USER MOD reduce.3.24.130724 H: found=0, std=0, add=1112, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 1110 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 96 LYS NZ :NH3+ -170:sc= 0.55 (180deg=0) USER MOD Set 1.2: A 98 TYR OH : rot 180:sc= 0.497 USER MOD Set 2.1: A 32 THR OG1 : rot 170:sc= 0 USER MOD Set 2.2: A 65 ASN : amide:sc= 0.944 K(o=0.94,f=-5.6!) USER MOD Set 3.1: A 31 TYR OH : rot 167:sc= 2.14 USER MOD Set 3.2: A 50 CYS SG : rot 160:sc= 1.07 USER MOD Set 3.3: A 55 SER OG : rot -160:sc= 2.37 USER MOD Set 4.1: A 12 SER OG : rot 180:sc= 0 USER MOD Set 4.2: A 16 ASN : amide:sc= 0.418 X(o=0.42,f=0.16) USER MOD Single : A 10 GLN : amide:sc= 0.185 K(o=0.19,f=-5!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 14:sc= 1.26 USER MOD Single : A 27 CYS SG : rot 76:sc= 0.893 USER MOD Single : A 30 LYS NZ :NH3+ -135:sc= 1.25 (180deg=0.273) USER MOD Single : A 39 HIS : no HE2:sc= -0.559 K(o=-0.56,f=-1.2) USER MOD Single : A 43 GLN : amide:sc= -0.23 X(o=-0.23,f=-0.03) USER MOD Single : A 44 THR OG1 : rot 180:sc= 0 USER MOD Single : A 47 GLN : amide:sc= -4.85! C(o=-4.8!,f=-7.8!) USER MOD Single : A 48 ASN : amide:sc= 1.68 K(o=1.7,f=-2.2!) USER MOD Single : A 62 THR OG1 : rot 132:sc= 0.033 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 SER OG : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= 0.534 K(o=0.53,f=0.0026) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 76 GLN : amide:sc= 0.757 K(o=0.76,f=-0.38) USER MOD Single : A 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 GLN : amide:sc= 0.624 K(o=0.62,f=-3.6!) USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 84 SER OG : rot 180:sc= 0.0179 USER MOD Single : A 87 TYR OH : rot 68:sc= -0.544 USER MOD Single : A 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 103 MET CE :methyl -135:sc= -1.84 (180deg=-3.67!) USER MOD Single : A 106 ASN : amide:sc= 1.18 K(o=1.2,f=-0.86) USER MOD Single : A 109 CYS SG : rot -179:sc= -0.561 USER MOD Single : A 113 LYS NZ :NH3+ -157:sc= 1.34 (180deg=0.832) USER MOD Single : A 119 HIS : no HE2:sc= -2.43 K(o=-2.4,f=-3.5!) USER MOD Single : A 124 MET CE :methyl 163:sc= -0.448 (180deg=-1) USER MOD Single : A 126 CYS SG : rot 92:sc= 0.00114 USER MOD Single : A 135 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 136 GLN : amide:sc= -0.0215 X(o=-0.021,f=-0.48) USER MOD Single : A 142 GLN : amide:sc=-0.00764 X(o=-0.0076,f=-0.3) USER MOD Single : A 143 GLN : amide:sc= 0.655 K(o=0.66,f=0) USER MOD ----------------------------------------------------------------- ATOM 36 N PRO A 4 -18.757 3.445 -10.100 1.00 1.00 N ATOM 37 CA PRO A 4 -18.703 2.849 -8.775 1.00 1.00 C ATOM 38 C PRO A 4 -17.380 3.128 -8.068 1.00 1.00 C ATOM 39 O PRO A 4 -16.349 3.384 -8.700 1.00 1.00 O ATOM 40 CB PRO A 4 -18.875 1.345 -9.009 1.00 1.00 C ATOM 41 CG PRO A 4 -18.189 1.145 -10.360 1.00 1.00 C ATOM 42 CD PRO A 4 -18.610 2.405 -11.111 1.00 1.00 C ATOM 0 HA PRO A 4 -19.475 3.267 -8.129 1.00 1.00 H new ATOM 0 HB2 PRO A 4 -18.405 0.755 -8.223 1.00 1.00 H new ATOM 0 HB3 PRO A 4 -19.925 1.056 -9.040 1.00 1.00 H new ATOM 0 HG2 PRO A 4 -17.106 1.070 -10.262 1.00 1.00 H new ATOM 0 HG3 PRO A 4 -18.528 0.238 -10.861 1.00 1.00 H new ATOM 0 HD2 PRO A 4 -17.862 2.685 -11.853 1.00 1.00 H new ATOM 0 HD3 PRO A 4 -19.546 2.246 -11.646 1.00 1.00 H new ATOM 50 N ARG A 5 -17.388 2.972 -6.745 1.00 1.00 N ATOM 51 CA ARG A 5 -16.203 3.022 -5.898 1.00 1.00 C ATOM 52 C ARG A 5 -16.268 2.012 -4.766 1.00 1.00 C ATOM 53 O ARG A 5 -15.231 1.741 -4.162 1.00 1.00 O ATOM 54 CB ARG A 5 -16.038 4.421 -5.288 1.00 1.00 C ATOM 55 CG ARG A 5 -15.717 5.563 -6.259 1.00 1.00 C ATOM 56 CD ARG A 5 -14.239 5.632 -6.660 1.00 1.00 C ATOM 57 NE ARG A 5 -13.843 4.637 -7.666 1.00 1.00 N ATOM 58 CZ ARG A 5 -12.583 4.234 -7.888 1.00 1.00 C ATOM 59 NH1 ARG A 5 -11.560 4.721 -7.187 1.00 1.00 N ATOM 60 NH2 ARG A 5 -12.358 3.303 -8.806 1.00 1.00 N ATOM 0 H ARG A 5 -18.246 2.802 -6.220 1.00 1.00 H new ATOM 0 HA ARG A 5 -15.353 2.781 -6.536 1.00 1.00 H new ATOM 0 HB2 ARG A 5 -16.958 4.672 -4.760 1.00 1.00 H new ATOM 0 HB3 ARG A 5 -15.244 4.375 -4.542 1.00 1.00 H new ATOM 0 HG2 ARG A 5 -16.323 5.446 -7.157 1.00 1.00 H new ATOM 0 HG3 ARG A 5 -16.005 6.509 -5.801 1.00 1.00 H new ATOM 0 HD2 ARG A 5 -14.025 6.628 -7.046 1.00 1.00 H new ATOM 0 HD3 ARG A 5 -13.625 5.496 -5.769 1.00 1.00 H new ATOM 0 HE ARG A 5 -14.580 4.223 -8.237 1.00 1.00 H new ATOM 0 HH11 ARG A 5 -11.725 5.418 -6.461 1.00 1.00 H new ATOM 0 HH12 ARG A 5 -10.612 4.397 -7.377 1.00 1.00 H new ATOM 0 HH21 ARG A 5 -13.137 2.905 -9.330 1.00 1.00 H new ATOM 0 HH22 ARG A 5 -11.406 2.985 -8.987 1.00 1.00 H new ATOM 74 N VAL A 6 -17.437 1.448 -4.469 1.00 1.00 N ATOM 75 CA VAL A 6 -17.591 0.522 -3.361 1.00 1.00 C ATOM 76 C VAL A 6 -18.468 -0.653 -3.794 1.00 1.00 C ATOM 77 O VAL A 6 -19.437 -0.480 -4.540 1.00 1.00 O ATOM 78 CB VAL A 6 -18.108 1.255 -2.101 1.00 1.00 C ATOM 79 CG1 VAL A 6 -17.158 2.382 -1.658 1.00 1.00 C ATOM 80 CG2 VAL A 6 -19.502 1.860 -2.285 1.00 1.00 C ATOM 0 H VAL A 6 -18.297 1.622 -4.990 1.00 1.00 H new ATOM 0 HA VAL A 6 -16.622 0.108 -3.081 1.00 1.00 H new ATOM 0 HB VAL A 6 -18.156 0.481 -1.335 1.00 1.00 H new ATOM 0 HG11 VAL A 6 -17.561 2.869 -0.770 1.00 1.00 H new ATOM 0 HG12 VAL A 6 -16.178 1.963 -1.429 1.00 1.00 H new ATOM 0 HG13 VAL A 6 -17.062 3.113 -2.461 1.00 1.00 H new ATOM 0 HG21 VAL A 6 -19.806 2.360 -1.365 1.00 1.00 H new ATOM 0 HG22 VAL A 6 -19.480 2.583 -3.100 1.00 1.00 H new ATOM 0 HG23 VAL A 6 -20.214 1.069 -2.521 1.00 1.00 H new ATOM 90 N VAL A 7 -18.157 -1.851 -3.306 1.00 1.00 N ATOM 91 CA VAL A 7 -19.087 -2.976 -3.282 1.00 1.00 C ATOM 92 C VAL A 7 -20.056 -2.760 -2.103 1.00 1.00 C ATOM 93 O VAL A 7 -19.778 -1.909 -1.255 1.00 1.00 O ATOM 94 CB VAL A 7 -18.302 -4.305 -3.235 1.00 1.00 C ATOM 95 CG1 VAL A 7 -17.238 -4.403 -4.333 1.00 1.00 C ATOM 96 CG2 VAL A 7 -17.607 -4.551 -1.899 1.00 1.00 C ATOM 0 H VAL A 7 -17.242 -2.070 -2.912 1.00 1.00 H new ATOM 0 HA VAL A 7 -19.689 -3.034 -4.189 1.00 1.00 H new ATOM 0 HB VAL A 7 -19.069 -5.064 -3.388 1.00 1.00 H new ATOM 0 HG11 VAL A 7 -16.718 -5.357 -4.251 1.00 1.00 H new ATOM 0 HG12 VAL A 7 -17.716 -4.332 -5.310 1.00 1.00 H new ATOM 0 HG13 VAL A 7 -16.522 -3.589 -4.220 1.00 1.00 H new ATOM 0 HG21 VAL A 7 -17.075 -5.501 -1.935 1.00 1.00 H new ATOM 0 HG22 VAL A 7 -16.899 -3.746 -1.704 1.00 1.00 H new ATOM 0 HG23 VAL A 7 -18.350 -4.582 -1.102 1.00 1.00 H new ATOM 106 N PRO A 8 -21.187 -3.484 -2.009 1.00 1.00 N ATOM 107 CA PRO A 8 -22.191 -3.182 -0.998 1.00 1.00 C ATOM 108 C PRO A 8 -21.660 -3.476 0.389 1.00 1.00 C ATOM 109 O PRO A 8 -21.549 -2.595 1.240 1.00 1.00 O ATOM 110 CB PRO A 8 -23.401 -4.047 -1.313 1.00 1.00 C ATOM 111 CG PRO A 8 -22.941 -5.083 -2.334 1.00 1.00 C ATOM 112 CD PRO A 8 -21.635 -4.542 -2.905 1.00 1.00 C ATOM 0 HA PRO A 8 -22.457 -2.125 -1.014 1.00 1.00 H new ATOM 0 HB2 PRO A 8 -23.776 -4.531 -0.412 1.00 1.00 H new ATOM 0 HB3 PRO A 8 -24.215 -3.443 -1.713 1.00 1.00 H new ATOM 0 HG2 PRO A 8 -22.791 -6.056 -1.866 1.00 1.00 H new ATOM 0 HG3 PRO A 8 -23.686 -5.218 -3.118 1.00 1.00 H new ATOM 0 HD2 PRO A 8 -20.887 -5.332 -2.974 1.00 1.00 H new ATOM 0 HD3 PRO A 8 -21.785 -4.156 -3.913 1.00 1.00 H new ATOM 120 N ASP A 9 -21.354 -4.749 0.609 1.00 1.00 N ATOM 121 CA ASP A 9 -20.655 -5.210 1.797 1.00 1.00 C ATOM 122 C ASP A 9 -19.159 -5.297 1.504 1.00 1.00 C ATOM 123 O ASP A 9 -18.637 -6.351 1.111 1.00 1.00 O ATOM 124 CB ASP A 9 -21.222 -6.523 2.333 1.00 1.00 C ATOM 125 CG ASP A 9 -20.665 -6.822 3.726 1.00 1.00 C ATOM 126 OD1 ASP A 9 -19.691 -6.168 4.164 1.00 1.00 O ATOM 127 OD2 ASP A 9 -21.238 -7.715 4.385 1.00 1.00 O ATOM 0 H ASP A 9 -21.588 -5.498 -0.043 1.00 1.00 H new ATOM 0 HA ASP A 9 -20.810 -4.484 2.595 1.00 1.00 H new ATOM 0 HB2 ASP A 9 -22.310 -6.465 2.375 1.00 1.00 H new ATOM 0 HB3 ASP A 9 -20.972 -7.338 1.653 1.00 1.00 H new ATOM 132 N GLN A 10 -18.484 -4.158 1.664 1.00 1.00 N ATOM 133 CA GLN A 10 -17.032 -4.039 1.571 1.00 1.00 C ATOM 134 C GLN A 10 -16.334 -5.012 2.528 1.00 1.00 C ATOM 135 O GLN A 10 -15.403 -5.703 2.117 1.00 1.00 O ATOM 136 CB GLN A 10 -16.577 -2.590 1.831 1.00 1.00 C ATOM 137 CG GLN A 10 -17.026 -1.587 0.753 1.00 1.00 C ATOM 138 CD GLN A 10 -16.193 -0.303 0.784 1.00 1.00 C ATOM 139 OE1 GLN A 10 -15.008 -0.306 0.447 1.00 1.00 O ATOM 140 NE2 GLN A 10 -16.779 0.820 1.155 1.00 1.00 N ATOM 0 H GLN A 10 -18.946 -3.271 1.867 1.00 1.00 H new ATOM 0 HA GLN A 10 -16.742 -4.305 0.554 1.00 1.00 H new ATOM 0 HB2 GLN A 10 -16.965 -2.267 2.797 1.00 1.00 H new ATOM 0 HB3 GLN A 10 -15.489 -2.569 1.901 1.00 1.00 H new ATOM 0 HG2 GLN A 10 -16.943 -2.050 -0.230 1.00 1.00 H new ATOM 0 HG3 GLN A 10 -18.077 -1.341 0.902 1.00 1.00 H new ATOM 0 HE21 GLN A 10 -17.760 0.816 1.433 1.00 1.00 H new ATOM 0 HE22 GLN A 10 -16.250 1.692 1.164 1.00 1.00 H new ATOM 149 N ARG A 11 -16.768 -5.100 3.789 1.00 1.00 N ATOM 150 CA ARG A 11 -16.112 -5.928 4.801 1.00 1.00 C ATOM 151 C ARG A 11 -16.211 -7.410 4.479 1.00 1.00 C ATOM 152 O ARG A 11 -15.250 -8.148 4.704 1.00 1.00 O ATOM 153 CB ARG A 11 -16.720 -5.663 6.188 1.00 1.00 C ATOM 154 CG ARG A 11 -15.715 -5.906 7.314 1.00 1.00 C ATOM 155 CD ARG A 11 -14.596 -4.856 7.245 1.00 1.00 C ATOM 156 NE ARG A 11 -14.241 -4.354 8.571 1.00 1.00 N ATOM 157 CZ ARG A 11 -14.922 -3.446 9.281 1.00 1.00 C ATOM 158 NH1 ARG A 11 -15.940 -2.770 8.753 1.00 1.00 N ATOM 159 NH2 ARG A 11 -14.583 -3.207 10.539 1.00 1.00 N ATOM 0 H ARG A 11 -17.585 -4.598 4.136 1.00 1.00 H new ATOM 0 HA ARG A 11 -15.057 -5.653 4.803 1.00 1.00 H new ATOM 0 HB2 ARG A 11 -17.076 -4.634 6.236 1.00 1.00 H new ATOM 0 HB3 ARG A 11 -17.587 -6.307 6.332 1.00 1.00 H new ATOM 0 HG2 ARG A 11 -16.217 -5.853 8.280 1.00 1.00 H new ATOM 0 HG3 ARG A 11 -15.293 -6.907 7.228 1.00 1.00 H new ATOM 0 HD2 ARG A 11 -13.716 -5.293 6.774 1.00 1.00 H new ATOM 0 HD3 ARG A 11 -14.915 -4.026 6.615 1.00 1.00 H new ATOM 0 HE ARG A 11 -13.394 -4.731 8.996 1.00 1.00 H new ATOM 0 HH11 ARG A 11 -16.217 -2.939 7.786 1.00 1.00 H new ATOM 0 HH12 ARG A 11 -16.443 -2.083 9.315 1.00 1.00 H new ATOM 0 HH21 ARG A 11 -13.806 -3.714 10.963 1.00 1.00 H new ATOM 0 HH22 ARG A 11 -15.099 -2.516 11.084 1.00 1.00 H new ATOM 173 N SER A 12 -17.343 -7.867 3.951 1.00 1.00 N ATOM 174 CA SER A 12 -17.440 -9.236 3.486 1.00 1.00 C ATOM 175 C SER A 12 -16.500 -9.431 2.304 1.00 1.00 C ATOM 176 O SER A 12 -15.794 -10.434 2.272 1.00 1.00 O ATOM 177 CB SER A 12 -18.900 -9.564 3.158 1.00 1.00 C ATOM 178 OG SER A 12 -19.018 -10.819 2.529 1.00 1.00 O ATOM 0 H SER A 12 -18.192 -7.314 3.838 1.00 1.00 H new ATOM 0 HA SER A 12 -17.128 -9.935 4.262 1.00 1.00 H new ATOM 0 HB2 SER A 12 -19.490 -9.558 4.074 1.00 1.00 H new ATOM 0 HB3 SER A 12 -19.311 -8.790 2.509 1.00 1.00 H new ATOM 0 HG SER A 12 -19.961 -11.000 2.334 1.00 1.00 H new ATOM 184 N LYS A 13 -16.424 -8.502 1.342 1.00 1.00 N ATOM 185 CA LYS A 13 -15.533 -8.696 0.197 1.00 1.00 C ATOM 186 C LYS A 13 -14.067 -8.734 0.618 1.00 1.00 C ATOM 187 O LYS A 13 -13.327 -9.545 0.076 1.00 1.00 O ATOM 188 CB LYS A 13 -15.760 -7.616 -0.854 1.00 1.00 C ATOM 189 CG LYS A 13 -15.229 -8.021 -2.242 1.00 1.00 C ATOM 190 CD LYS A 13 -16.327 -8.517 -3.186 1.00 1.00 C ATOM 191 CE LYS A 13 -17.092 -9.706 -2.600 1.00 1.00 C ATOM 192 NZ LYS A 13 -18.308 -10.017 -3.368 1.00 1.00 N ATOM 0 H LYS A 13 -16.955 -7.631 1.334 1.00 1.00 H new ATOM 0 HA LYS A 13 -15.774 -9.665 -0.240 1.00 1.00 H new ATOM 0 HB2 LYS A 13 -16.826 -7.402 -0.925 1.00 1.00 H new ATOM 0 HB3 LYS A 13 -15.270 -6.696 -0.536 1.00 1.00 H new ATOM 0 HG2 LYS A 13 -14.727 -7.166 -2.696 1.00 1.00 H new ATOM 0 HG3 LYS A 13 -14.480 -8.804 -2.123 1.00 1.00 H new ATOM 0 HD2 LYS A 13 -17.023 -7.704 -3.392 1.00 1.00 H new ATOM 0 HD3 LYS A 13 -15.883 -8.805 -4.139 1.00 1.00 H new ATOM 0 HE2 LYS A 13 -16.442 -10.581 -2.582 1.00 1.00 H new ATOM 0 HE3 LYS A 13 -17.363 -9.488 -1.567 1.00 1.00 H new ATOM 0 HZ1 LYS A 13 -18.794 -10.828 -2.935 1.00 1.00 H new ATOM 0 HZ2 LYS A 13 -18.941 -9.192 -3.364 1.00 1.00 H new ATOM 0 HZ3 LYS A 13 -18.049 -10.251 -4.348 1.00 1.00 H new ATOM 206 N PHE A 14 -13.670 -7.900 1.576 1.00 1.00 N ATOM 207 CA PHE A 14 -12.342 -7.856 2.177 1.00 1.00 C ATOM 208 C PHE A 14 -11.877 -9.250 2.623 1.00 1.00 C ATOM 209 O PHE A 14 -10.712 -9.612 2.428 1.00 1.00 O ATOM 210 CB PHE A 14 -12.410 -6.845 3.337 1.00 1.00 C ATOM 211 CG PHE A 14 -11.365 -6.997 4.418 1.00 1.00 C ATOM 212 CD1 PHE A 14 -10.017 -6.869 4.070 1.00 1.00 C ATOM 213 CD2 PHE A 14 -11.722 -7.256 5.755 1.00 1.00 C ATOM 214 CE1 PHE A 14 -9.014 -6.990 5.042 1.00 1.00 C ATOM 215 CE2 PHE A 14 -10.721 -7.358 6.739 1.00 1.00 C ATOM 216 CZ PHE A 14 -9.366 -7.222 6.382 1.00 1.00 C ATOM 0 H PHE A 14 -14.299 -7.202 1.973 1.00 1.00 H new ATOM 0 HA PHE A 14 -11.594 -7.533 1.453 1.00 1.00 H new ATOM 0 HB2 PHE A 14 -12.329 -5.841 2.921 1.00 1.00 H new ATOM 0 HB3 PHE A 14 -13.394 -6.920 3.799 1.00 1.00 H new ATOM 0 HD1 PHE A 14 -9.746 -6.675 3.043 1.00 1.00 H new ATOM 0 HD2 PHE A 14 -12.761 -7.376 6.025 1.00 1.00 H new ATOM 0 HE1 PHE A 14 -7.974 -6.905 4.762 1.00 1.00 H new ATOM 0 HE2 PHE A 14 -10.992 -7.541 7.768 1.00 1.00 H new ATOM 0 HZ PHE A 14 -8.598 -7.296 7.138 1.00 1.00 H new ATOM 226 N GLU A 15 -12.788 -10.027 3.209 1.00 1.00 N ATOM 227 CA GLU A 15 -12.561 -11.416 3.602 1.00 1.00 C ATOM 228 C GLU A 15 -12.690 -12.358 2.388 1.00 1.00 C ATOM 229 O GLU A 15 -11.880 -13.265 2.221 1.00 1.00 O ATOM 230 CB GLU A 15 -13.471 -11.750 4.816 1.00 1.00 C ATOM 231 CG GLU A 15 -14.723 -12.620 4.619 1.00 1.00 C ATOM 232 CD GLU A 15 -14.506 -14.132 4.758 1.00 1.00 C ATOM 233 OE1 GLU A 15 -13.529 -14.701 4.213 1.00 1.00 O ATOM 234 OE2 GLU A 15 -15.383 -14.792 5.359 1.00 1.00 O ATOM 0 H GLU A 15 -13.728 -9.698 3.429 1.00 1.00 H new ATOM 0 HA GLU A 15 -11.537 -11.571 3.943 1.00 1.00 H new ATOM 0 HB2 GLU A 15 -12.848 -12.242 5.563 1.00 1.00 H new ATOM 0 HB3 GLU A 15 -13.798 -10.804 5.247 1.00 1.00 H new ATOM 0 HG2 GLU A 15 -15.476 -12.311 5.343 1.00 1.00 H new ATOM 0 HG3 GLU A 15 -15.132 -12.419 3.629 1.00 1.00 H new ATOM 241 N ASN A 16 -13.690 -12.150 1.525 1.00 1.00 N ATOM 242 CA ASN A 16 -14.161 -13.134 0.559 1.00 1.00 C ATOM 243 C ASN A 16 -13.281 -13.220 -0.674 1.00 1.00 C ATOM 244 O ASN A 16 -13.046 -14.333 -1.155 1.00 1.00 O ATOM 245 CB ASN A 16 -15.585 -12.797 0.091 1.00 1.00 C ATOM 246 CG ASN A 16 -16.636 -13.585 0.845 1.00 1.00 C ATOM 247 OD1 ASN A 16 -17.058 -14.641 0.388 1.00 1.00 O ATOM 248 ND2 ASN A 16 -17.105 -13.085 1.967 1.00 1.00 N ATOM 0 H ASN A 16 -14.203 -11.270 1.482 1.00 1.00 H new ATOM 0 HA ASN A 16 -14.134 -14.092 1.078 1.00 1.00 H new ATOM 0 HB2 ASN A 16 -15.767 -11.731 0.225 1.00 1.00 H new ATOM 0 HB3 ASN A 16 -15.674 -13.004 -0.976 1.00 1.00 H new ATOM 0 HD21 ASN A 16 -17.837 -13.578 2.478 1.00 1.00 H new ATOM 0 HD22 ASN A 16 -16.737 -12.204 2.326 1.00 1.00 H new ATOM 255 N GLU A 17 -12.914 -12.073 -1.260 1.00 1.00 N ATOM 256 CA GLU A 17 -12.157 -12.029 -2.502 1.00 1.00 C ATOM 257 C GLU A 17 -10.896 -12.883 -2.408 1.00 1.00 C ATOM 258 O GLU A 17 -9.982 -12.586 -1.636 1.00 1.00 O ATOM 259 CB GLU A 17 -11.819 -10.577 -2.848 1.00 1.00 C ATOM 260 CG GLU A 17 -12.759 -9.980 -3.882 1.00 1.00 C ATOM 261 CD GLU A 17 -12.268 -10.238 -5.303 1.00 1.00 C ATOM 262 OE1 GLU A 17 -12.275 -11.413 -5.733 1.00 1.00 O ATOM 263 OE2 GLU A 17 -11.911 -9.271 -6.011 1.00 1.00 O ATOM 0 H GLU A 17 -13.137 -11.153 -0.880 1.00 1.00 H new ATOM 0 HA GLU A 17 -12.769 -12.446 -3.302 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -11.856 -9.975 -1.940 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -10.797 -10.527 -3.222 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -13.755 -10.405 -3.758 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -12.848 -8.906 -3.717 1.00 1.00 H new ATOM 270 N GLU A 18 -10.822 -13.935 -3.223 1.00 1.00 N ATOM 271 CA GLU A 18 -9.663 -14.810 -3.275 1.00 1.00 C ATOM 272 C GLU A 18 -8.434 -14.036 -3.772 1.00 1.00 C ATOM 273 O GLU A 18 -7.310 -14.377 -3.411 1.00 1.00 O ATOM 274 CB GLU A 18 -10.007 -16.051 -4.113 1.00 1.00 C ATOM 275 CG GLU A 18 -9.229 -17.303 -3.676 1.00 1.00 C ATOM 276 CD GLU A 18 -7.847 -17.463 -4.311 1.00 1.00 C ATOM 277 OE1 GLU A 18 -7.742 -17.377 -5.555 1.00 1.00 O ATOM 278 OE2 GLU