25 N ATOM 2307 CZ ARG B1328 153.454 -8.243 -8.327 1.00 8.49 C ATOM 2308 NH1 ARG B1328 152.685 -8.251 -9.390 1.00 8.66 N ATOM 2309 NH2 ARG B1328 153.028 -7.652 -7.245 1.00 8.83 N ATOM 0 H ARG B1328 158.265 -12.529 -11.830 1.00 9.79 H new ATOM 0 HA ARG B1328 158.545 -11.947 -9.035 1.00 8.77 H new ATOM 0 HB2 ARG B1328 157.480 -10.445 -10.770 1.00 8.43 H new ATOM 0 HB3 ARG B1328 156.167 -11.596 -10.923 1.00 8.43 H new ATOM 0 HG2 ARG B1328 155.709 -11.356 -8.445 1.00 8.17 H new ATOM 0 HG3 ARG B1328 156.974 -10.148 -8.348 1.00 8.17 H new ATOM 0 HD2 ARG B1328 155.747 -8.794 -10.117 1.00 8.16 H new ATOM 0 HD3 ARG B1328 154.448 -9.969 -10.066 1.00 8.16 H new ATOM 0 HE ARG B1328 155.211 -8.784 -7.455 1.00 8.25 H new ATOM 0 HH11 ARG B1328 153.001 -8.709 -10.245 1.00 8.66 H new ATOM 0 HH12 ARG B1328 151.771 -7.799 -9.362 1.00 8.66 H new ATOM 0 HH21 ARG B1328 153.612 -7.637 -6.409 1.00 8.83 H new ATOM 0 HH22 ARG B1328 152.111 -7.205 -7.235 1.00 8.83 H new ATOM 2323 N ALA B1329 157.399 -13.845 -7.941 1.00 7.76 N ATOM 2324 CA ALA B1329 156.691 -14.906 -7.229 1.00 7.36 C ATOM 2325 C ALA B1329 155.886 -14.327 -6.064 1.00 6.28 C ATOM 2326 O ALA B1329 156.222 -13.250 -5.567 1.00 5.85 O ATOM 2327 CB ALA B1329 157.692 -15.933 -6.697 1.00 7.73 C ATOM 0 H ALA B1329 158.184 -13.443 -7.428 1.00 7.76 H new ATOM 0 HA ALA B1329 156.006 -15.391 -7.924 1.00 7.36 H new ATOM 0 HB1 ALA B1329 157.157 -16.721 -6.167 1.00 7.73 H new ATOM 0 HB2 ALA B1329 158.246 -16.366 -7.530 1.00 7.73 H new ATOM 0 HB3 ALA B1329 158.387 -15.444 -6.014 1.00 7.73 H new ATOM 2333 N PRO B1330 154.843 -14.997 -5.616 1.00 5.98 N ATOM 2334 CA PRO B1330 154.033 -14.494 -4.466 1.00 5.01 C ATOM 2335 C PRO B1330 154.755 -14.681 -3.135 1.00 4.45 C ATOM 2336 O PRO B1330 155.407 -15.701 -2.910 1.00 4.94 O ATOM 2337 CB PRO B1330 152.755 -15.333 -4.516 1.00 5.26 C ATOM 2338 CG PRO B1330 153.153 -16.612 -5.167 1.00 6.23 C ATOM 2339 CD PRO B1330 154.305 -16.281 -6.116 1.00 6.70 C ATOM 0 HA PRO B1330 153.842 -13.423 -4.540 1.00 5.01 H new ATOM 0 HB2 PRO B1330 152.359 -15.507 -3.516 1.00 5.26 H new ATOM 0 HB3 PRO B1330 151.974 -14.828 -5.085 1.00 5.26 H new ATOM 0 HG2 PRO B1330 153.463 -17.345 -4.423 1.00 6.23 H new ATOM 0 HG3 PRO B1330 152.315 -17.046 -5.712 1.00 6.23 H new ATOM 0 HD2 PRO B1330 155.066 -17.061 -6.103 1.00 6.70 H new ATOM 0 HD3 PRO B1330 153.958 -16.191 -7.145 1.00 6.70 H new ATOM 2347 N PHE B1331 154.634 -13.691 -2.255 1.00 3.64 N ATOM 2348 CA PHE B1331 155.286 -13.751 -0.950 1.00 3.32 C ATOM 2349 C PHE B1331 154.307 -13.338 0.156 1.00 2.87 C ATOM 2350 O PHE B1331 154.119 -12.138 0.373 1.00 2.48 O ATOM 2351 CB PHE B1331 156.475 -12.789 -0.937 1.00 3.33 C ATOM 2352 CG PHE B1331 157.522 -13.141 0.093 1.00 3.99 C ATOM 2353 CD1 PHE B1331 158.396 -14.211 -0.134 1.00 4.80 C ATOM 2354 CD2 PHE B1331 157.618 -12.397 1.275 1.00 4.28 C ATOM 2355 CE1 PHE B1331 159.367 -14.537 0.820 1.00 5.68 C ATOM 2356 CE2 PHE B1331 158.589 -12.724 2.230 1.00 5.18 C ATOM 2357 CZ PHE B1331 159.463 -13.794 2.002 1.00 5.80 C ATOM 0 H PHE B1331 154.094 -12.842 -2.420 1.00 3.64 H new ATOM 0 HA PHE B1331 155.621 -14.773 -0.771 1.00 3.32 H new ATOM 0 HB2 PHE B1331 156.936 -12.780 -1.925 1.00 3.33 H new ATOM 0 HB3 PHE B1331 156.113 -11.779 -0.745 1.00 3.33 H new