USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 112 THR OG1 : rot 180:sc= -0.694 USER MOD Set 1.2: A 159 GLN : amide:sc= -0.461 X(o=-1.2,f=-0.99) USER MOD Set 2.1: A 116 THR OG1 : rot 78:sc= -0.9 USER MOD Set 2.2: A 155 TYR OH : rot -175:sc= 0.111 USER MOD Single : A 1 THR N :NH3+ 150:sc= -0.0453 (180deg=-0.415) USER MOD Single : A 1 THR OG1 : rot 47:sc= 0.0403 USER MOD Single : A 7 GLN : amide:sc= -4.49 X(o=-4.5,f=-4.9!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HD1:sc= -0.277 X(o=-0.28,f=-0.079) USER MOD Single : A 22 HIS : no HD1:sc= -0.0673 X(o=-0.067,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0359 X(o=-0.036,f=-0.27) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.0292 X(o=-0.029,f=0) USER MOD Single : A 34 THR OG1 : rot 75:sc= 1.12 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -127:sc= -0.877 (180deg=-4.77!) USER MOD Single : A 45 THR OG1 : rot 90:sc= -0.407 USER MOD Single : A 46 TYR OH : rot 165:sc= 0 USER MOD Single : A 48 SER OG : rot 143:sc= -5.5! USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 84:sc= 0.205 USER MOD Single : A 59 ASN : amide:sc= -0.524 K(o=-0.52,f=-2) USER MOD Single : A 63 THR OG1 : rot 104:sc= -1.24 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -0.701 F(o=-2.1!,f=-0.7) USER MOD Single : A 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.315 X(o=-0.31,f=0) USER MOD Single : A 71 GLN : amide:sc= -0.249 K(o=-0.25,f=-1.9!) USER MOD Single : A 77 HIS : no HD1:sc= -1.05 K(o=-1,f=-2.7!) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN :FLIP amide:sc= -0.282 F(o=-0.96,f=-0.28) USER MOD Single : A 89 HIS : no HD1:sc= -0.0107 X(o=-0.011,f=-0.021) USER MOD Single : A 92 GLN : amide:sc= -0.681 K(o=-0.68,f=-2) USER MOD Single : A 101 GLN : amide:sc= -0.0888 X(o=-0.089,f=-0.0025) USER MOD Single : A 104 THR OG1 : rot 180:sc= 0 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 121 SER OG : rot -174:sc= 0.59 USER MOD Single : A 126 THR OG1 : rot 94:sc= 0.558 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 132 ASN : amide:sc= -0.181 K(o=-0.18,f=-6.5!) USER MOD Single : A 137 THR OG1 : rot 180:sc=-0.00213 USER MOD Single : A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -0.206 K(o=-0.21,f=-1.8!) USER MOD Single : A 152 THR OG1 : rot 180:sc= -0.973 USER MOD Single : A 153 HIS :FLIP no HE2:sc= -6.65! C(o=-7.4!,f=-6.6!) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O2D : rot 180:sc= 0 USER MOD Single : A 170 NDP O3B : rot 163:sc= 0.667 USER MOD Single : A 170 NDP O3D : rot 170:sc= -2.73! USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -11.995 -4.792 3.410 1.00 1.00 N ATOM 2 CA THR A 1 -10.871 -3.861 3.637 1.00 1.00 C ATOM 3 C THR A 1 -9.545 -4.511 3.275 1.00 1.00 C ATOM 4 O THR A 1 -9.355 -5.701 3.482 1.00 1.00 O ATOM 5 CB THR A 1 -10.867 -3.442 5.109 1.00 1.00 C ATOM 6 OG1 THR A 1 -9.736 -2.635 5.392 1.00 1.00 O ATOM 7 CG2 THR A 1 -10.837 -4.626 6.061 1.00 1.00 C ATOM 0 H1 THR A 1 -12.760 -4.583 4.082 1.00 1.00 H new ATOM 0 H2 THR A 1 -12.348 -4.680 2.438 1.00 1.00 H new ATOM 0 H3 THR A 1 -11.669 -5.770 3.550 1.00 1.00 H new ATOM 0 HA THR A 1 -10.998 -2.985 3.000 1.00 1.00 H new ATOM 0 HB THR A 1 -11.795 -2.891 5.264 1.00 1.00 H new ATOM 0 HG1 THR A 1 -9.643 -1.947 4.700 1.00 1.00 H new ATOM 0 HG21 THR A 1 -10.835 -4.266 7.090 1.00 1.00 H new ATOM 0 HG22 THR A 1 -11.717 -5.248 5.896 1.00 1.00 H new ATOM 0 HG23 THR A 1 -9.937 -5.215 5.881 1.00 1.00 H new ATOM 17 N ALA A 2 -8.623 -3.717 2.737 1.00 1.00 N ATOM 18 CA ALA A 2 -7.317 -4.238 2.362 1.00 1.00 C ATOM 19 C ALA A 2 -6.218 -3.215 2.542 1.00 1.00 C ATOM 20 O ALA A 2 -6.432 -2.007 2.424 1.00 1.00 O ATOM 21 CB ALA A 2 -7.341 -4.714 0.918 1.00 1.00 C ATOM 0 H ALA A 2 -8.756 -2.722 2.554 1.00 1.00 H new ATOM 0 HA ALA A 2 -7.101 -5.075 3.026 1.00 1.00 H new ATOM 0 HB1 ALA A 2 -6.359 -5.102 0.646 1.00 1.00 H new ATOM 0 HB2 ALA A 2 -8.086 -5.502 0.807 1.00 1.00 H new ATOM 0 HB3 ALA A 2 -7.595 -3.880 0.264 1.00 1.00 H new ATOM 27 N PHE A 3 -5.028 -3.704 2.822 1.00 1.00 N ATOM 28 CA PHE A 3 -3.876 -2.842 3.008 1.00 1.00 C ATOM 29 C PHE A 3 -2.875 -3.041 1.867 1.00 1.00 C ATOM 30 O PHE A 3 -2.454 -4.172 1.597 1.00 1.00 O ATOM 31 CB PHE A 3 -3.206 -3.135 4.352 1.00 1.00 C ATOM 32 CG PHE A 3 -3.926 -2.595 5.565 1.00 1.00 C ATOM 33 CD1 PHE A 3 -5.146 -1.945 5.460 1.00 1.00 C ATOM 34 CD2 PHE A 3 -3.358 -2.745 6.820 1.00 1.00 C ATOM 35 CE1 PHE A 3 -5.786 -1.456 6.582 1.00 1.00 C ATOM 36 CE2 PHE A 3 -3.993 -2.257 7.946 1.00 1.00 C ATOM 37 CZ PHE A 3 -5.208 -1.611 7.827 1.00 1.00 C ATOM 0 H PHE A 3 -4.831 -4.699 2.927 1.00 1.00 H new ATOM 0 HA PHE A 3 -4.213 -1.805 3.003 1.00 1.00 H new ATOM 0 HB2 PHE A 3 -3.105 -4.215 4.461 1.00 1.00 H new ATOM 0 HB3 PHE A 3 -2.198 -2.721 4.334 1.00 1.00 H new ATOM 0 HD1 PHE A 3 -5.602 -1.819 4.489 1.00 1.00 H new ATOM 0 HD2 PHE A 3 -2.408 -3.249 6.919 1.00 1.00 H new ATOM 0 HE1 PHE A 3 -6.737 -0.953 6.486 1.00 1.00 H new ATOM 0 HE2 PHE A 3 -3.540 -2.381 8.918 1.00 1.00 H new ATOM 0 HZ PHE A 3 -5.705 -1.228 8.706 1.00 1.00 H new ATOM 47 N LEU A 4 -2.504 -1.949 1.204 1.00 1.00 N ATOM 48 CA LEU A 4 -1.566 -2.038 0.088 1.00 1.00 C ATOM 49 C LEU A 4 -0.228 -1.407 0.436 1.00 1.00 C ATOM 50 O LEU A 4 -0.153 -0.251 0.853 1.00 1.00 O ATOM 51 CB LEU A 4 -2.145 -1.351 -1.159 1.00 1.00 C ATOM 52 CG LEU A 4 -1.172 -1.241 -2.339 1.00 1.00 C ATOM 53 CD1 LEU A 4 -1.917 -1.325 -3.667 1.00 1.00 C ATOM 54 CD2 LEU A 4 -0.366 0.052 -2.279 1.00 1.00 C ATOM 0 H LEU A 4 -2.832 -1.006 1.415 1.00 1.00 H new ATOM 0 HA LEU A 4 -1.407 -3.096 -0.120 1.00 1.00 H new ATOM 0 HB2 LEU A 4 -3.028 -1.902 -1.484 1.00 1.00 H new ATOM 0 HB3 LEU A 4 -2.477 -0.350 -0.885 1.00 1.00 H new ATOM 0 HG LEU A 4 -0.480 -2.080 -2.267 1.00 1.00 H new ATOM 0 HD11 LEU A 4 -1.206 -1.245 -4.489 1.00 1.00 H new ATOM 0 HD12 LEU A 4 -2.439 -2.279 -3.731 1.00 1.00 H new ATOM 0 HD13 LEU A 4 -2.639 -0.511 -3.731 1.00 1.00 H new ATOM 0 HD21 LEU A 4 0.313 0.097 -3.130 1.00 1.00 H new ATOM 0 HD22 LEU A 4 -1.044 0.905 -2.310 1.00 1.00 H new ATOM 0 HD23 LEU A 4 0.209 0.079 -1.354 1.00 1.00 H new ATOM 66 N TRP A 5 0.843 -2.171 0.254 1.00 1.00 N ATOM 67 CA TRP A 5 2.191 -1.676 0.542 1.00 1.00 C ATOM 68 C TRP A 5 3.234 -2.339 -0.351 1.00 1.00 C ATOM 69 O TRP A 5 2.997 -3.393 -0.948 1.00 1.00 O ATOM 70 CB TRP A 5 2.538 -1.904 2.017 1.00 1.00 C ATOM 71 CG TRP A 5 3.250 -3.197 2.263 1.00 1.00 C ATOM 72 CD1 TRP A 5 4.593 -3.431 2.181 1.00 1.00 C ATOM 73 CD2 TRP A 5 2.648 -4.442 2.636 1.00 1.00 C ATOM 74 NE1 TRP A 5 4.861 -4.743 2.479 1.00 1.00 N ATOM 75 CE2 TRP A 5 3.685 -5.384 2.761 1.00 1.00 C ATOM 76 CE3 TRP A 5 1.332 -4.853 2.878 1.00 1.00 C ATOM 77 CZ2 TRP A 5 3.451 -6.708 3.116 1.00 1.00 C ATOM 78 CZ3 TRP A 5 1.101 -6.170 3.231 1.00 1.00 C ATOM 79 CH2 TRP A 5 2.156 -7.083 3.346 1.00 1.00 C ATOM 0 H TRP A 5 0.809 -3.131 -0.090 1.00 1.00 H new ATOM 0 HA TRP A 5 2.202 -0.606 0.333 1.00 1.00 H new ATOM 0 HB2 TRP A 5 3.161 -1.081 2.368 1.00 1.00 H new ATOM 0 HB3 TRP A 5 1.621 -1.884 2.606 1.00 1.00 H new ATOM 0 HD1 TRP A 5 5.335 -2.691 1.920 1.00 1.00 H new ATOM 0 HE1 TRP A 5 5.787 -5.171 2.489 1.00 1.00 H new ATOM 0 HE3 TRP A 5 0.513 -4.155 2.791 1.00 1.00 H new ATOM 0 HZ2 TRP A 5 4.263 -7.415 3.207 1.00 1.00 H new ATOM 0 HZ3 TRP A 5 0.090 -6.500 3.421 1.00 1.00 H new ATOM 0 HH2 TRP A 5 