A 18 -6.882 -17.851 -3.611 1.00 1.00 O ATOM 0 H GLU A 18 -11.569 -14.201 -3.865 1.00 1.00 H new ATOM 0 HA GLU A 18 -9.399 -15.167 -2.279 1.00 1.00 H new ATOM 0 HB2 GLU A 18 -11.076 -16.249 -4.037 1.00 1.00 H new ATOM 0 HB3 GLU A 18 -9.794 -15.845 -5.162 1.00 1.00 H new ATOM 0 HG2 GLU A 18 -9.113 -17.280 -2.592 1.00 1.00 H new ATOM 0 HG3 GLU A 18 -9.825 -18.184 -3.914 1.00 1.00 H new ATOM 285 N PHE A 19 -8.634 -12.916 -4.484 1.00 1.00 N ATOM 286 CA PHE A 19 -7.581 -11.965 -4.778 1.00 1.00 C ATOM 287 C PHE A 19 -6.918 -11.503 -3.472 1.00 1.00 C ATOM 288 O PHE A 19 -5.691 -11.515 -3.376 1.00 1.00 O ATOM 289 CB PHE A 19 -8.134 -10.808 -5.630 1.00 1.00 C ATOM 290 CG PHE A 19 -7.041 -9.849 -6.055 1.00 1.00 C ATOM 291 CD1 PHE A 19 -6.582 -8.900 -5.130 1.00 1.00 C ATOM 292 CD2 PHE A 19 -6.399 -9.973 -7.302 1.00 1.00 C ATOM 293 CE1 PHE A 19 -5.449 -8.115 -5.410 1.00 1.00 C ATOM 294 CE2 PHE A 19 -5.260 -9.195 -7.580 1.00 1.00 C ATOM 295 CZ PHE A 19 -4.766 -8.288 -6.627 1.00 1.00 C ATOM 0 H PHE A 19 -9.542 -12.654 -4.869 1.00 1.00 H new ATOM 0 HA PHE A 19 -6.801 -12.437 -5.374 1.00 1.00 H new ATOM 0 HB2 PHE A 19 -8.627 -11.211 -6.514 1.00 1.00 H new ATOM 0 HB3 PHE A 19 -8.891 -10.268 -5.061 1.00 1.00 H new ATOM 0 HD1 PHE A 19 -7.104 -8.771 -4.193 1.00 1.00 H new ATOM 0 HD2 PHE A 19 -6.779 -10.662 -8.042 1.00 1.00 H new ATOM 0 HE1 PHE A 19 -5.105 -7.383 -4.694 1.00 1.00 H new ATOM 0 HE2 PHE A 19 -4.762 -9.296 -8.533 1.00 1.00 H new ATOM 0 HZ PHE A 19 -3.866 -7.726 -6.828 1.00 1.00 H new ATOM 305 N PHE A 20 -7.682 -11.113 -2.448 1.00 1.00 N ATOM 306 CA PHE A 20 -7.105 -10.752 -1.164 1.00 1.00 C ATOM 307 C PHE A 20 -6.650 -11.955 -0.363 1.00 1.00 C ATOM 308 O PHE A 20 -5.711 -11.800 0.416 1.00 1.00 O ATOM 309 CB PHE A 20 -8.130 -9.969 -0.357 1.00 1.00 C ATOM 310 CG PHE A 20 -8.742 -8.759 -1.038 1.00 1.00 C ATOM 311 CD1 PHE A 20 -7.976 -7.842 -1.783 1.00 1.00 C ATOM 312 CD2 PHE A 20 -10.122 -8.563 -0.924 1.00 1.00 C ATOM 313 CE1 PHE A 20 -8.590 -6.732 -2.388 1.00 1.00 C ATOM 314 CE2 PHE A 20 -10.747 -7.470 -1.545 1.00 1.00 C ATOM 315 CZ PHE A 20 -9.980 -6.546 -2.275 1.00 1.00 C ATOM 0 H PHE A 20 -8.699 -11.041 -2.489 1.00 1.00 H new ATOM 0 HA PHE A 20 -6.221 -10.147 -1.365 1.00 1.00 H new ATOM 0 HB2 PHE A 20 -8.936 -10.648 -0.077 1.00 1.00 H new ATOM 0 HB3 PHE A 20 -7.657 -9.638 0.567 1.00 1.00 H new ATOM 0 HD1 PHE A 20 -6.912 -7.992 -1.890 1.00 1.00 H new ATOM 0 HD2 PHE A 20 -10.714 -9.261 -0.351 1.00 1.00 H new ATOM 0 HE1 PHE A 20 -7.994 -6.021 -2.940 1.00 1.00 H new ATOM 0 HE2 PHE A 20 -11.816 -7.339 -1.462 1.00 1.00 H new ATOM 0 HZ PHE A 20 -10.455 -5.698 -2.746 1.00 1.00 H new ATOM 325 N ARG A 21 -7.223 -13.148 -0.543 1.00 1.00 N ATOM 326 CA ARG A 21 -6.659 -14.330 0.109 1.00 1.00 C ATOM 327 C ARG A 21 -5.235 -14.572 -0.357 1.00 1.00 C ATOM 328 O ARG A 21 -4.396 -14.886 0.476 1.00 1.00 O ATOM 329 CB ARG A 21 -7.506 -15.588 -0.102 1.00 1.00 C ATOM 330 CG ARG A 21 -8.911 -15.493 0.499 1.00 1.00 C ATOM 331 CD ARG A 21 -8.904 -15.132 1.990 1.00 1.00 C ATOM 332 NE ARG A 21 -10.199 -15.438 2.599 1.00 1.00 N ATOM 333 CZ ARG A 21 -10.640 -16.647 2.947 1.00 1.00 C ATOM 334 NH1 ARG A 21 -9.824 -17.698 2.934 1.00 1.00 N ATOM 335 NH2 ARG A 21 -11.908 -16.792 3.299 1.00 1.00 N ATOM 0 H ARG A 21 -8.050 -13.318 -1.115 1.00 1.00 H new ATOM 0 HA ARG A 21 -6.658 -14.122 1.179 1.00 1.00 H new ATOM 0 HB2 ARG A 21 -7.590 -15.783 -1.171 1.00 1.00 H new ATOM 0 HB3 ARG A 21 -6.989 -16.441 0.338 1.00 1.00 H new ATOM 0 HG2 ARG A 21 -9.484 -14.744 -0.048 1.00 1.00 H new ATOM 0 HG3 ARG A 21 -9.423 -16.446 0.364 1.00 1.00 H new ATOM 0 HD2 ARG A 21 -8.116 -15.686 2.500 1.00 1.00 H new ATOM 0 HD3 ARG A 21 -8.680 -14.072 2.112 1.00 1.00 H new ATOM 0 HE ARG A 21 -10.824 -14.651 2.774 1.00 1.00 H new ATOM 0 HH11 ARG A 21 -8.849 -17.584 2.656 1.00 1.00 H new ATOM 0 HH12 ARG A 21 -10.173 -18.618 3.202 1.00 1.00 H new ATOM 0 HH21 ARG A 21 -12.532 -15.985 3.301 1.00 1.00 H new ATOM 0 HH22 ARG A 21 -12.261 -17.710 3.568 1.00 1.00 H new ATOM 349 N LYS A 22 -4.910 -14.338 -1.627 1.00 1.00 N ATOM 350 CA LYS A 22 -3.540 -14.489 -2.117 1.00 1.00 C ATOM 351 C LYS A 22 -2.581 -13.583 -1.346 1.00 1.00 C ATOM 352 O LYS A 22 -1.504 -14.019 -0.944 1.00 1.00 O ATOM 353 CB LYS A 22 -3.490 -14.191 -3.618 1.00 1.00 C ATOM 354 CG LYS A 22 -4.183 -15.317 -4.391 1.00 1.00 C ATOM 355 CD LYS A 22 -4.338 -14.969 -5.870 1.00 1.00 C ATOM 356 CE LYS A 22 -5.137 -16.082 -6.545 1.00 1.00 C ATOM 357 NZ LYS A 22 -5.224 -15.908 -8.005 1.00 1.00 N ATOM 0 H LYS A 22 -5.579 -14.042 -2.338 1.00 1.00 H new ATOM 0 HA LYS A 22 -3.221 -15.518 -1.954 1.00 1.00 H new ATOM 0 HB2 LYS A 22 -3.979 -13.239 -3.826 1.00 1.00 H new ATOM 0 HB3 LYS A 22 -2.455 -14.096 -3.945 1.00 1.00 H new ATOM 0 HG2 LYS A 22 -3.606 -16.236 -4.291 1.00 1.00 H new ATOM 0 HG3 LYS A 22 -5.164 -15.507 -3.956 1.00 1.00 H new ATOM 0 HD2 LYS A 22 -4.849 -14.013 -5.983 1.00 1.00 H new ATOM 0 HD3 LYS A 22 -3.360 -14.865 -6.340 1.00 1.00 H new ATOM 0 HE2 LYS A 22 -4.673 -17.043 -6.324 1.00 1.00 H new ATOM 0 HE3 LYS A 22 -6.142 -16.109 -6.125 1.00 1.00 H new ATOM 0 HZ1 LYS A 22 -5.776 -16.688 -8.415 1.00 1.00 H new ATOM 0 HZ2 LYS A 22 -5.691 -15.004 -8.220 1.00 1.00 H new ATOM 0 HZ3 LYS A 22 -4.267 -15.909 -8.412 1.00 1.00 H new ATOM 371 N LEU A 23 -2.955 -12.313 -1.182 1.00 1.00 N ATOM 372 CA LEU A 23 -2.154 -11.292 -0.505 1.00 1.00 C ATOM 373 C LEU A 23 -2.196 -11.446 1.017 1.00 1.00 C ATOM 374 O LEU A 23 -1.303 -10.972 1.709 1.00 1.00 O ATOM 375 CB LEU A 23 -2.620 -9.895 -0.942 1.00 1.00 C ATOM 376 CG LEU A 23 -2.664 -9.697 -2.473 1.00 1.00 C ATOM 377 CD1 LEU A 23 -2.821 -8.217 -2.826 1.00 1.00 C ATOM 378 CD2 LEU A 23 -1.453 -10.292 -3.209 1.00 1.00 C ATOM 0 H LEU A 23 -3.847 -11.957 -1.525 1.00 1.00 H new ATOM 0 HA LEU A 23 -1.113 -11.424 -0.799 1.00 1.00 H new ATOM 0 HB2 LEU A 23 -3.614 -9.711 -0.534 1.00 1.00 H new ATOM 0 HB3 LEU A 23 -1.954 -9.149 -0.509 1.00 1.00 H new ATOM 0 HG LEU A 23 -3.537 -10.250 -2.818 1.00 1.00 H new ATOM 0 HD11 LEU A 23 -2.849 -8.102 -3.910 1.00 1.00 H new ATOM 0 HD12 LEU A 23 -3.748 -7.837 -2.396 1.00 1.00 H new ATOM 0 HD13 LEU A 23 -1.978 -7.656 -2.424 1.00 1.00 H new ATOM 0 HD21 LEU A 23 -1.554 -10.114 -4.280 1.00 1.00 H new ATOM 0 HD22 LEU A 23 -0.540 -9.820 -2.848 1.00 1.00 H new ATOM 0 HD23 LEU A 23 -1.405 -11.365 -3.023 1.00 1.00 H new ATOM 390 N SER A 24 -3.201 -12.172 1.506 1.00 1.00 N ATOM 391 CA SER A 24 -3.377 -12.710 2.820 1.00 1.00 C ATOM 392 C SER A 24 -3.317 -11.667 3.955 1.00 1.00 C ATOM 393 O SER A 24 -3.484 -10.462 3.725 1.00 1.00 O ATOM 394 CB SER A 24 -2.357 -13.840 2.917 1.00 1.00 C ATOM 395 OG SER A 24 -2.848 -15.094 2.477 1.00 1.00 O ATOM 0 H SER A 24 -3.991 -12.414 0.908 1.00 1.00 H new ATOM 0 HA SER A 24 -4.389 -13.089 2.965 1.00 1.00 H new ATOM 0 HB2 SER A 24 -1.480 -13.576 2.326 1.00 1.00 H new ATOM 0 HB3 SER A 24 -2.028 -13.932 3.952 1.00 1.00 H new ATOM 0 HG SER A 24 -3.684 -14.963 1.983 1.00 1.00 H new ATOM 401 N ARG A 25 -3.237 -12.149 5.201 1.00 1.00 N ATOM 402 CA ARG A 25 -2.810 -11.372 6.365 1.00 1.00 C ATOM 403 C ARG A 25 -1.280 -11.371 6.388 1.00 1.00 C ATOM 404 O ARG A 25 -0.683 -11.678 5.361 1.00 1.00 O ATOM 405 CB ARG A 25 -3.461 -11.937 7.639 1.00 1.00 C ATOM 406 CG ARG A 25 -4.983 -11.852 7.486 1.00 1.00 C ATOM 407 CD ARG A 25 -5.747 -12.111 8.779 1.00 1.00 C ATOM 408 NE ARG A 25 -7.169 -11.851 8.526 1.00 1.00 N ATOM 409 CZ ARG A 25 -8.060 -11.300 9.349 1.00 1.00 C ATOM 410 NH1 ARG A 25 -7.758 -11.054 10.620 1.00 1.00 N ATOM 411 NH2 ARG A 25 -9.251 -10.954 8.880 1.00 1.00 N ATOM 0 H ARG A 25 -3.474 -13.114 5.431 1.00 1.00 H new ATOM 0 HA ARG A 25 -3.139 -10.334 6.310 1.00 1.00 H new ATOM 0 HB2 ARG A 25 -3.153 -12.971 7.795 1.00 1.00 H new ATOM 0 HB3 ARG A 25 -3.136 -11.372 8.513 1.00 1.00 H new ATOM 0 HG2 ARG A 25 -5.246 -10.863 7.111 1.00 1.00 H new ATOM 0 HG3 ARG A 25 -5.304 -12.573 6.735 1.00 1.00 H new ATOM 0 HD2 ARG A 25 -5.601 -13.140 9.109 1.00 1.00 H new ATOM 0 HD3 ARG A 25 -5.378 -11.465 9.576 1.00 1.00 H new ATOM 0 HE ARG A 25 -7.518 -12.126 7.608 1.00 1.00 H new ATOM 0 HH11 ARG A 25 -6.832 -11.288 10.979 1.00 1.00 H new ATOM 0 HH12 ARG A 25 -8.452 -10.632 11.237 1.00 1.00 H new ATOM 0 HH21 ARG A 25 -9.477 -11.110 7.898 1.00 1.00 H new ATOM 0 HH22 ARG A 25 -9.941 -10.531 9.501 1.00 1.00 H new ATOM 425 N GLU A 26 -0.638 -10.940 7.478 1.00 1.00 N ATOM 426 CA GLU A 26 0.799 -10.665 7.555 1.00 1.00 C ATOM 427 C GLU A 26 1.628 -11.770 6.883 1.00 1.00 C ATOM 428 O GLU A 26 1.554 -12.937 7.278 1.00 1.00 O ATOM 429 CB GLU A 26 1.220 -10.303 8.991 1.00 1.00 C ATOM 430 CG GLU A 26 1.017 -11.364 10.080 1.00 1.00 C ATOM 431 CD GLU A 26 -0.444 -11.642 10.446 1.00 1.00 C ATOM 432 OE1 GLU A 26 -1.320 -10.758 10.271 1.00 1.00 O ATOM 433 OE2 GLU A 26 -0.698 -12.747 10.978 1.00 1.00 O ATOM 0 H GLU A 26 -1.121 -10.767 8.360 1.00 1.00 H new ATOM 0 HA GLU A 26 1.021 -9.774 6.968 1.00 1.00 H new ATOM 0 HB2 GLU A 26 2.277 -10.037 8.974 1.00 1.00 H new ATOM 0 HB3 GLU A 26 0.671 -9.409 9.287 1.00 1.00 H new ATOM 0 HG2 GLU A 26 1.477 -12.295 9.750 1.00 1.00 H new ATOM 0 HG3 GLU A 26 1.547 -11.048 10.978 1.00 1.00 H new ATOM 440 N CYS A 27 2.348 -11.412 5.817 1.00 1.00 N ATOM 441 CA CYS A 27 3.147 -12.271 4.955 1.00 1.00 C ATOM 442 C CYS A 27 4.398 -11.529 4.481 1.00 1.00 C ATOM 443 O CYS A 27 4.581 -10.342 4.706 1.00 1.00 O ATOM 444 CB CYS A 27 2.341 -12.647 3.709 1.00 1.00 C ATOM 445 SG CYS A 27 1.039 -13.854 4.062 1.00 1.00 S ATOM 0 H CYS A 27 2.387 -10.438 5.515 1.00 1.00 H new ATOM 0 HA CYS A 27 3.423 -13.159 5.524 1.00 1.00 H new ATOM 0 HB2 CYS A 27 1.893 -11.748 3.285 1.00 1.00 H new ATOM 0 HB3 CYS A 27 3.014 -13.054 2.954 1.00 1.00 H new ATOM 0 HG CYS A 27 0.051 -13.263 4.665 1.00 1.00 H new ATOM 451 N GLU A 28 5.262 -12.232 3.770 1.00 1.00 N ATOM 452 CA GLU A 28 6.443 -11.663 3.144 1.00 1.00 C ATOM 453 C GLU A 28 6.066 -10.975 1.816 1.00 1.00 C ATOM 454 O GLU A 28 5.187 -11.449 1.078 1.00 1.00 O ATOM 455 CB GLU A 28 7.435 -12.812 2.953 1.00 1.00 C ATOM 456 CG GLU A 28 8.834 -12.345 2.553 1.00 1.00 C ATOM 457 CD GLU A 28 9.747 -11.934 3.714 1.00 1.00 C ATOM 458 OE1 GLU A 28 9.296 -11.715 4.861 1.00 1.00 O ATOM 459 OE2 GLU A 28 10.980 -11.931 3.471 1.00 1.00 O ATOM 0 H GLU A 28 5.160 -13.234 3.608 1.00 1.00 H new ATOM 0 HA GLU A 28 6.898 -10.888 3.761 1.00 1.00 H new ATOM 0 HB2 GLU A 28 7.501 -13.383 3.879 1.00 1.00 H new ATOM 0 HB3 GLU A 28 7.053 -13.489 2.188 1.00 1.00 H new ATOM 0 HG2 GLU A 28 9.321 -13.146 1.996 1.00 1.00 H new ATOM 0 HG3 GLU A 28 8.736 -11.499 1.873 1.00 1.00 H new ATOM 466 N ILE A 29 6.772 -9.889 1.480 1.00 1.00 N ATOM 467 CA ILE A 29 6.617 -9.049 0.294 1.00 1.00 C ATOM 468 C ILE A 29 7.981 -8.691 -0.314 1.00 1.00 C ATOM 469 O ILE A 29 9.034 -8.840 0.310 1.00 1.00 O ATOM 470 CB ILE A 29 5.813 -7.762 0.615 1.00 1.00 C ATOM 471 CG1 ILE A 29 6.483 -6.960 1.742 1.00 1.00 C ATOM 472 CG2 ILE A 29 4.344 -8.084 0.930 1.00 1.00 C ATOM 473 CD1 ILE A 29 5.932 -5.545 1.914 1.00 1.00 C ATOM 0 H ILE A 29 7.525 -9.551 2.080 1.00 1.00 H new ATOM 0 HA ILE A 29 6.055 -9.625 -0.441 1.00 1.00 H new ATOM 0 HB ILE A 29 5.815 -7.132 -0.275 1.00 1.00 H new ATOM 0 HG12 ILE A 29 6.362 -7.502 2.680 1.00 1.00 H new ATOM 0 HG13 ILE A 29 7.553 -6.900 1.544 1.00 1.00 H new ATOM 0 HG21 ILE A 29 3.808 -7.161 1.151 1.00 1.00 H new ATOM 0 HG22 ILE A 29 3.886 -8.573 0.070 1.00 1.00 H new ATOM 0 HG23 ILE A 29 4.294 -8.748 1.793 1.00 1.00 H new ATOM 0 HD11 ILE A 29 6.457 -5.047 2.729 1.00 1.00 H new ATOM 0 HD12 ILE A 29 6.077 -4.983 0.991 1.00 1.00 H new ATOM 0 HD13 ILE A 29 4.868 -5.594 2.145 1.00 1.00 H new ATOM 485 N LYS A 30 7.947 -8.183 -1.546 1.00 1.00 N ATOM 486 CA LYS A 30 9.114 -7.719 -2.302 1.00 1.00 C ATOM 487 C LYS A 30 8.779 -6.382 -2.959 1.00 1.00 C ATOM 488 O LYS A 30 7.692 -6.285 -3.513 1.00 1.00 O ATOM 489 CB LYS A 30 9.439 -8.772 -3.380 1.00 1.00 C ATOM 490 CG LYS A 30 10.916 -8.737 -3.781 1.00 1.00 C ATOM 491 CD LYS A 30 11.794 -9.532 -2.827 1.00 1.00 C ATOM 492 CE LYS A 30 11.692 -11.054 -2.922 1.00 1.00 C ATOM 493 NZ LYS A 30 12.438 -11.687 -1.815 1.00 1.00 N ATOM 0 H LYS A 30 7.075 -8.079 -2.065 1.00 1.00 H new ATOM 0 HA LYS A 30 9.974 -7.586 -1.646 1.00 1.00 H new ATOM 0 HB2 LYS A 30 9.187 -9.765 -3.006 1.00 1.00 H new ATOM 0 HB3 LYS A 30 8.819 -8.596 -4.259 1.00 1.00 H new ATOM 0 HG2 LYS A 30 11.026 -9.136 -4.789 1.00 1.00 H new ATOM 0 HG3 LYS A 30 11.258 -7.702 -3.809 1.00 1.00 H new ATOM 0 HD2 LYS A 30 12.832 -9.247 -3.000 1.00 1.00 H new ATOM 0 HD3 LYS A 30 11.547 -9.236 -1.808 1.00 1.00 H new ATOM 0 HE2 LYS A 30 10.646 -11.358 -2.886 1.00 1.00 H new ATOM 0 HE3 LYS A 30 12.090 -11.393 -3.879 1.00 1.00 H new ATOM 0 HZ1 LYS A 30 13.006 -12.476 -2.185 1.00 1.00 H new ATOM 0 HZ2 LYS A 30 13.066 -10.985 -1.374 1.00 1.00 H new ATOM 0 HZ3 LYS A 30 11.768 -12.046 -1.105 1.00 1.00 H new ATOM 507 N TYR A 31 9.628 -5.348 -2.950 1.00 1.00 N ATOM 508 CA TYR A 31 9.358 -4.198 -3.811 1.00 1.00 C ATOM 509 C TYR A 31 9.664 -4.594 -5.260 1.00 1.00 C ATOM 510 O TYR A 31 10.608 -5.348 -5.489 1.00 1.00 O ATOM 511 CB TYR A 31 10.217 -3.022 -3.354 1.00 1.00 C ATOM 512 CG TYR A 31 9.539 -1.678 -3.457 1.00 1.00 C ATOM 513 CD1 TYR A 31 9.257 -1.101 -4.705 1.00 1.00 C ATOM 514 CD2 TYR A 31 9.164 -1.011 -2.282 1.00 1.00 C ATOM 515 CE1 TYR A 31 8.710 0.189 -4.783 1.00 1.00 C ATOM 516 CE2 TYR A 31 8.544 0.245 -2.359 1.00 1.00 C ATOM 517 CZ TYR A 31 8.392 0.883 -3.595 1.00 1.00 C ATOM 518 OH TYR A 31 7.975 2.177 -3.608 1.00 1.00 O ATOM 0 H TYR A 31 10.472 -5.284 -2.381 1.00 1.00 H new ATOM 0 HA TYR A 31 8.313 -3.895 -3.748 1.00 1.00 H new ATOM 0 HB2 TYR A 31 10.515 -3.186 -2.319 1.00 1.00 H new ATOM 0 HB3 TYR A 31 11.130 -3.001 -3.949 1.00 1.00 H new ATOM 0 HD1 TYR A 31 9.462 -1.653 -5.610 1.00 1.00 H new ATOM 0 HD2 TYR A 31 9.352 -1.463 -1.320 1.00 1.00 H new ATOM 0 HE1 TYR A 31 8.534 0.648 -5.745 1.00 1.00 H new ATOM 0 HE2 TYR A 31 8.182 0.722 -1.460 1.00 1.00 H new ATOM 0 HH TYR A 31 7.609 2.412 -2.730 1.00 1.00 H new ATOM 528 N THR A 32 8.934 -4.063 -6.240 1.00 1.00 N ATOM 529 CA THR A 32 9.081 -4.439 -7.645 1.00 1.00 C ATOM 530 C THR A 32 8.965 -3.200 -8.541 1.00 1.00 C ATOM 531 O THR A 32 8.197 -3.193 -9.500 1.00 1.00 O ATOM 532 CB THR A 32 8.056 -5.546 -7.975 1.00 1.00 C ATOM 533 OG1 THR A 32 6.756 -5.200 -7.537 1.00 1.00 O ATOM 534 CG2 THR A 32 8.421 -6.867 -7.297 1.00 1.00 C ATOM 0 H THR A 32 8.218 -3.354 -6.080 1.00 1.00 H new ATOM 0 HA THR A 32 10.072 -4.850 -7.837 1.00 1.00 H new ATOM 0 HB THR A 32 8.074 -5.655 -9.059 1.00 1.00 H new ATOM 0 HG1 THR A 32 6.108 -5.839 -7.899 1.00 1.00 H new ATOM 0 HG21 THR A 32 7.679 -7.624 -7.551 1.00 1.00 H new ATOM 0 HG22 THR A 32 9.403 -7.193 -7.640 1.00 1.00 H new ATOM 0 HG23 THR A 32 8.442 -6.728 -6.216 1.00 1.00 H new ATOM 542 N GLY A 33 9.705 -2.132 -8.231 1.00 1.00 N ATOM 543 CA GLY A 33 9.611 -0.847 -8.913 1.00 1.00 C ATOM 544 C GLY A 33 10.977 -0.392 -9.412 1.00 1.00 C ATOM 545 O GLY A 33 11.758 -1.194 -9.927 1.00 1.00 O ATOM 0 H GLY A 33 10.399 -2.141 -7.483 1.00 1.00 H new ATOM 0 HA2 GLY A 33 8.921 -0.927 -9.753 1.00 1.00 H new ATOM 0 HA3 GLY A 33 9.201 -0.100 -8.234 1.00 1.00 H new ATOM 549 N PHE A 34 11.281 0.893 -9.221 1.00 1.00 N ATOM 550 CA PHE A 34 12.476 1.614 -9.642 1.00 1.00 C ATOM 551 C PHE A 34 13.772 0.944 -9.166 1.00 1.00 C ATOM 552 O PHE A 34 14.818 1.133 -9.793 1.00 1.00 O ATOM 553 CB PHE A 34 12.357 3.050 -9.100 1.00 1.00 C ATOM 554 CG PHE A 34 11.946 3.063 -7.643 1.00 1.00 C ATOM 555 CD1 PHE A 34 12.910 2.799 -6.662 1.00 1.00 C ATOM 556 CD2 PHE A 34 10.589 3.127 -7.289 1.00 1.00 C ATOM 557 CE1 PHE A 34 12.536 2.586 -5.328 1.00 1.00 C ATOM 558 CE2 PHE A 34 10.209 2.894 -5.960 1.00 1.00 C ATOM 559 CZ PHE A 34 11.175 2.629 -4.974 1.00 1.00 C ATOM 0 H PHE A 34 10.637 1.507 -8.723 1.00 1.00 H new ATOM 0 HA PHE A 34 12.536 1.612 -10.730 1.00 1.00 H new ATOM 0 HB2 PHE A 34 13.312 3.563 -9.214 1.00 1.00 H new ATOM 0 HB3 PHE A 34 11.626 3.603 -9.690 1.00 1.00 H new ATOM 0 HD1 PHE A 34 13.954 2.759 -6.937 1.00 1.00 H new ATOM 0 HD2 PHE A 34 9.843 3.354 -8.036 1.00 1.00 H new ATOM 0 HE1 PHE A 34 13.287 2.390 -4.577 1.00 1.00 H new ATOM 0 HE2 PHE A 34 9.163 2.918 -5.691 1.00 1.00 H new