ATOM 0 HD1 PHE B1331 158.321 -14.785 -1.046 1.00 4.80 H new ATOM 0 HD2 PHE B1331 156.944 -11.572 1.450 1.00 4.28 H new ATOM 0 HE1 PHE B1331 160.042 -15.362 0.644 1.00 5.68 H new ATOM 0 HE2 PHE B1331 158.664 -12.151 3.142 1.00 5.18 H new ATOM 0 HZ PHE B1331 160.211 -14.046 2.739 1.00 5.80 H new ATOM 2367 N PRO B1332 153.703 -14.264 0.877 1.00 3.09 N ATOM 2368 CA PRO B1332 152.743 -13.893 1.962 1.00 3.15 C ATOM 2369 C PRO B1332 153.408 -13.026 3.028 1.00 2.76 C ATOM 2370 O PRO B1332 154.468 -13.370 3.551 1.00 2.68 O ATOM 2371 CB PRO B1332 152.267 -15.230 2.545 1.00 3.65 C ATOM 2372 CG PRO B1332 153.247 -16.251 2.079 1.00 3.82 C ATOM 2373 CD PRO B1332 153.822 -15.730 0.764 1.00 3.54 C ATOM 0 HA PRO B1332 151.914 -13.297 1.581 1.00 3.15 H new ATOM 0 HB2 PRO B1332 152.232 -15.191 3.634 1.00 3.65 H new ATOM 0 HB3 PRO B1332 151.261 -15.469 2.202 1.00 3.65 H new ATOM 0 HG2 PRO B1332 154.036 -16.397 2.817 1.00 3.82 H new ATOM 0 HG3 PRO B1332 152.763 -17.217 1.935 1.00 3.82 H new ATOM 0 HD2 PRO B1332 154.860 -16.037 0.633 1.00 3.54 H new ATOM 0 HD3 PRO B1332 153.266 -16.110 -0.093 1.00 3.54 H new ATOM 2381 N GLY B1333 152.776 -11.899 3.341 1.00 2.85 N ATOM 2382 CA GLY B1333 153.308 -10.985 4.349 1.00 2.87 C ATOM 2383 C GLY B1333 154.045 -9.779 3.752 1.00 2.31 C ATOM 2384 O GLY B1333 154.459 -8.888 4.495 1.00 2.55 O ATOM 0 H GLY B1333 151.900 -11.597 2.915 1.00 2.85 H new ATOM 0 HA2 GLY B1333 152.489 -10.628 4.973 1.00 2.87 H new ATOM 0 HA3 GLY B1333 153.990 -11.532 5.000 1.00 2.87 H new ATOM 2388 N GLN B1334 154.218 -9.737 2.429 1.00 1.80 N ATOM 2389 CA GLN B1334 154.873 -8.601 1.789 1.00 1.41 C ATOM 2390 C GLN B1334 153.852 -7.522 1.444 1.00 1.20 C ATOM 2391 O GLN B1334 152.906 -7.766 0.696 1.00 1.29 O ATOM 2392 CB GLN B1334 155.586 -9.059 0.515 1.00 1.41 C ATOM 2393 CG GLN B1334 156.396 -7.897 -0.064 1.00 1.97 C ATOM 2394 CD GLN B1334 156.978 -8.291 -1.417 1.00 2.27 C ATOM 2395 OE1 GLN B1334 156.235 -8.633 -2.339 1.00 2.26 O ATOM 2396 NE2 GLN B1334 158.270 -8.264 -1.594 1.00 3.00 N ATOM 0 H GLN B1334 153.916 -10.470 1.788 1.00 1.80 H new ATOM 0 HA GLN B1334 155.604 -8.186 2.484 1.00 1.41 H new ATOM 0 HB2 GLN B1334 156.244 -9.900 0.736 1.00 1.41 H new ATOM 0 HB3 GLN B1334 154.857 -9.408 -0.217 1.00 1.41 H new ATOM 0 HG2 GLN B1334 155.760 -7.019 -0.174 1.00 1.97 H new ATOM 0 HG3 GLN B1334 157.199 -7.625 0.621 1.00 1.97 H new ATOM 0 HE21 GLN B1334 158.884 -7.981 -0.830 1.00 3.00 H new ATOM 0 HE22 GLN B1334 158.667 -8.526 -2.496 1.00 3.00 H new ATOM 2405 N MET B1335 154.049 -6.328 1.995 1.00 1.11 N ATOM 2406 CA MET B1335 153.130 -5.224 1.748 1.00 0.94 C ATOM 2407 C MET B1335 153.407 -4.609 0.371 1.00 0.74 C ATOM 2408 O MET B1335 154.575 -4.485 -0.003 1.00 0.75 O ATOM 2409 CB MET B1335 153.317 -4.157 2.833 1.00 0.97 C ATOM 2410 CG MET B1335 152.301 -3.028 2.642 1.00 0.89 C ATOM 2411 SD MET B1335 152.715 -1.650 3.741 1.00 0.96 S ATOM 2412 CE MET B1335 152.458 -0.317 2.543 1.00 0.69 C ATOM 0 H MET B1335 154.830 -6.102 2.610 1.00 1.11 H new ATOM 0 HA MET B1335 152.106 -5.597 1.771 1.00 0.94 H new ATOM 0 HB2 MET B1335 153.194 -4.605 3.819 1.00 0.97 H new ATOM 0 HB3 MET B1335 154.330 -3.756 2.789 1.00 0.97 H new ATOM 0 HG2 MET B1335 152.304 -2.693 1.605 1.00 0.89 H new ATOM 0 HG3 MET B1335 