1.943 -8.105 3.622 1.00 1.00 H new ATOM 90 N ALA A 6 4.398 -1.720 -0.430 1.00 1.00 N ATOM 91 CA ALA A 6 5.486 -2.260 -1.231 1.00 1.00 C ATOM 92 C ALA A 6 6.769 -2.287 -0.402 1.00 1.00 C ATOM 93 O ALA A 6 7.044 -1.357 0.351 1.00 1.00 O ATOM 94 CB ALA A 6 5.686 -1.420 -2.483 1.00 1.00 C ATOM 0 H ALA A 6 4.616 -0.846 0.048 1.00 1.00 H new ATOM 0 HA ALA A 6 5.235 -3.277 -1.534 1.00 1.00 H new ATOM 0 HB1 ALA A 6 6.503 -1.835 -3.073 1.00 1.00 H new ATOM 0 HB2 ALA A 6 4.771 -1.426 -3.075 1.00 1.00 H new ATOM 0 HB3 ALA A 6 5.928 -0.396 -2.199 1.00 1.00 H new ATOM 100 N GLN A 7 7.556 -3.353 -0.542 1.00 1.00 N ATOM 101 CA GLN A 7 8.808 -3.481 0.192 1.00 1.00 C ATOM 102 C GLN A 7 9.890 -4.117 -0.682 1.00 1.00 C ATOM 103 O GLN A 7 9.590 -4.914 -1.581 1.00 1.00 O ATOM 104 CB GLN A 7 8.539 -4.312 1.461 1.00 1.00 C ATOM 105 CG GLN A 7 9.775 -4.798 2.197 1.00 1.00 C ATOM 106 CD GLN A 7 9.971 -6.302 2.095 1.00 1.00 C ATOM 107 OE1 GLN A 7 10.453 -6.931 3.036 1.00 1.00 O ATOM 108 NE2 GLN A 7 9.610 -6.881 0.956 1.00 1.00 N ATOM 0 H GLN A 7 7.346 -4.139 -1.158 1.00 1.00 H new ATOM 0 HA GLN A 7 9.179 -2.496 0.477 1.00 1.00 H new ATOM 0 HB2 GLN A 7 7.941 -3.712 2.147 1.00 1.00 H new ATOM 0 HB3 GLN A 7 7.937 -5.178 1.186 1.00 1.00 H new ATOM 0 HG2 GLN A 7 10.653 -4.294 1.794 1.00 1.00 H new ATOM 0 HG3 GLN A 7 9.700 -4.517 3.247 1.00 1.00 H new ATOM 0 HE21 GLN A 7 9.214 -6.320 0.202 1.00 1.00 H new ATOM 0 HE22 GLN A 7 9.728 -7.887 0.835 1.00 1.00 H new ATOM 117 N ASP A 8 11.156 -3.795 -0.402 1.00 1.00 N ATOM 118 CA ASP A 8 12.277 -4.361 -1.137 1.00 1.00 C ATOM 119 C ASP A 8 12.390 -5.846 -0.815 1.00 1.00 C ATOM 120 O ASP A 8 12.048 -6.282 0.281 1.00 1.00 O ATOM 121 CB ASP A 8 13.586 -3.640 -0.797 1.00 1.00 C ATOM 122 CG ASP A 8 13.687 -2.286 -1.472 1.00 1.00 C ATOM 123 OD1 ASP A 8 13.188 -2.147 -2.607 1.00 1.00 O ATOM 124 OD2 ASP A 8 14.261 -1.360 -0.858 1.00 1.00 O ATOM 0 H ASP A 8 11.425 -3.141 0.333 1.00 1.00 H new ATOM 0 HA ASP A 8 12.097 -4.230 -2.204 1.00 1.00 H new ATOM 0 HB2 ASP A 8 13.658 -3.512 0.283 1.00 1.00 H new ATOM 0 HB3 ASP A 8 14.430 -4.260 -1.101 1.00 1.00 H new ATOM 129 N ARG A 9 12.855 -6.629 -1.785 1.00 1.00 N ATOM 130 CA ARG A 9 12.982 -8.067 -1.593 1.00 1.00 C ATOM 131 C ARG A 9 13.947 -8.377 -0.455 1.00 1.00 C ATOM 132 O ARG A 9 13.683 -9.269 0.355 1.00 1.00 O ATOM 133 CB ARG A 9 13.436 -8.750 -2.884 1.00 1.00 C ATOM 134 CG ARG A 9 14.750 -8.229 -3.433 1.00 1.00 C ATOM 135 CD ARG A 9 15.354 -9.218 -4.421 1.00 1.00 C ATOM 136 NE ARG A 9 14.345 -9.812 -5.304 1.00 1.00 N ATOM 137 CZ ARG A 9 14.573 -10.862 -6.093 1.00 1.00 C ATOM 138 NH1 ARG A 9 15.781 -11.410 -6.154 1.00 1.00 N ATOM 139 NH2 ARG A 9 13.588 -11.369 -6.820 1.00 1.00 N ATOM 0 H ARG A 9 13.147 -6.294 -2.703 1.00 1.00 H new ATOM 0 HA ARG A 9 12.001 -8.460 -1.326 1.00 1.00 H new ATOM 0 HB2 ARG A 9 13.530 -9.821 -2.702 1.00 1.00 H new ATOM 0 HB3 ARG A 9 12.662 -8.622 -3.641 1.00 1.00 H new ATOM 0 HG2 ARG A 9 14.589 -7.270 -3.925 1.00 1.00 H new ATOM 0 HG3 ARG A 9 15.448 -8.054 -2.614 1.00 1.00 H new ATOM 0 HD2 ARG A 9 16.107 -8.711 -5.024 1.00 1.00 H new ATOM 0 HD3 ARG A 9 15.864 -10.010 -3.873 1.00 1.00 H new ATOM 0 HE ARG A 9 13.413 -9.397 -5.315 1.00 1.00 H new ATOM 0 HH11 ARG A 9 16.543 -11.028 -5.594 1.00 1.00 H new ATOM 0 HH12 ARG A 9 15.947 -12.213 -6.760 1.00 1.00 H new ATOM 0 HH21 ARG A 9 12.656 -10.956 -6.776 1.00 1.00 H new ATOM 0 HH22 ARG A 9 13.761 -12.172 -7.424 1.00 1.00 H new ATOM 153 N ASP A 10 15.056 -7.650 -0.382 1.00 1.00 N ATOM 154 CA ASP A 10 16.050 -7.854 0.672 1.00 1.00 C ATOM 155 C ASP A 10 15.444 -7.635 2.055 1.00 1.00 C ATOM 156 O ASP A 10 15.893 -8.216 3.042 1.00 1.00 O ATOM 157 CB ASP A 10 17.241 -6.918 0.459 1.00 1.00 C ATOM 158 CG ASP A 10 18.457 -7.635 -0.103 1.00 1.00 C ATOM 159 OD1 ASP A 10 18.783 -8.737 0.386 1.00 1.00 O ATOM 160 OD2 ASP A 10 19.082 -7.087 -1.035 1.00 1.00 O ATOM 0 H ASP A 10 15.293 -6.910 -1.043 1.00 1.00 H new ATOM 0 HA ASP A 10 16.394 -8.887 0.618 1.00 1.00 H new ATOM 0 HB2 ASP A 10 16.951 -6.116 -0.220 1.00 1.00 H new ATOM 0 HB3 ASP A 10 17.506 -6.452 1.408 1.00 1.00 H new ATOM 165 N GLY A 11 14.412 -6.792 2.116 1.00 1.00 N ATOM 166 CA GLY A 11 13.763 -6.520 3.387 1.00 1.00 C ATOM 167 C GLY A 11 13.850 -5.059 3.807 1.00 1.00 C ATOM 168 O GLY A 11 14.171 -4.755 4.955 1.00 1.00 O ATOM 0 H GLY A 11 14.018 -6.298 1.315 1.00 1.00 H new ATOM 0 HA2 GLY A 11 12.714 -6.810 3.321 1.00 1.00 H new ATOM 0 HA3 GLY A 11 14.217 -7.141 4.159 1.00 1.00 H new ATOM 172 N LEU A 12 13.555 -4.147 2.880 1.00 1.00 N ATOM 173 CA LEU A 12 13.588 -2.721 3.171 1.00 1.00 C ATOM 174 C LEU A 12 12.311 -2.033 2.712 1.00 1.00 C ATOM 175 O LEU A 12 11.801 -2.300 1.619 1.00 1.00 O ATOM 176 CB LEU A 12 14.784 -2.070 2.485 1.00 1.00 C ATOM 177 CG LEU A 12 15.285 -0.783 3.148 1.00 1.00 C ATOM 178 CD1 LEU A 12 16.447 -1.094 4.082 1.00 1.00 C ATOM 179 CD2 LEU A 12 15.702 0.226 2.086 1.00 1.00 C ATOM 0 H LEU A 12 13.291 -4.375 1.922 1.00 1.00 H new ATOM 0 HA LEU A 12 13.676 -2.607 4.251 1.00 1.00 H new ATOM 0 HB2 LEU A 12 15.603 -2.789 2.455 1.00 1.00 H new ATOM 0 HB3 LEU A 12 14.516 -1.849 1.452 1.00 1.00 H new ATOM 0 HG LEU A 12 14.477 -0.348 3.736 1.00 1.00 H new ATOM 0 HD11 LEU A 12 16.796 -0.173 4.548 1.00 1.00 H new ATOM 0 HD12 LEU A 12 16.117 -1.789 4.854 1.00 1.00 H new ATOM 0 HD13 LEU A 12 17.261 -1.543 3.513 1.00 1.00 H new ATOM 0 HD21 LEU A 12 16.056 1.137 2.569 1.00 1.00 H new ATOM 0 HD22 LEU A 12 16.501 -0.196 1.477 1.00 1.00 H new ATOM 0 HD23 LEU A 12 14.847 0.461 1.451 1.00 1.00 H new ATOM 191 N ILE A 13 11.803 -1.142 3.548 1.00 1.00 N ATOM 192 CA ILE A 13 10.586 -0.393 3.228 1.00 1.00 C ATOM 193 C ILE A 13 10.882 1.095 2.997 1.00 1.00 C ATOM 194 O ILE A 13 10.220 1.756 2.193 1.00 1.00 O ATOM 195 CB ILE A 13 9.520 -0.526 4.339 1.00 1.00 C ATOM 196 CG1 ILE A 13 10.034 -0.001 5.685 1.00 1.00 C ATOM 197 CG2 ILE A 13 9.047 -1.974 4.476 1.00 1.00 C ATOM 198 CD1 ILE A 13 8.926 0.317 6.670 1.00 1.00 C ATOM 0 H ILE A 13 12.211 -0.916 4.455 1.00 1.00 H new ATOM 0 HA ILE A 13 10.195 -0.828 2.308 1.00 1.00 H new ATOM 0 HB ILE A 13 8.670 0.089 4.044 1.00 1.00 H new ATOM 0 HG12 ILE A 13 10.700 -0.743 6.126 1.00 1.00 H new ATOM 0 HG13 ILE A 13 10.627 0.898 5.514 1.00 1.00 H new ATOM 0 HG21 ILE A 13 8.297 -2.039 5.265 1.00 1.00 H new ATOM 0 HG22 ILE A 13 8.611 -2.305 3.533 1.00 1.00 H new ATOM 0 HG23 ILE A 13 9.895 -2.611 4.728 1.00 1.00 H new ATOM 0 HD11 ILE A 13 9.360 0.683 7.600 1.00 1.00 H new ATOM 0 HD12 ILE A 13 8.273 1.081 6.249 1.00 1.00 H new ATOM 0 HD13 ILE A 13 8.347 -0.585 6.870 1.00 1.00 H new ATOM 210 N GLY A 14 11.889 1.608 3.700 1.00 1.00 N ATOM 211 CA GLY A 14 12.256 3.007 3.552 1.00 1.00 C ATOM 212 C GLY A 14 13.516 3.361 4.317 1.00 1.00 C ATOM 213 O GLY A 14 13.951 2.618 5.196 1.00 1.00 O ATOM 0 H GLY A 14 12.455 1.083 4.367 1.00 1.00 H new ATOM 0 HA2 GLY A 14 12.401 3.231 2.495 1.00 1.00 H new ATOM 0 HA3 GLY A 14 11.435 3.633 3.901 1.00 1.00 H new ATOM 217 N LYS A 15 14.096 4.508 3.980 1.00 1.00 N ATOM 218 CA LYS A 15 15.322 4.972 4.646 1.00 1.00 C ATOM 219 C LYS A 15 14.984 5.789 5.892 1.00 1.00 C ATOM 220 O LYS A 15 15.289 5.387 7.009 1.00 1.00 O ATOM 221 CB LYS A 15 16.174 5.802 3.673 1.00 1.00 C ATOM 222 CG LYS A 15 17.639 5.880 4.060 1.00 1.00 C ATOM 223 CD LYS A 15 18.312 7.131 3.497 1.00 1.00 C