ATOM 0 HZ PHE A 34 10.874 2.459 -3.951 1.00 1.00 H new ATOM 569 N ARG A 35 13.720 0.160 -8.078 1.00 1.00 N ATOM 570 CA ARG A 35 14.835 -0.688 -7.628 1.00 1.00 C ATOM 571 C ARG A 35 15.332 -1.687 -8.681 1.00 1.00 C ATOM 572 O ARG A 35 16.344 -2.333 -8.432 1.00 1.00 O ATOM 573 CB ARG A 35 14.526 -1.433 -6.309 1.00 1.00 C ATOM 574 CG ARG A 35 13.678 -2.718 -6.463 1.00 1.00 C ATOM 575 CD ARG A 35 13.831 -3.647 -5.252 1.00 1.00 C ATOM 576 NE ARG A 35 13.459 -5.026 -5.596 1.00 1.00 N ATOM 577 CZ ARG A 35 13.667 -6.125 -4.862 1.00 1.00 C ATOM 578 NH1 ARG A 35 14.163 -6.059 -3.632 1.00 1.00 N ATOM 579 NH2 ARG A 35 13.408 -7.310 -5.388 1.00 1.00 N ATOM 0 H ARG A 35 12.896 0.096 -7.481 1.00 1.00 H new ATOM 0 HA ARG A 35 15.643 0.022 -7.451 1.00 1.00 H new ATOM 0 HB2 ARG A 35 15.469 -1.694 -5.828 1.00 1.00 H new ATOM 0 HB3 ARG A 35 14.004 -0.750 -5.638 1.00 1.00 H new ATOM 0 HG2 ARG A 35 12.629 -2.449 -6.585 1.00 1.00 H new ATOM 0 HG3 ARG A 35 13.979 -3.247 -7.368 1.00 1.00 H new ATOM 0 HD2 ARG A 35 14.862 -3.622 -4.898 1.00 1.00 H new ATOM 0 HD3 ARG A 35 13.204 -3.291 -4.434 1.00 1.00 H new ATOM 0 HE ARG A 35 12.991 -5.160 -6.492 1.00 1.00 H new ATOM 0 HH11 ARG A 35 14.396 -5.154 -3.224 1.00 1.00 H new ATOM 0 HH12 ARG A 35 14.311 -6.914 -3.095 1.00 1.00 H new ATOM 0 HH21 ARG A 35 13.054 -7.378 -6.342 1.00 1.00 H new ATOM 0 HH22 ARG A 35 13.562 -8.156 -4.840 1.00 1.00 H new ATOM 593 N ASP A 36 14.650 -1.855 -9.818 1.00 1.00 N ATOM 594 CA ASP A 36 15.123 -2.718 -10.909 1.00 1.00 C ATOM 595 C ASP A 36 16.484 -2.233 -11.436 1.00 1.00 C ATOM 596 O ASP A 36 17.226 -3.016 -12.027 1.00 1.00 O ATOM 597 CB ASP A 36 14.086 -2.814 -12.046 1.00 1.00 C ATOM 598 CG ASP A 36 13.693 -4.254 -12.385 1.00 1.00 C ATOM 599 OD1 ASP A 36 14.410 -4.930 -13.159 1.00 1.00 O ATOM 600 OD2 ASP A 36 12.623 -4.694 -11.897 1.00 1.00 O ATOM 0 H ASP A 36 13.758 -1.399 -10.009 1.00 1.00 H new ATOM 0 HA ASP A 36 15.254 -3.722 -10.506 1.00 1.00 H new ATOM 0 HB2 ASP A 36 13.193 -2.258 -11.762 1.00 1.00 H new ATOM 0 HB3 ASP A 36 14.489 -2.335 -12.938 1.00 1.00 H new ATOM 605 N ARG A 37 16.865 -0.974 -11.167 1.00 1.00 N ATOM 606 CA ARG A 37 18.249 -0.498 -11.228 1.00 1.00 C ATOM 607 C ARG A 37 19.114 -1.387 -10.321 1.00 1.00 C ATOM 608 O ARG A 37 18.985 -1.265 -9.101 1.00 1.00 O ATOM 609 CB ARG A 37 18.327 0.967 -10.751 1.00 1.00 C ATOM 610 CG ARG A 37 18.250 2.022 -11.856 1.00 1.00 C ATOM 611 CD ARG A 37 17.086 1.810 -12.823 1.00 1.00 C ATOM 612 NE ARG A 37 16.746 3.066 -13.502 1.00 1.00 N ATOM 613 CZ ARG A 37 17.179 3.487 -14.690 1.00 1.00 C ATOM 614 NH1 ARG A 37 17.958 2.724 -15.447 1.00 1.00 N ATOM 615 NH2 ARG A 37 16.834 4.703 -15.089 1.00 1.00 N ATOM 0 H ARG A 37 16.203 -0.247 -10.896 1.00 1.00 H new ATOM 0 HA ARG A 37 18.611 -0.548 -12.255 1.00 1.00 H new ATOM 0 HB2 ARG A 37 17.516 1.145 -10.045 1.00 1.00 H new ATOM 0 HB3 ARG A 37 19.261 1.104 -10.205 1.00 1.00 H new ATOM 0 HG2 ARG A 37 18.158 3.008 -11.400 1.00 1.00 H new ATOM 0 HG3 ARG A 37 19.184 2.017 -12.418 1.00 1.00 H new ATOM 0 HD2 ARG A 37 17.351 1.052 -13.560 1.00 1.00 H new ATOM 0 HD3 ARG A 37 16.218 1.437 -12.280 1.00 1.00 H new ATOM 0 HE ARG A 37 16.105 3.687 -13.008 1.00 1.00 H new ATOM 0 HH11 ARG A 37 18.235 1.798 -15.122 1.00 1.00 H new ATOM 0 HH12 ARG A 37 18.279 3.064 -16.353 1.00 1.00 H new ATOM 0 HH21 ARG A 37 16.252 5.290 -14.491 1.00 1.00 H new ATOM 0 HH22 ARG A 37 17.151 5.052 -15.994 1.00 1.00 H new ATOM 629 N PRO A 38 20.015 -2.230 -10.857 1.00 1.00 N ATOM 630 CA PRO A 38 20.726 -3.244 -10.079 1.00 1.00 C ATOM 631 C PRO A 38 21.435 -2.635 -8.869 1.00 1.00 C ATOM 632 O PRO A 38 21.982 -1.535 -8.974 1.00 1.00 O ATOM 633 CB PRO A 38 21.685 -3.938 -11.050 1.00 1.00 C ATOM 634 CG PRO A 38 21.715 -3.051 -12.288 1.00 1.00 C ATOM 635 CD PRO A 38 20.397 -2.295 -12.256 1.00 1.00 C ATOM 0 HA PRO A 38 20.037 -3.972 -9.651 1.00 1.00 H new ATOM 0 HB2 PRO A 38 22.679 -4.040 -10.615 1.00 1.00 H new ATOM 0 HB3 PRO A 38 21.339 -4.942 -11.294 1.00 1.00 H new ATOM 0 HG2 PRO A 38 22.564 -2.367 -12.264 1.00 1.00 H new ATOM 0 HG3 PRO A 38 21.809 -3.644 -13.198 1.00 1.00 H new ATOM 0 HD2 PRO A 38 20.508 -1.296 -12.678 1.00 1.00 H new ATOM 0 HD3 PRO A 38 19.637 -2.808 -12.846 1.00 1.00 H new ATOM 643 N HIS A 39 21.365 -3.326 -7.728 1.00 1.00 N ATOM 644 CA HIS A 39 21.609 -2.794 -6.394 1.00 1.00 C ATOM 645 C HIS A 39 22.968 -2.113 -6.250 1.00 1.00 C ATOM 646 O HIS A 39 23.958 -2.560 -6.829 1.00 1.00 O ATOM 647 CB HIS A 39 21.418 -3.895 -5.338 1.00 1.00 C ATOM 648 CG HIS A 39 20.093 -3.764 -4.638 1.00 1.00 C ATOM 649 ND1 HIS A 39 18.872 -4.221 -5.078 1.00 1.00 N ATOM 650 CD2 HIS A 39 19.886 -3.081 -3.474 1.00 1.00 C ATOM 651 CE1 HIS A 39 17.944 -3.795 -4.200 1.00 1.00 C ATOM 652 NE2 HIS A 39 18.516 -3.087 -3.212 1.00 1.00 N ATOM 0 H HIS A 39 21.125 -4.317 -7.714 1.00 1.00 H new ATOM 0 HA HIS A 39 20.870 -2.010 -6.228 1.00 1.00 H new ATOM 0 HB2 HIS A 39 21.484 -4.873 -5.815 1.00 1.00 H new ATOM 0 HB3 HIS A 39 22.224 -3.842 -4.606 1.00 1.00 H new ATOM 0 HD1 HIS A 39 18.701 -4.779 -5.914 1.00 1.00 H new ATOM 0 HD2 HIS A 39 20.648 -2.618 -2.864 1.00 1.00 H new ATOM 0 HE1 HIS A 39 16.886 -3.995 -4.279 1.00 1.00 H new ATOM 660 N GLU A 40 22.985 -1.049 -5.446 1.00 1.00 N ATOM 661 CA GLU A 40 24.146 -0.223 -5.126 1.00 1.00 C ATOM 662 C GLU A 40 23.757 0.744 -4.000 1.00 1.00 C ATOM 663 O GLU A 40 24.421 0.816 -2.971 1.00 1.00 O ATOM 664 CB GLU A 40 24.577 0.601 -6.362 1.00 1.00 C ATOM 665 CG GLU A 40 25.795 1.515 -6.109 1.00 1.00 C ATOM 666 CD GLU A 40 25.739 2.786 -6.961 1.00 1.00 C ATOM 667 OE1 GLU A 40 25.690 2.698 -8.209 1.00 1.00 O ATOM 668 OE2 GLU A 40 25.698 3.913 -6.421 1.00 1.00 O ATOM 0 H GLU A 40 22.141 -0.724 -4.975 1.00 1.00 H new ATOM 0 HA GLU A 40 24.973 -0.864 -4.821 1.00 1.00 H new ATOM 0 HB2 GLU A 40 24.811 -0.082 -7.179 1.00 1.00 H new ATOM 0 HB3 GLU A 40 23.737 1.214 -6.689 1.00 1.00 H new ATOM 0 HG2 GLU A 40 25.833 1.786 -5.054 1.00 1.00 H new ATOM 0 HG3 GLU A 40 26.712 0.969 -6.331 1.00 1.00 H new ATOM 675 N GLU A 41 22.695 1.520 -4.220 1.00 1.00 N ATOM 676 CA GLU A 41 22.400 2.767 -3.539 1.00 1.00 C ATOM 677 C GLU A 41 20.948 3.086 -3.922 1.00 1.00 C ATOM 678 O GLU A 41 20.686 3.820 -4.878 1.00 1.00 O ATOM 679 CB GLU A 41 23.398 3.820 -4.065 1.00 1.00 C ATOM 680 CG GLU A 41 23.177 5.255 -3.579 1.00 1.00 C ATOM 681 CD GLU A 41 23.892 5.598 -2.273 1.00 1.00 C ATOM 682 OE1 GLU A 41 25.108 5.899 -2.306 1.00 1.00 O ATOM 683 OE2 GLU A 41 23.200 5.707 -1.234 1.00 1.00 O ATOM 0 H GLU A 41 21.987 1.278 -4.913 1.00 1.00 H new ATOM 0 HA GLU A 41 22.498 2.735 -2.454 1.00 1.00 H new ATOM 0 HB2 GLU A 41 24.404 3.512 -3.781 1.00 1.00 H new ATOM 0 HB3 GLU A 41 23.359 3.816 -5.154 1.00 1.00 H new ATOM 0 HG2 GLU A 41 23.513 5.944 -4.354 1.00 1.00 H new ATOM 0 HG3 GLU A 41 22.108 5.420 -3.447 1.00 1.00 H new ATOM 690 N ARG A 42 19.983 2.392 -3.320 1.00 1.00 N ATOM 691 CA ARG A 42 18.555 2.583 -3.611 1.00 1.00 C ATOM 692 C ARG A 42 17.696 2.868 -2.386 1.00 1.00 C ATOM 693 O ARG A 42 16.560 3.275 -2.596 1.00 1.00 O ATOM 694 CB ARG A 42 17.955 1.411 -4.417 1.00 1.00 C ATOM 695 CG ARG A 42 18.440 1.336 -5.873 1.00 1.00 C ATOM 696 CD ARG A 42 19.712 0.496 -5.979 1.00 1.00 C ATOM 697 NE ARG A 42 20.298 0.508 -7.325 1.00 1.00 N ATOM 698 CZ ARG A 42 21.059 1.450 -7.897 1.00 1.00 C ATOM 699 NH1 ARG A 42 21.247 2.644 -7.348 1.00 1.00 N ATOM 700 NH2 ARG A 42 21.652 1.181 -9.049 1.00 1.00 N ATOM 0 H ARG A 42 20.166 1.679 -2.614 1.00 1.00 H new ATOM 0 HA ARG A 42 18.531 3.482 -4.226 1.00 1.00 H new ATOM 0 HB2 ARG A 42 18.201 0.475 -3.915 1.00 1.00 H new ATOM 0 HB3 ARG A 42 16.869 1.499 -4.412 1.00 1.00 H new ATOM 0 HG2 ARG A 42 17.660 0.903 -6.499 1.00 1.00 H new ATOM 0 HG3 ARG A 42 18.630 2.341 -6.250 1.00 1.00 H new ATOM 0 HD2 ARG A 42 20.447 0.869 -5.266 1.00 1.00 H new ATOM 0 HD3 ARG A 42 19.486 -0.532 -5.696 1.00 1.00 H new ATOM 0 HE ARG A 42 20.099 -0.310 -7.901 1.00 1.00 H new ATOM 0 HH11 ARG A 42 20.804 2.871 -6.458 1.00 1.00 H new ATOM 0 HH12 ARG A 42 21.834 3.334 -7.816 1.00 1.00 H new ATOM 0 HH21 ARG A 42 21.526 0.268 -9.487 1.00 1.00 H new ATOM 0 HH22 ARG A 42 22.235 1.886 -9.499 1.00 1.00 H new ATOM 714 N GLN A 43 18.142 2.670 -1.141 1.00 1.00 N ATOM 715 CA GLN A 43 17.260 2.851 0.016 1.00 1.00 C ATOM 716 C GLN A 43 16.684 4.268 0.097 1.00 1.00 C ATOM 717 O GLN A 43 15.474 4.423 0.221 1.00 1.00 O ATOM 718 CB GLN A 43 17.955 2.477 1.330 1.00 1.00 C ATOM 719 CG GLN A 43 17.755 0.998 1.689 1.00 1.00 C ATOM 720 CD GLN A 43 18.549 0.068 0.777 1.00 1.00 C ATOM 721 OE1 GLN A 43 19.763 0.005 0.887 1.00 1.00 O ATOM 722 NE2 GLN A 43 17.923 -0.632 -0.156 1.00 1.00 N ATOM 0 H GLN A 43 19.095 2.388 -0.910 1.00 1.00 H new ATOM 0 HA GLN A 43 16.426 2.166 -0.133 1.00 1.00 H new ATOM 0 HB2 GLN A 43 19.021 2.689 1.249 1.00 1.00 H new ATOM 0 HB3 GLN A 43 17.567 3.101 2.135 1.00 1.00 H new ATOM 0 HG2 GLN A 43 18.057 0.834 2.723 1.00 1.00 H new ATOM 0 HG3 GLN A 43 16.696 0.750 1.623 1.00 1.00 H new ATOM 0 HE21 GLN A 43 16.908 -0.574 -0.242 1.00 1.00 H new ATOM 0 HE22 GLN A 43 18.455 -1.229 -0.789 1.00 1.00 H new ATOM 731 N THR A 44 17.511 5.304 0.022 1.00 1.00 N ATOM 732 CA THR A 44 17.015 6.680 0.070 1.00 1.00 C ATOM 733 C THR A 44 16.059 6.938 -1.093 1.00 1.00 C ATOM 734 O THR A 44 14.966 7.467 -0.880 1.00 1.00 O ATOM 735 CB THR A 44 18.195 7.656 0.125 1.00 1.00 C ATOM 736 OG1 THR A 44 18.725 7.553 1.427 1.00 1.00 O ATOM 737 CG2 THR A 44 17.819 9.117 -0.127 1.00 1.00 C ATOM 0 H THR A 44 18.523 5.222 -0.072 1.00 1.00 H new ATOM 0 HA THR A 44 16.436 6.841 0.979 1.00 1.00 H new ATOM 0 HB THR A 44 18.895 7.388 -0.666 1.00 1.00 H new ATOM 0 HG1 THR A 44 19.489 8.159 1.518 1.00 1.00 H new ATOM 0 HG21 THR A 44 18.713 9.738 -0.070 1.00 1.00 H new ATOM 0 HG22 THR A 44 17.374 9.213 -1.117 1.00 1.00 H new ATOM 0 HG23 THR A 44 17.102 9.443 0.626 1.00 1.00 H new ATOM 745 N ARG A 45 16.407 6.526 -2.314 1.00 1.00 N ATOM 746 CA ARG A 45 15.517 6.647 -3.456 1.00 1.00 C ATOM 747 C ARG A 45 14.220 5.915 -3.194 1.00 1.00 C ATOM 748 O ARG A 45 13.175 6.413 -3.574 1.00 1.00 O ATOM 749 CB ARG A 45 16.205 6.098 -4.711 1.00 1.00 C ATOM 750 CG ARG A 45 15.333 6.297 -5.962 1.00 1.00 C ATOM 751 CD ARG A 45 16.035 7.163 -7.003 1.00 1.00 C ATOM 752 NE ARG A 45 17.120 6.454 -7.694 1.00 1.00 N ATOM 753 CZ ARG A 45 16.993 5.699 -8.787 1.00 1.00 C ATOM 754 NH1 ARG A 45 15.793 5.391 -9.272 1.00 1.00 N ATOM 755 NH2 ARG A 45 18.091 5.258 -9.388 1.00 1.00 N ATOM 0 H ARG A 45 17.309 6.103 -2.532 1.00 1.00 H new ATOM 0 HA ARG A 45 15.285 7.700 -3.616 1.00 1.00 H new ATOM 0 HB2 ARG A 45 17.163 6.598 -4.850 1.00 1.00 H new ATOM 0 HB3 ARG A 45 16.416 5.037 -4.578 1.00 1.00 H new ATOM 0 HG2 ARG A 45 15.093 5.327 -6.397 1.00 1.00 H new ATOM 0 HG3 ARG A 45 14.389 6.762 -5.678 1.00 1.00 H new ATOM 0 HD2 ARG A 45 15.305 7.505 -7.737 1.00 1.00 H new ATOM 0 HD3 ARG A 45 16.439 8.051 -6.518 1.00 1.00 H new ATOM 0 HE ARG A 45 18.057 6.547 -7.302 1.00 1.00 H new ATOM 0 HH11 ARG A 45 14.952 5.733 -8.807 1.00 1.00 H new ATOM 0 HH12 ARG A 45 15.714 4.813 -10.109 1.00 1.00 H new ATOM 0 HH21 ARG A 45 19.009 5.498 -9.013 1.00 1.00 H new ATOM 0 HH22 ARG A 45 18.017 4.679 -10.225 1.00 1.00 H new ATOM 769 N PHE A 46 14.254 4.784 -2.510 1.00 1.00 N ATOM 770 CA PHE A 46 13.067 4.036 -2.162 1.00 1.00 C ATOM 771 C PHE A 46 12.124 4.881 -1.310 1.00 1.00 C ATOM 772 O PHE A 46 10.948 5.001 -1.654 1.00 1.00 O ATOM 773 CB PHE A 46 13.489 2.701 -1.544 1.00 1.00 C ATOM 774 CG PHE A 46 12.624 2.191 -0.427 1.00 1.00 C ATOM 775 CD1 PHE A 46 11.450 1.500 -0.771 1.00 1.00 C ATOM 776 CD2 PHE A 46 13.025 2.315 0.925 1.00 1.00 C ATOM 777 CE1 PHE A 46 10.695 0.885 0.229 1.00 1.00 C ATOM 778 CE2 PHE A 46 12.301 1.627 1.903 1.00 1.00 C ATOM 779 CZ PHE A 46 11.141 0.926 1.549 1.00 1.00 C ATOM 0 H PHE A 46 15.119 4.358 -2.179 1.00 1.00 H new ATOM 0 HA PHE A 46 12.479 3.792 -3.047 1.00 1.00 H new ATOM 0 HB2 PHE A 46 13.511 1.949 -2.333 1.00 1.00 H new ATOM 0 HB3 PHE A 46 14.508 2.802 -1.171 1.00 1.00 H new ATOM 0 HD1 PHE A 46 11.134 1.445 -1.802 1.00 1.00 H new ATOM 0 HD2 PHE A 46 13.872 2.928 1.195 1.00 1.00 H new ATOM 0 HE1 PHE A 46 9.772 0.381 -0.018 1.00 1.00 H new ATOM 0 HE2 PHE A 46 12.635 1.636 2.930 1.00 1.00 H new ATOM 0 HZ PHE A 46 10.582 0.407 2.313 1.00 1.00 H new ATOM 789 N GLN A 47 12.624 5.522 -0.252 1.00 1.00 N ATOM 790 CA GLN A 47 11.788 6.422 0.534 1.00 1.00 C ATOM 791 C GLN A 47 11.435 7.707 -0.234 1.00 1.00 C ATOM 792 O GLN A 47 10.453 8.349 0.139 1.00 1.00 O ATOM 793 CB GLN A 47 12.430 6.734 1.891 1.00 1.00 C ATOM 794 CG GLN A 47 12.360 5.549 2.875 1.00 1.00 C ATOM 795 CD GLN A 47 13.686 4.901 3.226 1.00 1.00 C ATOM 796 OE1 GLN A 47 14.777 5.283 2.832 1.00 1.00 O ATOM 797 NE2 GLN A 47 13.617 3.870 4.041 1.00 1.00 N ATOM 0 H GLN A 47 13.587 5.436 0.074 1.00 1.00 H new ATOM 0 HA GLN A 47 10.849 5.902 0.723 1.00 1.00 H new ATOM 0 HB2 GLN A 47 13.473 7.012 1.738 1.00 1.00 H new ATOM 0 HB3 GLN A 47 11.932 7.597 2.333 1.00 1.00 H new ATOM 0 HG2 GLN A 47 11.891 5.894 3.796 1.00 1.00 H new ATOM 0 HG3 GLN A 47 11.706 4.787 2.450 1.00 1.00 H new ATOM 0 HE21 GLN A 47 12.710 3.544 4.375 1.00 1.00 H new ATOM 0 HE22 GLN A 47 14.470 3.397 4.338 1.00 1.00 H new ATOM 806 N ASN A 48 12.162 8.096 -1.295 1.00 1.00 N ATOM 807 CA ASN A 48 11.752 9.244 -2.110 1.00 1.00 C ATOM 808 C ASN A 48 10.678 8.828 -3.109 1.00 1.00 C ATOM 809 O ASN A 48 9.726 9.569 -3.295 1.00 1.00 O ATOM 810 CB ASN A 48 12.933 9.920 -2.818 1.00 1.00 C ATOM 811 CG ASN A 48 13.707 10.806 -1.855 1.00 1.00 C ATOM 812 OD1 ASN A 48 13.575 12.023 -1.843 1.00 1.00 O ATOM 813 ND2 ASN A 48 14.561 10.234 -1.024 1.00 1.00 N ATOM 0 H ASN A 48 13.021 7.640 -1.602 1.00 1.00 H new ATOM 0 HA ASN A 48 11.335 9.988 -1.431 1.00 1.00 H new ATOM 0 HB2 ASN A 48 13.596 9.161 -3.233 1.00 1.00 H new ATOM 0 HB3 ASN A 48 12.568 10.517 -3.654 1.00 1.00 H new ATOM 0 HD21 ASN A 48 15.105 10.806 -0.378 1.00 1.00 H new ATOM 0 HD22 ASN A 48 14.676 9.221 -1.029 1.00 1.00 H new ATOM 820 N ALA A 49 10.760 7.644 -3.711 1.00 1.00 N ATOM 821 CA ALA A 49 9.773 7.139 -4.655 1.00 1.00 C ATOM 822 C ALA A 49 8.452 6.838 -3.937 1.00 1.00 C ATOM 823 O ALA A 49 7.386 7.165 -4.445 1.00 1.00 O ATOM 824 CB ALA A 49 10.343 5.887 -5.337 1.00 1.00 C ATOM 0 H ALA A 49 11.532 6.997 -3.551 1.00 1.00 H new ATOM 0 HA ALA A 49 9.561 7.891 -5.415 1.00 1.00 H new ATOM 0 HB1 ALA A 49 9.615 5.496 -6.048 1.00 1.00 H new ATOM 0 HB2 ALA A 49 11.261 6.146 -5.864 1.00 1.00 H new ATOM 0 HB3 ALA A 49 10.558 5.129 -4.584 1.00 1.00 H new ATOM 830 N CYS A 50 8.519 6.341 -2.698 1.00 1.00 N ATOM 831 CA CYS A 50 7.350 6.214 -1.824 1.00 1.00 C ATOM 832 C CYS A 50 6.737 7.590 -1.507 1.00 1.00 C ATOM 833 O CYS A 50 5.521 7.714 -1.352 1.00 1.00 O ATOM 834 CB CYS A 50 7.752 5.426 -0.554 1.00 1.00 C ATOM 835 SG CYS A 50 7.655 3.654 -0.924 1.00 1.00 S ATOM 0 H CYS A 50 9.387 6.015 -2.273 1.00 1.00 H new ATOM 0 HA CYS A 50 6.567 5.654 -2.335 1.00 1.00 H new ATOM 0 HB2 CYS A 50 8.763 5.694 -0.246 1.00 1.00 H new ATOM 0 HB3 CYS A 50 7.089 5.677 0.274 1.00 1.00 H new ATOM 0 HG CYS A 50 8.370 2.991 -0.064 1.00 1.00 H new ATOM 841 N ARG A 51 7.552 8.646 -1.434 1.00 1.00 N ATOM 842 CA ARG A 51 7.079 10.010 -1.234 1.00 1.00 C ATOM 843 C ARG A 51 6.478 10.553 -2.527 1.00 1.00 C ATOM 844 O ARG A 51 5.439 11.207 -2.469 1.00 1.00 O ATOM 845 CB ARG A 51 8.226 10.853 -0.656 1.00 1.00 C ATOM 846 CG ARG A 51 7.806 12.288 -0.329 1.00 1.00 C ATOM 847 CD ARG A 51 8.761 12.936 0.685 1.00 1.00 C ATOM 848 NE ARG A 51 10.155 13.000 0.214 1.00 1.00 N ATOM 849 CZ ARG A 51 11.236 13.170 0.987 1.00 1.00 C ATOM 850 NH1 ARG A 51 11.134 13.247 2.307 1.00 1.00 N ATOM 851 NH2 ARG A 51 12.439 13.266 0.443 1.00 1.00 N ATOM 0 H ARG A 51 8.566 8.573 -1.513 1.00 1.00 H new ATOM 0 HA ARG A 51 6.269 10.047 -0.506 1.00 1.00 H new ATOM 0 HB2 ARG A 51 8.601 10.375 0.249 1.00 1.00 H new ATOM 0 HB3 ARG A 51 9.049 10.875 -1.370 1.00 1.00 H new ATOM 0 HG2 ARG A 51 7.788 12.881 -1.244 1.00 1.00 H new ATOM 0 HG3 ARG A 51 6.792 12.289 0.072 1.00 1.00 H new ATOM 0 HD2 ARG A 51 8.413 13.945 0.908 1.00 1.00 H new ATOM 0 HD3 ARG A 51 8.725 12.373 1.618 1.00 1.00 H new ATOM 0 HE ARG A 51 10.311 12.907 -0.790 1.00 1.00 H new ATOM 0 HH11 