151.295 -3.389 2.857 1.00 0.89 H new ATOM 0 HE1 MET B1335 151.922 0.503 3.021 1.00 0.69 H new ATOM 0 HE2 MET B1335 153.423 0.041 2.184 1.00 0.69 H new ATOM 0 HE3 MET B1335 151.874 -0.691 1.702 1.00 0.69 H new ATOM 2422 N PRO B1336 152.401 -4.226 -0.393 1.00 0.71 N ATOM 2423 CA PRO B1336 152.638 -3.549 -1.706 1.00 0.68 C ATOM 2424 C PRO B1336 153.156 -2.127 -1.520 1.00 0.58 C ATOM 2425 O PRO B1336 152.861 -1.477 -0.517 1.00 0.57 O ATOM 2426 CB PRO B1336 151.268 -3.546 -2.386 1.00 0.90 C ATOM 2427 CG PRO B1336 150.282 -3.603 -1.272 1.00 1.01 C ATOM 2428 CD PRO B1336 150.953 -4.385 -0.144 1.00 0.89 C ATOM 0 HA PRO B1336 153.398 -4.062 -2.296 1.00 0.68 H new ATOM 0 HB2 PRO B1336 151.129 -2.649 -2.990 1.00 0.90 H new ATOM 0 HB3 PRO B1336 151.158 -4.400 -3.054 1.00 0.90 H new ATOM 0 HG2 PRO B1336 150.010 -2.600 -0.942 1.00 1.01 H new ATOM 0 HG3 PRO B1336 149.363 -4.093 -1.591 1.00 1.01 H new ATOM 0 HD2 PRO B1336 150.673 -3.991 0.833 1.00 0.89 H new ATOM 0 HD3 PRO B1336 150.660 -5.435 -0.160 1.00 0.89 H new ATOM 2436 N ASN B1337 153.928 -1.647 -2.490 1.00 0.60 N ATOM 2437 CA ASN B1337 154.498 -0.307 -2.408 1.00 0.59 C ATOM 2438 C ASN B1337 153.701 0.673 -3.265 1.00 0.56 C ATOM 2439 O ASN B1337 153.730 0.605 -4.494 1.00 0.70 O ATOM 2440 CB ASN B1337 155.952 -0.330 -2.882 1.00 0.75 C ATOM 2441 CG ASN B1337 156.772 -1.263 -1.998 1.00 1.81 C ATOM 2442 OD1 ASN B1337 157.538 -2.085 -2.504 1.00 2.57 O ATOM 2443 ND2 ASN B1337 156.659 -1.186 -0.700 1.00 2.54 N ATOM 0 H ASN B1337 154.172 -2.162 -3.336 1.00 0.60 H new ATOM 0 HA ASN B1337 154.456 0.020 -1.369 1.00 0.59 H new ATOM 0 HB2 ASN B1337 156.000 -0.662 -3.919 1.00 0.75 H new ATOM 0 HB3 ASN B1337 156.370 0.676 -2.850 1.00 0.75 H new ATOM 0 HD21 ASN B1337 157.205 -1.807 -0.103 1.00 2.54 H new ATOM 0 HD22 ASN B1337 156.024 -0.505 -0.283 1.00 2.54 H new ATOM 2450 N LEU B1338 152.991 1.585 -2.607 1.00 0.44 N ATOM 2451 CA LEU B1338 152.228 2.604 -3.319 1.00 0.41 C ATOM 2452 C LEU B1338 153.188 3.596 -3.979 1.00 0.45 C ATOM 2453 O LEU B1338 154.292 3.793 -3.468 1.00 0.51 O ATOM 2454 CB LEU B1338 151.331 3.372 -2.345 1.00 0.32 C ATOM 2455 CG LEU B1338 150.348 2.416 -1.652 1.00 0.32 C ATOM 2456 CD1 LEU B1338 150.009 2.948 -0.258 1.00 0.27 C ATOM 2457 CD2 LEU B1338 149.054 2.311 -2.463 1.00 0.37 C ATOM 0 H LEU B1338 152.928 1.639 -1.590 1.00 0.44 H new ATOM 0 HA LEU B1338 151.614 2.113 -4.073 1.00 0.41 H new ATOM 0 HB2 LEU B1338 151.944 3.877 -1.598 1.00 0.32 H new ATOM 0 HB3 LEU B1338 150.780 4.145 -2.881 1.00 0.32 H new ATOM 0 HG LEU B1338 150.814 1.433 -1.576 1.00 0.32 H new ATOM 0 HD11 LEU B1338 149.312 2.268 0.231 1.00 0.27 H new ATOM 0 HD12 LEU B1338 150.921 3.021 0.335 1.00 0.27 H new ATOM 0 HD13 LEU B1338 149.553 3.934 -0.346 1.00 0.27 H new ATOM 0 HD21 LEU B1338 148.365 1.631 -1.962 1.00 0.37 H new ATOM 0 HD22 LEU B1338 148.595 3.296 -2.546 1.00 0.37 H new ATOM 0 HD23 LEU B1338 149.279 1.931 -3.459 1.00 0.37 H new ATOM 2469 N PRO B1339 152.818 4.216 -5.080 1.00 0.47 N ATOM 2470 CA PRO B1339 153.669 5.280 -5.687 1.00 0.51 C ATOM 2471 C PRO B1339 153.503 6.603 -4.948 1.00 0.41 C ATOM 2472 O PRO B1339 152.392 6.968 -4.562 1.00 0.36 O ATOM 2473 CB PRO B1339 153.156 5.382 -7.123 1.00 0.60 C ATOM 2474 CG PRO B1339 151.724 4.973 -7.057 1.00 