ATOM 224 CE LYS A 15 19.755 7.247 3.966 1.00 1.00 C ATOM 225 NZ LYS A 15 20.558 8.146 3.077 1.00 1.00 N ATOM 0 H LYS A 15 13.745 5.134 3.256 1.00 1.00 H new ATOM 0 HA LYS A 15 15.897 4.100 4.957 1.00 1.00 H new ATOM 0 HB2 LYS A 15 16.093 5.371 2.675 1.00 1.00 H new ATOM 0 HB3 LYS A 15 15.767 6.812 3.618 1.00 1.00 H new ATOM 0 HG2 LYS A 15 17.728 5.878 5.146 1.00 1.00 H new ATOM 0 HG3 LYS A 15 18.158 4.994 3.696 1.00 1.00 H new ATOM 0 HD2 LYS A 15 18.284 7.102 2.408 1.00 1.00 H new ATOM 0 HD3 LYS A 15 17.755 8.016 3.807 1.00 1.00 H new ATOM 0 HE2 LYS A 15 19.776 7.631 4.986 1.00 1.00 H new ATOM 0 HE3 LYS A 15 20.211 6.257 3.989 1.00 1.00 H new ATOM 0 HZ1 LYS A 15 21.535 8.200 3.429 1.00 1.00 H new ATOM 0 HZ2 LYS A 15 20.559 7.766 2.109 1.00 1.00 H new ATOM 0 HZ3 LYS A 15 20.138 9.097 3.075 1.00 1.00 H new ATOM 239 N ASP A 16 14.325 6.933 5.691 1.00 1.00 N ATOM 240 CA ASP A 16 13.933 7.800 6.809 1.00 1.00 C ATOM 241 C ASP A 16 12.695 8.615 6.454 1.00 1.00 C ATOM 242 O ASP A 16 12.794 9.802 6.172 1.00 1.00 O ATOM 243 CB ASP A 16 15.089 8.727 7.183 1.00 1.00 C ATOM 244 CG ASP A 16 15.558 9.574 6.007 1.00 1.00 C ATOM 245 OD1 ASP A 16 15.191 9.247 4.859 1.00 1.00 O ATOM 246 OD2 ASP A 16 16.281 10.567 6.238 1.00 1.00 O ATOM 0 H ASP A 16 14.052 7.280 4.772 1.00 1.00 H new ATOM 0 HA ASP A 16 13.692 7.171 7.666 1.00 1.00 H new ATOM 0 HB2 ASP A 16 14.778 9.381 7.997 1.00 1.00 H new ATOM 0 HB3 ASP A 16 15.923 8.132 7.554 1.00 1.00 H new ATOM 251 N GLY A 17 11.536 7.962 6.465 1.00 1.00 N ATOM 252 CA GLY A 17 10.297 8.638 6.133 1.00 1.00 C ATOM 253 C GLY A 17 10.230 9.022 4.666 1.00 1.00 C ATOM 254 O GLY A 17 9.736 10.098 4.312 1.00 1.00 O ATOM 0 H GLY A 17 11.434 6.974 6.699 1.00 1.00 H new ATOM 0 HA2 GLY A 17 9.455 7.990 6.376 1.00 1.00 H new ATOM 0 HA3 GLY A 17 10.198 9.534 6.746 1.00 1.00 H new ATOM 258 N HIS A 18 10.748 8.150 3.804 1.00 1.00 N ATOM 259 CA HIS A 18 10.767 8.389 2.371 1.00 1.00 C ATOM 260 C HIS A 18 11.059 7.103 1.605 1.00 1.00 C ATOM 261 O HIS A 18 11.506 6.113 2.183 1.00 1.00 O ATOM 262 CB HIS A 18 11.813 9.447 2.032 1.00 1.00 C ATOM 263 CG HIS A 18 11.525 10.185 0.762 1.00 1.00 C ATOM 264 ND1 HIS A 18 10.687 11.278 0.698 1.00 1.00 N ATOM 265 CD2 HIS A 18 11.966 9.975 -0.494 1.00 1.00 C ATOM 266 CE1 HIS A 18 10.626 11.708 -0.551 1.00 1.00 C ATOM 267 NE2 HIS A 18 11.394 10.933 -1.295 1.00 1.00 N ATOM 0 H HIS A 18 11.164 7.261 4.083 1.00 1.00 H new ATOM 0 HA HIS A 18 9.782 8.747 2.072 1.00 1.00 H new ATOM 0 HB2 HIS A 18 11.875 10.162 2.853 1.00 1.00 H new ATOM 0 HB3 HIS A 18 12.789 8.969 1.952 1.00 1.00 H new ATOM 0 HD2 HIS A 18 12.644 9.197 -0.812 1.00 1.00 H new ATOM 0 HE1 HIS A 18 10.047 12.549 -0.903 1.00 1.00 H new ATOM 0 HE2 HIS A 18 11.539 11.030 -2.300 1.00 1.00 H new ATOM 276 N LEU A 19 10.790 7.123 0.309 1.00 1.00 N ATOM 277 CA LEU A 19 11.017 5.954 -0.525 1.00 1.00 C ATOM 278 C LEU A 19 12.308 6.093 -1.338 1.00 1.00 C ATOM 279 O LEU A 19 12.578 7.158 -1.902 1.00 1.00 O ATOM 280 CB LEU A 19 9.821 5.729 -1.456 1.00 1.00 C ATOM 281 CG LEU A 19 8.586 5.104 -0.793 1.00 1.00 C ATOM 282 CD1 LEU A 19 7.326 5.863 -1.184 1.00 1.00 C ATOM 283 CD2 LEU A 19 8.460 3.637 -1.160 1.00 1.00 C ATOM 0 H LEU A 19 10.416 7.932 -0.186 1.00 1.00 H new ATOM 0 HA LEU A 19 11.126 5.088 0.128 1.00 1.00 H new ATOM 0 HB2 LEU A 19 9.535 6.686 -1.891 1.00 1.00 H new ATOM 0 HB3 LEU A 19 10.137 5.087 -2.278 1.00 1.00 H new ATOM 0 HG LEU A 19 8.709 5.175 0.288 1.00 1.00 H new ATOM 0 HD11 LEU A 19 6.461 5.405 -0.704 1.00 1.00 H new ATOM 0 HD12 LEU A 19 7.412 6.901 -0.862 1.00 1.00 H new ATOM 0 HD13 LEU A 19 7.201 5.828 -2.266 1.00 1.00 H new ATOM 0 HD21 LEU A 19 7.578 3.216 -0.678 1.00 1.00 H new ATOM 0 HD22 LEU A 19 8.365 3.539 -2.241 1.00 1.00 H new ATOM 0 HD23 LEU A 19 9.347 3.100 -0.824 1.00 1.00 H new ATOM 295 N PRO A 20 13.120 5.027 -1.413 1.00 1.00 N ATOM 296 CA PRO A 20 14.373 5.044 -2.160 1.00 1.00 C ATOM 297 C PRO A 20 14.182 4.779 -3.652 1.00 1.00 C ATOM 298 O PRO A 20 14.871 5.357 -4.488 1.00 1.00 O ATOM 299 CB PRO A 20 15.149 3.905 -1.523 1.00 1.00 C ATOM 300 CG PRO A 20 14.096 2.912 -1.146 1.00 1.00 C ATOM 301 CD PRO A 20 12.883 3.714 -0.772 1.00 1.00 C ATOM 0 HA PRO A 20 14.864 6.016 -2.113 1.00 1.00 H new ATOM 0 HB2 PRO A 20 15.870 3.476 -2.219 1.00 1.00 H new ATOM 0 HB3 PRO A 20 15.709 4.243 -0.651 1.00 1.00 H new ATOM 0 HG2 PRO A 20 13.878 2.240 -1.976 1.00 1.00 H new ATOM 0 HG3 PRO A 20 14.426 2.292 -0.312 1.00 1.00 H new ATOM 0 HD2 PRO A 20 11.967 3.249 -1.138 1.00 1.00 H new ATOM 0 HD3 PRO A 20 12.783 3.808 0.309 1.00 1.00 H new ATOM 309 N TRP A 21 13.245 3.901 -3.975 1.00 1.00 N ATOM 310 CA TRP A 21 12.972 3.559 -5.368 1.00 1.00 C ATOM 311 C TRP A 21 11.813 4.389 -5.917 1.00 1.00 C ATOM 312 O TRP A 21 11.080 5.023 -5.156 1.00 1.00 O ATOM 313 CB TRP A 21 12.661 2.064 -5.491 1.00 1.00 C ATOM 314 CG TRP A 21 11.237 1.719 -5.192 1.00 1.00 C ATOM 315 CD1 TRP A 21 10.174 1.832 -6.043 1.00 1.00 C ATOM 316 CD2 TRP A 21 10.716 1.203 -3.966 1.00 1.00 C ATOM 317 NE1 TRP A 21 9.022 1.422 -5.416 1.00 1.00 N ATOM 318 CE2 TRP A 21 9.330 1.030 -4.139 1.00 1.00 C ATOM 319 CE3 TRP A 21 11.289 0.871 -2.738 1.00 1.00 C ATOM 320 CZ2 TRP A 21 8.511 0.540 -3.127 1.00 1.00 C ATOM 321 CZ3 TRP A 21 10.475 0.386 -1.733 1.00 1.00 C ATOM 322 CH2 TRP A 21 9.099 0.225 -1.934 1.00 1.00 C ATOM 0 H TRP A 21 12.661 3.412 -3.296 1.00 1.00 H new ATOM 0 HA TRP A 21 13.860 3.786 -5.958 1.00 1.00 H new ATOM 0 HB2 TRP A 21 12.901 1.734 -6.502 1.00 1.00 H new ATOM 0 HB3 TRP A 21 13.310 1.510 -4.813 1.00 1.00 H new ATOM 0 HD1 TRP A 21 10.231 2.191 -7.060 1.00 1.00 H new ATOM 0 HE1 TRP A 21 8.091 1.411 -5.832 1.00 1.00 H new ATOM 0 HE3 TRP A 21 12.350 0.991 -2.576 1.00 1.00 H new ATOM 0 HZ2 TRP A 21 7.449 0.413 -3.278 1.00 1.00 H new ATOM 0 HZ3 TRP A 21 10.907 0.127 -0.778 1.00 1.00 H new ATOM 0 HH2 TRP A 21 8.489 -0.156 -1.129 1.00 1.00 H new ATOM 333 N HIS A 22 11.666 4.391 -7.237 1.00 1.00 N ATOM 334 CA HIS A 22 10.603 5.137 -7.889 1.00 1.00 C ATOM 335 C HIS A 22 9.925 4.296 -8.969 1.00 1.00 C ATOM 336 O HIS A 22 10.376 4.255 -10.110 1.00 1.00 O ATOM 337 CB HIS A 22 11.162 6.428 -8.504 1.00 1.00 C ATOM 338 CG HIS A 22 10.126 7.486 -8.754 1.00 1.00 C ATOM 339 ND1 HIS A 22 10.356 8.584 -9.556 1.00 1.00 N ATOM 340 CD2 HIS A 22 8.861 7.619 -8.290 1.00 1.00 C ATOM 341 CE1 HIS A 22 9.277 9.347 -9.573 1.00 1.00 C ATOM 342 NE2 HIS A 22 8.357 8.783 -8.814 1.00 1.00 N ATOM 0 H HIS A 22 12.274 3.881 -7.877 1.00 1.00 H new ATOM 0 HA HIS A 22 9.858 5.392 -7.136 1.00 1.00 H new ATOM 0 HB2 HIS A 22 11.926 6.833 -7.841 1.00 1.00 H new ATOM 0 HB3 HIS A 22 11.653 6.186 -9.446 1.00 1.00 H new ATOM 0 HD2 HIS A 22 8.345 6.937 -7.631 1.00 1.00 H new ATOM 0 HE1 HIS A 22 9.167 10.274 -10.116 1.00 1.00 H new ATOM 0 HE2 HIS A 22 7.422 9.153 -8.644 1.00 1.00 H new ATOM 351 N LEU A 23 8.842 3.629 -8.597 1.00 1.00 N ATOM 352 CA LEU A 23 8.103 2.786 -9.528 1.00 1.00 C ATOM 353 C LEU A 23 6.771 3.436 -9.902 1.00 1.00 C ATOM 354 O LEU A 23 5.707 3.031 -9.425 1.00 1.00 O ATOM 355 CB LEU A 23 7.863 1.391 -8.919 1.00 1.00 C ATOM 356 CG LEU A 23 8.720 0.268 -9.506 1.00 1.00 C ATOM 357 CD1 LEU A 23 10.191 0.555 -9.298 1.00 1.00 C ATOM 358 CD2 LEU A 23 8.354 -1.074 -8.880 1.00 1.00 C ATOM 0 H LEU A 23 8.454 3.655 -7.654 1.00 1.00 H new ATOM 0 HA LEU A 23 8.699 2.673 -10.433 1.00 1.00 H new ATOM 0 HB2 LEU A 23 8.047 1.444 -7.846 1.00 1.00 H new ATOM 0 HB3 LEU A 23 6.813 1.131 -9.050 1.00 1.00 H new ATOM 0 HG LEU A 23 8.522 0.217 -10.577 1.00 1.00 H new ATOM 0 HD11 LEU A 23 10.783 -0.256 -9.723 1.00 1.00 H new ATOM 0 HD12 LEU A 23 10.452 1.492 -9.790 1.00 1.00 H new ATOM 0 HD13 LEU A 23 10.399 0.636 -8.231 1.00 1.00 H new ATOM 0 HD21 LEU A 23 8.975 -1.858 -9.312 1.00 1.00 H new ATOM 0 HD22 LEU A 23 8.520 -1.031 -7.804 1.00 1.00 H new ATOM 0 HD23 LEU A 23 7.304 -1.293 -9.077 1.00 1.00 H new ATOM 370 N PRO A 24 6.807 4.473 -10.764 1.00 1.00 N ATOM 371 CA PRO A 24 5.596 5.189 -11.199 1.00 1.00 C ATOM 372 C PRO A 24 4.535 4.258 -11.751 1.00 1.00 C ATOM 373 O PRO A 24 3.337 4.500 -11.596 1.00 1.00 O ATOM 374 CB PRO A 24 6.099 6.137 -12.298 1.00 1.00 C ATOM 375 CG PRO A 24 7.489 5.698 -12.618 1.00 1.00 C ATOM 376 CD PRO A 24 8.025 5.030 -11.379 1.00 1.00 C ATOM 0 HA PRO A 24 5.118 5.703 -10.365 1.00 1.00 H new ATOM 0 HB2 PRO A 24 5.461 6.085 -13.180 1.00 1.00 H new ATOM 0 HB3 PRO A 24 6.086 7.172 -11.956 1.00 1.00 H new ATOM 0 HG2 PRO A 24 7.493 5.009 -13.462 1.00 1.00 H new ATOM 0 HG3 PRO A 24 8.109 6.549 -12.898 1.00 1.00 H new ATOM 0 HD2 PRO A 24 8.750 4.253 -11.619 1.00 1.00 H new ATOM 0 HD3 PRO A 24 8.525 5.740 -10.719 1.00 1.00 H new ATOM 384 N ASP A 25 4.975 3.181 -12.397 1.00 1.00 N ATOM 385 CA ASP A 25 4.056 2.210 -12.975 1.00 1.00 C ATOM 386 C ASP A 25 3.152 1.627 -11.900 1.00 1.00 C ATOM 387 O ASP A 25 1.936 1.630 -12.055 1.00 1.00 O ATOM 388 CB ASP A 25 4.841 1.090 -13.665 1.00 1.00 C ATOM 389 CG ASP A 25 5.227 1.441 -15.092 1.00 1.00 C ATOM 390 OD1 ASP A 25 4.872 2.552 -15.541 1.00 1.00 O ATOM 391 OD2 ASP A 25 5.879 0.610 -15.757 1.00 1.00 O ATOM 0 H ASP A 25 5.962 2.961 -12.532 1.00 1.00 H new ATOM 0 HA ASP A 25 3.435 2.717 -13.714 1.00 1.00 H new ATOM 0 HB2 ASP A 25 5.742 0.876 -13.091 1.00 1.00 H new ATOM 0 HB3 ASP A 25 4.241 0.180 -13.668 1.00 1.00 H new ATOM 396 N ASP A 26 3.750 1.124 -10.818 1.00 1.00 N ATOM 397 CA ASP A 26 2.985 0.538 -9.724 1.00 1.00 C ATOM 398 C ASP A 26 2.112 1.600 -9.063 1.00 1.00 C ATOM 399 O ASP A 26 0.988 1.327 -8.628 1.00 1.00 O ATOM 400 CB ASP A 26 3.929 -0.091 -8.690 1.00 1.00 C ATOM 401 CG ASP A 26 3.190 -0.894 -7.633 1.00 1.00 C ATOM 402 OD1 ASP A 26 1.969 -0.684 -7.476 1.00 1.00 O ATOM 403 OD2 ASP A 26 3.830 -1.739 -6.971 1.00 1.00 O ATOM 0 H ASP A 26 4.760 1.112 -10.679 1.00 1.00 H new ATOM 0 HA ASP A 26 2.341 -0.243 -10.129 1.00 1.00 H new ATOM 0 HB2 ASP A 26 4.641 -0.739 -9.201 1.00 1.00 H new ATOM 0 HB3 ASP A 26 4.506 0.696 -8.205 1.00 1.00 H new ATOM 408 N LEU A 27 2.631 2.820 -8.987 1.00 1.00 N ATOM 409 CA LEU A 27 1.898 3.924 -8.383 1.00 1.00 C ATOM 410 C LEU A 27 0.626 4.231 -9.168 1.00 1.00 C ATOM 411 O LEU A 27 -0.439 4.466 -8.589 1.00 1.00 O ATOM 412 CB LEU A 27 2.776 5.175 -8.312 1.00 1.00 C ATOM 413 CG LEU A 27 3.454 5.417 -6.963 1.00 1.00 C ATOM 414 CD1 LEU A 27 2.455 5.977 -5.957 1.00 1.00 C ATOM 415 CD2 LEU A 27 4.083 4.131 -6.443 1.00 1.00 C ATOM 0 H LEU A 27 3.556 3.069 -9.336 1.00 1.00 H new ATOM 0 HA LEU A 27 1.619 3.625 -7.372 1.00 1.00 H new ATOM 0 HB2 LEU A 27 3.546 5.103 -9.080 1.00 1.00 H new ATOM 0 HB3 LEU A 27 2.164 6.044 -8.554 1.00 1.00 H new ATOM 0 HG LEU A 27 4.247 6.152 -7.101 1.00 1.00 H new ATOM 0 HD11 LEU A 27 2.954 6.143 -5.002 1.00 1.00 H new ATOM 0 HD12 LEU A 27 2.056 6.921 -6.327 1.00 1.00 H new ATOM 0 HD13 LEU A 27 1.639 5.267 -5.821 1.00 1.00 H new ATOM 0 HD21 LEU A 27 4.561 4.322 -5.482 1.00 1.00 H new ATOM 0 HD22 LEU A 27 3.310 3.372 -6.319 1.00 1.00 H new ATOM 0 HD23 LEU A 27 4.829 3.777 -7.155 1.00 1.00 H new ATOM 427 N HIS A 28 0.740 4.210 -10.493 1.00 1.00 N ATOM 428 CA HIS A 28 -0.399 4.486 -11.361 1.00 1.00 C ATOM 429 C HIS A 28 -1.509 3.492 -11.069 1.00 1.00 C ATOM 430 O HIS A 28 -2.669 3.863 -10.949 1.00 1.00 O ATOM 431 CB HIS A 28 0.012 4.402 -12.829 1.00 1.00 C ATOM 432 CG HIS A 28 0.780 5.592 -13.311 1.00 1.00 C ATOM 433 ND1 HIS A 28 1.970 5.502 -14.002 1.00 1.00 N ATOM 434 CD2 HIS A 28 0.517 6.916 -13.189 1.00 1.00 C ATOM 435 CE1 HIS A 28 2.407 6.716 -14.285 1.00 1.00 C ATOM 436 NE2 HIS A 28 1.544 7.590 -13.803 1.00 1.00 N ATOM 0 H HIS A 28 1.608 4.005 -10.988 1.00 1.00 H new ATOM 0 HA HIS A 28 -0.758 5.497 -11.165 1.00 1.00 H new ATOM 0 HB2 HIS A 28 0.617 3.507 -12.977 1.00 1.00 H new ATOM 0 HB3 HIS A 28 -0.883 4.287 -13.441 1.00 1.00 H new ATOM 0 HD2 HIS A 28 -0.339 7.358 -12.701 1.00 1.00 H new ATOM 0 HE1 HIS A 28 3.315 6.953 -14.819 1.00 1.00 H new ATOM 0 HE2 HIS A 28 1.626 8.604 -13.875 1.00 1.00 H new ATOM 445 N TYR A 29 -1.129 2.228 -10.929 1.00 1.00 N ATOM 446 CA TYR A 29 -2.084 1.177 -10.625 1.00 1.00 C ATOM 447 C TYR A 29 -2.768 1.458 -9.289 1.00 1.00 C ATOM 448 O TYR A 29 -3.989 1.333 -9.162 1.00 1.00 O ATOM 449 CB TYR A 29 -1.391 -0.183 -10.577 1.00 1.00 C ATOM 450 CG TYR A 29 -2.344 -1.346 -10.406 1.00 1.00 C ATOM 451 CD1 TYR A 29 -2.785 -1.727 -9.145 1.00 1.00 C ATOM 452 CD2 TYR A 29 -2.804 -2.061 -11.505 1.00 1.00 C ATOM 453 CE1 TYR A 29 -3.656 -2.788 -8.984 1.00 1.00 C ATOM 454 CE2 TYR A 29 -3.675 -3.123 -11.352 1.00 1.00 C ATOM 455 CZ TYR A 29 -4.098 -3.483 -10.090 1.00 1.00 C ATOM 456 OH TYR A 29 -4.954 -4.545 -9.927 1.00 1.00 O ATOM 0 H TYR A 29 -0.165 1.909 -11.022 1.00 1.00 H new ATOM 0 HA TYR A 29 -2.835 1.158 -11.414 1.00 1.00 H new ATOM 0 HB2 TYR A 29 -0.822 -0.323 -11.496 1.00 1.00 H new ATOM 0 HB3 TYR A 29 -0.675 -0.187 -9.755 1.00 1.00 H new ATOM 0 HD1 TYR A 29 -2.442 -1.185 -8.276 1.00 1.00 H new ATOM 0 HD2 TYR A 29 -2.475 -1.782 -12.495 1.00 1.00 H new ATOM 0 HE1 TYR A 29 -3.989 -3.071 -7.996 1.00 1.00 H new ATOM 0 HE2 TYR A 29 -4.023 -3.668 -12.217 1.00 1.00 H new ATOM 0 HH TYR A 29 -5.172 -4.927 -10.803 1.00 1.00 H new ATOM 466 N PHE A 30 -1.968 1.839 -8.294 1.00 1.00 N ATOM 467 CA PHE A 30 -2.487 2.134 -6.961 1.00 1.00 C ATOM 468 C PHE A 30 -3.483 3.289 -6.995 1.00 1.00 C ATOM 469 O PHE A 30 -4.555 3.209 -6.408 1.00 1.00 O ATOM 470 CB PHE A 30 -1.349 2.472 -5.997 1.00 1.00 C ATOM 471 CG PHE A 30 -1.739 3.474 -4.942 1.00 1.00 C ATOM 472 CD1 PHE A 30 -2.532 3.101 -3.870 1.00 1.00 C ATOM 473 CD2 PHE A 30 -1.307 4.788 -5.027 1.00 1.00 C ATOM 474 CE1 PHE A 30 -2.889 4.018 -2.901 1.00 1.00 C ATOM 475 CE2 PHE A 30 -1.662 5.711 -4.061 1.00 1.00 C ATOM 476 CZ PHE A 30 -2.453 5.326 -2.996 1.00 1.00 C ATOM 0 H PHE A 30 -0.958 1.950 -8.387 1.00 1.00 H new ATOM 0 HA PHE A 30 -3.002 1.240 -6.610 1.00 1.00 H new ATOM 0 HB2 PHE A 30 -1.010 1.557 -5.511 1.00 1.00 H new ATOM 0 HB3 PHE A 30 -0.505 2.863 -6.565 1.00 1.00 H new ATOM 0 HD1 PHE A 30 -2.876 2.080 -3.791 1.00 1.00 H new ATOM 0 HD2 PHE A 30 -0.687 5.094 -5.856 1.00 1.00 H new ATOM 0 HE1 PHE A 30 -3.508 3.713 -2.070 1.00 1.00 H new ATOM 0 HE2 PHE A 30 -1.321 6.733 -4.139 1.00 1.00 H new ATOM 0 HZ PHE A 30 -2.730 6.045 -2.240 1.00 1.00 H new ATOM 486 N ARG A 31 -3.116 4.369 -7.691 1.00 1.00 N ATOM 487 CA ARG A 31 -3.993 5.533 -7.784 1.00 1.00 C ATOM 488 C ARG A 31 -5.310 5.157 -8.452 1.00 1.00 C ATOM 489 O ARG A 31 -6.376 5.563 -7.999 1.00 1.00 O ATOM 490 CB ARG A 31 -3.312 6.649 -8.569 1.00 1.00 C ATOM 491 CG ARG A 31 -4.287 7.615 -9.229 1.00 1.00 C ATOM 492 CD ARG A 31 -3.624 8.944 -9.528 1.00 1.00 C ATOM 493 NE ARG A 31 -3.240 9.063 -10.932 1.00 1.00 N ATOM 494 CZ ARG A 31 -2.506 10.065 -11.415 1.00 1.00 C ATOM 495 NH1 ARG A 31 -2.053 11.019 -10.608 1.00 1.00 N ATOM 496 NH2 ARG A 31 -2.224 10.116 -12.709 1.00 1.00 N ATOM 0 H ARG A 31 -2.231 4.459 -8.190 1.00 1.00 H new ATOM 0 HA ARG A 31 -4.201 5.887 -6.774 1.00 1.00 H new ATOM 0 HB2 ARG A 31 -2.659 7.207 -7.898 1.00 1.00 H new ATOM 0 HB3 ARG A 31 -2.677 6.206 -9.336 1.00 1.00 H new ATOM 0 HG2 ARG A 31 -4.666 7.179 -10.153 1.00 1.00 H new ATOM 0 HG3 ARG A 31 -5.145 7.773 -8.576 1.00 1.00 H new ATOM 0 HD2 ARG A 31 -4.305 9.755 -9.269 1.00 1.00 H new ATOM 0 HD3 ARG A 31 -2.740 9.057 -8.900 1.00 1.00 H new ATOM 0 HE ARG A 31 -3.551 8.339 -11.579 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -2.266 10.988 -9.611 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -1.492 11.782 -10.986 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -2.569 9.388 -13.335 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -1.662 10.883 -13.079 1.00 1.00 H new ATOM 510 N ALA A 32 -5.231 4.372 -9.527 1.00 1.00 N ATOM 511 CA ALA A 32 -6.435 3.953 -10.237 1.00 1.00 C ATOM 512 C ALA A 32 -7.313 3.083 -9.342 1.00 1.00 C ATOM 513 O ALA A 32 -8.534 3.177 -9.366 1.00 1.00 O ATOM 514 CB ALA A 32 -6.051 3.201 -11.499 1.00 1.00 C ATOM 0 H ALA A 32 -4.358 4.019 -9.919 1.00 1.00 H new ATOM 0 HA ALA A 32 -7.007 4.839 -10.512 1.00 1.00 H new ATOM 0 HB1 ALA A 32 -6.953 2.890 -12.026 1.00 1.00 H new ATOM 0 HB2 ALA A 32 -5.460 3.851 -12.144 1.00 1.00 H new ATOM 0 HB3 ALA A 32 -5.464 2.321 -11.234 1.00 1.00 H new ATOM 520 N GLN A 33 -6.666 2.239 -8.547 1.00 1.00 N ATOM 521 CA GLN A 33 -7.360 1.353 -7.627 1.00 1.00 C ATOM 522 C GLN A 33 -8.103 2.136 -6.546 1.00 1.00 C ATOM 523 O GLN A 33 -9.202 1.775 -6.148 1.00 1.00 O ATOM 524 CB GLN A 33 -6.383 0.374 -6.985 1.00 1.00 C ATOM 525 CG GLN A 33 -7.038 -0.910 -6.501 1.00 1.00 C ATOM 526 CD GLN A 33 -6.602 -1.302 -5.103 1.00 1.00 C ATOM 527 OE1 GLN A 33 -7.428 -1.574 -4.231 1.00 1.00 O ATOM 528 NE2 GLN A 33 -5.293 -1.335 -4.884 1.00 1.00 N ATOM 0 H GLN A 33 -5.650 2.151 -8.523 1.00 1.00 H new ATOM 0 HA GLN A 33 -8.096 0.794 -8.205 1.00 1.00 H new ATOM 0 HB2 GLN A 33 -5.604 0.125 -7.706 1.00 1.00 H new ATOM 0 HB3 GLN A 33 -5.893 0.862 -6.142 1.00 1.00 H new ATOM 0 HG2 GLN A 33 -8.121 -0.789 -6.518 1.00 1.00 H new ATOM 0 HG3 GLN A 33 -6.797 -1.718 -7.192 1.00 1.00 H new ATOM 0 HE21 GLN A 33 -4.644 -1.102 -5.636 1.00 1.00 H new ATOM 0 HE22 GLN A 33 -4.936 -1.593 -3.964 1.00 1.00 H new ATOM 537 N THR A 34 -7.480 3.207 -6.063 1.00 1.00 N ATOM 538 CA THR A 34 -8.054 4.013 -5.000 1.00 1.00 C ATOM 539 C THR A 34 -9.164 4.940 -5.504 1.00 1.00 C ATOM 540 O THR A 34 -9.737 5.710 -4.722 1.00 1.00 O ATOM 541 CB THR A 34 -6.965 4.834 -4.318 1.00 1.00 C ATOM 542 OG1 THR A 34 -5.816 4.047 -4.111 1.00 1.00 O ATOM 543 CG2 THR A 34 -7.393 5.386 -2.974 1.00 1.00 C ATOM 0 H THR A 34 -6.573 3.535 -6.396 1.00 1.00 H new ATOM 0 HA THR A 34 -8.503 3.326 -4.283 1.00 1.00 H new ATOM 0 HB THR A 34 -6.759 5.669 -4.987 1.00 1.00 H new ATOM 0 HG1 THR A 34 -5.345 3.926 -4.962 1.00 1.00 H new ATOM 0 HG21 THR A 34 -6.575 5.961 -2.539 1.00 1.00 H new ATOM 0 HG22 THR A 34 -8.261 6.033 -3.106 1.00 1.00 H new ATOM 0 HG23 THR A 34 -7.652 4.563 -2.308 1.00 1.00 H new ATOM 551 N VAL A 35 -9.494 4.869 -6.789 1.00 1.00 N ATOM 552 CA VAL A 35 -10.545 5.715 -7.333 1.00 1.00 C ATOM 553 C VAL A 35 -11.917 5.213 -6.911 1.00 1.00 C ATOM 554 O VAL A 35 -12.229 4.021 -7.035 1.00 1.00 O ATOM 555 CB VAL A 35 -10.505 5.793 -8.865 1.00 1.00 C ATOM 556 CG1 VAL A 35 -10.938 4.476 -9.491 1.00 1.00 C ATOM 557 CG2 VAL A 35 -11.380 6.928 -9.364 1.00 1.00 C ATOM 0 H VAL A 35 -9.055 4.243 -7.464 1.00 1.00 H new ATOM 0 HA VAL A 35 -10.367 6.712 -6.931 1.00 1.00 H new ATOM 0 HB VAL A 35 -9.475 5.989 -9.164 1.00 1.00 H new ATOM 0 HG11 VAL A 35 -10.900 4.560 -10.577 1.00 1.00 H new ATOM 0 HG12 VAL A 35 -10.268 3.680 -9.165 1.00 1.00 H new ATOM 0 HG13 VAL A 35 -11.956 4.243 -9.180 1.00 1.00 H new ATOM 0 HG21 VAL A 35 -11.339 6.968 -10.453 1.00 1.00 H new ATOM 0 HG22 VAL A 35 -12.409 6.761 -9.046 1.00 1.00 H new ATOM 0 HG23 VAL A 35 -11.021 7.872 -8.953 1.00 1.00 H new ATOM 567 N GLY A 36 -12.729 6.134 -6.418 1.00 1.00 N ATOM 568 CA GLY A 36 -14.067 5.790 -5.972 1.00 1.00 C ATOM 569 C GLY A 36 -14.066 5.114 -4.610 1.00 1.00 C ATOM 570 O GLY A 36 -15.034 4.452 -4.240 1.00 1.00 O ATOM 0 H GLY A 36 -12.486 7.120 -6.317 1.00 1.00 H new ATOM 0 HA2 GLY A 36 -14.676 6.693 -5.926 1.00 1.00 H new ATOM 0 HA3 GLY A 36 -14.532 5.129 -6.703 1.00 1.00 H new ATOM 574 N LYS A 37 -12.971 5.269 -3.870 1.00 1.00 N ATOM 575 CA LYS A 37 -12.828 4.657 -2.553 1.00 1.00 C ATOM 576 C LYS A 37 -12.100 5.610 -1.598 1.00 1.00 C ATOM 577 O LYS A 37 -11.394 6.514 -2.042 1.00 1.00 O ATOM 578 CB LYS A 37 -12.047 3.342 -2.668 1.00 1.00 C ATOM 579 CG LYS A 37 -12.421 2.510 -3.897 1.00 1.00 C ATOM 580 CD LYS A 37 -11.912 1.084 -3.776 1.00 1.00 C ATOM 581 CE LYS A 37 -12.057 0.333 -5.091 1.00 1.00 C ATOM 582 NZ LYS A 37 -13.471 -0.117 -5.305 1.00 1.00 N ATOM 0 H LYS A 37 -12.164 5.818 -4.164 1.00 1.00 H new ATOM 0 HA LYS A 37 -13.822 4.451 -2.155 1.00 1.00 H new ATOM 0 HB2 LYS A 37 -10.981 3.565 -2.702 1.00 1.00 H new ATOM 0 HB3 LYS A 37 -12.220 2.747 -1.771 1.00 1.00 H new ATOM 0 HG2 LYS A 37 -13.504 2.502 -4.017 1.00 1.00 H new ATOM 0 HG3 LYS A 37 -12.004 2.972 -4.792 1.00 1.00 H new ATOM 0 HD2 LYS A 37 -10.865 1.094 -3.474 1.00 1.00 H new ATOM 0 HD3 LYS A 37 -12.465 0.563 -2.994 1.00 1.00 H new ATOM 0 HE2 LYS A 37 -11.748 0.975 -5.916 1.00 1.00 H new ATOM 0 HE3 LYS A 37 -11.393 -0.531 -5.094 1.00 1.00 H new ATOM 0 HZ1 LYS A 37 -13.540 -0.626 -6.209 1.00 1.00 H new ATOM 0 HZ2 LYS A 37 -13.755 -0.749 -4.529 1.00 1.00 H new ATOM 0 HZ3 LYS A 37 -14.100 0.711 -5.325 1.00 1.00 H new ATOM 596 N ILE A 38 -12.278 5.412 -0.294 1.00 1.00 N ATOM 597 CA ILE A 38 -11.633 6.271 0.698 1.00 1.00 C ATOM 598 C ILE A 38 -10.447 5.560 1.335 1.00 1.00 C ATOM 599 O ILE A 38 -10.560 4.432 1.790 1.00 1.00 O ATOM 600 CB ILE A 38 -12.620 6.703 1.806 1.00 1.00 C ATOM 601 CG1 ILE A 38 -13.995 7.015 1.197 1.00 1.00 C ATOM 602 CG2 ILE A 38 -12.075 7.921 2.535 1.00 1.00 C ATOM 603 CD1 ILE A 38 -14.979 7.579 2.197 1.00 1.00 C ATOM 0 H ILE A 38 -12.858 4.671 0.099 1.00 1.00 H new ATOM 0 HA ILE A 38 -11.287 7.162 0.173 1.00 1.00 H new ATOM 0 HB ILE A 38 -12.735 5.887 2.520 1.00 1.00 H new ATOM 0 HG12 ILE A 38 -13.870 7.726 0.380 1.00 1.00 H new ATOM 0 HG13 ILE A 38 -14.409 6.104 0.765 1.00 1.00 H new ATOM 0 HG21 ILE A 38 -12.775 8.221 3.315 1.00 1.00 H new ATOM 0 HG22 ILE A 38 -11.113 7.675 2.985 1.00 1.00 H new ATOM 0 HG23 ILE A 38 -11.946 8.741 1.828 1.00 1.00 H new ATOM 0 HD11 ILE A 38 -15.929 7.777 1.701 1.00 1.00 H new ATOM 0 HD12 ILE A 38 -15.133 6.860 3.002 1.00 1.00 H new ATOM 0 HD13 ILE A 38 -14.586 8.508 2.611 1.00 1.00 H new ATOM 615 N MET A 39 -9.290 6.221 1.326 1.00 1.00 N ATOM 616 CA MET A 39 -8.065 5.630 1.865 1.00 1.00 C ATOM 617 C MET A 39 -7.455 6.516 2.943 1.00 1.00 C ATOM 618 O MET A 39 -7.595 7.741 2.914 1.00 1.00 O ATOM 619 CB MET A 39 -7.039 5.408 0.744 1.00 1.00 C ATOM 620 CG MET A 39 -6.376 6.684 0.257 1.00 1.00 C ATOM 621 SD MET A 39 -5.105 6.360 -0.978 1.00 1.00 S ATOM 622 CE MET A 39 -3.676 7.040 -0.148 1.00 1.00 C ATOM 0 H MET A 39 -9.175 7.163 0.953 1.00 1.00 H new ATOM 0 HA MET A 39 -8.329 4.671 2.310 1.00 