ARG A 51 10.219 13.177 2.753 1.00 1.00 H new ATOM 0 HH12 ARG A 51 11.970 13.377 2.876 1.00 1.00 H new ATOM 0 HH21 ARG A 51 12.547 13.211 -0.570 1.00 1.00 H new ATOM 0 HH22 ARG A 51 13.258 13.395 1.037 1.00 1.00 H new ATOM 865 N ASP A 52 7.063 10.230 -3.677 1.00 1.00 N ATOM 866 CA ASP A 52 6.661 10.600 -5.027 1.00 1.00 C ATOM 867 C ASP A 52 5.254 10.141 -5.347 1.00 1.00 C ATOM 868 O ASP A 52 4.575 10.742 -6.175 1.00 1.00 O ATOM 869 CB ASP A 52 7.614 9.969 -6.041 1.00 1.00 C ATOM 870 CG ASP A 52 7.802 10.865 -7.256 1.00 1.00 C ATOM 871 OD1 ASP A 52 8.273 12.006 -7.067 1.00 1.00 O ATOM 872 OD2 ASP A 52 7.563 10.406 -8.396 1.00 1.00 O ATOM 0 H ASP A 52 7.904 9.652 -3.687 1.00 1.00 H new ATOM 0 HA ASP A 52 6.694 11.688 -5.085 1.00 1.00 H new ATOM 0 HB2 ASP A 52 8.579 9.785 -5.570 1.00 1.00 H new ATOM 0 HB3 ASP A 52 7.224 9.002 -6.357 1.00 1.00 H new ATOM 877 N GLY A 53 4.794 9.106 -4.657 1.00 1.00 N ATOM 878 CA GLY A 53 3.411 8.680 -4.694 1.00 1.00 C ATOM 879 C GLY A 53 3.356 7.194 -4.949 1.00 1.00 C ATOM 880 O GLY A 53 4.126 6.446 -4.347 1.00 1.00 O ATOM 0 H GLY A 53 5.382 8.535 -4.050 1.00 1.00 H new ATOM 0 HA2 GLY A 53 2.920 8.918 -3.751 1.00 1.00 H new ATOM 0 HA3 GLY A 53 2.874 9.216 -5.477 1.00 1.00 H new ATOM 884 N ARG A 54 2.412 6.772 -5.795 1.00 1.00 N ATOM 885 CA ARG A 54 2.074 5.375 -6.038 1.00 1.00 C ATOM 886 C ARG A 54 3.307 4.589 -6.417 1.00 1.00 C ATOM 887 O ARG A 54 4.255 5.131 -6.985 1.00 1.00 O ATOM 888 CB ARG A 54 1.000 5.277 -7.131 1.00 1.00 C ATOM 889 CG ARG A 54 1.380 5.865 -8.507 1.00 1.00 C ATOM 890 CD ARG A 54 1.615 4.782 -9.563 1.00 1.00 C ATOM 891 NE ARG A 54 2.840 4.007 -9.325 1.00 1.00 N ATOM 892 CZ ARG A 54 3.262 3.012 -10.111 1.00 1.00 C ATOM 893 NH1 ARG A 54 2.443 2.444 -10.980 1.00 1.00 N ATOM 894 NH2 ARG A 54 4.515 2.577 -10.052 1.00 1.00 N ATOM 0 H ARG A 54 1.846 7.418 -6.345 1.00 1.00 H new ATOM 0 HA ARG A 54 1.672 4.944 -5.121 1.00 1.00 H new ATOM 0 HB2 ARG A 54 0.741 4.227 -7.266 1.00 1.00 H new ATOM 0 HB3 ARG A 54 0.102 5.783 -6.777 1.00 1.00 H new ATOM 0 HG2 ARG A 54 0.587 6.532 -8.845 1.00 1.00 H new ATOM 0 HG3 ARG A 54 2.281 6.469 -8.404 1.00 1.00 H new ATOM 0 HD2 ARG A 54 0.760 4.105 -9.579 1.00 1.00 H new ATOM 0 HD3 ARG A 54 1.671 5.247 -10.547 1.00 1.00 H new ATOM 0 HE ARG A 54 3.404 4.243 -8.509 1.00 1.00 H new ATOM 0 HH11 ARG A 54 1.478 2.765 -11.056 1.00 1.00 H new ATOM 0 HH12 ARG A 54 2.777 1.685 -11.575 1.00 1.00 H new ATOM 0 HH21 ARG A 54 5.173 3.003 -9.399 1.00 1.00 H new ATOM 0 HH22 ARG A 54 4.820 1.816 -10.659 1.00 1.00 H new ATOM 908 N SER A 55 3.242 3.283 -6.229 1.00 1.00 N ATOM 909 CA SER A 55 4.368 2.414 -6.524 1.00 1.00 C ATOM 910 C SER A 55 3.958 1.033 -7.015 1.00 1.00 C ATOM 911 O SER A 55 2.814 0.802 -7.398 1.00 1.00 O ATOM 912 CB SER A 55 5.299 2.334 -5.315 1.00 1.00 C ATOM 913 OG SER A 55 6.603 2.244 -5.829 1.00 1.00 O ATOM 0 H SER A 55 2.418 2.799 -5.872 1.00 1.00 H new ATOM 0 HA SER A 55 4.908 2.863 -7.358 1.00 1.00 H new ATOM 0 HB2 SER A 55 5.190 3.214 -4.681 1.00 1.00 H new ATOM 0 HB3 SER A 55 5.063 1.466 -4.699 1.00 1.00 H new ATOM 0 HG SER A 55 7.199 1.871 -5.146 1.00 1.00 H new ATOM 919 N GLU A 56 4.926 0.122 -7.025 1.00 1.00 N ATOM 920 CA GLU A 56 4.820 -1.209 -7.585 1.00 1.00 C ATOM 921 C GLU A 56 5.511 -2.095 -6.562 1.00 1.00 C ATOM 922 O GLU A 56 6.738 -2.046 -6.413 1.00 1.00 O ATOM 923 CB GLU A 56 5.440 -1.238 -8.995 1.00 1.00 C ATOM 924 CG GLU A 56 5.079 -2.538 -9.730 1.00 1.00 C ATOM 925 CD GLU A 56 5.577 -2.611 -11.182 1.00 1.00 C ATOM 926 OE1 GLU A 56 5.681 -1.569 -11.873 1.00 1.00 O ATOM 927 OE2 GLU A 56 5.804 -3.737 -11.684 1.00 1.00 O ATOM 0 H GLU A 56 5.845 0.306 -6.623 1.00 1.00 H new ATOM 0 HA GLU A 56 3.799 -1.557 -7.744 1.00 1.00 H new ATOM 0 HB2 GLU A 56 5.086 -0.382 -9.569 1.00 1.00 H new ATOM 0 HB3 GLU A 56 6.524 -1.147 -8.921 1.00 1.00 H new ATOM 0 HG2 GLU A 56 5.492 -3.380 -9.175 1.00 1.00 H new ATOM 0 HG3 GLU A 56 3.995 -2.654 -9.725 1.00 1.00 H new ATOM 934 N ILE A 57 4.711 -2.795 -5.762 1.00 1.00 N ATOM 935 CA ILE A 57 5.221 -3.729 -4.758 1.00 1.00 C ATOM 936 C ILE A 57 4.667 -5.104 -5.168 1.00 1.00 C ATOM 937 O ILE A 57 3.759 -5.193 -5.989 1.00 1.00 O ATOM 938 CB ILE A 57 4.920 -3.203 -3.311 1.00 1.00 C ATOM 939 CG1 ILE A 57 5.561 -1.800 -3.091 1.00 1.00 C ATOM 940 CG2 ILE A 57 5.434 -4.171 -2.230 1.00 1.00 C ATOM 941 CD1 ILE A 57 5.583 -1.237 -1.649 1.00 1.00 C ATOM 0 H ILE A 57 3.693 -2.732 -5.790 1.00 1.00 H new ATOM 0 HA ILE A 57 6.306 -3.825 -4.721 1.00 1.00 H new ATOM 0 HB ILE A 57 3.836 -3.129 -3.220 1.00 1.00 H new ATOM 0 HG12 ILE A 57 6.589 -1.841 -3.451 1.00 1.00 H new ATOM 0 HG13 ILE A 57 5.031 -1.086 -3.722 1.00 1.00 H new ATOM 0 HG21 ILE A 57 5.205 -3.769 -1.243 1.00 1.00 H new ATOM 0 HG22 ILE A 57 4.949 -5.140 -2.349 1.00 1.00 H new ATOM 0 HG23 ILE A 57 6.513 -4.291 -2.332 1.00 1.00 H new ATOM 0 HD11 ILE A 57 6.058 -0.256 -1.649 1.00 1.00 H new ATOM 0 HD12 ILE A 57 4.562 -1.146 -1.278 1.00 1.00 H new ATOM 0 HD13 ILE A 57 6.145 -1.912 -1.003 1.00 1.00 H new ATOM 953 N ALA A 58 5.208 -6.200 -4.655 1.00 1.00 N ATOM 954 CA ALA A 58 4.698 -7.537 -4.873 1.00 1.00 C ATOM 955 C ALA A 58 4.681 -8.295 -3.559 1.00 1.00 C ATOM 956 O ALA A 58 5.356 -7.922 -2.603 1.00 1.00 O ATOM 957 CB ALA A 58 5.559 -8.274 -5.903 1.00 1.00 C ATOM 0 H ALA A 58 6.036 -6.178 -4.060 1.00 1.00 H new ATOM 0 HA ALA A 58 3.681 -7.473 -5.260 1.00 1.00 H new ATOM 0 HB1 ALA A 58 5.163 -9.278 -6.056 1.00 1.00 H new ATOM 0 HB2 ALA A 58 5.543 -7.729 -6.847 1.00 1.00 H new ATOM 0 HB3 ALA A 58 6.585 -8.340 -5.540 1.00 1.00 H new ATOM 963 N PHE A 59 3.946 -9.401 -3.518 1.00 1.00 N ATOM 964 CA PHE A 59 4.045 -10.350 -2.421 1.00 1.00 C ATOM 965 C PHE A 59 5.105 -11.394 -2.717 1.00 1.00 C ATOM 966 O PHE A 59 5.506 -11.563 -3.865 1.00 1.00 O ATOM 967 CB PHE A 59 2.664 -10.967 -2.112 1.00 1.00 C ATOM 968 CG PHE A 59 1.860 -10.023 -1.273 1.00 1.00 C ATOM 969 CD1 PHE A 59 1.237 -8.926 -1.892 1.00 1.00 C ATOM 970 CD2 PHE A 59 1.815 -10.195 0.118 1.00 1.00 C ATOM 971 CE1 PHE A 59 0.558 -7.983 -1.085 1.00 1.00 C ATOM 972 CE2 PHE A 59 1.161 -9.246 0.909 1.00 1.00 C ATOM 973 CZ PHE A 59 0.534 -8.139 0.313 1.00 1.00 C ATOM 0 H PHE A 59 3.272 -9.661 -4.238 1.00 1.00 H new ATOM 0 HA PHE A 59 4.362 -9.826 -1.519 1.00 1.00 H new ATOM 0 HB2 PHE A 59 2.136 -11.182 -3.041 1.00 1.00 H new ATOM 0 HB3 PHE A 59 2.788 -11.916 -1.590 1.00 1.00 H new ATOM 0 HD1 PHE A 59 1.276 -8.805 -2.964 1.00 1.00 H new ATOM 0 HD2 PHE A 59 2.282 -11.055 0.575 1.00 1.00 H new ATOM 0 HE1 PHE A 59 0.058 -7.142 -1.543 1.00 1.00 H new ATOM 0 HE2 PHE A 59 1.138 -9.364 1.982 1.00 1.00 H new ATOM 0 HZ PHE A 59 0.033 -7.407 0.929 1.00 1.00 H new ATOM 983 N VAL A 60 5.511 -12.128 -1.687 1.00 1.00 N ATOM 984 CA VAL A 60 6.346 -13.318 -1.793 1.00 1.00 C ATOM 985 C VAL A 60 5.492 -14.548 -1.479 1.00 1.00 C ATOM 986 O VAL A 60 5.635 -15.563 -2.153 1.00 1.00 O ATOM 987 CB VAL A 60 7.572 -13.167 -0.870 1.00 1.00 C ATOM 988 CG1 VAL A 60 8.360 -14.469 -0.700 1.00 1.00 C ATOM 989 CG2 VAL A 60 8.516 -12.082 -1.398 1.00 1.00 C ATOM 0 H VAL A 60 5.260 -11.903 -0.724 1.00 1.00 H new ATOM 0 HA VAL A 60 6.733 -13.445 -2.804 1.00 1.00 H new ATOM 0 HB VAL A 60 7.178 -12.885 0.107 1.00 1.00 H new ATOM 0 HG11 VAL A 60 9.210 -14.296 -0.040 1.00 1.00 H new ATOM 0 HG12 VAL A 60 7.713 -15.232 -0.267 1.00 1.00 H new ATOM 0 HG13 VAL A 60 8.719 -14.807 -1.672 1.00 1.00 H new ATOM 0 HG21 VAL A 60 9.374 -11.991 -0.732 1.00 1.00 H new ATOM 0 HG22 VAL A 60 8.858 -12.352 -2.397 1.00 1.00 H new ATOM 0 HG23 VAL A 60 7.988 -11.129 -1.441 1.00 1.00 H new ATOM 999 N ALA A 61 4.554 -14.462 -0.526 1.00 1.00 N ATOM 1000 CA ALA A 61 3.696 -15.577 -0.117 1.00 1.00 C ATOM 1001 C ALA A 61 3.034 -16.281 -1.303 1.00 1.00 C ATOM 1002 O ALA A 61 2.954 -17.504 -1.343 1.00 1.00 O ATOM 1003 CB ALA A 61 2.637 -15.073 0.861 1.00 1.00 C ATOM 0 H ALA A 61 4.369 -13.601 -0.011 1.00 1.00 H new ATOM 0 HA ALA A 61 4.331 -16.318 0.369 1.00 1.00 H new ATOM 0 HB1 ALA A 61 1.999 -15.902 1.165 1.00 1.00 H new ATOM 0 HB2 ALA A 61 3.125 -14.649 1.739 1.00 1.00 H new ATOM 0 HB3 ALA A 61 2.031 -14.307 0.378 1.00 1.00 H new ATOM 1009 N THR A 62 2.559 -15.508 -2.277 1.00 1.00 N ATOM 1010 CA THR A 62 1.904 -15.990 -3.479 1.00 1.00 C ATOM 1011 C THR A 62 2.454 -15.291 -4.743 1.00 1.00 C ATOM 1012 O THR A 62 2.073 -15.612 -5.873 1.00 1.00 O ATOM 1013 CB THR A 62 0.418 -15.769 -3.218 1.00 1.00 C ATOM 1014 OG1 THR A 62 -0.014 -16.574 -2.130 1.00 1.00 O ATOM 1015 CG2 THR A 62 -0.460 -16.111 -4.404 1.00 1.00 C ATOM 0 H THR A 62 2.625 -14.491 -2.244 1.00 1.00 H new ATOM 0 HA THR A 62 2.094 -17.043 -3.685 1.00 1.00 H new ATOM 0 HB THR A 62 0.315 -14.705 -3.004 1.00 1.00 H new ATOM 0 HG1 THR A 62 -0.538 -16.028 -1.507 1.00 1.00 H new ATOM 0 HG21 THR A 62 -1.504 -15.930 -4.148 1.00 1.00 H new ATOM 0 HG22 THR A 62 -0.182 -15.488 -5.254 1.00 1.00 H new ATOM 0 HG23 THR A 62 -0.327 -17.161 -4.664 1.00 1.00 H new ATOM 1023 N GLY A 63 3.356 -14.321 -4.574 1.00 1.00 N ATOM 1024 CA GLY A 63 4.123 -13.758 -5.681 1.00 1.00 C ATOM 1025 C GLY A 63 3.259 -12.888 -6.571 1.00 1.00 C ATOM 1026 O GLY A 63 3.109 -13.178 -7.757 1.00 1.00 O ATOM 0 H GLY A 63 3.573 -13.907 -3.667 1.00 1.00 H new ATOM 0 HA2 GLY A 63 4.951 -13.168 -5.288 1.00 1.00 H new ATOM 0 HA3 GLY A 63 4.558 -14.565 -6.271 1.00 1.00 H new ATOM 1030 N THR A 64 2.614 -11.875 -5.995 1.00 1.00 N ATOM 1031 CA THR A 64 1.599 -11.101 -6.683 1.00 1.00 C ATOM 1032 C THR A 64 2.050 -9.654 -6.682 1.00 1.00 C ATOM 1033 O THR A 64 2.014 -9.017 -5.630 1.00 1.00 O ATOM 1034 CB THR A 64 0.264 -11.326 -5.978 1.00 1.00 C ATOM 1035 OG1 THR A 64 -0.069 -12.701 -6.073 1.00 1.00 O ATOM 1036 CG2 THR A 64 -0.852 -10.461 -6.566 1.00 1.00 C ATOM 0 H THR A 64 2.786 -11.572 -5.036 1.00 1.00 H new ATOM 0 HA THR A 64 1.463 -11.404 -7.721 1.00 1.00 H new ATOM 0 HB THR A 64 0.367 -11.032 -4.933 1.00 1.00 H new ATOM 0 HG1 THR A 64 -0.924 -12.862 -5.623 1.00 1.00 H new ATOM 0 HG21 THR A 64 -1.782 -10.655 -6.033 1.00 1.00 H new ATOM 0 HG22 THR A 64 -0.588 -9.408 -6.464 1.00 1.00 H new ATOM 0 HG23 THR A 64 -0.982 -10.702 -7.621 1.00 1.00 H new ATOM 1044 N ASN A 65 2.529 -9.187 -7.832 1.00 1.00 N ATOM 1045 CA ASN A 65 2.759 -7.786 -8.132 1.00 1.00 C ATOM 1046 C ASN A 65 1.429 -7.045 -8.007 1.00 1.00 C ATOM 1047 O ASN A 65 0.421 -7.504 -8.552 1.00 1.00 O ATOM 1048 CB ASN A 65 3.359 -7.644 -9.539 1.00 1.00 C ATOM 1049 CG ASN A 65 3.870 -6.232 -9.817 1.00 1.00 C ATOM 1050 OD1 ASN A 65 3.218 -5.244 -9.510 1.00 1.00 O ATOM 1051 ND2 ASN A 65 5.028 -6.101 -10.437 1.00 1.00 N ATOM 0 H ASN A 65 2.776 -9.802 -8.607 1.00 1.00 H new ATOM 0 HA ASN A 65 3.472 -7.353 -7.431 1.00 1.00 H new ATOM 0 HB2 ASN A 65 4.179 -8.353 -9.654 1.00 1.00 H new ATOM 0 HB3 ASN A 65 2.604 -7.906 -10.280 1.00 1.00 H new ATOM 0 HD21 ASN A 65 5.384 -5.172 -10.663 1.00 1.00 H new ATOM 0 HD22 ASN A 65 5.567 -6.929 -10.690 1.00 1.00 H new ATOM 1058 N LEU A 66 1.401 -5.943 -7.264 1.00 1.00 N ATOM 1059 CA LEU A 66 0.255 -5.083 -7.076 1.00 1.00 C ATOM 1060 C LEU A 66 0.734 -3.633 -7.108 1.00 1.00 C ATOM 1061 O LEU A 66 1.776 -3.283 -6.545 1.00 1.00 O ATOM 1062 CB LEU A 66 -0.568 -5.565 -5.868 1.00 1.00 C ATOM 1063 CG LEU A 66 -0.296 -5.026 -4.460 1.00 1.00 C ATOM 1064 CD1 LEU A 66 1.091 -5.361 -3.911 1.00 1.00 C ATOM 1065 CD2 LEU A 66 -0.589 -3.531 -4.392 1.00 1.00 C ATOM 0 H LEU A 66 2.222 -5.616 -6.755 1.00 1.00 H new ATOM 0 HA LEU A 66 -0.474 -5.135 -7.884 1.00 1.00 H new ATOM 0 HB2 LEU A 66 -1.614 -5.358 -6.092 1.00 1.00 H new ATOM 0 HB3 LEU A 66 -0.461 -6.649 -5.821 1.00 1.00 H new ATOM 0 HG LEU A 66 -0.985 -5.551 -3.799 1.00 1.00 H new ATOM 0 HD11 LEU A 66 1.198 -4.941 -2.911 1.00 1.00 H new ATOM 0 HD12 LEU A 66 1.213 -6.443 -3.865 1.00 1.00 H new ATOM 0 HD13 LEU A 66 1.853 -4.938 -4.565 1.00 1.00 H new ATOM 0 HD21 LEU A 66 -0.390 -3.167 -3.384 1.00 1.00 H new ATOM 0 HD22 LEU A 66 0.048 -3.003 -5.101 1.00 1.00 H new ATOM 0 HD23 LEU A 66 -1.635 -3.354 -4.642 1.00 1.00 H new ATOM 1077 N SER A 67 -0.002 -2.776 -7.812 1.00 1.00 N ATOM 1078 CA SER A 67 0.356 -1.373 -7.891 1.00 1.00 C ATOM 1079 C SER A 67 -0.145 -0.754 -6.600 1.00 1.00 C ATOM 1080 O SER A 67 -1.357 -0.715 -6.348 1.00 1.00 O ATOM 1081 CB SER A 67 -0.263 -0.683 -9.116 1.00 1.00 C ATOM 1082 OG SER A 67 -0.373 -1.559 -10.224 1.00 1.00 O ATOM 0 H SER A 67 -0.843 -3.031 -8.330 1.00 1.00 H new ATOM 0 HA SER A 67 1.433 -1.252 -8.010 1.00 1.00 H new ATOM 0 HB2 SER A 67 -1.251 -0.302 -8.856 1.00 1.00 H new ATOM 0 HB3 SER A 67 0.347 0.177 -9.394 1.00 1.00 H new ATOM 0 HG SER A 67 -0.773 -1.081 -10.980 1.00 1.00 H new ATOM 1088 N LEU A 68 0.785 -0.358 -5.742 1.00 1.00 N ATOM 1089 CA LEU A 68 0.438 0.319 -4.516 1.00 1.00 C ATOM 1090 C LEU A 68 0.060 1.741 -4.838 1.00 1.00 C ATOM 1091 O LEU A 68 0.694 2.374 -5.672 1.00 1.00 O ATOM 1092 CB LEU A 68 1.616 0.350 -3.543 1.00 1.00 C ATOM 1093 CG LEU A 68 1.469 -0.651 -2.398 1.00 1.00 C ATOM 1094 CD1 LEU A 68 2.464 -0.215 -1.333 1.00 1.00 C ATOM 1095 CD2 LEU A 68 0.075 -0.703 -1.773 1.00 1.00 C ATOM 0 H LEU A 68 1.786 -0.498 -5.880 1.00 1.00 H new ATOM 0 HA LEU A 68 -0.389 -0.219 -4.052 1.00 1.00 H new ATOM 0 HB2 LEU A 68 2.536 0.138 -4.088 1.00 1.00 H new ATOM 0 HB3 LEU A 68 1.713 1.354 -3.131 1.00 1.00 H new ATOM 0 HG LEU A 68 1.647 -1.651 -2.794 1.00 1.00 H new ATOM 0 HD11 LEU A 68 2.408 -0.894 -0.483 1.00 1.00 H new ATOM 0 HD12 LEU A 68 3.472 -0.235 -1.747 1.00 1.00 H new ATOM 0 HD13 LEU A 68 2.226 0.797 -1.005 1.00 1.00 H new ATOM 0 HD21 LEU A 68 0.064 -1.440 -0.970 1.00 1.00 H new ATOM 0 HD22 LEU A 68 -0.180 0.277 -1.370 1.00 1.00 H new ATOM 0 HD23 LEU A 68 -0.654 -0.984 -2.533 1.00 1.00 H new ATOM 1107 N GLN A 69 -0.924 2.275 -4.134 1.00 1.00 N ATOM 1108 CA GLN A 69 -1.507 3.553 -4.467 1.00 1.00 C ATOM 1109 C GLN A 69 -1.519 4.371 -3.178 1.00 1.00 C ATOM 1110 O GLN A 69 -2.351 4.128 -2.309 1.00 1.00 O ATOM 1111 CB GLN A 69 -2.922 3.288 -5.017 1.00 1.00 C ATOM 1112 CG GLN A 69 -2.974 2.364 -6.246 1.00 1.00 C ATOM 1113 CD GLN A 69 -4.242 1.506 -6.284 1.00 1.00 C ATOM 1114 OE1 GLN A 69 -5.356 2.023 -6.208 1.00 1.00 O ATOM 1115 NE2 GLN A 69 -4.123 0.190 -6.372 1.00 1.00 N ATOM 0 H GLN A 69 -1.338 1.830 -3.315 1.00 1.00 H new ATOM 0 HA GLN A 69 -0.954 4.105 -5.227 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -3.528 2.850 -4.224 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -3.380 4.242 -5.278 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -2.921 2.967 -7.152 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -2.099 1.713 -6.244 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -3.198 -0.235 -6.435 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -4.956 -0.398 -6.377 1.00 1.00 H new ATOM 1124 N PHE A 70 -0.567 5.289 -2.997 1.00 1.00 N ATOM 1125 CA PHE A 70 -0.441 6.077 -1.768 1.00 1.00 C ATOM 1126 C PHE A 70 -1.449 7.243 -1.779 1.00 1.00 C ATOM 1127 O PHE A 70 -1.069 8.406 -1.653 1.00 1.00 O ATOM 1128 CB PHE A 70 1.031 6.503 -1.575 1.00 1.00 C ATOM 1129 CG PHE A 70 1.967 5.339 -1.271 1.00 1.00 C ATOM 1130 CD1 PHE A 70 2.144 4.814 0.019 1.00 1.00 C ATOM 1131 CD2 PHE A 70 2.660 4.745 -2.322 1.00 1.00 C ATOM 1132 CE1 PHE A 70 3.014 3.723 0.227 1.00 1.00 C ATOM 1133 CE2 PHE A 70 3.493 3.635 -2.154 1.00 1.00 C ATOM 1134 CZ PHE A 70 3.682 3.120 -0.859 1.00 1.00 C ATOM 0 H PHE A 70 0.140 5.508 -3.699 1.00 1.00 H new ATOM 0 HA PHE A 70 -0.699 5.478 -0.895 1.00 1.00 H new ATOM 0 HB2 PHE A 70 1.375 7.010 -2.477 1.00 1.00 H new ATOM 0 HB3 PHE A 70 1.088 7.226 -0.762 1.00 1.00 H new ATOM 0 HD1 PHE A 70 1.613 5.246 0.854 1.00 1.00 H new ATOM 0 HD2 PHE A 70 2.549 5.161 -3.313 1.00 1.00 H new ATOM 0 HE1 PHE A 70 3.170 3.346 1.227 1.00 1.00 H new ATOM 0 HE2 PHE A 70 3.982 3.181 -3.003 1.00 1.00 H new ATOM 0 HZ PHE A 70 4.331 2.272 -0.698 1.00 1.00 H new ATOM 1144 N PHE A 71 -2.735 6.914 -1.925 1.00 1.00 N ATOM 1145 CA PHE A 71 -3.907 7.781 -1.872 1.00 1.00 C ATOM 1146 C PHE A 71 -4.771 7.480 -0.634 1.00 1.00 C ATOM 1147 O PHE A 71 -5.334 6.391 -0.528 1.00 1.00 O ATOM 1148 CB PHE A 71 -4.634 7.757 -3.229 1.00 1.00 C ATOM 1149 CG PHE A 71 -5.765 6.756 -3.424 1.00 1.00 C ATOM 1150 CD1 PHE A 71 -5.435 5.411 -3.658 1.00 1.00 C ATOM 1151 CD2 PHE A 71 -7.117 7.144 -3.482 1.00 1.00 C ATOM 1152 CE1 PHE A 71 -6.416 4.486 -4.048 1.00 1.00 C ATOM 1153 CE2 PHE A 71 -8.106 6.224 -3.874 1.00 1.00 C ATOM 1154 CZ PHE A 71 -7.747 4.904 -4.202 1.00 1.00 C ATOM 0 H PHE A 71 -3.003 5.945 -2.099 1.00 1.00 H new ATOM 0 HA PHE A 71 -3.610 8.820 -1.726 1.00 1.00 H new ATOM 0 HB2 PHE A 71 -5.038 8.754 -3.408 1.00 1.00 H new ATOM 0 HB3 PHE A 71 -3.889 7.571 -4.002 1.00 1.00 H new ATOM 0 HD1 PHE A 71 -4.413 5.084 -3.536 1.00 1.00 H new ATOM 0 HD2 PHE A 71 -7.397 8.155 -3.224 1.00 1.00 H new ATOM 0 HE1 PHE A 71 -6.147 3.456 -4.229 1.00 1.00 H new ATOM 0 HE2 PHE A 71 -9.140 6.531 -3.923 1.00 1.00 H new ATOM 0 HZ PHE A 71 -8.492 4.215 -4.571 1.00 1.00 H new ATOM 1164 N PRO A 72 -4.820 8.351 0.389 1.00 1.00 N ATOM 1165 CA PRO A 72 -5.776 8.252 1.491 1.00 1.00 C ATOM 1166 C PRO A 72 -7.167 8.682 0.989 1.00 1.00 C ATOM 1167 O PRO A 72 -7.456 8.562 -0.198 1.00 1.00 O ATOM 1168 CB PRO A 72 -5.191 9.144 2.589 1.00 1.00 C ATOM 1169 CG PRO A 72 -4.442 10.216 1.818 1.00 1.00 C ATOM 1170 CD PRO A 72 -3.912 9.462 0.604 1.00 1.00 C ATOM 0 HA PRO A 72 -5.920 7.245 1.883 1.00 1.00 H new ATOM 0 HB2 PRO A 72 -5.973 9.573 3.216 1.00 1.00 H new ATOM 0 HB3 PRO A 72 -4.526 8.585 3.247 1.00 1.00 H new ATOM 0 HG2 PRO A 72 -5.098 11.037 1.528 1.00 1.00 H new ATOM 0 HG3 PRO A 72 -3.634 10.647 2.409 1.00 1.00 H new ATOM 0 HD2 PRO A 72 -3.876 10.110 -0.272 1.00 1.00 H new ATOM 0 HD3 PRO A 72 -2.897 9.107 0.779 1.00 1.00 H new ATOM 1178 N ALA A 73 -8.056 9.147 1.867 1.00 1.00 N ATOM 1179 CA ALA A 73 -9.234 9.892 1.447 1.00 1.00 C ATOM 1180 C ALA A 73 -8.831 11.236 0.836 1.00 1.00 C ATOM 1181 O ALA A 73 -9.237 11.556 -0.278 1.00 1.00 O ATOM 1182 CB ALA A 73 -10.143 10.120 2.648 1.00 1.00 C ATOM 0 H ALA A 73 -7.979 9.018 2.876 1.00 1.00 H new ATOM 0 HA ALA A 73 -9.766 9.315 0.690 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -11.026 10.678 2.335 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -10.449 9.159 3.061 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -9.606 10.687 3.408 1.00 1.00 H new ATOM 1188 N SER A 74 -8.036 12.032 1.557 1.00 1.00 N ATOM 1189 CA SER A 74 -7.777 13.429 1.239 1.00 1.00 C ATOM 1190 C SER A 74 -6.333 13.609 0.768 1.00 1.00 C ATOM 1191 O SER A 74 -5.399 13.497 1.562 1.00 1.00 O ATOM 1192 CB SER A 74 -8.150 14.300 2.444 1.00 1.00 C ATOM 1193 OG SER A 74 -9.461 13.988 2.913 1.00 1.00 O ATOM 0 H SER A 74 -7.548 11.712 2.393 1.00 1.00 H new ATOM 0 HA SER A 74 -8.401 13.756 0.407 1.00 1.00 H new ATOM 0 HB2 SER A 74 -7.427 14.147 3.245 1.00 1.00 H new ATOM 0 HB3 SER A 74 -8.100 15.353 2.166 1.00 1.00 H new ATOM 0 HG SER A 74 -9.676 14.555 3.683 1.00 1.00 H new ATOM 1199 N TRP A 75 -6.135 13.811 -0.537 1.00 1.00 N ATOM 1200 CA TRP A 75 -4.834 13.920 -1.199 1.00 1.00 C ATOM 1201 C TRP A 75 -4.878 15.036 -2.226 1.00 1.00 C ATOM 1202 O TRP A 75 -5.874 15.219 -2.925 1.00 1.00 O ATOM 1203 CB TRP A 75 -4.430 12.613 -1.906 1.00 1.00 C ATOM 1204 CG TRP A 75 -5.563 11.767 -2.400 1.00 1.00 C ATOM 1205 CD1 TRP A 75 -6.372 11.091 -1.571 1.00 1.00 C ATOM 1206 CD2 TRP A 75 -6.088 11.524 -3.744 1.00 1.00 C ATOM 1207 NE1 TRP A 75 -7.406 10.524 -2.275 1.00 1.00 N ATOM 1208 CE2 TRP A 75 -7.286 10.756 -3.623 1.00 1.00 C ATOM 1209 CE3 TRP A 75 -5.690 11.860 -5.054 1.00 1.00 C ATOM 1210 CZ2 TRP A 75 -8.054 10.360 -4.725 1.00 1.00 C ATOM 1211 CZ3 TRP A 75 -6.444 11.453 -6.172 1.00 1.00 C ATOM 1212 CH2 TRP A 75 -7.624 10.707 -6.012 1.00 1.00 C ATOM 0 H TRP A 75 -6.913 13.907 -1.190 1.00 1.00 H new ATOM 0 HA TRP A 75 -4.094 14.132 -0.427 1.00 1.00 H new ATOM 0 HB2 TRP A 75 -3.790 12.862 -2.753 1.00 1.00 H new ATOM 0 HB3 TRP A 75 -3.830 12.019 -1.217 1.00 1.00 H new ATOM 0 HD1 TRP A 75 -6.231 11.005 -0.504 1.00 1.00 H new ATOM 0 HE1 TRP A 75 -8.168 9.996 -1.849 1.00 1.00 H new ATOM 0 HE3 TRP A 75 -4.791 12.440 -5.203 1.00 1.00 H new ATOM 0 HZ2 TRP A 75 -8.964 9.796 -4.585 1.00 1.00 H new ATOM 0 HZ3 TRP A 75 -6.111 11.718 -7.165 1.00 1.00 H new ATOM 0 HH2 TRP A 75 -8.196 10.403 -6.876 1.00 1.00 H new ATOM 1223 N GLN A 76 -3.776 15.772 -2.310 1.00 1.00 N ATOM 1224 CA GLN A 76 -3.622 16.894 -3.234 1.00 1.00 C ATOM 1225 C GLN A 76 -3.345 16.392 -4.660 1.00 1.00 C ATOM 1226 O GLN A 76 -3.719 17.048 -5.634 1.00 1.00 O ATOM 1227 CB GLN A 76 -2.589 17.914 -2.717 1.00 1.00 C ATOM 1228 CG GLN A 76 -1.255 17.373 -2.192 1.00 1.00 C ATOM 1229 CD GLN A 76 -0.405 16.911 -3.360 1.00 1.00 C ATOM 1230 OE1 GLN A 76 -0.165 17.659 -4.304 1.00 1.00 O ATOM 1231 NE2 GLN A 76 0.012 15.667 -3.377 1.00 1.00 N ATOM 0 H GLN A 76 -2.952 15.606 -1.732 1.00 1.00 H new ATOM 0 HA GLN A 76 -4.564 17.440 -3.284 1.00 1.00 H new ATOM 0 HB2 GLN A 76 -2.373 18.612 -3.526 1.00 1.00 H new ATOM 0 HB3 GLN A 76 -3.056 18.488 -1.917 1.00 1.00 H new ATOM 0 HG2 GLN A 76 -0.732 18.147 -1.631 1.00 1.00 H new ATOM 0 HG3 GLN A 76 -1.431 16.545 -1.505 1.00 1.00 H new ATOM 0 HE21 GLN A 76 -0.190 15.050 -2.590 1.00 1.00 H new ATOM 0 HE22 GLN A 76 0.539 15.317 -4.177 1.00 1.00 H new ATOM 1240 N GLY A 77 -2.740 15.214 -4.781 1.00 1.00 N ATOM 1241 CA GLY A 77 -2.651 14.384 -5.951 1.00 1.00 C ATOM 1242 C GLY A 77 -1.749 13.260 -5.489 1.00 1.00 C ATOM 1243 O GLY A 77 -2.175 12.370 -4.761 1.00 1.00 O ATOM 0 H GLY A 77 -2.262 14.790 -3.986 1.00 1.00 H new ATOM 0 HA2 GLY A 77 -3.629 14.017 -6.263 1.00 1.00 H new ATOM 0 HA3 GLY A 77 -2.227 14.922 -6.799 1.00 1.00 H new ATOM 1247 N GLU A 78 -0.470 13.410 -5.787 1.00 1.00 N ATOM 1248 CA GLU A 78 0.663 12.590 -5.408 1.00 1.00 C ATOM 1249 C GLU A 78 1.892 13.526 -5.371 1.00 1.00 C ATOM 1250 O GLU A 78 1.717 14.747 -5.444 1.00 1.00 O ATOM 1251 CB GLU A 78 0.768 11.457 -6.441 1.00 1.00 C ATOM 1252 CG GLU A 78 0.134 10.163 -5.901 1.00 1.00 C ATOM 1253 CD GLU A 78 0.204 9.018 -6.906 1.00 1.00 C ATOM 1254 OE1 GLU A 78 1.305 8.792 -7.464 1.00 1.00 O ATOM 1255 OE2 GLU A 78 -0.821 8.327 -7.109 1.00 1.00 O ATOM 0 H GLU A 78 -0.170 14.196 -6.364 1.00 1.00 H new ATOM 0 HA GLU A 78 0.575 12.122 -4.428 1.00 1.00 H new ATOM 0 HB2 GLU A 78 0.270 11.753 -7.364 1.00 1.00 H new ATOM 0 HB3 GLU A 78 1.815 11.279 -6.687 1.00 1.00 H new ATOM 0 HG2 GLU A 78 0.642 9.868 -4.983 1.00 1.00 H new ATOM 0 HG3 GLU A 78 -0.908 10.353 -5.642 1.00 1.00 H new ATOM 1262 N GLN A 79 3.116 12.993 -5.290 1.00 1.00 N ATOM 1263 CA GLN A 79 4.379 13.718 -5.192 1.00 1.00 C ATOM 1264 C GLN A 79 4.402 14.555 -3.914 1.00 1.00 C ATOM 1265 O GLN A 79 4.129 15.753 -3.899 1.00 1.00 O ATOM 1266 CB GLN A 79 4.655 14.465 -6.507 1.00 1.00 C ATOM 1267 CG GLN A 79 6.145 14.673 -6.781 1.00 1.00 C ATOM 1268 CD GLN A 79 6.706 15.964 -6.190 1.00 1.00 C ATOM 1269 OE1 GLN A 79 6.589 17.032 -6.783 1.00 1.00 O ATOM 1270 NE2 GLN A 79 7.364 15.886 -5.043 1.00 1.00 N ATOM 0 H GLN A 79 3.255 11.983 -5.292 1.00 1.00 H new ATOM 0 HA GLN A 79 5.226 13.040 -5.083 1.00 1.00 H new ATOM 0 HB2 GLN A 79 4.215 13.907 -7.333 1.00 1.00 H new ATOM 0 HB3 GLN A 79 4.159 15.435 -6.477 1.00 1.00 H new ATOM 0 HG2 GLN A 79 6.701 13.827 -6.376 1.00 1.00 H new ATOM 0 HG3 GLN A 79 6.310 14.676 -7.858 1.00 1.00 H new ATOM 0 HE21 GLN A 79 7.451 14.989 -4.565 1.00 1.00 H new ATOM 0 HE22 GLN A 79 7.784 16.723 -4.638 1.00 1.00 H new ATOM 1279 N ARG A 80 4.742 13.878 -2.816 1.00 1.00 N ATOM 1280 CA ARG A 80 4.450 14.252 -1.436 1.00 1.00 C ATOM 1281 C ARG A 80 2.937 14.484 -1.276 1.00 1.00 C ATOM 1282 O ARG A 80 2.159 14.176 -2.176 1.00 1.00 O ATOM 1283 CB ARG A 80 5.402 15.363 -0.951 1.00 1.00 C ATOM 1284 CG ARG A 80 5.732 15.257 0.551 1.00 1.00 C ATOM 1285 CD ARG A 80 6.693 16.357 1.012 1.00 1.00 C ATOM 1286 NE ARG A 80 6.801 16.372 2.484 1.00 1.00 N ATOM 1287 CZ ARG A 80 6.374 17.345 3.299 1.00 1.00 C ATOM 1288 NH1 ARG A 80 6.127 18.566 2.834 1.00 1.00 N ATOM 1289 NH2 ARG A 80 6.186 17.069 4.584 1.00 1.00 N ATOM 0 H ARG A 80 5.260 13.001 -2.873 1.00 1.00 H new ATOM 0 HA ARG A 80 4.668 13.441 -0.741 1.00 1.00 H new ATOM 0 HB2 ARG A 80 6.327 15.318 -1.525 1.00 1.00 H new ATOM 0 HB3 ARG A 80 4.950 16.335 -1.151 1.00 1.00 H new ATOM 0 HG2 ARG A 80 4.810 15.317 1.129 1.00 1.00 H new ATOM 0 HG3 ARG A 80 6.174 14.282 0.756 1.00 1.00 H new ATOM 0 HD2 ARG A 80 7.677 16.195 0.572 1.00 1.00 H new ATOM 0 HD3 ARG A 80 6.341 17.326 0.658 1.00 1.00 H new ATOM 0 HE ARG A 80 7.243 15.564 2.922 1.00 1.00 H new ATOM 0 HH11 ARG A 80 6.262 18.772 1.844 1.00 1.00 H new ATOM 0 HH12 ARG A 80 5.802 19.297 3.467 1.00 1.00 H new ATOM 0 HH21 ARG A 80 6.366 16.129 4.935 1.00 1.00 H new ATOM 0 HH22 ARG A 80 5.861 17.797 5.220 1.00 1.00 H new ATOM 1303 N GLN A 81 2.522 14.876 -0.073 1.00 1.00 N ATOM 1304 CA GLN A 81 1.194 14.799 0.546 1.00 1.00 C ATOM 1305 C GLN A 81 1.200 15.094 2.056 1.00 1.00 C ATOM 1306 O GLN A 81 0.142 15.070 2.675 1.00 1.00 O ATOM 1307 CB GLN A 81 0.469 13.474 0.202 1.00 1.00 C ATOM 1308 CG GLN A 81 0.638 12.313 1.190 1.00 1.00 C ATOM 1309 CD GLN A 81 -0.089 11.063 0.709 1.00 1.00 C ATOM 1310 OE1 GLN A 81 -1.190 10.778 1.171 1.00 1.00 O ATOM 1311 NE2 GLN A 81 0.496 10.284 -0.187 1.00 1.00 N ATOM 0 H GLN A 81 3.186 15.307 0.570 1.00 1.00 H new ATOM 0 HA GLN A 81 0.612 15.606 0.101 1.00 1.00 H new ATOM 0 HB2 GLN A 81 -0.596 13.685 0.106 1.00 1.00 H new ATOM 0 HB3 GLN A 81 0.817 13.141 -0.776 1.00 1.00 H new ATOM 0 HG2 GLN A 81 1.698 12.093 1.317 1.00 1.00 H new ATOM 0 HG3 GLN A 81 0.254 12.606 2.167 1.00 1.00 H new ATOM 0 HE21 GLN A 81 1.411 10.535 -0.561 1.00 1.00 H new ATOM 0 HE22 GLN A 81 0.032 9.433 -0.503 1.00 1.00 H new ATOM 1320 N THR A 82 2.372 15.301 2.661 1.00 1.00 N ATOM 1321 CA THR A 82 2.645 15.181 4.096 1.00 1.00 C ATOM 1322 C THR A 82 1.886 13.960 4.704 1.00 1.00 C ATOM 1323 O THR A 82 0.919 14.108 5.461 1.00 1.00 O ATOM 1324 CB THR A 82 2.569 16.578 4.747 1.00 1.00 C ATOM 1325 OG1 THR A 82 3.425 16.704 5.862 1.00 1.00 O ATOM 1326 CG2 THR A 82 1.200 17.089 5.139 1.00 1.00 C ATOM 0 H THR A 82 3.202 15.572 2.134 1.00 1.00 H new ATOM 0 HA THR A 82 3.668 14.890 4.334 1.00 1.00 H new ATOM 0 HB THR A 82 2.897 17.208 3.920 1.00 1.00 H new ATOM 0 HG1 THR A 82 3.342 17.605 6.238 1.00 1.00 H new ATOM 0 HG21 THR A 82 1.295 18.080 5.584 1.00 1.00 H new ATOM 0 HG22 THR A 82 0.566 17.148 4.254 1.00 1.00 H new ATOM 0 HG23 THR A 82 0.751 16.408 5.862 1.00 1.00 H new ATOM 1334 N PRO A 83 2.273 12.727 4.306 1.00 1.00 N ATOM 1335 CA PRO A 83 1.586 11.487 4.684 1.00 1.00 C ATOM 1336 C PRO A 83 1.779 11.132 6.165 1.00 1.00 C ATOM 1337 O PRO A 83 2.494 11.824 6.893 1.00 1.00 O ATOM 1338 CB PRO A 83 2.149 10.402 3.759 1.00 1.00 C ATOM 1339 CG PRO A 83 3.502 10.934 3.296 1.00 1.00 C ATOM 1340 CD PRO A 83 3.430 12.444 3.466 1.00 1.00 C ATOM 0 HA PRO A 83 0.507 11.592 4.568 1.00 1.00 H new ATOM 0 HB2 PRO A 83 2.258 9.454 4.285 1.00 1.00 H new ATOM 0 HB3 PRO A 83 1.486 10.223 2.913 1.00 1.00 H new ATOM 0 HG2 PRO A 83 4.313 10.511 3.889 1.00 1.00 H new ATOM 0 HG3 PRO A 83 3.694 10.666 2.257 1.00 1.00 H new ATOM 0 HD2 PRO A 83 4.342 12.824 3.927 1.00 1.00 H new ATOM 0 HD3 PRO A 83 3.333 12.936 2.498 1.00 1.00 H new ATOM 1348 N SER A 84 1.138 10.057 6.637 1.00 1.00 N ATOM 1349 CA SER A 84 1.300 9.589 8.008 1.00 1.00 C ATOM 1350 C SER A 84 2.587 8.767 8.119 1.00 1.00 C ATOM 1351 O SER A 84 3.112 8.304 7.108 1.00 1.00 O ATOM 1352 CB SER A 84 0.091 8.753 8.441 1.00 1.00 C ATOM 1353 OG SER A 84 -1.048 8.998 7.635 1.00 1.00 O ATOM 0 H SER A 84 0.497 9.493 6.079 1.00 1.00 H new ATOM 0 HA SER A 84 1.367 10.451 8.671 1.00 1.00 H new ATOM 0 HB2 SER A 84 0.347 7.695 8.392 1.00 1.00 H new ATOM 0 HB3 SER A 84 -0.148 8.975 9.481 1.00 1.00 H new ATOM 0 HG SER A 84 -1.794 8.443 7.945 1.00 1.00 H new ATOM 1359 N ARG A 85 3.068 8.521 9.335 1.00 1.00 N ATOM 1360 CA ARG A 85 4.339 7.832 9.548 1.00 1.00 C ATOM 1361 C ARG A 85 4.224 6.316 9.370 1.00 1.00 C ATOM 1362 O ARG A 85 5.219 5.689 9.038 1.00 1.00 O ATOM 1363 CB ARG A 85 4.929 8.236 10.911 1.00 1.00 C ATOM 1364 CG ARG A 85 5.584 9.631 10.822 1.00 1.00 C ATOM 1365 CD ARG A 85 5.827 10.298 12.179 1.00 1.00 C ATOM 1366 NE ARG A 85 6.661 9.490 13.086 1.00 1.00 N ATOM 1367 CZ ARG A 85 6.750 9.673 14.409 1.00 1.00 C ATOM 1368 NH1 ARG A 85 6.088 10.658 15.015 1.00 1.00 N ATOM 1369 NH2 ARG A 85 7.510 8.869 15.136 1.00 1.00 N ATOM 0 H ARG A 85 2.592 8.791 10.196 1.00 1.00 H new ATOM 0 HA ARG A 85 5.037 8.151 8.773 1.00 1.00 H new ATOM 0 HB2 ARG A 85 4.143 8.244 11.667 1.00 1.00 H new ATOM 0 HB3 ARG A 85 5.668 7.500 11.227 1.00 1.00 H new ATOM 0 HG2 ARG A 85 6.536 9.540 10.299 1.00 1.00 H new ATOM 0 HG3 ARG A 85 4.949 10.280 10.219 1.00 1.00 H new ATOM 0 HD2 ARG A 85 6.306 11.264 12.020 1.00 1.00 H new ATOM 0 HD3 ARG A 85 4.867 10.493 12.657 1.00 1.00 H new ATOM 0 HE ARG A 85 7.211 8.736 12.675 1.00 1.00 H new ATOM 0 HH11 ARG A 85 5.501 11.289 14.470 1.00 1.00 H new ATOM 0 HH12 ARG A 85 6.169 10.781 16.024 1.00 1.00 H new ATOM 0 HH21 ARG A 85 8.026 8.112 14.688 1.00 1.00 H new ATOM 0 HH22 ARG A 85 7.579 9.007 16.144 1.00 1.00 H new ATOM 1383 N GLU A 86 3.040 5.721 9.517 1.00 1.00 N ATOM 1384 CA GLU A 86 2.803 4.343 9.070 1.00 1.00 C ATOM 1385 C GLU A 86 2.743 4.309 7.526 1.00 1.00 C ATOM 1386 O GLU A 86 3.196 3.357 6.903 1.00 1.00 O ATOM 1387 CB GLU A 86 1.496 3.850 9.727 1.00 1.00 C ATOM 1388 CG GLU A 86 1.019 2.425 9.376 1.00 1.00 C ATOM 1389 CD GLU A 86 1.689 1.243 10.091 1.00 1.00 C ATOM 1390 OE1 GLU A 86 2.573 1.431 10.952 1.00 1.00 O ATOM 1391 OE2 GLU A 86 1.259 0.092 9.832 1.00 1.00 O ATOM 0 H GLU A 86 2.228 6.170 9.942 1.00 1.00 H new ATOM 0 HA GLU A 86 3.611 3.676 9.370 1.00 1.00 H new ATOM 0 HB2 GLU A 86 1.620 3.907 10.808 1.00 1.00 H new ATOM 0 HB3 GLU A 86 0.701 4.547 9.460 1.00 1.00 H new ATOM 0 HG2 GLU A 86 -0.051 2.373 9.576 1.00 1.00 H new ATOM 0 HG3 GLU A 86 1.150 2.284 8.303 1.00 1.00 H new ATOM 1398 N TYR A 87 2.166 5.355 6.918 1.00 1.00 N ATOM 1399 CA TYR A 87 1.856 5.539 5.495 1.00 1.00 C ATOM 1400 C TYR A 87 3.146 5.680 4.674 1.00 1.00 C ATOM 1401 O TYR A 87 3.476 4.764 3.921 1.00 1.00 O ATOM 1402 CB TYR A 87 0.871 6.730 5.402 1.00 1.00 C ATOM 1403 CG TYR A 87 -0.096 6.722 4.238 1.00 1.00 C ATOM 1404 CD1 TYR A 87 0.391 6.948 2.944 1.00 1.00 C ATOM 1405 CD2 TYR A 87 -1.485 6.547 4.444 1.00 1.00 C ATOM 1406 CE1 TYR A 87 -0.487 6.880 1.859 1.00 1.00 C ATOM 1407 CE2 TYR A 87 -2.376 6.457 3.351 1.00 1.00 C ATOM 1408 CZ TYR A 87 -1.844 6.567 2.050 1.00 1.00 C ATOM 1409 OH TYR A 87 -2.613 6.360 0.958 1.00 1.00 O ATOM 0 H TYR A 87 1.878 6.169 7.461 1.00 1.00 H new ATOM 0 HA TYR A 87 1.366 4.671 5.053 1.00 1.00 H new ATOM 0 HB2 TYR A 87 0.292 6.766 6.325 1.00 1.00 H new ATOM 0 HB3 TYR A 87 1.453 7.650 5.355 1.00 1.00 H new ATOM 0 HD1 TYR A 87 1.436 7.173 2.786 1.00 1.00 H new ATOM 0 HD2 TYR A 87 -1.870 6.481 5.451 1.00 1.00 H new ATOM 0 HE1 TYR A 87 -0.119 7.070 0.862 1.00 1.00 H new ATOM 0 HE2 TYR A 87 -3.434 6.308 3.508 1.00 1.00 H new ATOM 0 HH TYR A 87 -2.330 5.536 0.510 1.00 1.00 H new ATOM 1419 N VAL A 88 3.864 6.805 4.770 1.00 1.00 N ATOM 1420 CA VAL A 88 5.085 7.060 3.996 1.00 1.00 C ATOM 1421 C VAL A 88 6.014 8.012 4.778 1.00 1.00 C ATOM 1422 O VAL A 88 5.539 8.964 5.394 1.00 1.00 O ATOM 1423 CB VAL A 88 4.685 7.645 2.607 1.00 1.00 C ATOM 1424 CG1 VAL A 88 5.789 8.433 1.897 1.00 1.00 C ATOM 1425 CG2 VAL A 88 4.194 6.619 1.572 1.00 1.00 C ATOM 0 H VAL A 88 3.611 7.572 5.393 1.00 1.00 H new ATOM 0 HA VAL A 88 5.636 6.133 3.834 1.00 1.00 H new ATOM 0 HB VAL A 88 3.868 8.299 2.912 1.00 1.00 H new ATOM 0 HG11 VAL A 88 5.417 8.800 0.940 1.00 1.00 H new ATOM 0 HG12 VAL A 88 6.090 9.277 2.517 1.00 1.00 H new ATOM 0 HG13 VAL A 88 6.648 7.784 1.727 1.00 1.00 H new ATOM 0 HG21 VAL A 88 3.942 7.131 0.643 1.00 1.00 H new ATOM 0 HG22 VAL A 88 4.981 5.889 1.382 1.00 1.00 H new ATOM 0 HG23 VAL A 88 3.310 6.109 1.956 1.00 1.00 H new ATOM 1435 N ASP A 89 7.335 7.826 4.626 1.00 1.00 N ATOM 1436 CA ASP A 89 8.419 8.795 4.881 1.00 1.00 C ATOM 1437 C ASP A 89 8.475 9.311 6.321 1.00 1.00 C ATOM 1438 O ASP A 89 7.995 10.393 6.649 1.00 1.00 O ATOM 1439 CB ASP A 89 8.398 9.934 3.849 1.00 1.00 C ATOM 1440 CG ASP A 89 9.517 10.953 4.066 1.00 1.00 C ATOM 1441 OD1 ASP A 89 10.695 10.540 4.195 1.00 1.00 O ATOM 1442 OD2 ASP A 89 9.248 12.170 3.946 1.00 1.00 O ATOM 0 H ASP A 89 7.702 6.932 4.299 1.00 1.00 H new ATOM 0 HA ASP A 89 9.350 8.243 4.754 1.00 1.00 H new ATOM 0 HB2 ASP A 89 8.486 