0.60 C ATOM 2475 CD PRO B1339 151.589 4.009 -5.874 1.00 0.53 C ATOM 0 HA PRO B1339 154.733 5.048 -5.637 1.00 0.51 H new ATOM 0 HB2 PRO B1339 153.258 6.397 -7.506 1.00 0.60 H new ATOM 0 HB3 PRO B1339 153.721 4.731 -7.790 1.00 0.60 H new ATOM 0 HG2 PRO B1339 151.080 5.842 -6.922 1.00 0.60 H new ATOM 0 HG3 PRO B1339 151.417 4.490 -7.985 1.00 0.60 H new ATOM 0 HD2 PRO B1339 150.697 4.225 -5.287 1.00 0.53 H new ATOM 0 HD3 PRO B1339 151.505 2.976 -6.212 1.00 0.53 H new ATOM 2483 N LYS B1340 154.605 7.320 -4.753 1.00 0.48 N ATOM 2484 CA LYS B1340 154.551 8.606 -4.067 1.00 0.48 C ATOM 2485 C LYS B1340 154.502 9.746 -5.094 1.00 0.46 C ATOM 2486 O LYS B1340 155.376 9.794 -5.962 1.00 0.53 O ATOM 2487 CB LYS B1340 155.799 8.774 -3.198 1.00 0.63 C ATOM 2488 CG LYS B1340 155.840 7.672 -2.138 1.00 0.74 C ATOM 2489 CD LYS B1340 154.864 8.010 -1.010 1.00 0.85 C ATOM 2490 CE LYS B1340 155.117 7.082 0.180 1.00 1.57 C ATOM 2491 NZ LYS B1340 156.487 7.323 0.715 1.00 2.42 N ATOM 0 H LYS B1340 155.537 7.037 -5.056 1.00 0.48 H new ATOM 0 HA LYS B1340 153.657 8.638 -3.445 1.00 0.48 H new ATOM 0 HB2 LYS B1340 156.694 8.729 -3.818 1.00 0.63 H new ATOM 0 HB3 LYS B1340 155.791 9.753 -2.719 1.00 0.63 H new ATOM 0 HG2 LYS B1340 155.577 6.713 -2.585 1.00 0.74 H new ATOM 0 HG3 LYS B1340 156.850 7.572 -1.741 1.00 0.74 H new ATOM 0 HD2 LYS B1340 154.988 9.050 -0.707 1.00 0.85 H new ATOM 0 HD3 LYS B1340 153.837 7.900 -1.358 1.00 0.85 H new ATOM 0 HE2 LYS B1340 154.375 7.260 0.958 1.00 1.57 H new ATOM 0 HE3 LYS B1340 155.013 6.042 -0.128 1.00 1.57 H new ATOM 0 HZ1 LYS B1340 156.567 6.907 1.665 1.00 2.42 H new ATOM 0 HZ2 LYS B1340 157.188 6.884 0.085 1.00 2.42 H new ATOM 0 HZ3 LYS B1340 156.663 8.346 0.769 1.00 2.42 H new ATOM 2505 N PRO B1341 153.541 10.650 -5.049 1.00 0.43 N ATOM 2506 CA PRO B1341 153.521 11.812 -5.993 1.00 0.44 C ATOM 2507 C PRO B1341 154.504 12.909 -5.574 1.00 0.43 C ATOM 2508 O PRO B1341 155.040 12.857 -4.466 1.00 0.45 O ATOM 2509 CB PRO B1341 152.081 12.316 -5.917 1.00 0.47 C ATOM 2510 CG PRO B1341 151.656 12.003 -4.526 1.00 0.70 C ATOM 2511 CD PRO B1341 152.373 10.708 -4.144 1.00 0.48 C ATOM 0 HA PRO B1341 153.825 11.527 -7.000 1.00 0.44 H new ATOM 0 HB2 PRO B1341 152.022 13.385 -6.120 1.00 0.47 H new ATOM 0 HB3 PRO B1341 151.446 11.817 -6.649 1.00 0.47 H new ATOM 0 HG2 PRO B1341 151.923 12.812 -3.846 1.00 0.70 H new ATOM 0 HG3 PRO B1341 150.574 11.881 -4.467 1.00 0.70 H new ATOM 0 HD2 PRO B1341 152.681 10.719 -3.099 1.00 0.48 H new ATOM 0 HD3 PRO B1341 151.725 9.842 -4.276 1.00 0.48 H new ATOM 2519 N PRO B1342 154.759 13.890 -6.416 1.00 0.45 N ATOM 2520 CA PRO B1342 155.647 15.032 -6.034 1.00 0.45 C ATOM 2521 C PRO B1342 155.034 15.862 -4.908 1.00 0.40 C ATOM 2522 O PRO B1342 153.818 15.878 -4.734 1.00 0.35 O ATOM 2523 CB PRO B1342 155.788 15.859 -7.315 1.00 0.49 C ATOM 2524 CG PRO B1342 154.610 15.497 -8.154 1.00 0.67 C ATOM 2525 CD PRO B1342 154.258 14.054 -7.798 1.00 0.49 C ATOM 0 HA PRO B1342 156.610 14.690 -5.656 1.00 0.45 H new ATOM 0 HB2 PRO B1342 155.799 16.926 -7.094 1.00 0.49 H new ATOM 0 HB3 PRO B1342 156.721 15.630 -7.829 1.00 0.49 H new ATOM 0 HG2 PRO B1342 153.771 16.163 -7.954 1.00 0.67 H new ATOM 0 HG3 PRO B1342 154.845 15.590 -9.214 1.00 0.67 H new ATOM 0 HD2 PRO B1342 