1.00 H new ATOM 0 HB2 MET A 39 -6.269 4.723 1.099 1.00 1.00 H new ATOM 0 HB3 MET A 39 -7.534 4.923 -0.097 1.00 1.00 H new ATOM 0 HG2 MET A 39 -7.132 7.346 -0.166 1.00 1.00 H new ATOM 0 HG3 MET A 39 -5.933 7.207 1.104 1.00 1.00 H new ATOM 0 HE1 MET A 39 -3.179 7.753 -0.805 1.00 1.00 H new ATOM 0 HE2 MET A 39 -3.992 7.546 0.764 1.00 1.00 H new ATOM 0 HE3 MET A 39 -2.985 6.236 0.104 1.00 1.00 H new ATOM 632 N VAL A 40 -6.771 5.880 3.894 1.00 1.00 N ATOM 633 CA VAL A 40 -6.129 6.583 4.988 1.00 1.00 C ATOM 634 C VAL A 40 -4.629 6.355 4.943 1.00 1.00 C ATOM 635 O VAL A 40 -4.168 5.217 4.842 1.00 1.00 O ATOM 636 CB VAL A 40 -6.665 6.114 6.356 1.00 1.00 C ATOM 637 CG1 VAL A 40 -7.361 7.246 7.075 1.00 1.00 C ATOM 638 CG2 VAL A 40 -7.616 4.932 6.173 1.00 1.00 C ATOM 0 H VAL A 40 -6.651 4.868 3.922 1.00 1.00 H new ATOM 0 HA VAL A 40 -6.353 7.643 4.872 1.00 1.00 H new ATOM 0 HB VAL A 40 -5.820 5.793 6.966 1.00 1.00 H new ATOM 0 HG11 VAL A 40 -7.731 6.893 8.037 1.00 1.00 H new ATOM 0 HG12 VAL A 40 -6.657 8.063 7.235 1.00 1.00 H new ATOM 0 HG13 VAL A 40 -8.197 7.600 6.472 1.00 1.00 H new ATOM 0 HG21 VAL A 40 -7.988 4.610 7.146 1.00 1.00 H new ATOM 0 HG22 VAL A 40 -8.455 5.234 5.546 1.00 1.00 H new ATOM 0 HG23 VAL A 40 -7.085 4.108 5.697 1.00 1.00 H new ATOM 648 N VAL A 41 -3.866 7.441 4.997 1.00 1.00 N ATOM 649 CA VAL A 41 -2.417 7.375 4.941 1.00 1.00 C ATOM 650 C VAL A 41 -1.787 8.002 6.177 1.00 1.00 C ATOM 651 O VAL A 41 -2.134 9.115 6.572 1.00 1.00 O ATOM 652 CB VAL A 41 -1.880 8.095 3.694 1.00 1.00 C ATOM 653 CG1 VAL A 41 -1.651 7.111 2.564 1.00 1.00 C ATOM 654 CG2 VAL A 41 -2.826 9.206 3.265 1.00 1.00 C ATOM 0 H VAL A 41 -4.237 8.388 5.081 1.00 1.00 H new ATOM 0 HA VAL A 41 -2.149 6.319 4.896 1.00 1.00 H new ATOM 0 HB VAL A 41 -0.921 8.548 3.947 1.00 1.00 H new ATOM 0 HG11 VAL A 41 -1.271 7.642 1.691 1.00 1.00 H new ATOM 0 HG12 VAL A 41 -0.925 6.360 2.877 1.00 1.00 H new ATOM 0 HG13 VAL A 41 -2.592 6.623 2.311 1.00 1.00 H new ATOM 0 HG21 VAL A 41 -2.427 9.703 2.381 1.00 1.00 H new ATOM 0 HG22 VAL A 41 -3.803 8.782 3.033 1.00 1.00 H new ATOM 0 HG23 VAL A 41 -2.927 9.930 4.073 1.00 1.00 H new ATOM 664 N GLY A 42 -0.847 7.282 6.781 1.00 1.00 N ATOM 665 CA GLY A 42 -0.183 7.791 7.960 1.00 1.00 C ATOM 666 C GLY A 42 0.651 9.009 7.637 1.00 1.00 C ATOM 667 O GLY A 42 1.109 9.174 6.510 1.00 1.00 O ATOM 0 H GLY A 42 -0.537 6.360 6.475 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -0.925 8.046 8.717 1.00 1.00 H new ATOM 0 HA3 GLY A 42 0.453 7.015 8.386 1.00 1.00 H new ATOM 671 N ARG A 43 0.827 9.893 8.615 1.00 1.00 N ATOM 672 CA ARG A 43 1.586 11.113 8.393 1.00 1.00 C ATOM 673 C ARG A 43 3.028 10.804 7.993 1.00 1.00 C ATOM 674 O ARG A 43 3.549 11.391 7.056 1.00 1.00 O ATOM 675 CB ARG A 43 1.577 11.995 9.638 1.00 1.00 C ATOM 676 CG ARG A 43 1.637 13.476 9.320 1.00 1.00 C ATOM 677 CD ARG A 43 3.070 13.951 9.153 1.00 1.00 C ATOM 678 NE ARG A 43 3.249 14.747 7.946 1.00 1.00 N ATOM 679 CZ ARG A 43 4.290 15.550 7.727 1.00 1.00 C ATOM 680 NH1 ARG A 43 5.246 15.672 8.639 1.00 1.00 N ATOM 681 NH2 ARG A 43 4.377 16.236 6.596 1.00 1.00 N ATOM 0 H ARG A 43 0.457 9.786 9.560 1.00 1.00 H new ATOM 0 HA ARG A 43 1.105 11.649 7.575 1.00 1.00 H new ATOM 0 HB2 ARG A 43 0.675 11.790 10.214 1.00 1.00 H new ATOM 0 HB3 ARG A 43 2.426 11.731 10.269 1.00 1.00 H new ATOM 0 HG2 ARG A 43 1.077 13.676 8.406 1.00 1.00 H new ATOM 0 HG3 ARG A 43 1.156 14.041 10.119 1.00 1.00 H new ATOM 0 HD2 ARG A 43 3.359 14.542 10.022 1.00 1.00 H new ATOM 0 HD3 ARG A 43 3.735 13.088 9.119 1.00 1.00 H new ATOM 0 HE ARG A 43 2.532 14.686 7.223 1.00 1.00 H new ATOM 0 HH11 ARG A 43 5.187 15.150 9.513 1.00 1.00 H new ATOM 0 HH12 ARG A 43 6.040 16.288 8.466 1.00 1.00 H new ATOM 0 HH21 ARG A 43 3.646 16.150 5.890 1.00 1.00 H new ATOM 0 HH22 ARG A 43 5.175 16.850 6.432 1.00 1.00 H new ATOM 695 N ARG A 44 3.664 9.871 8.655 1.00 1.00 N ATOM 696 CA ARG A 44 5.038 9.542 8.320 1.00 1.00 C ATOM 697 C ARG A 44 5.113 9.070 6.879 1.00 1.00 C ATOM 698 O ARG A 44 6.054 9.390 6.157 1.00 1.00 O ATOM 699 CB ARG A 44 5.572 8.475 9.266 1.00 1.00 C ATOM 700 CG ARG A 44 6.403 9.038 10.402 1.00 1.00 C ATOM 701 CD ARG A 44 7.862 9.187 10.004 1.00 1.00 C ATOM 702 NE ARG A 44 8.295 10.581 10.010 1.00 1.00 N ATOM 703 CZ ARG A 44 9.493 10.988 9.595 1.00 1.00 C ATOM 704 NH1 ARG A 44 10.385 10.107 9.158 1.00 1.00 N ATOM 705 NH2 ARG A 44 9.799 12.278 9.616 1.00 1.00 N ATOM 0 H ARG A 44 3.264 9.328 9.421 1.00 1.00 H new ATOM 0 HA ARG A 44 5.657 10.432 8.430 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.734 7.916 9.682 1.00 1.00 H new ATOM 0 HB3 ARG A 44 6.177 7.767 8.699 1.00 1.00 H new ATOM 0 HG2 ARG A 44 6.005 10.008 10.699 1.00 1.00 H new ATOM 0 HG3 ARG A 44 6.327 8.383 11.270 1.00 1.00 H new ATOM 0 HD2 ARG A 44 8.484 8.612 10.689 1.00 1.00 H new ATOM 0 HD3 ARG A 44 8.010 8.766 9.009 1.00 1.00 H new ATOM 0 HE ARG A 44 7.641 11.285 10.352 1.00 1.00 H new ATOM 0 HH11 ARG A 44 10.154 9.114 9.139 1.00 1.00 H new ATOM 0 HH12 ARG A 44 11.301 10.423 8.841 1.00 1.00 H new ATOM 0 HH21 ARG A 44 9.117 12.959 9.950 1.00 1.00 H new ATOM 0 HH22 ARG A 44 10.717 12.590 9.298 1.00 1.00 H new ATOM 719 N THR A 45 4.110 8.315 6.483 1.00 1.00 N ATOM 720 CA THR A 45 4.030 7.784 5.123 1.00 1.00 C ATOM 721 C THR A 45 3.899 8.913 4.098 1.00 1.00 C ATOM 722 O THR A 45 4.578 8.897 3.074 1.00 1.00 O ATOM 723 CB THR A 45 2.868 6.794 4.997 1.00 1.00 C ATOM 724 OG1 THR A 45 3.094 5.645 5.806 1.00 1.00 O ATOM 725 CG2 THR A 45 2.651 6.316 3.579 1.00 1.00 C ATOM 0 H THR A 45 3.329 8.049 7.083 1.00 1.00 H new ATOM 0 HA THR A 45 4.957 7.250 4.914 1.00 1.00 H new ATOM 0 HB THR A 45 1.983 7.339 5.325 1.00 1.00 H new ATOM 0 HG1 THR A 45 2.719 5.795 6.699 1.00 1.00 H new ATOM 0 HG21 THR A 45 1.815 5.617 3.555 1.00 1.00 H new ATOM 0 HG22 THR A 45 2.430 7.169 2.937 1.00 1.00 H new ATOM 0 HG23 THR A 45 3.552 5.817 3.222 1.00 1.00 H new ATOM 733 N TYR A 46 3.028 9.882 4.378 1.00 1.00 N ATOM 734 CA TYR A 46 2.824 11.006 3.482 1.00 1.00 C ATOM 735 C TYR A 46 4.144 11.626 3.062 1.00 1.00 C ATOM 736 O TYR A 46 4.324 12.014 1.903 1.00 1.00 O ATOM 737 CB TYR A 46 1.949 12.061 4.147 1.00 1.00 C ATOM 738 CG TYR A 46 0.697 12.368 3.365 1.00 1.00 C ATOM 739 CD1 TYR A 46 0.762 13.067 2.167 1.00 1.00 C ATOM 740 CD2 TYR A 46 -0.550 11.958 3.819 1.00 1.00 C ATOM 741 CE1 TYR A 46 -0.380 13.351 1.443 1.00 1.00 C ATOM 742 CE2 TYR A 46 -1.697 12.239 3.104 1.00 1.00 C ATOM 743 CZ TYR A 46 -1.607 12.935 1.917 1.00 1.00 C ATOM 744 OH TYR A 46 -2.743 13.219 1.203 1.00 1.00 O ATOM 0 H TYR A 46 2.454 9.906 5.221 1.00 1.00 H new ATOM 0 HA TYR A 46 2.323 10.631 2.590 1.00 1.00 H new ATOM 0 HB2 TYR A 46 1.673 11.719 5.145 1.00 1.00 H new ATOM 0 HB3 TYR A 46 2.526 12.977 4.272 1.00 1.00 H new ATOM 0 HD1 TYR A 46 1.722 13.394 1.795 1.00 1.00 H new ATOM 0 HD2 TYR A 46 -0.624 11.410 4.747 1.00 1.00 H new ATOM 0 HE1 TYR A 46 -0.313 13.895 0.512 1.00 1.00 H new ATOM 0 HE2 TYR A 46 -2.659 11.916 3.472 1.00 1.00 H new ATOM 0 HH TYR A 46 -3.483 12.667 1.532 1.00 1.00 H new ATOM 754 N GLU A 47 5.074 11.730 4.005 1.00 1.00 N ATOM 755 CA GLU A 47 6.377 12.317 3.728 1.00 1.00 C ATOM 756 C GLU A 47 7.037 11.628 2.536 1.00 1.00 C ATOM 757 O GLU A 47 7.862 12.219 1.839 1.00 1.00 O ATOM 758 CB GLU A 47 7.275 12.208 4.956 1.00 1.00 C ATOM 759 CG GLU A 47 7.934 