9.512 2.848 1.00 1.00 H new ATOM 0 HB3 ASP A 89 7.435 10.443 3.897 1.00 1.00 H new ATOM 1447 N LEU A 90 9.089 8.507 7.188 1.00 1.00 N ATOM 1448 CA LEU A 90 9.006 8.603 8.643 1.00 1.00 C ATOM 1449 C LEU A 90 10.386 8.685 9.304 1.00 1.00 C ATOM 1450 O LEU A 90 10.588 8.155 10.392 1.00 1.00 O ATOM 1451 CB LEU A 90 8.118 7.467 9.197 1.00 1.00 C ATOM 1452 CG LEU A 90 8.357 6.006 8.758 1.00 1.00 C ATOM 1453 CD1 LEU A 90 7.813 5.710 7.354 1.00 1.00 C ATOM 1454 CD2 LEU A 90 9.818 5.557 8.817 1.00 1.00 C ATOM 0 H LEU A 90 9.684 7.737 6.881 1.00 1.00 H new ATOM 0 HA LEU A 90 8.524 9.545 8.903 1.00 1.00 H new ATOM 0 HB2 LEU A 90 8.199 7.495 10.284 1.00 1.00 H new ATOM 0 HB3 LEU A 90 7.086 7.714 8.948 1.00 1.00 H new ATOM 0 HG LEU A 90 7.800 5.431 9.498 1.00 1.00 H new ATOM 0 HD11 LEU A 90 8.010 4.669 7.100 1.00 1.00 H new ATOM 0 HD12 LEU A 90 6.738 5.892 7.334 1.00 1.00 H new ATOM 0 HD13 LEU A 90 8.304 6.359 6.629 1.00 1.00 H new ATOM 0 HD21 LEU A 90 9.893 4.519 8.492 1.00 1.00 H new ATOM 0 HD22 LEU A 90 10.419 6.187 8.161 1.00 1.00 H new ATOM 0 HD23 LEU A 90 10.184 5.644 9.840 1.00 1.00 H new ATOM 1466 N GLU A 91 11.349 9.338 8.646 1.00 1.00 N ATOM 1467 CA GLU A 91 12.672 9.628 9.210 1.00 1.00 C ATOM 1468 C GLU A 91 13.427 8.349 9.635 1.00 1.00 C ATOM 1469 O GLU A 91 14.184 8.359 10.607 1.00 1.00 O ATOM 1470 CB GLU A 91 12.516 10.638 10.364 1.00 1.00 C ATOM 1471 CG GLU A 91 13.797 11.424 10.668 1.00 1.00 C ATOM 1472 CD GLU A 91 13.817 11.905 12.116 1.00 1.00 C ATOM 1473 OE1 GLU A 91 13.125 12.904 12.429 1.00 1.00 O ATOM 1474 OE2 GLU A 91 14.528 11.299 12.953 1.00 1.00 O ATOM 0 H GLU A 91 11.230 9.685 7.694 1.00 1.00 H new ATOM 0 HA GLU A 91 13.295 10.076 8.436 1.00 1.00 H new ATOM 0 HB2 GLU A 91 11.719 11.339 10.117 1.00 1.00 H new ATOM 0 HB3 GLU A 91 12.204 10.105 11.263 1.00 1.00 H new ATOM 0 HG2 GLU A 91 14.667 10.795 10.479 1.00 1.00 H new ATOM 0 HG3 GLU A 91 13.870 12.279 9.997 1.00 1.00 H new ATOM 1481 N ARG A 92 13.221 7.241 8.906 1.00 1.00 N ATOM 1482 CA ARG A 92 13.616 5.875 9.196 1.00 1.00 C ATOM 1483 C ARG A 92 13.005 5.370 10.497 1.00 1.00 C ATOM 1484 O ARG A 92 13.134 5.979 11.556 1.00 1.00 O ATOM 1485 CB ARG A 92 15.136 5.712 9.154 1.00 1.00 C ATOM 1486 CG ARG A 92 15.665 5.047 7.882 1.00 1.00 C ATOM 1487 CD ARG A 92 15.312 5.878 6.646 1.00 1.00 C ATOM 1488 NE ARG A 92 15.951 5.374 5.445 1.00 1.00 N ATOM 1489 CZ ARG A 92 17.167 5.691 4.980 1.00 1.00 C ATOM 1490 NH1 ARG A 92 18.086 6.239 5.770 1.00 1.00 N ATOM 1491 NH2 ARG A 92 17.431 5.458 3.700 1.00 1.00 N ATOM 0 H ARG A 92 12.726 7.297 8.016 1.00 1.00 H new ATOM 0 HA ARG A 92 13.212 5.241 8.407 1.00 1.00 H new ATOM 0 HB2 ARG A 92 15.598 6.694 9.255 1.00 1.00 H new ATOM 0 HB3 ARG A 92 15.450 5.122 10.015 1.00 1.00 H new ATOM 0 HG2 ARG A 92 16.747 4.930 7.950 1.00 1.00 H new ATOM 0 HG3 ARG A 92 15.242 4.047 7.786 1.00 1.00 H new ATOM 0 HD2 ARG A 92 14.231 5.878 6.507 1.00 1.00 H new ATOM 0 HD3 ARG A 92 15.613 6.913 6.808 1.00 1.00 H new ATOM 0 HE ARG A 92 15.415 4.704 4.893 1.00 1.00 H new ATOM 0 HH11 ARG A 92 17.871 6.425 6.750 1.00 1.00 H new ATOM 0 HH12 ARG A 92 19.006 6.473 5.396 1.00 1.00 H new ATOM 0 HH21 ARG A 92 16.717 5.048 3.098 1.00 1.00 H new ATOM 0 HH22 ARG A 92 18.348 5.689 3.318 1.00 1.00 H new ATOM 1505 N GLU A 93 12.331 4.232 10.381 1.00 1.00 N ATOM 1506 CA GLU A 93 11.865 3.473 11.523 1.00 1.00 C ATOM 1507 C GLU A 93 13.043 2.617 12.008 1.00 1.00 C ATOM 1508 O GLU A 93 14.145 3.145 12.153 1.00 1.00 O ATOM 1509 CB GLU A 93 10.527 2.758 11.230 1.00 1.00 C ATOM 1510 CG GLU A 93 9.773 2.230 12.462 1.00 1.00 C ATOM 1511 CD GLU A 93 9.754 3.205 13.635 1.00 1.00 C ATOM 1512 OE1 GLU A 93 8.838 4.049 13.731 1.00 1.00 O ATOM 1513 OE2 GLU A 93 10.681 3.105 14.467 1.00 1.00 O ATOM 0 H GLU A 93 12.093 3.811 9.483 1.00 1.00 H new ATOM 0 HA GLU A 93 11.581 4.104 12.365 1.00 1.00 H new ATOM 0 HB2 GLU A 93 9.875 3.450 10.696 1.00 1.00 H new ATOM 0 HB3 GLU A 93 10.722 1.921 10.559 1.00 1.00 H new ATOM 0 HG2 GLU A 93 8.747 1.999 12.177 1.00 1.00 H new ATOM 0 HG3 GLU A 93 10.232 1.296 12.785 1.00 1.00 H new ATOM 1520 N ALA A 94 12.844 1.328 12.285 1.00 1.00 N ATOM 1521 CA ALA A 94 13.880 0.371 12.619 1.00 1.00 C ATOM 1522 C ALA A 94 14.814 0.151 11.418 1.00 1.00 C ATOM 1523 O ALA A 94 15.021 1.012 10.563 1.00 1.00 O ATOM 1524 CB ALA A 94 13.170 -0.911 13.087 1.00 1.00 C ATOM 0 H ALA A 94 11.913 0.912 12.280 1.00 1.00 H new ATOM 0 HA ALA A 94 14.525 0.730 13.421 1.00 1.00 H new ATOM 0 HB1 ALA A 94 13.914 -1.663 13.350 1.00 1.00 H new ATOM 0 HB2 ALA A 94 12.555 -0.689 13.959 1.00 1.00 H new ATOM 0 HB3 ALA A 94 12.538 -1.291 12.284 1.00 1.00 H new ATOM 1530 N GLY A 95 15.378 -1.043 11.305 1.00 1.00 N ATOM 1531 CA GLY A 95 16.070 -1.473 10.093 1.00 1.00 C ATOM 1532 C GLY A 95 15.110 -1.738 8.929 1.00 1.00 C ATOM 1533 O GLY A 95 15.540 -2.225 7.880 1.00 1.00 O ATOM 0 H GLY A 95 15.370 -1.742 12.048 1.00 1.00 H new ATOM 0 HA2 GLY A 95 16.789 -0.708 9.799 1.00 1.00 H new ATOM 0 HA3 GLY A 95 16.637 -2.379 10.305 1.00 1.00 H new ATOM 1537 N LYS A 96 13.828 -1.402 9.083 1.00 1.00 N ATOM 1538 CA LYS A 96 12.817 -1.345 8.048 1.00 1.00 C ATOM 1539 C LYS A 96 12.184 0.039 8.038 1.00 1.00 C ATOM 1540 O LYS A 96 12.245 0.748 9.041 1.00 1.00 O ATOM 1541 CB LYS A 96 11.789 -2.470 8.240 1.00 1.00 C ATOM 1542 CG LYS A 96 11.246 -2.694 9.664 1.00 1.00 C ATOM 1543 CD LYS A 96 11.999 -3.777 10.465 1.00 1.00 C ATOM 1544 CE LYS A 96 11.056 -4.742 11.203 1.00 1.00 C ATOM 1545 NZ LYS A 96 10.239 -4.109 12.257 1.00 1.00 N ATOM 0 H LYS A 96 13.453 -1.147 9.997 1.00 1.00 H new ATOM 0 HA LYS A 96 13.271 -1.506 7.070 1.00 1.00 H new ATOM 0 HB2 LYS A 96 10.942 -2.269 7.584 1.00 1.00 H new ATOM 0 HB3 LYS A 96 12.241 -3.402 7.901 1.00 1.00 H new ATOM 0 HG2 LYS A 96 11.295 -1.753 10.212 1.00 1.00 H new ATOM 0 HG3 LYS A 96 10.194 -2.971 9.600 1.00 1.00 H new ATOM 0 HD2 LYS A 96 12.635 -4.346 9.787 1.00 1.00 H new ATOM 0 HD3 LYS A 96 12.656 -3.295 11.189 1.00 1.00 H new ATOM 0 HE2 LYS A 96 10.391 -5.208 10.476 1.00 1.00 H new ATOM 0 HE3 LYS A 96 11.649 -5.540 11.650 1.00 1.00 H new ATOM 0 HZ1 LYS A 96 9.761 -4.845 12.815 1.00 1.00 H new ATOM 0 HZ2 LYS A 96 10.852 -3.545 12.880 1.00 1.00 H new ATOM 0 HZ3 LYS A 96 9.527 -3.490 11.820 1.00 1.00 H new ATOM 1559 N VAL A 97 11.566 0.421 6.922 1.00 1.00 N ATOM 1560 CA VAL A 97 10.615 1.537 6.899 1.00 1.00 C ATOM 1561 C VAL A 97 9.224 0.917 6.870 1.00 1.00 C ATOM 1562 O VAL A 97 9.082 -0.238 6.468 1.00 1.00 O ATOM 1563 CB VAL A 97 10.887 2.474 5.703 1.00 1.00 C ATOM 1564 CG1 VAL A 97 10.261 2.009 4.392 1.00 1.00 C ATOM 1565 CG2 VAL A 97 10.419 3.907 5.903 1.00 1.00 C ATOM 0 H VAL A 97 11.706 -0.027 6.016 1.00 1.00 H new ATOM 0 HA VAL A 97 10.715 2.172 7.779 1.00 1.00 H new ATOM 0 HB VAL A 97 11.975 2.437 5.646 1.00 1.00 H new ATOM 0 HG11 VAL A 97 10.499 2.722 3.602 1.00 1.00 H new ATOM 0 HG12 VAL A 97 10.657 1.029 4.127 1.00 1.00 H new ATOM 0 HG13 VAL A 97 9.179 1.944 4.508 1.00 1.00 H new ATOM 0 HG21 VAL A 97 10.651 4.493 5.014 1.00 1.00 H new ATOM 0 HG22 VAL A 97 9.343 3.918 6.074 1.00 1.00 H new ATOM 0 HG23 VAL A 97 10.928 4.339 6.765 1.00 1.00 H new ATOM 1575 N TYR A 98 8.205 1.686 7.233 1.00 1.00 N ATOM 1576 CA TYR A 98 6.833 1.249 7.232 1.00 1.00 C ATOM 1577 C TYR A 98 6.161 1.924 6.055 1.00 1.00 C ATOM 1578 O TYR A 98 6.601 2.990 5.600 1.00 1.00 O ATOM 1579 CB TYR A 98 6.218 1.579 8.589 1.00 1.00 C ATOM 1580 CG TYR A 98 6.664 0.573 9.634 1.00 1.00 C ATOM 1581 CD1 TYR A 98 8.007 0.559 10.050 1.00 1.00 C ATOM 1582 CD2 TYR A 98 5.781 -0.411 10.116 1.00 1.00 C ATOM 1583 CE1 TYR A 98 8.478 -0.424 10.928 1.00 1.00 C ATOM 1584 CE2 TYR A 98 6.235 -1.388 11.022 1.00 1.00 C ATOM 1585 CZ TYR A 98 7.586 -1.389 11.434 1.00 1.00 C ATOM 1586 OH TYR A 98 8.037 -2.275 12.356 1.00 1.00 O ATOM 0 H TYR A 98 8.323 2.651 7.542 1.00 1.00 H new ATOM 0 HA TYR A 98 6.715 0.173 7.106 1.00 1.00 H new ATOM 0 HB2 TYR A 98 6.512 2.583 8.894 1.00 1.00 H new ATOM 0 HB3 TYR A 98 5.131 1.575 8.513 1.00 1.00 H new ATOM 0 HD1 TYR A 98 8.685 1.317 9.687 1.00 1.00 H new ATOM 0 HD2 TYR A 98 4.751 -0.417 9.790 1.00 1.00 H new ATOM 0 HE1 TYR A 98 9.519 -0.442 11.216 1.00 1.00 H new ATOM 0 HE2 TYR A 98 5.553 -2.134 11.401 1.00 1.00 H new ATOM 0 HH TYR A 98 7.309 -2.879 12.613 1.00 1.00 H new ATOM 1596 N LEU A 99 5.179 1.233 5.497 1.00 1.00 N ATOM 1597 CA LEU A 99 4.455 1.606 4.330 1.00 1.00 C ATOM 1598 C LEU A 99 3.002 1.220 4.563 1.00 1.00 C ATOM 1599 O LEU A 99 2.682 0.216 5.204 1.00 1.00 O ATOM 1600 CB LEU A 99 5.041 0.843 3.147 1.00 1.00 C ATOM 1601 CG LEU A 99 6.429 1.293 2.661 1.00 1.00 C ATOM 1602 CD1 LEU A 99 6.804 0.446 1.442 1.00 1.00 C ATOM 1603 CD2 LEU A 99 6.516 2.777 2.277 1.00 1.00 C ATOM 0 H LEU A 99 4.860 0.345 5.884 1.00 1.00 H new ATOM 0 HA LEU A 99 4.520 2.674 4.123 1.00 1.00 H new ATOM 0 HB2 LEU A 99 5.099 -0.212 3.416 1.00 1.00 H new ATOM 0 HB3 LEU A 99 4.345 0.921 2.312 1.00 1.00 H new ATOM 0 HG LEU A 99 7.116 1.155 3.496 1.00 1.00 H new ATOM 0 HD11 LEU A 99 7.786 0.747 1.078 1.00 1.00 H new ATOM 0 HD12 LEU A 99 6.828 -0.607 1.724 1.00 1.00 H new ATOM 0 HD13 LEU A 99 6.065 0.594 0.655 1.00 1.00 H new ATOM 0 HD21 LEU A 99 7.528 3.008 1.946 1.00 1.00 H new ATOM 0 HD22 LEU A 99 5.814 2.986 1.470 1.00 1.00 H new ATOM 0 HD23 LEU A 99 6.268 3.392 3.142 1.00 1.00 H new ATOM 1615 N LYS A 100 2.115 1.988 3.956 1.00 1.00 N ATOM 1616 CA LYS A 100 0.672 1.854 4.102 1.00 1.00 C ATOM 1617 C LYS A 100 0.095 2.601 2.933 1.00 1.00 C ATOM 1618 O LYS A 100 0.491 3.736 2.674 1.00 1.00 O ATOM 1619 CB LYS A 100 0.128 2.469 5.411 1.00 1.00 C ATOM 1620 CG LYS A 100 -0.844 1.554 6.164 1.00 1.00 C ATOM 1621 CD LYS A 100 -2.042 2.275 6.810 1.00 1.00 C ATOM 1622 CE LYS A 100 -1.706 3.564 7.574 1.00 1.00 C ATOM 1623 NZ LYS A 100 -2.728 3.891 8.593 1.00 1.00 N ATOM 0 H LYS A 100 2.384 2.746 3.328 1.00 1.00 H new ATOM 0 HA LYS A 100 0.400 0.799 4.135 1.00 1.00 H new ATOM 0 HB2 LYS A 100 0.966 2.710 6.065 1.00 1.00 H new ATOM 0 HB3 LYS A 100 -0.376 3.407 5.179 1.00 1.00 H new ATOM 0 HG2 LYS A 100 -1.221 0.801 5.472 1.00 1.00 H new ATOM 0 HG3 LYS A 100 -0.294 1.025 6.942 1.00 1.00 H new ATOM 0 HD2 LYS A 100 -2.764 2.514 6.029 1.00 1.00 H new ATOM 0 HD3 LYS A 100 -2.532 1.584 7.496 1.00 1.00 H new ATOM 0 HE2 LYS A 100 -0.735 3.456 8.057 1.00 1.00 H new ATOM 0 HE3 LYS A 100 -1.621 4.391 6.869 1.00 1.00 H new ATOM 0 HZ1 LYS A 100 -2.461 4.768 9.084 1.00 1.00 H new ATOM 0 HZ2 LYS A 100 -3.650 4.021 8.130 1.00 1.00 H new ATOM 0 HZ3 LYS A 100 -2.792 3.115 9.282 1.00 1.00 H new ATOM 1637 N ALA A 101 -0.811 1.966 2.215 1.00 1.00 N ATOM 1638 CA ALA A 101 -1.361 2.530 1.010 1.00 1.00 C ATOM 1639 C ALA A 101 -2.692 1.848 0.762 1.00 1.00 C ATOM 1640 O ALA A 101 -2.751 0.819 0.089 1.00 1.00 O ATOM 1641 CB ALA A 101 -0.348 2.324 -0.104 1.00 1.00 C ATOM 0 H ALA A 101 -1.182 1.047 2.455 1.00 1.00 H new ATOM 0 HA ALA A 101 -1.548 3.602 1.075 1.00 1.00 H new ATOM 0 HB1 ALA A 101 -0.738 2.742 -1.032 1.00 1.00 H new ATOM 0 HB2 ALA A 101 0.585 2.824 0.156 1.00 1.00 H new ATOM 0 HB3 ALA A 101 -0.164 1.258 -0.236 1.00 1.00 H new ATOM 1647 N PRO A 102 -3.758 2.364 1.382 1.00 1.00 N ATOM 1648 CA PRO A 102 -5.091 1.881 1.138 1.00 1.00 C ATOM 1649 C PRO A 102 -5.493 2.094 -0.307 1.00 1.00 C ATOM 1650 O PRO A 102 -5.009 2.984 -1.005 1.00 1.00 O ATOM 1651 CB PRO A 102 -6.000 2.631 2.103 1.00 1.00 C ATOM 1652 CG PRO A 102 -5.218 3.911 2.385 1.00 1.00 C ATOM 1653 CD PRO A 102 -3.779 3.436 2.353 1.00 1.00 C ATOM 0 HA PRO A 102 -5.162 0.806 1.305 1.00 1.00 H new ATOM 0 HB2 PRO A 102 -6.973 2.842 1.660 1.00 1.00 H new ATOM 0 HB3 PRO A 102 -6.181 2.060 3.013 1.00 1.00 H new ATOM 0 HG2 PRO A 102 -5.409 4.676 1.632 1.00 1.00 H new ATOM 0 HG3 PRO A 102 -5.481 4.342 3.351 1.00 1.00 H new ATOM 0 HD2 PRO A 102 -3.104 4.242 2.065 1.00 1.00 H new ATOM 0 HD3 PRO A 102 -3.457 3.086 3.334 1.00 1.00 H new ATOM 1661 N MET A 103 -6.408 1.243 -0.734 1.00 1.00 N ATOM 1662 CA MET A 103 -6.693 1.023 -2.136 1.00 1.00 C ATOM 1663 C MET A 103 -8.167 1.212 -2.409 1.00 1.00 C ATOM 1664 O MET A 103 -8.946 1.467 -1.496 1.00 1.00 O ATOM 1665 CB MET A 103 -6.221 -0.372 -2.581 1.00 1.00 C ATOM 1666 CG MET A 103 -5.344 -1.169 -1.610 1.00 1.00 C ATOM 1667 SD MET A 103 -4.787 -2.759 -2.271 1.00 1.00 S ATOM 1668 CE MET A 103 -3.615 -2.135 -3.498 1.00 1.00 C ATOM 0 H MET A 103 -6.981 0.679 -0.106 1.00 1.00 H new ATOM 0 HA MET A 103 -6.141 1.760 -2.719 1.00 1.00 H new ATOM 0 HB2 MET A 103 -7.105 -0.970 -2.803 1.00 1.00 H new ATOM 0 HB3 MET A 103 -5.670 -0.258 -3.515 1.00 1.00 H new ATOM 0 HG2 MET A 103 -4.473 -0.570 -1.346 1.00 1.00 H new ATOM 0 HG3 MET A 103 -5.902 -1.343 -0.690 1.00 1.00 H new ATOM 0 HE1 MET A 103 -3.752 -2.670 -4.437 1.00 1.00 H new ATOM 0 HE2 MET A 103 -3.788 -1.071 -3.658 1.00 1.00 H new ATOM 0 HE3 MET A 103 -2.597 -2.287 -3.139 1.00 1.00 H new ATOM 1678 N ILE A 104 -8.543 1.087 -3.676 1.00 1.00 N ATOM 1679 CA ILE A 104 -9.909 0.807 -4.075 1.00 1.00 C ATOM 1680 C ILE A 104 -9.727 -0.310 -5.087 1.00 1.00 C ATOM 1681 O ILE A 104 -9.393 -0.067 -6.248 1.00 1.00 O ATOM 1682 CB ILE A 104 -10.647 2.067 -4.574 1.00 1.00 C ATOM 1683 CG1 ILE A 104 -10.759 3.062 -3.394 1.00 1.00 C ATOM 1684 CG2 ILE A 104 -12.036 1.676 -5.110 1.00 1.00 C ATOM 1685 CD1 ILE A 104 -11.350 4.420 -3.746 1.00 1.00 C ATOM 0 H ILE A 104 -7.898 1.179 -4.461 1.00 1.00 H new ATOM 0 HA ILE A 104 -10.570 0.497 -3.265 1.00 1.00 H new ATOM 0 HB ILE A 104 -10.099 2.539 -5.389 1.00 1.00 H new ATOM 0 HG12 ILE A 104 -11.370 2.609 -2.614 1.00 1.00 H new ATOM 0 HG13 ILE A 104 -9.766 3.214 -2.972 1.00 1.00 H new ATOM 0 HG21 ILE A 104 -12.555 2.568 -5.462 1.00 1.00 H new ATOM 0 HG22 ILE A 104 -11.923 0.973 -5.935 1.00 1.00 H new ATOM 0 HG23 ILE A 104 -12.615 1.210 -4.313 1.00 1.00 H new ATOM 0 HD11 ILE A 104 -11.386 5.044 -2.853 1.00 1.00 H new ATOM 0 HD12 ILE A 104 -10.729 4.902 -4.501 1.00 1.00 H new ATOM 0 HD13 ILE A 104 -12.359 4.287 -4.137 1.00 1.00 H new ATOM 1697 N LEU A 105 -9.807 -1.543 -4.592 1.00 1.00 N ATOM 1698 CA LEU A 105 -9.552 -2.757 -5.350 1.00 1.00 C ATOM 1699 C LEU A 105 -10.879 -3.486 -5.417 1.00 1.00 C ATOM 1700 O LEU A 105 -11.436 -3.833 -4.379 1.00 1.00 O ATOM 1701 CB LEU A 105 -8.447 -3.596 -4.674 1.00 1.00 C ATOM 1702 CG LEU A 105 -7.113 -3.661 -5.442 1.00 1.00 C ATOM 1703 CD1 LEU A 105 -7.240 -4.495 -6.714 1.00 1.00 C ATOM 1704 CD2 LEU A 105 -6.544 -2.291 -5.823 1.00 1.00 C ATOM 0 H LEU A 105 -10.059 -1.726 -3.621 1.00 1.00 H new ATOM 0 HA LEU A 105 -9.184 -2.549 -6.355 1.00 1.00 H new ATOM 0 HB2 LEU A 105 -8.257 -3.187 -3.682 1.00 1.00 H new ATOM 0 HB3 LEU A 105 -8.818 -4.611 -4.534 1.00 1.00 H new ATOM 0 HG LEU A 105 -6.421 -4.129 -4.742 1.00 1.00 H new ATOM 0 HD11 LEU A 105 -6.280 -4.519 -7.230 1.00 1.00 H new ATOM 0 HD12 LEU A 105 -7.538 -5.511 -6.455 1.00 1.00 H new ATOM 0 HD13 LEU A 105 -7.992 -4.051 -7.366 1.00 1.00 H new ATOM 0 HD21 LEU A 105 -5.605 -2.424 -6.360 1.00 1.00 H new ATOM 0 HD22 LEU A 105 -7.256 -1.766 -6.460 1.00 1.00 H new ATOM 0 HD23 LEU A 105 -6.366 -1.707 -4.920 1.00 1.00 H new ATOM 1716 N ASN A 106 -11.426 -3.625 -6.623 1.00 1.00 N ATOM 1717 CA ASN A 106 -12.752 -4.160 -6.938 1.00 1.00 C ATOM 1718 C ASN A 106 -13.899 -3.395 -6.256 1.00 1.00 C ATOM 1719 O ASN A 106 -15.046 -3.828 -6.313 1.00 1.00 O ATOM 1720 CB ASN A 106 -12.785 -5.672 -6.650 1.00 1.00 C ATOM 1721 CG ASN A 106 -13.822 -6.443 -7.465 1.00 1.00 C ATOM 1722 OD1 ASN A 106 -14.582 -5.900 -8.261 1.00 1.00 O ATOM 1723 ND2 ASN A 106 -13.835 -7.755 -7.317 1.00 1.00 N ATOM 0 H ASN A 106 -10.921 -3.348 -7.465 1.00 1.00 H new ATOM 0 HA ASN A 106 -12.927 -4.010 -8.003 1.00 1.00 H new ATOM 0 HB2 ASN A 106 -11.798 -6.090 -6.850 1.00 1.00 H new ATOM 0 HB3 ASN A 106 -12.987 -5.824 -5.590 1.00 1.00 H new ATOM 0 HD21 ASN A 106 -14.479 -8.324 -7.866 1.00 1.00 H new ATOM 0 HD22 ASN A 106 -13.201 -8.200 -6.654 1.00 1.00 H new ATOM 1730 N GLY A 107 -13.627 -2.250 -5.618 1.00 1.00 N ATOM 1731 CA GLY A 107 -14.589 -1.525 -4.793 1.00 1.00 C ATOM 1732 C GLY A 107 -14.434 -1.820 -3.302 1.00 1.00 C ATOM 1733 O GLY A 107 -15.416 -1.740 -2.567 1.00 1.00 O ATOM 0 H GLY A 107 -12.714 -1.797 -5.664 1.00 1.00 H new ATOM 0 HA2 GLY A 107 -14.470 -0.455 -4.961 1.00 1.00 H