153.183 13.880 -7.856 1.00 0.49 H new ATOM 0 HD3 PRO B1342 154.732 13.348 -8.480 1.00 0.49 H new ATOM 2533 N LEU B1343 155.877 16.581 -4.173 1.00 0.42 N ATOM 2534 CA LEU B1343 155.422 17.360 -3.019 1.00 0.39 C ATOM 2535 C LEU B1343 154.220 18.244 -3.358 1.00 0.36 C ATOM 2536 O LEU B1343 153.341 18.458 -2.522 1.00 0.33 O ATOM 2537 CB LEU B1343 156.579 18.227 -2.510 1.00 0.45 C ATOM 2538 CG LEU B1343 156.170 18.971 -1.224 1.00 1.20 C ATOM 2539 CD1 LEU B1343 157.386 19.139 -0.307 1.00 1.84 C ATOM 2540 CD2 LEU B1343 155.615 20.359 -1.572 1.00 1.59 C ATOM 0 H LEU B1343 156.879 16.642 -4.353 1.00 0.42 H new ATOM 0 HA LEU B1343 155.102 16.662 -2.246 1.00 0.39 H new ATOM 0 HB2 LEU B1343 157.451 17.602 -2.314 1.00 0.45 H new ATOM 0 HB3 LEU B1343 156.868 18.946 -3.277 1.00 0.45 H new ATOM 0 HG LEU B1343 155.403 18.387 -0.715 1.00 1.20 H new ATOM 0 HD11 LEU B1343 157.088 19.666 0.600 1.00 1.84 H new ATOM 0 HD12 LEU B1343 157.781 18.158 -0.043 1.00 1.84 H new ATOM 0 HD13 LEU B1343 158.155 19.713 -0.824 1.00 1.84 H new ATOM 0 HD21 LEU B1343 155.329 20.876 -0.656 1.00 1.59 H new ATOM 0 HD22 LEU B1343 156.379 20.937 -2.092 1.00 1.59 H new ATOM 0 HD23 LEU B1343 154.742 20.251 -2.216 1.00 1.59 H new ATOM 2552 N PHE B1344 154.162 18.730 -4.594 1.00 0.38 N ATOM 2553 CA PHE B1344 153.097 19.646 -4.998 1.00 0.38 C ATOM 2554 C PHE B1344 151.715 19.057 -4.711 1.00 0.34 C ATOM 2555 O PHE B1344 150.796 19.770 -4.317 1.00 0.35 O ATOM 2556 CB PHE B1344 153.218 19.955 -6.490 1.00 0.43 C ATOM 2557 CG PHE B1344 152.238 21.000 -6.969 1.00 1.31 C ATOM 2558 CD1 PHE B1344 152.591 22.355 -6.945 1.00 2.28 C ATOM 2559 CD2 PHE B1344 150.977 20.615 -7.438 1.00 2.02 C ATOM 2560 CE1 PHE B1344 151.683 23.323 -7.389 1.00 3.22 C ATOM 2561 CE2 PHE B1344 150.069 21.583 -7.882 1.00 2.91 C ATOM 2562 CZ PHE B1344 150.422 22.938 -7.858 1.00 3.35 C ATOM 0 H PHE B1344 154.833 18.508 -5.329 1.00 0.38 H new ATOM 0 HA PHE B1344 153.205 20.563 -4.418 1.00 0.38 H new ATOM 0 HB2 PHE B1344 154.232 20.295 -6.702 1.00 0.43 H new ATOM 0 HB3 PHE B1344 153.064 19.037 -7.057 1.00 0.43 H new ATOM 0 HD1 PHE B1344 153.564 22.653 -6.584 1.00 2.28 H new ATOM 0 HD2 PHE B1344 150.704 19.570 -7.457 1.00 2.02 H new ATOM 0 HE1 PHE B1344 151.956 24.368 -7.370 1.00 3.22 H new ATOM 0 HE2 PHE B1344 149.096 21.285 -8.243 1.00 2.91 H new ATOM 0 HZ PHE B1344 149.722 23.685 -8.201 1.00 3.35 H new ATOM 2572 N TRP B1345 151.585 17.747 -4.883 1.00 0.31 N ATOM 2573 CA TRP B1345 150.306 17.070 -4.711 1.00 0.28 C ATOM 2574 C TRP B1345 149.806 17.228 -3.271 1.00 0.26 C ATOM 2575 O TRP B1345 148.662 17.621 -3.042 1.00 0.27 O ATOM 2576 CB TRP B1345 150.510 15.596 -5.100 1.00 0.27 C ATOM 2577 CG TRP B1345 149.478 14.619 -4.618 1.00 0.24 C ATOM 2578 CD1 TRP B1345 148.401 14.205 -5.323 1.00 0.32 C ATOM 2579 CD2 TRP B1345 149.435 13.913 -3.345 1.00 0.21 C ATOM 2580 NE1 TRP B1345 147.703 13.277 -4.568 1.00 0.29 N ATOM 2581 CE2 TRP B1345 148.298 13.069 -3.338 1.00 0.20 C ATOM 2582 CE3 TRP B1345 150.264 13.924 -2.211 1.00 0.31 C ATOM 2583 CZ2 TRP B1345 148.001 12.261 -2.236 1.00 0.20 C ATOM 2584 CZ3 TRP B1345 149.968 13.116 -1.106 1.00 0.37 C ATOM 2585 CH2 TRP B1345 148.841 12.285 -1.117 1.00 0.30 C ATOM 0 H TRP B1345 152.354 17.130 -5.143 1.00 0.31 H new ATOM 0 HA TRP