13.515 5.339 1.00 1.00 C ATOM 760 CD GLU A 47 9.420 13.359 5.580 1.00 1.00 C ATOM 761 OE1 GLU A 47 9.788 12.766 6.616 1.00 1.00 O ATOM 762 OE2 GLU A 47 10.216 13.814 4.732 1.00 1.00 O ATOM 0 H GLU A 47 4.949 11.415 4.967 1.00 1.00 H new ATOM 0 HA GLU A 47 6.234 13.370 3.484 1.00 1.00 H new ATOM 0 HB2 GLU A 47 6.684 11.848 5.798 1.00 1.00 H new ATOM 0 HB3 GLU A 47 8.047 11.462 4.767 1.00 1.00 H new ATOM 0 HG2 GLU A 47 7.771 14.247 4.548 1.00 1.00 H new ATOM 0 HG3 GLU A 47 7.461 13.908 6.239 1.00 1.00 H new ATOM 769 N SER A 48 6.669 10.367 2.308 1.00 1.00 N ATOM 770 CA SER A 48 7.220 9.581 1.206 1.00 1.00 C ATOM 771 C SER A 48 6.456 9.812 -0.099 1.00 1.00 C ATOM 772 O SER A 48 7.028 9.726 -1.185 1.00 1.00 O ATOM 773 CB SER A 48 7.194 8.094 1.557 1.00 1.00 C ATOM 774 OG SER A 48 8.286 7.407 0.964 1.00 1.00 O ATOM 0 H SER A 48 5.987 9.866 2.877 1.00 1.00 H new ATOM 0 HA SER A 48 8.249 9.908 1.056 1.00 1.00 H new ATOM 0 HB2 SER A 48 7.229 7.973 2.640 1.00 1.00 H new ATOM 0 HB3 SER A 48 6.256 7.654 1.217 1.00 1.00 H new ATOM 0 HG SER A 48 8.614 6.719 1.581 1.00 1.00 H new ATOM 780 N PHE A 49 5.152 10.089 0.001 1.00 1.00 N ATOM 781 CA PHE A 49 4.299 10.315 -1.184 1.00 1.00 C ATOM 782 C PHE A 49 4.984 11.250 -2.174 1.00 1.00 C ATOM 783 O PHE A 49 5.046 12.453 -1.950 1.00 1.00 O ATOM 784 CB PHE A 49 2.959 10.908 -0.758 1.00 1.00 C ATOM 785 CG PHE A 49 1.821 9.937 -0.859 1.00 1.00 C ATOM 786 CD1 PHE A 49 1.933 8.660 -0.328 1.00 1.00 C ATOM 787 CD2 PHE A 49 0.641 10.289 -1.493 1.00 1.00 C ATOM 788 CE1 PHE A 49 0.891 7.758 -0.430 1.00 1.00 C ATOM 789 CE2 PHE A 49 -0.404 9.392 -1.596 1.00 1.00 C ATOM 790 CZ PHE A 49 -0.279 8.124 -1.065 1.00 1.00 C ATOM 0 H PHE A 49 4.658 10.164 0.890 1.00 1.00 H new ATOM 0 HA PHE A 49 4.131 9.355 -1.672 1.00 1.00 H new ATOM 0 HB2 PHE A 49 3.036 11.261 0.271 1.00 1.00 H new ATOM 0 HB3 PHE A 49 2.741 11.778 -1.378 1.00 1.00 H new ATOM 0 HD1 PHE A 49 2.845 8.368 0.171 1.00 1.00 H new ATOM 0 HD2 PHE A 49 0.537 11.279 -1.913 1.00 1.00 H new ATOM 0 HE1 PHE A 49 0.992 6.767 -0.013 1.00 1.00 H new ATOM 0 HE2 PHE A 49 -1.318 9.682 -2.092 1.00 1.00 H new ATOM 0 HZ PHE A 49 -1.094 7.420 -1.146 1.00 1.00 H new ATOM 800 N PRO A 50 5.498 10.720 -3.299 1.00 1.00 N ATOM 801 CA PRO A 50 6.172 11.524 -4.325 1.00 1.00 C ATOM 802 C PRO A 50 5.206 12.385 -5.133 1.00 1.00 C ATOM 803 O PRO A 50 5.591 13.423 -5.676 1.00 1.00 O ATOM 804 CB PRO A 50 6.849 10.483 -5.212 1.00 1.00 C ATOM 805 CG PRO A 50 5.998 9.275 -5.064 1.00 1.00 C ATOM 806 CD PRO A 50 5.466 9.293 -3.670 1.00 1.00 C ATOM 0 HA PRO A 50 6.868 12.238 -3.884 1.00 1.00 H new ATOM 0 HB2 PRO A 50 6.896 10.813 -6.250 1.00 1.00 H new ATOM 0 HB3 PRO A 50 7.873 10.291 -4.892 1.00 1.00 H new ATOM 0 HG2 PRO A 50 5.184 9.284 -5.789 1.00 1.00 H new ATOM 0 HG3 PRO A 50 6.577 8.369 -5.246 1.00 1.00 H new ATOM 0 HD2 PRO A 50 4.454 8.890 -3.623 1.00 1.00 H new ATOM 0 HD3 PRO A 50 6.080 8.692 -3.000 1.00 1.00 H new ATOM 814 N LYS A 51 3.951 11.954 -5.206 1.00 1.00 N ATOM 815 CA LYS A 51 2.926 12.681 -5.939 1.00 1.00 C ATOM 816 C LYS A 51 1.801 13.092 -5.008 1.00 1.00 C ATOM 817 O LYS A 51 0.700 12.539 -5.059 1.00 1.00 O ATOM 818 CB LYS A 51 2.377 11.827 -7.094 1.00 1.00 C ATOM 819 CG LYS A 51 3.197 11.913 -8.371 1.00 1.00 C ATOM 820 CD LYS A 51 2.517 11.178 -9.521 1.00 1.00 C ATOM 821 CE LYS A 51 3.261 11.389 -10.820 1.00 1.00 C ATOM 822 NZ LYS A 51 2.816 12.621 -11.530 1.00 1.00 N ATOM 0 H LYS A 51 3.620 11.098 -4.762 1.00 1.00 H new ATOM 0 HA LYS A 51 3.378 13.580 -6.359 1.00 1.00 H new ATOM 0 HB2 LYS A 51 2.332 10.786 -6.773 1.00 1.00 H new ATOM 0 HB3 LYS A 51 1.355 12.139 -7.309 1.00 1.00 H new ATOM 0 HG2 LYS A 51 3.343 12.959 -8.642 1.00 1.00 H new ATOM 0 HG3 LYS A 51 4.186 11.487 -8.199 1.00 1.00 H new ATOM 0 HD2 LYS A 51 2.467 10.113 -9.296 1.00 1.00 H new ATOM 0 HD3 LYS A 51 1.491 11.530 -9.625 1.00 1.00 H new ATOM 0 HE2 LYS A 51 4.330 11.454 -10.618 1.00 1.00 H new ATOM 0 HE3 LYS A 51 3.111 10.525 -11.467 1.00 1.00 H new ATOM 0 HZ1 LYS A 51 3.353 12.725 -12.415 1.00 1.00 H new ATOM 0 HZ2 LYS A 51 1.801 12.549 -11.747 1.00 1.00 H new ATOM 0 HZ3 LYS A 51 2.983 13.450 -10.924 1.00 1.00 H new ATOM 836 N ARG A 52 2.086 14.069 -4.156 1.00 1.00 N ATOM 837 CA ARG A 52 1.113 14.558 -3.202 1.00 1.00 C ATOM 838 C ARG A 52 0.831 16.039 -3.432 1.00 1.00 C ATOM 839 O ARG A 52 1.721 16.784 -3.853 1.00 1.00 O ATOM 840 CB ARG A 52 1.625 14.320 -1.784 1.00 1.00 C ATOM 841 CG ARG A 52 2.002 15.588 -1.020 1.00 1.00 C ATOM 842 CD ARG A 52 0.779 16.294 -0.468 1.00 1.00 C ATOM 843 NE ARG A 52 1.016 16.802 0.876 1.00 1.00 N ATOM 844 CZ ARG A 52 1.696 17.912 1.145 1.00 1.00 C ATOM 845 NH1 ARG A 52 2.213 18.638 0.160 1.00 1.00 N ATOM 846 NH2 ARG A 52 1.859 18.300 2.403 1.00 1.00 N ATOM 0 H ARG A 52 2.991 14.537 -4.111 1.00 1.00 H new ATOM 0 HA ARG A 52 0.178 14.015 -3.338 1.00 1.00 H new ATOM 0 HB2 ARG A 52 0.859 13.787 -1.221 1.00 1.00 H new ATOM 0 HB3 ARG A 52 2.497 13.668 -1.832 1.00 1.00 H new ATOM 0 HG2 ARG A 52 2.676 15.333 -0.202 1.00 1.00 H new ATOM 0 HG3 ARG A 52 2.545 16.264 -1.681 1.00 1.00 H new ATOM 0 HD2 ARG A 52 0.506 17.118 -1.127 1.00 1.00 H new ATOM 0 HD3 ARG A 52 -0.065 15.604 -0.454 1.00 1.00 H new ATOM 0 HE ARG A 52 0.636 16.273 1.661 1.00 1.00 H new ATOM 0 HH11 ARG A 52 2.089 18.345 -0.809 1.00 1.00 H new ATOM 0 HH12 ARG A 52 2.734 19.489 0.373 1.00 1.00 H new ATOM 0 HH21 ARG A 52 1.463 17.747 3.163 1.00 1.00 H new ATOM 0 HH22 ARG A 52 2.381 19.152 2.611 1.00 1.00 H new ATOM 860 N PRO A 53 -0.418 16.488 -3.159 1.00 1.00 N ATOM 861 CA PRO A 53 -1.497 15.628 -2.662 1.00 1.00 C ATOM 862 C PRO A 53 -2.229 14.907 -3.787 1.00 1.00 C ATOM 863 O PRO A 53 -1.767 14.893 -4.926 1.00 1.00 O ATOM 864 CB PRO A 53 -2.434 16.629 -1.981 1.00 1.00 C ATOM 865 CG PRO A 53 -2.273 17.887 -2.759 1.00 1.00 C ATOM 866 CD PRO A 53 -0.873 17.878 -3.324 1.00 1.00 C ATOM 0 HA PRO A 53 -1.129 14.836 -2.009 1.00 1.00 H new ATOM 0 HB2 PRO A 53 -3.467 16.281 -2.000 1.00 1.00 H new ATOM 0 HB3 PRO A 53 -2.166 16.774 -0.934 1.00 1.00 H new ATOM 0 HG2 PRO A 53 -3.012 17.944 -3.559 1.00 1.00 H new ATOM 0 HG3 PRO A 53 -2.426 18.758 -2.121 1.00 1.00 H new ATOM 0 HD2 PRO A 53 -0.866 18.176 -4.372 1.00 1.00 H new ATOM 0 HD3 PRO A 53 -0.225 18.574 -2.791 1.00 1.00 H new ATOM 874 N LEU A 54 -3.373 14.312 -3.452 1.00 1.00 N ATOM 875 CA LEU A 54 -4.182 13.589 -4.427 1.00 1.00 C ATOM 876 C LEU A 54 -5.561 14.239 -4.574 1.00 1.00 C ATOM 877 O LEU A 54 -6.504 13.873 -3.865 1.00 1.00 O ATOM 878 CB LEU A 54 -4.331 12.127 -4.024 1.00 1.00 C ATOM 879 CG LEU A 54 -3.359 11.166 -4.707 1.00 1.00 C ATOM 880 CD1 LEU A 54 -3.410 9.803 -4.049 1.00 1.00 C ATOM 881 CD2 LEU A 54 -3.669 11.078 -6.191 1.00 1.00 C ATOM 0 H LEU A 54 -3.760 14.318 -2.508 1.00 1.00 H new ATOM 0 HA LEU A 54 -3.672 13.634 -5.389 1.00 1.00 H new ATOM 0 HB2 LEU A 54 -4.198 12.048 -2.945 1.00 1.00 H new ATOM 0 HB3 LEU A 54 -5.349 11.807 -4.244 1.00 1.00 H new ATOM 0 HG LEU A 54 -2.344 11.548 -4.596 1.00 1.00 H new ATOM 0 HD11 LEU A 54 -2.711 9.132 -4.548 1.00 1.00 H new ATOM 0 HD12 LEU A 54 -3.136 9.896 -2.998 1.00 1.00 H new ATOM 0 HD13 LEU A 54 -4.419 9.399 -4.126 1.00 1.00 H new ATOM 0 HD21 LEU A 54 -2.971 10.391 -6.668 1.00 1.00 H new ATOM 0 HD22 LEU A 54 -4.687 10.715 -6.329 1.00 1.00 H new ATOM 0 HD23 LEU A 54 -3.572 12.065 -6.642 