new ATOM 0 HA3 GLY A 107 -15.599 -1.787 -5.107 1.00 1.00 H new ATOM 1737 N VAL A 108 -13.246 -2.201 -2.838 1.00 1.00 N ATOM 1738 CA VAL A 108 -12.939 -2.400 -1.440 1.00 1.00 C ATOM 1739 C VAL A 108 -11.808 -1.465 -1.038 1.00 1.00 C ATOM 1740 O VAL A 108 -10.698 -1.543 -1.582 1.00 1.00 O ATOM 1741 CB VAL A 108 -12.633 -3.871 -1.104 1.00 1.00 C ATOM 1742 CG1 VAL A 108 -12.721 -4.107 0.415 1.00 1.00 C ATOM 1743 CG2 VAL A 108 -13.606 -4.838 -1.787 1.00 1.00 C ATOM 0 H VAL A 108 -12.451 -2.383 -3.451 1.00 1.00 H new ATOM 0 HA VAL A 108 -13.823 -2.154 -0.852 1.00 1.00 H new ATOM 0 HB VAL A 108 -11.624 -4.065 -1.469 1.00 1.00 H new ATOM 0 HG11 VAL A 108 -12.502 -5.152 0.634 1.00 1.00 H new ATOM 0 HG12 VAL A 108 -11.998 -3.470 0.925 1.00 1.00 H new ATOM 0 HG13 VAL A 108 -13.726 -3.866 0.763 1.00 1.00 H new ATOM 0 HG21 VAL A 108 -13.349 -5.863 -1.519 1.00 1.00 H new ATOM 0 HG22 VAL A 108 -14.623 -4.622 -1.460 1.00 1.00 H new ATOM 0 HG23 VAL A 108 -13.539 -4.718 -2.868 1.00 1.00 H new ATOM 1753 N CYS A 109 -12.098 -0.605 -0.064 1.00 1.00 N ATOM 1754 CA CYS A 109 -11.120 0.127 0.711 1.00 1.00 C ATOM 1755 C CYS A 109 -10.468 -0.837 1.699 1.00 1.00 C ATOM 1756 O CYS A 109 -10.792 -0.859 2.886 1.00 1.00 O ATOM 1757 CB CYS A 109 -11.804 1.301 1.412 1.00 1.00 C ATOM 1758 SG CYS A 109 -12.124 2.650 0.244 1.00 1.00 S ATOM 0 H CYS A 109 -13.058 -0.397 0.211 1.00 1.00 H new ATOM 0 HA CYS A 109 -10.340 0.541 0.072 1.00 1.00 H new ATOM 0 HB2 CYS A 109 -12.742 0.969 1.856 1.00 1.00 H new ATOM 0 HB3 CYS A 109 -11.175 1.661 2.226 1.00 1.00 H new ATOM 0 HG CYS A 109 -12.688 3.641 0.869 1.00 1.00 H new ATOM 1764 N VAL A 110 -9.535 -1.639 1.199 1.00 1.00 N ATOM 1765 CA VAL A 110 -8.569 -2.311 2.054 1.00 1.00 C ATOM 1766 C VAL A 110 -7.433 -1.327 2.313 1.00 1.00 C ATOM 1767 O VAL A 110 -7.171 -0.436 1.499 1.00 1.00 O ATOM 1768 CB VAL A 110 -8.078 -3.624 1.410 1.00 1.00 C ATOM 1769 CG1 VAL A 110 -9.277 -4.544 1.159 1.00 1.00 C ATOM 1770 CG2 VAL A 110 -7.260 -3.394 0.131 1.00 1.00 C ATOM 0 H VAL A 110 -9.429 -1.839 0.204 1.00 1.00 H new ATOM 0 HA VAL A 110 -9.022 -2.602 3.002 1.00 1.00 H new ATOM 0 HB VAL A 110 -7.394 -4.106 2.108 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -8.934 -5.473 0.704 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -9.771 -4.764 2.105 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -9.981 -4.050 0.489 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -6.943 -4.354 -0.276 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -7.873 -2.873 -0.604 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -6.382 -2.791 0.364 1.00 1.00 H new ATOM 1780 N ILE A 111 -6.728 -1.524 3.416 1.00 1.00 N ATOM 1781 CA ILE A 111 -5.399 -1.002 3.632 1.00 1.00 C ATOM 1782 C ILE A 111 -4.446 -2.068 3.123 1.00 1.00 C ATOM 1783 O ILE A 111 -4.541 -3.216 3.542 1.00 1.00 O ATOM 1784 CB ILE A 111 -5.142 -0.730 5.137 1.00 1.00 C ATOM 1785 CG1 ILE A 111 -6.034 0.414 5.622 1.00 1.00 C ATOM 1786 CG2 ILE A 111 -3.672 -0.398 5.392 1.00 1.00 C ATOM 1787 CD1 ILE A 111 -5.835 0.980 7.024 1.00 1.00 C ATOM 0 H ILE A 111 -7.080 -2.067 4.204 1.00 1.00 H new ATOM 0 HA ILE A 111 -5.264 -0.053 3.113 1.00 1.00 H new ATOM 0 HB ILE A 111 -5.386 -1.635 5.694 1.00 1.00 H new ATOM 0 HG12 ILE A 111 -5.919 1.238 4.918 1.00 1.00 H new ATOM 0 HG13 ILE A 111 -7.067 0.075 5.550 1.00 1.00 H new ATOM 0 HG21 ILE A 111 -3.520 -0.212 6.455 1.00 1.00 H new ATOM 0 HG22 ILE A 111 -3.050 -1.236 5.078 1.00 1.00 H new ATOM 0 HG23 ILE A 111 -3.396 0.491 4.825 1.00 1.00 H new ATOM 0 HD11 ILE A 111 -6.552 1.782 7.198 1.00 1.00 H new ATOM 0 HD12 ILE A 111 -5.988 0.191 7.760 1.00 1.00 H new ATOM 0 HD13 ILE A 111 -4.822 1.372 7.118 1.00 1.00 H new ATOM 1799 N TRP A 112 -3.527 -1.712 2.233 1.00 1.00 N ATOM 1800 CA TRP A 112 -2.332 -2.528 2.087 1.00 1.00 C ATOM 1801 C TRP A 112 -1.392 -1.930 3.126 1.00 1.00 C ATOM 1802 O TRP A 112 -1.245 -0.701 3.156 1.00 1.00 O ATOM 1803 CB TRP A 112 -1.736 -2.409 0.687 1.00 1.00 C ATOM 1804 CG TRP A 112 -0.474 -3.200 0.475 1.00 1.00 C ATOM 1805 CD1 TRP A 112 -0.385 -4.374 -0.189 1.00 1.00 C ATOM 1806 CD2 TRP A 112 0.887 -2.895 0.922 1.00 1.00 C ATOM 1807 NE1 TRP A 112 0.927 -4.808 -0.189 1.00 1.00 N ATOM 1808 CE2 TRP A 112 1.758 -3.919 0.454 1.00 1.00 C ATOM 1809 CE3 TRP A 112 1.487 -1.844 1.650 1.00 1.00 C ATOM 1810 CZ2 TRP A 112 3.144 -3.886 0.671 1.00 1.00 C ATOM 1811 CZ3 TRP A 112 2.862 -1.841 1.938 1.00 1.00 C ATOM 1812 CH2 TRP A 112 3.698 -2.852 1.441 1.00 1.00 C ATOM 0 H TRP A 112 -3.582 -0.896 1.624 1.00 1.00 H new ATOM 0 HA TRP A 112 -2.524 -3.592 2.226 1.00 1.00 H new ATOM 0 HB2 TRP A 112 -2.480 -2.735 -0.040 1.00 1.00 H new ATOM 0 HB3 TRP A 112 -1.530 -1.358 0.482 1.00 1.00 H new ATOM 0 HD1 TRP A 112 -1.213 -4.893 -0.649 1.00 1.00 H new ATOM 0 HE1 TRP A 112 1.241 -5.681 -0.614 1.00 1.00 H new ATOM 0 HE3 TRP A 112 0.874 -1.023 1.993 1.00 1.00 H new ATOM 0 HZ2 TRP A 112 3.779 -4.650 0.249 1.00 1.00 H new ATOM 0 HZ3 TRP A 112 3.279 -1.053 2.548 1.00 1.00 H new ATOM 0 HH2 TRP A 112 4.758 -2.835 1.649 1.00 1.00 H new ATOM 1823 N LYS A 113 -0.776 -2.740 3.984 1.00 1.00 N ATOM 1824 CA LYS A 113 0.272 -2.283 4.892 1.00 1.00 C ATOM 1825 C LYS A 113 1.493 -3.188 4.830 1.00 1.00 C ATOM 1826 O LYS A 113 1.406 -4.325 4.364 1.00 1.00 O ATOM 1827 CB LYS A 113 -0.292 -2.163 6.311 1.00 1.00 C ATOM 1828 CG LYS A 113 -0.641 -3.497 7.001 1.00 1.00 C ATOM 1829 CD LYS A 113 -0.154 -3.516 8.454 1.00 1.00 C ATOM 1830 CE LYS A 113 -0.962 -2.580 9.363 1.00 1.00 C ATOM 1831 NZ LYS A 113 -0.184 -2.160 10.545 1.00 1.00 N ATOM 0 H LYS A 113 -0.990 -3.734 4.069 1.00 1.00 H new ATOM 0 HA LYS A 113 0.609 -1.295 4.578 1.00 1.00 H new ATOM 0 HB2 LYS A 113 0.434 -1.634 6.928 1.00 1.00 H new ATOM 0 HB3 LYS A 113 -1.190 -1.546 6.275 1.00 1.00 H new ATOM 0 HG2 LYS A 113 -1.720 -3.651 6.975 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -0.187 -4.322 6.452 1.00 1.00 H new ATOM 0 HD2 LYS A 113 -0.216 -4.533 8.840 1.00 1.00 H new ATOM 0 HD3 LYS A 113 0.897 -3.227 8.484 1.00 1.00 H new ATOM 0 HE2 LYS A 113 -1.269 -1.700 8.798 1.00 1.00 H new ATOM 0 HE3 LYS A 113 -1.872 -3.084 9.687 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 -0.834 -1.874 11.305 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 0.404 -2.952 10.873 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 0.427 -1.357 10.291 1.00 1.00 H new ATOM 1845 N GLY A 114 2.611 -2.724 5.376 1.00 1.00 N ATOM 1846 CA GLY A 114 3.784 -3.549 5.558 1.00 1.00 C ATOM 1847 C GLY A 114 4.966 -2.730 6.035 1.00 1.00 C ATOM 1848 O GLY A 114 4.886 -1.510 6.170 1.00 1.00 O ATOM 0 H GLY A 114 2.723 -1.764 5.703 1.00 1.00 H new ATOM 0 HA2 GLY A 114 3.569 -4.336 6.281 1.00 1.00 H new ATOM 0 HA3 GLY A 114 4.035 -4.040 4.618 1.00 1.00 H new ATOM 1852 N TRP A 115 6.085 -3.405 6.252 1.00 1.00 N ATOM 1853 CA TRP A 115 7.370 -2.802 6.495 1.00 1.00 C ATOM 1854 C TRP A 115 8.340 -3.391 5.473 1.00 1.00 C ATOM 1855 O TRP A 115 8.576 -4.599 5.436 1.00 1.00 O ATOM 1856 CB TRP A 115 7.767 -2.970 7.966 1.00 1.00 C ATOM 1857 CG TRP A 115 7.996 -4.367 8.467 1.00 1.00 C ATOM 1858 CD1 TRP A 115 9.135 -5.076 8.298 1.00 1.00 C ATOM 1859 CD2 TRP A 115 7.070 -5.269 9.147 1.00 1.00 C ATOM 1860 NE1 TRP A 115 8.991 -6.333 8.840 1.00 1.00 N ATOM 1861 CE2 TRP A 115 7.766 -6.479 9.448 1.00 1.00 C ATOM 1862 CE3 TRP A 115 5.699 -5.222 9.491 1.00 1.00 C ATOM 1863 CZ2 TRP A 115 7.155 -7.557 10.098 1.00 1.00 C ATOM 1864 CZ3 TRP A 115 5.060 -6.329 10.086 1.00 1.00 C ATOM 1865 CH2 TRP A 115 5.793 -7.481 10.413 1.00 1.00 C ATOM 0 H TRP A 115 6.115 -4.425 6.262 1.00 1.00 H new ATOM 0 HA TRP A 115 7.368 -1.722 6.351 1.00 1.00 H new ATOM 0 HB2 TRP A 115 8.679 -2.398 8.136 1.00 1.00 H new ATOM 0 HB3 TRP A 115 6.988 -2.516 8.579 1.00 1.00 H new ATOM 0 HD1 TRP A 115 10.026 -4.710 7.810 1.00 1.00 H new ATOM 0 HE1 TRP A 115 9.702 -7.063 8.796 1.00 1.00 H new ATOM 0 HE3 TRP A 115 5.132 -4.324 9.295 1.00 1.00 H new ATOM 0 HZ2 TRP A 115 7.727 -8.437 10.354 1.00 1.00 H new ATOM 0 HZ3 TRP A 115 4.000 -6.291 10.291 1.00 1.00 H new ATOM 0 HH2 TRP A 115 5.306 -8.309 10.908 1.00 1.00 H new ATOM 1876 N ILE A 116 8.856 -2.547 4.582 1.00 1.00 N ATOM 1877 CA ILE A 116 9.876 -2.960 3.634 1.00 1.00 C ATOM 1878 C ILE A 116 11.201 -2.646 4.316 1.00 1.00 C ATOM 1879 O ILE A 116 11.468 -1.518 4.744 1.00 1.00 O ATOM 1880 CB ILE A 116 9.677 -2.301 2.256 1.00 1.00 C ATOM 1881 CG1 ILE A 116 8.588 -2.999 1.411 1.00 1.00 C ATOM 1882 CG2 ILE A 116 10.985 -2.307 1.460 1.00 1.00 C ATOM 1883 CD1 ILE A 116 8.949 -4.371 0.813 1.00 1.00 C ATOM 0 H ILE A 116 8.579 -1.569 4.501 1.00 1.00 H new ATOM 0 HA ILE A 116 9.831 -4.023 3.396 1.00 1.00 H new ATOM 0 HB ILE A 116 9.355 -1.279 2.455 1.00 1.00 H new ATOM 0 HG12 ILE A 116 7.702 -3.122 2.033 1.00 1.00 H new ATOM 0 HG13 ILE A 116 8.313 -2.333 0.593 1.00 1.00 H new ATOM 0 HG21 ILE A 116 10.823 -1.837 0.490 1.00 1.00 H new ATOM 0 HG22 ILE A 116 11.747 -1.753 2.008 1.00 1.00 H new ATOM 0 HG23 ILE A 116 11.317 -3.335 1.314 1.00 1.00 H new ATOM 0 HD11 ILE A 116 8.102 -4.754 0.243 1.00 1.00 H new ATOM 0 HD12 ILE A 116 9.811 -4.265 0.155 1.00 1.00 H new ATOM 0 HD13 ILE A 116 9.190 -5.066 1.617 1.00 1.00 H new ATOM 1895 N ASP A 117 12.000 -3.688 4.464 1.00 1.00 N ATOM 1896 CA ASP A 117 13.272 -3.679 5.133 1.00 1.00 C ATOM 1897 C ASP A 117 14.361 -3.033 4.276 1.00 1.00 C ATOM 1898 O ASP A 117 14.386 -3.129 3.043 1.00 1.00 O ATOM 1899 CB ASP A 117 13.594 -5.111 5.553 1.00 1.00 C ATOM 1900 CG ASP A 117 14.839 -5.163 6.426 1.00 1.00 C ATOM 1901 OD1 ASP A 117 15.959 -5.019 5.893 1.00 1.00 O ATOM 1902 OD2 ASP A 117 14.681 -5.354 7.652 1.00 1.00 O ATOM 0 H ASP A 117 11.758 -4.609 4.098 1.00 1.00 H new ATOM 0 HA ASP A 117 13.227 -3.058 6.027 1.00 1.00 H new ATOM 0 HB2 ASP A 117 12.748 -5.532 6.096 1.00 1.00 H new ATOM 0 HB3 ASP A 117 13.742 -5.728 4.667 1.00 1.00 H new ATOM 1907 N LEU A 118 15.265 -2.329 4.954 1.00 1.00 N ATOM 1908 CA LEU A 118 16.272 -1.457 4.367 1.00 1.00 C ATOM 1909 C LEU A 118 17.461 -2.250 3.810 1.00 1.00 C ATOM 1910 O LEU A 118 18.393 -1.629 3.304 1.00 1.00 O ATOM 1911 CB LEU A 118 16.742 -0.423 5.410 1.00 1.00 C ATOM 1912 CG LEU A 118 15.601 0.384 6.068 1.00 1.00 C ATOM 1913 CD1 LEU A 118 16.102 1.098 7.325 1.00 1.00 C ATOM 1914 CD2 LEU A 118 14.894 1.360 5.119 1.00 1.00 C ATOM 0 H LEU A 118 15.315 -2.354 5.972 1.00 1.00 H new ATOM 0 HA LEU A 118 15.816 -0.934 3.526 1.00 1.00 H new ATOM 0 HB2 LEU A 118 17.301 -0.940 6.190 1.00 1.00 H new ATOM 0 HB3 LEU A 118 17.432 0.271 4.930 1.00 1.00 H new ATOM 0 HG LEU A 118 14.841 -0.345 6.348 1.00 1.00 H new ATOM 0 HD11 LEU A 118 15.284 1.661 7.774 1.00 1.00 H new ATOM 0 HD12 LEU A 118 16.471 0.362 8.039 1.00 1.00 H new ATOM 0 HD13 LEU A 118 16.909 1.781 7.058 1.00 1.00 H new ATOM 0 HD21 LEU A 118 14.107 1.887 5.659 1.00 1.00 H new ATOM 0 HD22 LEU A 118 15.616 2.081 4.735 1.00 1.00 H new ATOM 0 HD23 LEU A 118 14.456 0.807 4.288 1.00 1.00 H new ATOM 1926 N HIS A 119 17.458 -3.587 3.867 1.00 1.00 N ATOM 1927 CA HIS A 119 18.514 -4.386 3.259 1.00 1.00 C ATOM 1928 C HIS A 119 18.499 -4.175 1.738 1.00 1.00 C ATOM 1929 O HIS A 119 19.466 -3.674 1.168 1.00 1.00 O ATOM 1930 CB HIS A 119 18.407 -5.871 3.669 1.00 1.00 C ATOM 1931 CG HIS A 119 17.273 -6.681 3.079 1.00 1.00 C ATOM 1932 ND1 HIS A 119 17.424 -7.830 2.332 1.00 1.00 N ATOM 1933 CD2 HIS A 119 15.935 -6.385 3.102 1.00 1.00 C ATOM 1934 CE1 HIS A 119 16.209 -8.220 1.918 1.00 1.00 C ATOM 1935 NE2 HIS A 119 15.280 -7.356 2.351 1.00 1.00 N ATOM 0 H HIS A 119 16.732 -4.134 4.330 1.00 1.00 H new ATOM 0 HA HIS A 119 19.483 -4.053 3.630 1.00 1.00 H new ATOM 0 HB2 HIS A 119 19.344 -6.361 3.403 1.00 1.00 H new ATOM 0 HB3 HIS A 119 18.321 -5.914 4.755 1.00 1.00 H new ATOM 0 HD1 HIS A 119 18.306 -8.301 2.129 1.00 1.00 H new ATOM 0 HD2 HIS A 119 15.474 -5.551 3.610 1.00 1.00 H new ATOM 0 HE1 HIS A 119 16.009 -9.100 1.324 1.00 1.00 H new ATOM 1943 N ARG A 120 17.411 -4.558 1.066 1.00 1.00 N ATOM 1944 CA ARG A 120 17.306 -4.653 -0.393 1.00 1.00 C ATOM 1945 C ARG A 120 15.916 -4.285 -0.889 1.00 1.00 C ATOM 1946 O ARG A 120 15.653 -4.363 -2.088 1.00 1.00 O ATOM 1947 CB ARG A 120 17.636 -6.086 -0.842 1.00 1.00 C ATOM 1948 CG ARG A 120 19.021 -6.596 -0.421 1.00 1.00 C ATOM 1949 CD ARG A 120 20.176 -5.915 -1.174 1.00 1.00 C ATOM 1950 NE ARG A 120 20.297 -6.466 -2.532 1.00 1.00 N ATOM 1951 CZ ARG A 120 20.740 -7.708 -2.782 1.00 1.00 C ATOM 1952 NH1 ARG A 120 21.588 -8.309 -1.954 1.00 1.00 N ATOM 1953 NH2 ARG A 120 20.292 -8.363 -3.841 1.00 1.00 N ATOM 0 H ARG A 120 16.547 -4.820 1.540 1.00 1.00 H new ATOM 0 HA ARG A 120 18.016 -3.945 -0.820 1.00 1.00 H new ATOM 0 HB2 ARG A 120 16.880 -6.760 -0.439 1.00 1.00 H new ATOM 0 HB3 ARG A 120 17.562 -6.136 -1.928 1.00 1.00 H new ATOM 0 HG2 ARG A 120 19.150 -6.435 0.649 1.00 1.00 H new ATOM 0 HG3 ARG A 120 19.071 -7.672 -0.590 1.00 1.00 H new ATOM 0 HD2 ARG A 120 20.002 -4.840 -1.225 1.00 1.00 H new ATOM 0 HD3 ARG A 120 21.109 -6.061 -0.631 1.00 1.00 H new ATOM 0 HE ARG A 120 20.032 -5.877 -3.321 1.00 1.00 H new ATOM 0 HH11 ARG A 120 21.911 -7.826 -1.115 1.00 1.00 H new ATOM 0 HH12 ARG A 120 21.916 -9.253 -2.157 1.00 1.00 H new ATOM 0 HH21 ARG A 120 19.613 -7.924 -4.463 1.00 1.00 H new ATOM 0 HH22 ARG A 120 20.626 -9.307 -4.035 1.00 1.00 H new ATOM 1967 N LEU A 121 15.029 -3.850 0.003 1.00 1.00 N ATOM 1968 CA LEU A 121 13.629 -3.592 -0.272 1.00 1.00 C ATOM 1969 C LEU A 121 12.853 -4.892 -0.503 1.00 1.00 C ATOM 1970 O LEU A 121 12.021 -4.977 -1.407 1.00 1.00 O ATOM 1971 CB LEU A 121 13.354 -2.556 -1.381 1.00 1.00 C ATOM 1972 CG LEU A 121 14.025 -1.179 -1.347 1.00 1.00 C ATOM 1973 CD1 LEU A 121 14.356 -0.659 0.058 1.00 1.00 C ATOM 1974 CD2 LEU A 121 15.269 -1.077 -2.229 1.00 1.00 C ATOM 0 H LEU A 121 15.282 -3.662 0.973 1.00 1.00 H new ATOM 0 HA LEU A 121 13.255 -3.118 0.635 1.00 1.00 H new ATOM 0 HB2 LEU A 121 13.624 -3.021 -2.329 1.00 1.00 H new ATOM 0 HB3 LEU A 121 12.277 -2.388 -1.404 1.00 1.00 H new ATOM 0 HG LEU A 121 13.250 -0.534 -1.761 1.00 1.00 H new ATOM 0 HD11 LEU A 121 14.828 0.321 -0.018 1.00 1.00 H new ATOM 0 HD12 LEU A 121 13.439 -0.575 0.641 1.00 1.00 H new ATOM 0 HD13 LEU A 121 15.037 -1.352 0.551 1.00 1.00 H new ATOM 0 HD21 LEU A 121 15.688 -0.074 -2.152 1.00 1.00 H new ATOM 0 HD22 LEU A 121 16.010 -1.806 -1.899 1.00 1.00 H new ATOM 0 HD23 LEU A 121 14.998 -1.279 -3.265 1.00 1.00 H new ATOM 1986 N ASP A 122 13.119 -5.903 0.314 1.00 1.00 N ATOM 1987 CA ASP A 122 12.191 -7.009 0.530 1.00 1.00 C ATOM 1988 C ASP A 122 11.625 -6.745 1.935 1.00 1.00 C ATOM 1989 O ASP A 122 12.013 -5.763 2.578 1.00 1.00 O ATOM 1990 CB ASP A 122 12.831 -8.413 0.429 1.00 1.00 C ATOM 1991 CG ASP A 122 13.853 -8.709 -0.679 1.00 1.00 C ATOM 1992 OD1 ASP A 122 14.214 -7.850 -1.517 1.00 1.00 O ATOM 1993 OD2 ASP A 122 14.271 -9.887 -0.780 1.00 1.00 O ATOM 0 H ASP A 122 13.985 -5.981 0.847 1.00 1.00 H new ATOM 0 HA ASP A 122 11.431 -7.033 -0.251 1.00 1.00 H new ATOM 0 HB2 ASP A 122 13.317 -8.618 1.383 1.00 1.00 H new ATOM 0 HB3 ASP A 122 12.020 -9.133 0.324 1.00 1.00 H new ATOM 1998 N GLY A 123 10.712 -7.561 2.459 1.00 1.00 N ATOM 1999 CA GLY A 123 10.241 -7.371 3.826 1.00 1.00 C ATOM 2000 C GLY A 123 8.877 -8.005 4.019 1.00 1.00 C ATOM 2001 O GLY A 123 8.612 -9.057 3.441 1.00 1.00 O ATOM 0 H GLY A 123 10.290 -8.348 1.965 1.00 1.00 H new ATOM 0 HA2 GLY A 123 10.953 -7.810 4.525 1.00 1.00 H new ATOM 0 HA3 GLY A 123 10.187 -6.306 4.052 1.00 1.00 H new ATOM 2005 N MET A 124 8.026 -7.391 4.836 1.00 1.00 N ATOM 2006 CA MET A 124 6.798 -7.984 5.355 1.00 1.00 C ATOM 2007 C MET A 124 5.629 -7.050 5.069 1.00 1.00 C ATOM 2008 O MET A 124 5.801 -5.836 5.023 1.00 1.00 O ATOM 2009 CB MET A 124 6.971 -8.167 6.864 1.00 1.00 C ATOM 2010 CG MET A 124 6.541 -9.509 7.429 1.00 1.00 C ATOM 2011 SD MET A 124 4.768 -9.700 7.720 1.00 1.00 S ATOM 2012 CE MET A 124 4.798 -11.479 8.036 1.00 1.00 C ATOM 0 H MET A 124 8.177 -6.437 5.165 1.00 1.00 H new ATOM 0 HA MET A 124 6.598 -8.945 4.882 1.00 1.00 H new ATOM 0 HB2 MET A 124 8.022 -8.012 7.110 1.00 1.00 H new ATOM 0 HB3 MET A 124 6.406 -7.385 7.371 1.00 1.00 H new ATOM 0 HG2 MET A 124 6.865 -10.292 6.744 1.00 1.00 H new ATOM 0 HG3 MET A 124 7.065 -9.672 8.371 1.00 1.00 H new