B1345 149.539 17.508 -5.349 1.00 0.28 H new ATOM 0 HB2 TRP B1345 150.554 15.535 -6.187 1.00 0.27 H new ATOM 0 HB3 TRP B1345 151.482 15.277 -4.723 1.00 0.27 H new ATOM 0 HD1 TRP B1345 148.130 14.543 -6.312 1.00 0.32 H new ATOM 0 HE1 TRP B1345 146.855 12.805 -4.881 1.00 0.29 H new ATOM 0 HE3 TRP B1345 151.136 14.560 -2.191 1.00 0.31 H new ATOM 0 HZ2 TRP B1345 147.130 11.623 -2.248 1.00 0.20 H new ATOM 0 HZ3 TRP B1345 150.613 13.134 -0.240 1.00 0.37 H new ATOM 0 HH2 TRP B1345 148.620 11.663 -0.262 1.00 0.30 H new ATOM 2596 N GLN B1346 150.684 16.969 -2.308 1.00 0.26 N ATOM 2597 CA GLN B1346 150.298 17.050 -0.902 1.00 0.25 C ATOM 2598 C GLN B1346 149.880 18.472 -0.542 1.00 0.28 C ATOM 2599 O GLN B1346 148.826 18.692 0.055 1.00 0.27 O ATOM 2600 CB GLN B1346 151.469 16.622 -0.014 1.00 0.30 C ATOM 2601 CG GLN B1346 151.001 16.528 1.439 1.00 1.14 C ATOM 2602 CD GLN B1346 152.185 16.220 2.349 1.00 1.19 C ATOM 2603 OE1 GLN B1346 152.659 15.085 2.392 1.00 1.23 O ATOM 2604 NE2 GLN B1346 152.695 17.170 3.086 1.00 1.82 N ATOM 0 H GLN B1346 151.656 16.704 -2.470 1.00 0.26 H new ATOM 0 HA GLN B1346 149.453 16.382 -0.738 1.00 0.25 H new ATOM 0 HB2 GLN B1346 151.857 15.659 -0.345 1.00 0.30 H new ATOM 0 HB3 GLN B1346 152.285 17.340 -0.099 1.00 0.30 H new ATOM 0 HG2 GLN B1346 150.534 17.466 1.741 1.00 1.14 H new ATOM 0 HG3 GLN B1346 150.245 15.749 1.536 1.00 1.14 H new ATOM 0 HE21 GLN B1346 152.302 18.110 3.050 1.00 1.82 H new ATOM 0 HE22 GLN B1346 153.487 16.972 3.698 1.00 1.82 H new ATOM 2613 N GLN B1347 150.699 19.440 -0.936 1.00 0.32 N ATOM 2614 CA GLN B1347 150.434 20.834 -0.599 1.00 0.37 C ATOM 2615 C GLN B1347 149.086 21.282 -1.156 1.00 0.39 C ATOM 2616 O GLN B1347 148.295 21.918 -0.462 1.00 0.42 O ATOM 2617 CB GLN B1347 151.542 21.727 -1.161 1.00 0.43 C ATOM 2618 CG GLN B1347 151.349 23.160 -0.662 1.00 1.34 C ATOM 2619 CD GLN B1347 152.343 24.090 -1.348 1.00 1.52 C ATOM 2620 OE1 GLN B1347 152.372 24.172 -2.576 1.00 1.37 O ATOM 2621 NE2 GLN B1347 153.164 24.800 -0.624 1.00 2.40 N ATOM 0 H GLN B1347 151.545 19.288 -1.485 1.00 0.32 H new ATOM 0 HA GLN B1347 150.409 20.923 0.487 1.00 0.37 H new ATOM 0 HB2 GLN B1347 152.517 21.352 -0.851 1.00 0.43 H new ATOM 0 HB3 GLN B1347 151.523 21.705 -2.251 1.00 0.43 H new ATOM 0 HG2 GLN B1347 150.330 23.490 -0.865 1.00 1.34 H new ATOM 0 HG3 GLN B1347 151.488 23.199 0.418 1.00 1.34 H new ATOM 0 HE21 GLN B1347 153.138 24.730 0.393 1.00 2.40 H new ATOM 0 HE22 GLN B1347 153.832 25.425 -1.075 1.00 2.40 H new ATOM 2630 N GLU B1348 148.818 20.922 -2.406 1.00 0.38 N ATOM 2631 CA GLU B1348 147.595 21.354 -3.068 1.00 0.43 C ATOM 2632 C GLU B1348 146.369 20.879 -2.296 1.00 0.42 C ATOM 2633 O GLU B1348 145.446 21.651 -2.043 1.00 0.49 O ATOM 2634 CB GLU B1348 147.549 20.801 -4.493 1.00 0.45 C ATOM 2635 CG GLU B1348 146.363 21.418 -5.247 1.00 0.54 C ATOM 2636 CD GLU B1348 146.217 20.838 -6.657 1.00 1.06 C ATOM 2637 OE1 GLU B1348 146.968 19.942 -7.020 1.00 1.53 O ATOM 2638 OE2 GLU B1348 145.341 21.305 -7.366 1.00 1.27 O ATOM 0 H GLU B1348 149.427 20.336 -2.977 1.00 0.38 H new ATOM 0 HA GLU B1348 147.589 22.443 -3.101 1.00 0.43 H new ATOM 0 HB2 GLU B1348 148.480 21.028 -5.012 1.00 0.45 H new ATOM 0 HB3 GLU B1348 147.453 19.715 -4.470 1.00 0.45 H new ATOM 0 HG2 GLU B1348 145.445 21.242 -4.686 1.00 0.54 H new ATOM 0 HG3 GLU B1348 146.496 22.498 -5.311 1.00 0.54 H new ATOM 2645 N ALA B1349 146.378 19.610 -1.904 1.00 0.35 N ATOM 2646 CA ALA B1349 145.239 19.037 -1.197 1.00 0.36 C ATOM 2647 C ALA B1349 144.973 19.797 0.099 1.00 0.37 C ATOM 2648 O ALA B1349 143.843 20.192 0.384 1.00 0.43 O ATOM 2649 CB ALA B1349 145.506 17.564 -0.881 1.00 0.32 C ATOM 0 H ALA B1349 147.152 18.965 -2.061 1.00 0.35 H new ATOM 0 HA ALA B1349 144.361 19.117 -1.838 1.00 0.36 H new ATOM 0 HB1 ALA B1349 144.650 17.144 -0.353 1.00 0.32 H new ATOM 0 HB2 ALA B1349 145.664 17.016 -1.810 1.00 0.32 H new ATOM 0 HB3 ALA B1349 146.395 17.481 -0.255 1.00 0.32 H new ATOM 2655 N GLN B1350 146.031 20.023 0.868 1.00 0.35 N ATOM 2656 CA GLN B1350 145.894 20.679 2.164 1.00 0.40 C ATOM 2657 C GLN B1350 145.277 22.066 2.016 1.00 0.48 C ATOM 2658 O GLN B1350 144.418 22.461 2.803 1.00 0.52 O ATOM 2659 CB GLN B1350 147.265 20.799 2.835 1.00 0.43 C ATOM 2660 CG GLN B1350 147.803 19.401 3.150 1.00 1.29 C ATOM 2661 CD GLN B1350 149.208 19.494 3.740 1.00 1.41 C ATOM 2662 OE1 GLN B1350 149.908 20.487 3.537 1.00 1.43 O ATOM 2663 NE2 GLN B1350 149.666 18.510 4.463 1.00 2.09 N ATOM 0 H GLN B1350 146.986 19.765 0.620 1.00 0.35 H new ATOM 0 HA GLN B1350 145.233 20.071 2.782 1.00 0.40 H new ATOM 0 HB2 GLN B1350 147.957 21.328 2.180 1.00 0.43 H new ATOM 0 HB3 GLN B1350 147.183 21.384 3.751 1.00 0.43 H new ATOM 0 HG2 GLN B1350 147.139 18.898 3.853 1.00 1.29 H new ATOM 0 HG3 GLN B1350 147.822 18.798 2.242 1.00 1.29 H new ATOM 0 HE21 GLN B1350 149.086 17.688 4.631 1.00 2.09 H new ATOM 0 HE22 GLN B1350 150.604 18.563 4.860 1.00 2.09 H new ATOM 2672 N LYS B1351 145.722 22.801 1.002 1.00 0.52 N ATOM 2673 CA LYS B1351 145.241 24.161 0.784 1.00 0.63 C ATOM 2674 C LYS B1351 143.751 24.169 0.452 1.00 0.66 C ATOM 2675 O LYS B1351 142.982 24.940 1.026 1.00 0.72 O ATOM 2676 CB LYS B1351 146.023 24.812 -0.358 1.00 0.70 C ATOM 2677 CG LYS B1351 145.632 26.287 -0.474 1.00 1.43 C ATOM 2678 CD LYS B1351 146.498 26.963 -1.540 1.00 1.68 C ATOM 2679 CE LYS B1351 146.136 26.410 -2.919 1.00 2.56 C ATOM 2680 NZ LYS B1351 146.655 27.327 -3.973 1.00 3.34 N ATOM 0 H LYS B1351 146.411 22.480 0.322 1.00 0.52 H new ATOM 0 HA LYS B1351 145.393 24.727 1.703 1.00 0.63 H new ATOM 0 HB2 LYS B1351 147.094 24.723 -0.176 1.00 0.70 H new ATOM 0 HB3 LYS B1351 145.815 24.296 -1.295 1.00 0.70 H new ATOM 0 HG2 LYS B1351 144.578 26.375 -0.737 1.00 1.43 H new ATOM 0 HG3 LYS B1351 145.763 26.786 0.486 1.00 1.43 H new ATOM 0 HD2 LYS B1351 146.344 28.042 -1.518 1.00 1.68 H new ATOM 0 HD3 LYS B1351 147.553 26.787 -1.332 1.00 1.68 H new ATOM 0 HE2 LYS B1351 146.561 25.414 -3.047 1.00 2.56 H new ATOM 0 HE3 LYS B1351 145.054 26.309 -3.010 1.00 2.56 H new ATOM 0 HZ1 LYS B1351 146.409 26.952 -4.911 1.00 3.34 H new ATOM 0 HZ2 LYS B1351 146.229 28.268 -3.854 1.00 3.34 H new ATOM 0 HZ3 LYS B1351 147.689 27.402 -3.890 1.00 3.34 H new ATOM 2694 N GLN B1352 143.350 23.307 -0.476 1.00 0.64 N ATOM 2695 CA GLN B1352 141.955 23.245 -0.903 1.00 0.71 C ATOM 2696 C GLN B1352 141.024 23.030 0.286 1.00 0.71 C ATOM 2697 O GLN B1352 140.000 23.700 0.412 1.00 0.81 O ATOM 2698 CB GLN B1352 141.768 22.109 -1.911 1.00 0.72 C ATOM 2699 CG GLN B1352 142.528 22.437 -3.199 