ATOM 0 HE1 MET A 124 3.874 -11.776 8.532 1.00 1.00 H new ATOM 0 HE2 MET A 124 4.892 -12.015 7.091 1.00 1.00 H new ATOM 0 HE3 MET A 124 5.647 -11.721 8.676 1.00 1.00 H new ATOM 2022 N GLY A 125 4.435 -7.586 4.885 1.00 1.00 N ATOM 2023 CA GLY A 125 3.237 -6.831 4.578 1.00 1.00 C ATOM 2024 C GLY A 125 2.066 -7.744 4.268 1.00 1.00 C ATOM 2025 O GLY A 125 2.176 -8.966 4.323 1.00 1.00 O ATOM 0 H GLY A 125 4.270 -8.591 4.948 1.00 1.00 H new ATOM 0 HA2 GLY A 125 2.985 -6.189 5.422 1.00 1.00 H new ATOM 0 HA3 GLY A 125 3.426 -6.178 3.726 1.00 1.00 H new ATOM 2029 N CYS A 126 0.916 -7.141 4.004 1.00 1.00 N ATOM 2030 CA CYS A 126 -0.380 -7.793 3.890 1.00 1.00 C ATOM 2031 C CYS A 126 -1.458 -6.776 3.580 1.00 1.00 C ATOM 2032 O CYS A 126 -1.189 -5.594 3.349 1.00 1.00 O ATOM 2033 CB CYS A 126 -0.724 -8.538 5.182 1.00 1.00 C ATOM 2034 SG CYS A 126 -0.787 -7.452 6.641 1.00 1.00 S ATOM 0 H CYS A 126 0.859 -6.133 3.856 1.00 1.00 H new ATOM 0 HA CYS A 126 -0.327 -8.513 3.073 1.00 1.00 H new ATOM 0 HB2 CYS A 126 -1.688 -9.032 5.063 1.00 1.00 H new ATOM 0 HB3 CYS A 126 0.016 -9.320 5.351 1.00 1.00 H new ATOM 0 HG CYS A 126 -2.003 -7.026 6.813 1.00 1.00 H new ATOM 2040 N LEU A 127 -2.695 -7.256 3.609 1.00 1.00 N ATOM 2041 CA LEU A 127 -3.861 -6.413 3.613 1.00 1.00 C ATOM 2042 C LEU A 127 -4.449 -6.350 5.011 1.00 1.00 C ATOM 2043 O LEU A 127 -4.177 -7.187 5.875 1.00 1.00 O ATOM 2044 CB LEU A 127 -4.885 -6.957 2.622 1.00 1.00 C ATOM 2045 CG LEU A 127 -4.336 -7.042 1.192 1.00 1.00 C ATOM 2046 CD1 LEU A 127 -5.436 -7.614 0.313 1.00 1.00 C ATOM 2047 CD2 LEU A 127 -3.846 -5.686 0.673 1.00 1.00 C ATOM 0 H LEU A 127 -2.908 -8.253 3.630 1.00 1.00 H new ATOM 0 HA LEU A 127 -3.583 -5.403 3.312 1.00 1.00 H new ATOM 0 HB2 LEU A 127 -5.205 -7.948 2.944 1.00 1.00 H new ATOM 0 HB3 LEU A 127 -5.768 -6.318 2.631 1.00 1.00 H new ATOM 0 HG LEU A 127 -3.460 -7.690 1.175 1.00 1.00 H new ATOM 0 HD11 LEU A 127 -5.079 -7.689 -0.714 1.00 1.00 H new ATOM 0 HD12 LEU A 127 -5.712 -8.605 0.674 1.00 1.00 H new ATOM 0 HD13 LEU A 127 -6.307 -6.959 0.348 1.00 1.00 H new ATOM 0 HD21 LEU A 127 -3.467 -5.800 -0.343 1.00 1.00 H new ATOM 0 HD22 LEU A 127 -4.673 -4.976 0.674 1.00 1.00 H new ATOM 0 HD23 LEU A 127 -3.049 -5.316 1.318 1.00 1.00 H new ATOM 2059 N GLU A 128 -5.278 -5.338 5.186 1.00 1.00 N ATOM 2060 CA GLU A 128 -6.143 -5.058 6.322 1.00 1.00 C ATOM 2061 C GLU A 128 -7.348 -4.272 5.774 1.00 1.00 C ATOM 2062 O GLU A 128 -7.371 -3.957 4.584 1.00 1.00 O ATOM 2063 CB GLU A 128 -5.308 -4.295 7.360 1.00 1.00 C ATOM 2064 CG GLU A 128 -5.911 -4.268 8.762 1.00 1.00 C ATOM 2065 CD GLU A 128 -4.801 -4.237 9.812 1.00 1.00 C ATOM 2066 OE1 GLU A 128 -4.253 -3.148 10.094 1.00 1.00 O ATOM 2067 OE2 GLU A 128 -4.472 -5.319 10.356 1.00 1.00 O ATOM 0 H GLU A 128 -5.373 -4.620 4.467 1.00 1.00 H new ATOM 0 HA GLU A 128 -6.530 -5.945 6.823 1.00 1.00 H new ATOM 0 HB2 GLU A 128 -4.317 -4.746 7.413 1.00 1.00 H new ATOM 0 HB3 GLU A 128 -5.173 -3.269 7.016 1.00 1.00 H new ATOM 0 HG2 GLU A 128 -6.552 -3.393 8.874 1.00 1.00 H new ATOM 0 HG3 GLU A 128 -6.540 -5.145 8.913 1.00 1.00 H new ATOM 2074 N PHE A 129 -8.366 -3.963 6.573 1.00 1.00 N ATOM 2075 CA PHE A 129 -9.471 -3.114 6.109 1.00 1.00 C ATOM 2076 C PHE A 129 -9.122 -1.651 6.389 1.00 1.00 C ATOM 2077 O PHE A 129 -8.393 -1.387 7.348 1.00 1.00 O ATOM 2078 CB PHE A 129 -10.773 -3.500 6.821 1.00 1.00 C ATOM 2079 CG PHE A 129 -12.021 -2.938 6.165 1.00 1.00 C ATOM 2080 CD1 PHE A 129 -12.380 -3.366 4.874 1.00 1.00 C ATOM 2081 CD2 PHE A 129 -12.826 -1.995 6.831 1.00 1.00 C ATOM 2082 CE1 PHE A 129 -13.507 -2.827 4.233 1.00 1.00 C ATOM 2083 CE2 PHE A 129 -13.980 -1.487 6.203 1.00 1.00 C ATOM 2084 CZ PHE A 129 -14.311 -1.890 4.899 1.00 1.00 C ATOM 0 H PHE A 129 -8.453 -4.282 7.538 1.00 1.00 H new ATOM 0 HA PHE A 129 -9.617 -3.255 5.038 1.00 1.00 H new ATOM 0 HB2 PHE A 129 -10.849 -4.587 6.854 1.00 1.00 H new ATOM 0 HB3 PHE A 129 -10.728 -3.152 7.853 1.00 1.00 H new ATOM 0 HD1 PHE A 129 -11.785 -4.114 4.372 1.00 1.00 H new ATOM 0 HD2 PHE A 129 -12.559 -1.661 7.823 1.00 1.00 H new ATOM 0 HE1 PHE A 129 -13.755 -3.134 3.228 1.00 1.00 H new ATOM 0 HE2 PHE A 129 -14.613 -0.785 6.726 1.00 1.00 H new ATOM 0 HZ PHE A 129 -15.182 -1.480 4.410 1.00 1.00 H new ATOM 2094 N ASP A 130 -9.657 -0.703 5.608 1.00 1.00 N ATOM 2095 CA ASP A 130 -9.562 0.726 5.933 1.00 1.00 C ATOM 2096 C ASP A 130 -10.928 1.227 6.363 1.00 1.00 C ATOM 2097 O ASP A 130 -11.711 1.671 5.531 1.00 1.00 O ATOM 2098 CB ASP A 130 -9.025 1.588 4.777 1.00 1.00 C ATOM 2099 CG ASP A 130 -8.506 2.920 5.333 1.00 1.00 C ATOM 2100 OD1 ASP A 130 -9.101 3.496 6.274 1.00 1.00 O ATOM 2101 OD2 ASP A 130 -7.501 3.430 4.791 1.00 1.00 O ATOM 0 H ASP A 130 -10.162 -0.901 4.744 1.00 1.00 H new ATOM 0 HA ASP A 130 -8.838 0.823 6.742 1.00 1.00 H new ATOM 0 HB2 ASP A 130 -8.224 1.061 4.258 1.00 1.00 H new ATOM 0 HB3 ASP A 130 -9.814 1.769 4.047 1.00 1.00 H new ATOM 2106 N GLU A 131 -11.267 1.105 7.642 1.00 1.00 N ATOM 2107 CA GLU A 131 -12.617 1.324 8.112 1.00 1.00 C ATOM 2108 C GLU A 131 -13.099 2.745 7.832 1.00 1.00 C ATOM 2109 O GLU A 131 -14.175 2.945 7.269 1.00 1.00 O ATOM 2110 CB GLU A 131 -12.657 0.944 9.595 1.00 1.00 C ATOM 2111 CG GLU A 131 -14.048 0.432 9.959 1.00 1.00 C ATOM 2112 CD GLU A 131 -14.120 -0.226 11.340 1.00 1.00 C ATOM 2113 OE1 GLU A 131 -13.088 -0.321 12.046 1.00 1.00 O ATOM 2114 OE2 GLU A 131 -15.201 -0.744 11.703 1.00 1.00 O ATOM 0 H GLU A 131 -10.608 0.851 8.378 1.00 1.00 H new ATOM 0 HA GLU A 131 -13.319 0.694 7.566 1.00 1.00 H new ATOM 0 HB2 GLU A 131 -11.911 0.177 9.804 1.00 1.00 H new ATOM 0 HB3 GLU A 131 -12.406 1.809 10.209 1.00 1.00 H new ATOM 0 HG2 GLU A 131 -14.752 1.264 9.925 1.00 1.00 H new ATOM 0 HG3 GLU A 131 -14.369 -0.288 9.206 1.00 1.00 H new ATOM 2121 N GLU A 132 -12.294 3.737 8.193 1.00 1.00 N ATOM 2122 CA GLU A 132 -12.667 5.135 8.068 1.00 1.00 C ATOM 2123 C GLU A 132 -12.695 5.565 6.610 1.00 1.00 C ATOM 2124 O GLU A 132 -13.630 6.240 6.174 1.00 1.00 O ATOM 2125 CB GLU A 132 -11.658 5.969 8.865 1.00 1.00 C ATOM 2126 CG GLU A 132 -12.074 7.408 9.083 1.00 1.00 C ATOM 2127 CD GLU A 132 -11.014 8.189 9.860 1.00 1.00 C ATOM 2128 OE1 GLU A 132 -10.645 7.782 10.988 1.00 1.00 O ATOM 2129 OE2 GLU A 132 -10.535 9.225 9.351 1.00 1.00 O ATOM 0 H GLU A 132 -11.362 3.591 8.581 1.00 1.00 H new ATOM 0 HA GLU A 132 -13.671 5.287 8.463 1.00 1.00 H new ATOM 0 HB2 GLU A 132 -11.500 5.498 9.835 1.00 1.00 H new ATOM 0 HB3 GLU A 132 -10.701 5.955 8.344 1.00 1.00 H new ATOM 0 HG2 GLU A 132 -12.246 7.887 8.119 1.00 1.00 H new ATOM 0 HG3 GLU A 132 -13.018 7.436 9.626 1.00 1.00 H new ATOM 2136 N ARG A 133 -11.678 5.183 5.841 1.00 1.00 N ATOM 2137 CA ARG A 133 -11.621 5.520 4.421 1.00 1.00 C ATOM 2138 C ARG A 133 -12.718 4.795 3.651 1.00 1.00 C ATOM 2139 O ARG A 133 -13.275 5.393 2.735 1.00 1.00 O ATOM 2140 CB ARG A 133 -10.263 5.123 3.924 1.00 1.00 C ATOM 2141 CG ARG A 133 -9.869 5.742 2.592 1.00 1.00 C ATOM 2142 CD ARG A 133 -8.438 5.254 2.398 1.00 1.00 C ATOM 2143 NE ARG A 133 -7.941 5.470 1.048 1.00 1.00 N ATOM 2144 CZ ARG A 133 -8.216 4.688 -0.004 1.00 1.00 C ATOM 2145 NH1 ARG A 133 -9.174 3.770 0.054 1.00 1.00 N ATOM 2146 NH2 ARG A 133 -7.499 4.805 -1.102 1.00 1.00 N ATOM 0 H ARG A 133 -10.883 4.640 6.177 1.00 1.00 H new ATOM 0 HA ARG A 133 -11.782 6.588 4.272 1.00 1.00 H new ATOM 0 HB2 ARG A 133 -9.521 5.402 4.672 1.00 1.00 H new ATOM 0 HB3 ARG A 133 -10.228 4.038 3.829 1.00 1.00 H new ATOM 0 HG2 ARG A 133 -10.522 5.411 1.784 1.00 1.00 H new ATOM 0 HG3 ARG A 133 -9.924 6.830 2.620 1.00 1.00 H new ATOM 0 HD2 ARG A 133 -7.786 5.767 3.105 1.00 1.00 H new ATOM 0 HD3 ARG A 133 -8.388 4.191 2.632 1.00 1.00 H new ATOM 0 HE ARG A 133 -7.338 6.277 0.891 1.00 1.00 H new ATOM 0 HH11 ARG A 133 -9.715 3.651 0.910 1.00 1.00 H new ATOM 0 HH12 ARG A 133 -9.369 3.184 -0.758 1.00 1.00 H new ATOM 0 HH21 ARG A 133 -6.742 5.487 -1.146 1.00 1.00 H new ATOM 0 HH22 ARG A 133 -7.701 4.214 -1.908 1.00 1.00 H new ATOM 2160 N ALA A 134 -13.047 3.552 4.016 1.00 1.00 N ATOM 2161 CA ALA A 134 -14.167 2.827 3.441 1.00 1.00 C ATOM 2162 C ALA A 134 -15.445 3.579 3.751 1.00 1.00 C ATOM 2163 O ALA A 134 -16.216 3.808 2.826 1.00 1.00 O ATOM 2164 CB ALA A 134 -14.268 1.387 3.971 1.00 1.00 C ATOM 0 H ALA A 134 -12.536 3.024 4.723 1.00 1.00 H new ATOM 0 HA ALA A 134 -14.009 2.760 2.365 1.00 1.00 H new ATOM 0 HB1 ALA A 134 -15.121 0.889 3.510 1.00 1.00 H new ATOM 0 HB2 ALA A 134 -13.355 0.844 3.726 1.00 1.00 H new ATOM 0 HB3 ALA A 134 -14.400 1.406 5.053 1.00 1.00 H new ATOM 2170 N GLN A 135 -15.655 4.018 5.002 1.00 1.00 N ATOM 2171 CA GLN A 135 -16.819 4.819 5.328 1.00 1.00 C ATOM 2172 C GLN A 135 -16.833 6.128 4.537 1.00 1.00 C ATOM 2173 O GLN A 135 -17.918 6.656 4.279 1.00 1.00 O ATOM 2174 CB GLN A 135 -16.870 5.118 6.832 1.00 1.00 C ATOM 2175 CG GLN A 135 -17.376 3.939 7.667 1.00 1.00 C ATOM 2176 CD GLN A 135 -17.922 4.442 8.998 1.00 1.00 C ATOM 2177 OE1 GLN A 135 -19.014 5.009 9.051 1.00 1.00 O ATOM 2178 NE2 GLN A 135 -17.191 4.294 10.087 1.00 1.00 N ATOM 0 H GLN A 135 -15.034 3.828 5.789 1.00 1.00 H new ATOM 0 HA GLN A 135 -17.701 4.241 5.052 1.00 1.00 H new ATOM 0 HB2 GLN A 135 -15.873 5.395 7.174 1.00 1.00 H new ATOM 0 HB3 GLN A 135 -17.516 5.979 7.003 1.00 1.00 H new ATOM 0 HG2 GLN A 135 -18.155 3.405 7.123 1.00 1.00 H new ATOM 0 HG3 GLN A 135 -16.566 3.231 7.841 1.00 1.00 H new ATOM 0 HE21 GLN A 135 -16.288 3.823 10.035 1.00 1.00 H new ATOM 0 HE22 GLN A 135 -17.529 4.650 10.981 1.00 1.00 H new ATOM 2187 N GLN A 136 -15.676 6.700 4.185 1.00 1.00 N ATOM 2188 CA GLN A 136 -15.617 7.926 3.432 1.00 1.00 C ATOM 2189 C GLN A 136 -16.020 7.650 1.980 1.00 1.00 C ATOM 2190 O GLN A 136 -16.884 8.341 1.443 1.00 1.00 O ATOM 2191 CB GLN A 136 -14.192 8.466 3.593 1.00 1.00 C ATOM 2192 CG GLN A 136 -14.091 9.935 3.227 1.00 1.00 C ATOM 2193 CD GLN A 136 -14.586 10.837 4.356 1.00 1.00 C ATOM 2194 OE1 GLN A 136 -15.783 11.063 4.512 1.00 1.00 O ATOM 2195 NE2 GLN A 136 -13.694 11.352 5.186 1.00 1.00 N ATOM 0 H GLN A 136 -14.762 6.314 4.422 1.00 1.00 H new ATOM 0 HA GLN A 136 -16.315 8.683 3.789 1.00 1.00 H new ATOM 0 HB2 GLN A 136 -13.867 8.327 4.624 1.00 1.00 H new ATOM 0 HB3 GLN A 136 -13.514 7.889 2.964 1.00 1.00 H new ATOM 0 HG2 GLN A 136 -13.055 10.181 2.993 1.00 1.00 H new ATOM 0 HG3 GLN A 136 -14.675 10.126 2.327 1.00 1.00 H new ATOM 0 HE21 GLN A 136 -12.701 11.160 5.051 1.00 1.00 H new ATOM 0 HE22 GLN A 136 -13.999 11.941 5.961 1.00 1.00 H new ATOM 2204 N GLU A 137 -15.439 6.625 1.352 1.00 1.00 N ATOM 2205 CA GLU A 137 -15.717 6.267 -0.027 1.00 1.00 C ATOM 2206 C GLU A 137 -17.154 5.757 -0.187 1.00 1.00 C ATOM 2207 O GLU A 137 -17.782 5.999 -1.215 1.00 1.00 O ATOM 2208 CB GLU A 137 -14.706 5.206 -0.484 1.00 1.00 C ATOM 2209 CG GLU A 137 -14.461 5.298 -1.995 1.00 1.00 C ATOM 2210 CD GLU A 137 -13.745 6.576 -2.482 1.00 1.00 C ATOM 2211 OE1 GLU A 137 -13.064 7.259 -1.683 1.00 1.00 O ATOM 2212 OE2 GLU A 137 -13.821 6.893 -3.694 1.00 1.00 O ATOM 0 H GLU A 137 -14.754 6.016 1.800 1.00 1.00 H new ATOM 0 HA GLU A 137 -15.617 7.154 -0.652 1.00 1.00 H new ATOM 0 HB2 GLU A 137 -13.765 5.341 0.050 1.00 1.00 H new ATOM 0 HB3 GLU A 137 -15.076 4.212 -0.231 1.00 1.00 H new ATOM 0 HG2 GLU A 137 -13.871 4.434 -2.302 1.00 1.00 H new ATOM 0 HG3 GLU A 137 -15.422 5.225 -2.505 1.00 1.00 H new ATOM 2219 N ASP A 138 -17.690 5.099 0.848 1.00 1.00 N ATOM 2220 CA ASP A 138 -19.071 4.629 0.924 1.00 1.00 C ATOM 2221 C ASP A 138 -19.990 5.822 0.733 1.00 1.00 C ATOM 2222 O ASP A 138 -20.893 5.775 -0.101 1.00 1.00 O ATOM 2223 CB ASP A 138 -19.387 3.963 2.280 1.00 1.00 C ATOM 2224 CG ASP A 138 -19.154 2.453 2.327 1.00 1.00 C ATOM 2225 OD1 ASP A 138 -19.461 1.752 1.342 1.00 1.00 O ATOM 2226 OD2 ASP A 138 -18.731 1.932 3.386 1.00 1.00 O ATOM 0 H ASP A 138 -17.151 4.873 1.684 1.00 1.00 H new ATOM 0 HA ASP A 138 -19.221 3.879 0.147 1.00 1.00 H new ATOM 0 HB2 ASP A 138 -18.776 4.434 3.050 1.00 1.00 H new ATOM 0 HB3 ASP A 138 -20.428 4.163 2.532 1.00 1.00 H new ATOM 2231 N ALA A 139 -19.758 6.899 1.488 1.00 1.00 N ATOM 2232 CA ALA A 139 -20.520 8.124 1.327 1.00 1.00 C ATOM 2233 C ALA A 139 -20.289 8.700 -0.072 1.00 1.00 C ATOM 2234 O ALA A 139 -21.243 9.097 -0.744 1.00 1.00 O ATOM 2235 CB ALA A 139 -20.157 9.114 2.433 1.00 1.00 C ATOM 0 H ALA A 139 -19.045 6.940 2.216 1.00 1.00 H new ATOM 0 HA ALA A 139 -21.585 7.914 1.420 1.00 1.00 H new ATOM 0 HB1 ALA A 139 -20.733 10.030 2.305 1.00 1.00 H new ATOM 0 HB2 ALA A 139 -20.386 8.675 3.404 1.00 1.00 H new ATOM 0 HB3 ALA A 139 -19.093 9.344 2.380 1.00 1.00 H new ATOM 2241 N LEU A 140 -19.039 8.735 -0.543 1.00 1.00 N ATOM 2242 CA LEU A 140 -18.692 9.313 -1.833 1.00 1.00 C ATOM 2243 C LEU A 140 -19.278 8.593 -3.034 1.00 1.00 C ATOM 2244 O LEU A 140 -19.312 9.182 -4.117 1.00 1.00 O ATOM 2245 CB LEU A 140 -17.173 9.451 -2.005 1.00 1.00 C ATOM 2246 CG LEU A 140 -16.538 10.578 -1.177 1.00 1.00 C ATOM 2247 CD1 LEU A 140 -15.104 10.782 -1.668 1.00 1.00 C ATOM 2248 CD2 LEU A 140 -17.330 11.885 -1.302 1.00 1.00 C ATOM 0 H LEU A 140 -18.239 8.360 -0.033 1.00 1.00 H new ATOM 0 HA LEU A 140 -19.153 10.300 -1.812 1.00 1.00 H new ATOM 0 HB2 LEU A 140 -16.702 8.507 -1.732 1.00 1.00 H new ATOM 0 HB3 LEU A 140 -16.954 9.623 -3.059 1.00 1.00 H new ATOM 0 HG LEU A 140 -16.547 10.296 -0.124 1.00 1.00 H new ATOM 0 HD11 LEU A 140 -14.633 11.579 -1.093 1.00 1.00 H new ATOM 0 HD12 LEU A 140 -14.540 9.858 -1.538 1.00 1.00 H new ATOM 0 HD13 LEU A 140 -15.116 11.054 -2.723 1.00 1.00 H new ATOM 0 HD21 LEU A 140 -16.851 12.659 -0.703 1.00 1.00 H new ATOM 0 HD22 LEU A 140 -17.354 12.197 -2.346 1.00 1.00 H new ATOM 0 HD23 LEU A 140 -18.348 11.729 -0.946 1.00 1.00 H new ATOM 2260 N ALA A 141 -19.812 7.388 -2.884 1.00 1.00 N ATOM 2261 CA ALA A 141 -20.558 6.680 -3.921 1.00 1.00 C ATOM 2262 C ALA A 141 -21.891 7.368 -4.288 1.00 1.00 C ATOM 2263 O ALA A 141 -22.761 6.722 -4.878 1.00 1.00 O ATOM 2264 CB ALA A 141 -20.788 5.244 -3.449 1.00 1.00 C ATOM 0 H ALA A 141 -19.737 6.860 -2.015 1.00 1.00 H new ATOM 0 HA ALA A 141 -19.968 6.690 -4.837 1.00 1.00 H new ATOM 0 HB1 ALA A 141 -21.344 4.696 -4.209 1.00 1.00 H new ATOM 0 HB2 ALA A 141 -19.827 4.758 -3.281 1.00 1.00 H new ATOM 0 HB3 ALA A 141 -21.357 5.253 -2.519 1.00 1.00 H new ATOM 2270 N GLN A 142 -22.070 8.657 -3.970 1.00 1.00 N ATOM 2271 CA GLN A 142 -23.330 9.368 -3.834 1.00 1.00 C ATOM 2272 C GLN A 142 -24.316 8.512 -3.033 1.00 1.00 C ATOM 2273 O GLN A 142 -25.416 8.188 -3.492 1.00 1.00 O ATOM 2274 CB GLN A 142 -23.834 9.847 -5.201 1.00 1.00 C ATOM 2275 CG GLN A 142 -23.056 11.051 -5.772 1.00 1.00 C ATOM 2276 CD GLN A 142 -21.911 10.669 -6.712 1.00 1.00 C ATOM 2277 OE1 GLN A 142 -22.057 9.813 -7.588 1.00 1.00 O ATOM 2278 NE2 GLN A 142 -20.763 11.311 -6.609 1.00 1.00 N ATOM 0 H GLN A 142 -21.273 9.268 -3.789 1.00 1.00 H new ATOM 0 HA GLN A 142 -23.199 10.284 -3.259 1.00 1.00 H new ATOM 0 HB2 GLN A 142 -23.774 9.020 -5.909 1.00 1.00 H new ATOM 0 HB3 GLN A 142 -24.887 10.116 -5.114 1.00 1.00 H new ATOM 0 HG2 GLN A 142 -23.751 11.697 -6.308 1.00 1.00 H new ATOM 0 HG3 GLN A 142 -22.652 11.634 -4.944 1.00 1.00 H new ATOM 0 HE21 GLN A 142 -20.638 12.020 -5.886 1.00 1.00 H new ATOM 0 HE22 GLN A 142 -20.000 11.099 -7.252 1.00 1.00 H new ATOM 2287 N GLN A 143 -23.894 8.123 -1.828 1.00 1.00 N ATOM 2288 CA GLN A 143 -24.751 7.468 -0.848 1.00 1.00 C ATOM 2289 C GLN A 143 -25.302 8.556 0.052 1.00 1.00 C ATOM 2290 O GLN A 143 -26.463 8.963 -0.148 1.00 1.00 O ATOM 2291 CB GLN A 143 -23.952 6.368 -0.128 1.00 1.00 C ATOM 2292 CG GLN A 143 -24.816 5.391 0.686 1.00 1.00 C ATOM 2293 CD GLN A 143 -24.097 4.097 1.105 1.00 1.00 C ATOM 2294 OE1 GLN A 143 -24.730 3.145 1.557 1.00 1.00 O ATOM 2295 NE2 GLN A 143 -22.790 3.974 0.944 1.00 1.00 N ATOM 0 H GLN A 143 -22.936 8.257 -1.505 1.00 1.00 H new ATOM 0 HA GLN A 143 -25.601 6.951 -1.293 1.00 1.00 H new ATOM 0 HB2 GLN A 143 -23.384 5.804 -0.868 1.00 1.00 H new ATOM 0 HB3 GLN A 143 -23.228 6.837 0.538 1.00 1.00 H new ATOM 0 HG2 GLN A 143 -25.171 5.900 1.582 1.00 1.00 H new ATOM 0 HG3 GLN A 143 -25.696 5.128 0.099 1.00 1.00 H new ATOM 0 HE21 GLN A 143 -22.247 4.752 0.570 1.00 1.00 H new ATOM 0 HE22 GLN A 143 -22.325 3.101 1.193 1.00 1.00 H new