1.00 1.14 C ATOM 2700 CD GLN B1352 142.432 21.275 -4.183 1.00 1.45 C ATOM 2701 OE1 GLN B1352 142.174 20.137 -3.788 1.00 1.70 O ATOM 2702 NE2 GLN B1352 142.625 21.495 -5.454 1.00 2.23 N ATOM 0 H GLN B1352 143.967 22.644 -0.946 1.00 0.64 H new ATOM 0 HA GLN B1352 141.703 24.197 -1.371 1.00 0.71 H new ATOM 0 HB2 GLN B1352 142.132 21.172 -1.490 1.00 0.72 H new ATOM 0 HB3 GLN B1352 140.709 21.971 -2.127 1.00 0.72 H new ATOM 0 HG2 GLN B1352 142.118 23.340 -3.651 1.00 1.14 H new ATOM 0 HG3 GLN B1352 143.574 22.642 -2.970 1.00 1.14 H new ATOM 0 HE21 GLN B1352 142.839 22.437 -5.782 1.00 2.23 H new ATOM 0 HE22 GLN B1352 142.562 20.725 -6.120 1.00 2.23 H new ATOM 2711 N GLU B1353 141.385 22.092 1.157 1.00 0.64 N ATOM 2712 CA GLU B1353 140.583 21.826 2.347 1.00 0.70 C ATOM 2713 C GLU B1353 140.579 23.031 3.287 1.00 0.84 C ATOM 2714 O GLU B1353 139.564 23.332 3.914 1.00 1.15 O ATOM 2715 CB GLU B1353 141.137 20.606 3.086 1.00 0.70 C ATOM 2716 CG GLU B1353 140.195 20.230 4.233 1.00 1.06 C ATOM 2717 CD GLU B1353 138.876 19.680 3.691 1.00 1.15 C ATOM 2718 OE1 GLU B1353 138.883 19.106 2.614 1.00 1.46 O ATOM 2719 OE2 GLU B1353 137.873 19.843 4.366 1.00 1.84 O ATOM 0 H GLU B1353 142.217 21.510 1.064 1.00 0.64 H new ATOM 0 HA GLU B1353 139.559 21.631 2.029 1.00 0.70 H new ATOM 0 HB2 GLU B1353 141.241 19.767 2.398 1.00 0.70 H new ATOM 0 HB3 GLU B1353 142.131 20.824 3.475 1.00 0.70 H new ATOM 0 HG2 GLU B1353 140.670 19.485 4.871 1.00 1.06 H new ATOM 0 HG3 GLU B1353 140.002 21.105 4.854 1.00 1.06 H new ATOM 2726 N ALA B1354 141.714 23.718 3.382 1.00 0.76 N ATOM 2727 CA ALA B1354 141.817 24.893 4.240 1.00 0.96 C ATOM 2728 C ALA B1354 141.131 26.091 3.591 1.00 1.22 C ATOM 2729 O ALA B1354 141.111 26.219 2.367 1.00 1.64 O ATOM 2730 CB ALA B1354 143.288 25.224 4.500 1.00 1.42 C ATOM 0 H ALA B1354 142.570 23.483 2.879 1.00 0.76 H new ATOM 0 HA ALA B1354 141.322 24.673 5.186 1.00 0.96 H new ATOM 0 HB1 ALA B1354 143.355 26.103 5.141 1.00 1.42 H new ATOM 0 HB2 ALA B1354 143.770 24.379 4.991 1.00 1.42 H new ATOM 0 HB3 ALA B1354 143.788 25.427 3.553 1.00 1.42 H new ATOM 2736 N LEU B1355 140.570 26.966 4.420 1.00 1.40 N ATOM 2737 CA LEU B1355 139.886 28.152 3.915 1.00 1.94 C ATOM 2738 C LEU B1355 140.172 29.354 4.808 1.00 2.13 C ATOM 2739 O LEU B1355 139.622 29.403 5.897 1.00 2.51 O ATOM 2740 CB LEU B1355 138.378 27.901 3.860 1.00 2.38 C ATOM 2741 CG LEU B1355 137.691 29.056 3.130 1.00 3.05 C ATOM 2742 CD1 LEU B1355 137.829 28.863 1.618 1.00 3.74 C ATOM 2743 CD2 LEU B1355 136.208 29.085 3.506 1.00 3.76 C ATOM 2744 OXT LEU B1355 140.936 30.209 4.391 1.00 2.54 O ATOM 0 H LEU B1355 140.575 26.878 5.436 1.00 1.40 H new ATOM 0 HA LEU B1355 140.255 28.363 2.911 1.00 1.94 H new ATOM 0 HB2 LEU B1355 138.174 26.961 3.347 1.00 2.38 H new ATOM 0 HB3 LEU B1355 137.978 27.806 4.870 1.00 2.38 H new ATOM 0 HG LEU B1355 138.160 29.997 3.419 1.00 3.05 H new ATOM 0 HD11 LEU B1355 137.339 29.687 1.100 1.00 3.74 H new ATOM 0 HD12 LEU B1355 138.885 28.842 1.349 1.00 3.74 H new ATOM 0 HD13 LEU B1355 137.362 27.922 1.327 1.00 3.74 H new ATOM 0 HD21 LEU B1355 135.717 29.908 2.986 1.00 3.76 H new ATOM 0 HD22 LEU B1355 135.741 28.143 3.217 1.00 3.76 H new ATOM 0 HD23 LEU B1355 136.108 29.225 4.582 1.00 3.76 H new TER 2756 LEU B1355