1.00 1.00 H new ATOM 893 N PRO A 55 -5.692 15.211 -5.492 1.00 1.00 N ATOM 894 CA PRO A 55 -6.968 15.905 -5.737 1.00 1.00 C ATOM 895 C PRO A 55 -8.060 14.975 -6.268 1.00 1.00 C ATOM 896 O PRO A 55 -7.790 13.865 -6.714 1.00 1.00 O ATOM 897 CB PRO A 55 -6.609 16.966 -6.774 1.00 1.00 C ATOM 898 CG PRO A 55 -5.377 16.456 -7.435 1.00 1.00 C ATOM 899 CD PRO A 55 -4.621 15.709 -6.379 1.00 1.00 C ATOM 0 HA PRO A 55 -7.383 16.316 -4.817 1.00 1.00 H new ATOM 0 HB2 PRO A 55 -7.416 17.103 -7.494 1.00 1.00 H new ATOM 0 HB3 PRO A 55 -6.433 17.934 -6.304 1.00 1.00 H new ATOM 0 HG2 PRO A 55 -5.625 15.804 -8.272 1.00 1.00 H new ATOM 0 HG3 PRO A 55 -4.781 17.276 -7.835 1.00 1.00 H new ATOM 0 HD2 PRO A 55 -4.036 14.893 -6.803 1.00 1.00 H new ATOM 0 HD3 PRO A 55 -3.925 16.357 -5.847 1.00 1.00 H new ATOM 907 N GLU A 56 -9.315 15.435 -6.210 1.00 1.00 N ATOM 908 CA GLU A 56 -10.452 14.646 -6.676 1.00 1.00 C ATOM 909 C GLU A 56 -10.445 13.253 -6.053 1.00 1.00 C ATOM 910 O GLU A 56 -10.971 12.301 -6.639 1.00 1.00 O ATOM 911 CB GLU A 56 -10.434 14.512 -8.203 1.00 1.00 C ATOM 912 CG GLU A 56 -11.785 14.748 -8.845 1.00 1.00 C ATOM 913 CD GLU A 56 -11.795 15.949 -9.763 1.00 1.00 C ATOM 914 OE1 GLU A 56 -11.517 17.064 -9.273 1.00 1.00 O ATOM 915 OE2 GLU A 56 -12.090 15.786 -10.966 1.00 1.00 O ATOM 0 H GLU A 56 -9.565 16.353 -5.843 1.00 1.00 H new ATOM 0 HA GLU A 56 -11.357 15.170 -6.370 1.00 1.00 H new ATOM 0 HB2 GLU A 56 -9.716 15.222 -8.614 1.00 1.00 H new ATOM 0 HB3 GLU A 56 -10.083 13.515 -8.468 1.00 1.00 H new ATOM 0 HG2 GLU A 56 -12.073 13.862 -9.410 1.00 1.00 H new ATOM 0 HG3 GLU A 56 -12.534 14.886 -8.065 1.00 1.00 H new ATOM 922 N ARG A 57 -9.861 13.127 -4.868 1.00 1.00 N ATOM 923 CA ARG A 57 -9.792 11.845 -4.178 1.00 1.00 C ATOM 924 C ARG A 57 -10.057 12.021 -2.683 1.00 1.00 C ATOM 925 O ARG A 57 -9.618 12.988 -2.071 1.00 1.00 O ATOM 926 CB ARG A 57 -8.421 11.205 -4.405 1.00 1.00 C ATOM 927 CG ARG A 57 -8.460 9.991 -5.317 1.00 1.00 C ATOM 928 CD ARG A 57 -8.889 10.363 -6.732 1.00 1.00 C ATOM 929 NE ARG A 57 -8.003 9.794 -7.752 1.00 1.00 N ATOM 930 CZ ARG A 57 -8.142 10.014 -9.058 1.00 1.00 C ATOM 931 NH1 ARG A 57 -9.088 10.830 -9.503 1.00 1.00 N ATOM 932 NH2 ARG A 57 -7.328 9.420 -9.920 1.00 1.00 N ATOM 0 H ARG A 57 -9.427 13.900 -4.363 1.00 1.00 H new ATOM 0 HA ARG A 57 -10.561 11.188 -4.584 1.00 1.00 H new ATOM 0 HB2 ARG A 57 -7.749 11.949 -4.833 1.00 1.00 H new ATOM 0 HB3 ARG A 57 -8.002 10.912 -3.442 1.00 1.00 H new ATOM 0 HG2 ARG A 57 -7.475 9.526 -5.346 1.00 1.00 H new ATOM 0 HG3 ARG A 57 -9.150 9.252 -4.910 1.00 1.00 H new ATOM 0 HD2 ARG A 57 -9.907 10.014 -6.904 1.00 1.00 H new ATOM 0 HD3 ARG A 57 -8.903 11.448 -6.831 1.00 1.00 H new ATOM 0 HE ARG A 57 -7.237 9.196 -7.444 1.00 1.00 H new ATOM 0 HH11 ARG A 57 -9.714 11.293 -8.844 1.00 1.00 H new ATOM 0 HH12 ARG A 57 -9.190 10.995 -10.504 1.00 1.00 H new ATOM 0 HH21 ARG A 57 -6.596 8.795 -9.583 1.00 1.00 H new ATOM 0 HH22 ARG A 57 -7.434 9.588 -10.920 1.00 1.00 H new ATOM 946 N THR A 58 -10.775 11.063 -2.115 1.00 1.00 N ATOM 947 CA THR A 58 -11.102 11.105 -0.693 1.00 1.00 C ATOM 948 C THR A 58 -9.940 10.591 0.153 1.00 1.00 C ATOM 949 O THR A 58 -9.943 9.458 0.622 1.00 1.00 O ATOM 950 CB THR A 58 -12.359 10.272 -0.435 1.00 1.00 C ATOM 951 OG1 THR A 58 -12.608 9.392 -1.515 1.00 1.00 O ATOM 952 CG2 THR A 58 -13.603 11.117 -0.248 1.00 1.00 C ATOM 0 H THR A 58 -11.141 10.251 -2.611 1.00 1.00 H new ATOM 0 HA THR A 58 -11.288 12.140 -0.407 1.00 1.00 H new ATOM 0 HB THR A 58 -12.159 9.725 0.486 1.00 1.00 H new ATOM 0 HG1 THR A 58 -12.069 8.581 -1.407 1.00 1.00 H new ATOM 0 HG21 THR A 58 -14.460 10.468 -0.069 1.00 1.00 H new ATOM 0 HG22 THR A 58 -13.467 11.782 0.605 1.00 1.00 H new ATOM 0 HG23 THR A 58 -13.778 11.710 -1.146 1.00 1.00 H new ATOM 960 N ASN A 59 -8.945 11.455 0.364 1.00 1.00 N ATOM 961 CA ASN A 59 -7.789 11.093 1.164 1.00 1.00 C ATOM 962 C ASN A 59 -7.891 11.689 2.555 1.00 1.00 C ATOM 963 O ASN A 59 -8.347 12.819 2.714 1.00 1.00 O ATOM 964 CB ASN A 59 -6.516 11.580 0.488 1.00 1.00 C ATOM 965 CG ASN A 59 -6.534 11.342 -1.011 1.00 1.00 C ATOM 966 OD1 ASN A 59 -6.530 12.286 -1.800 1.00 1.00 O ATOM 967 ND2 ASN A 59 -6.543 10.077 -1.412 1.00 1.00 N ATOM 0 H ASN A 59 -8.922 12.404 -0.009 1.00 1.00 H new ATOM 0 HA ASN A 59 -7.759 10.007 1.252 1.00 1.00 H new ATOM 0 HB2 ASN A 59 -6.388 12.645 0.683 1.00 1.00 H new ATOM 0 HB3 ASN A 59 -5.657 11.070 0.925 1.00 1.00 H new ATOM 0 HD21 ASN A 59 -6.547 9.858 -2.408 1.00 1.00 H new ATOM 0 HD22 ASN A 59 -6.546 9.324 -0.724 1.00 1.00 H new ATOM 974 N VAL A 60 -7.471 10.929 3.570 1.00 1.00 N ATOM 975 CA VAL A 60 -7.528 11.396 4.938 1.00 1.00 C ATOM 976 C VAL A 60 -6.151 11.322 5.595 1.00 1.00 C ATOM 977 O VAL A 60 -5.493 10.284 5.545 1.00 1.00 O ATOM 978 CB VAL A 60 -8.542 10.562 5.752 1.00 1.00 C ATOM 979 CG1 VAL A 60 -8.649 11.080 7.182 1.00 1.00 C ATOM 980 CG2 VAL A 60 -9.904 10.574 5.065 1.00 1.00 C ATOM 0 H VAL A 60 -7.090 9.989 3.460 1.00 1.00 H new ATOM 0 HA VAL A 60 -7.853 12.436 4.925 1.00 1.00 H new ATOM 0 HB VAL A 60 -8.186 9.533 5.798 1.00 1.00 H new ATOM 0 HG11 VAL A 60 -9.369 10.476 7.735 1.00 1.00 H new ATOM 0 HG12 VAL A 60 -7.674 11.016 7.666 1.00 1.00 H new ATOM 0 HG13 VAL A 60 -8.980 12.118 7.169 1.00 1.00 H new ATOM 0 HG21 VAL A 60 -10.611 9.983 5.648 1.00 1.00 H new ATOM 0 HG22 VAL A 60 -10.264 11.600 4.990 1.00 1.00 H new ATOM 0 HG23 VAL A 60 -9.811 10.148 4.066 1.00 1.00 H new ATOM 990 N VAL A 61 -5.708 12.427 6.215 1.00 1.00 N ATOM 991 CA VAL A 61 -4.401 12.445 6.878 1.00 1.00 C ATOM 992 C VAL A 61 -4.532 12.016 8.329 1.00 1.00 C ATOM 993 O VAL A 61 -5.393 12.516 9.045 1.00 1.00 O ATOM 994 CB VAL A 61 -3.758 13.848 6.842 1.00 1.00 C ATOM 995 CG1 VAL A 61 -3.128 14.180 8.193 1.00 1.00 C ATOM 996 CG2 VAL A 61 -2.721 13.935 5.731 1.00 1.00 C ATOM 0 H VAL A 61 -6.227 13.303 6.270 1.00 1.00 H new ATOM 0 HA VAL A 61 -3.764 11.748 6.334 1.00 1.00 H new ATOM 0 HB VAL A 61 -4.539 14.580 6.637 1.00 1.00 H new ATOM 0 HG11 VAL A 61 -2.679 15.172 8.151 1.00 1.00 H new ATOM 0 HG12 VAL A 61 -3.895 14.161 8.967 1.00 1.00 H new ATOM 0 HG13 VAL A 61 -2.359 13.444 8.427 1.00 1.00 H new ATOM 0 HG21 VAL A 61 -2.280 14.932 5.722 1.00 1.00 H new ATOM 0 HG22 VAL A 61 -1.940 13.194 5.903 1.00 1.00 H new ATOM 0 HG23 VAL A 61 -3.199 13.742 4.771 1.00 1.00 H new ATOM 1006 N LEU A 62 -3.682 11.080 8.767 1.00 1.00 N ATOM 1007 CA LEU A 62 -3.726 10.601 10.140 1.00 1.00 C ATOM 1008 C LEU A 62 -2.647 11.281 10.974 1.00 1.00 C ATOM 1009 O LEU A 62 -1.466 11.244 10.637 1.00 1.00 O ATOM 1010 CB LEU A 62 -3.534 9.085 10.175 1.00 1.00 C ATOM 1011 CG LEU A 62 -4.736 8.300 10.705 1.00 1.00 C ATOM 1012 CD1 LEU A 62 -5.162 7.259 9.694 1.00 1.00 C ATOM 1013 CD2 LEU A 62 -4.401 7.637 12.035 1.00 1.00 C ATOM 0 H LEU A 62 -2.962 10.646 8.189 1.00 1.00 H new ATOM 0 HA LEU A 62 -4.701 10.845 10.562 1.00 1.00 H new ATOM 0 HB2 LEU A 62 -3.307 8.738 9.167 1.00 1.00 H new ATOM 0 HB3 LEU A 62 -2.667 8.857 10.794 1.00 1.00 H new ATOM 0 HG LEU A 62 -5.560 8.995 10.866 1.00 1.00 H new ATOM 0 HD11 LEU A 62 -6.018 6.706 10.080 1.00 1.00 H new ATOM 0 HD12 LEU A 62 -5.438 7.750 8.761 1.00 1.00 H new ATOM 0 HD13 LEU A 62 -4.337 6.570 9.511 1.00 1.00 H new ATOM 0 HD21 LEU A 62 -5.269 7.084 12.395 1.00 1.00 H new ATOM 0 HD22 LEU A 62 -3.565 6.951 11.899 1.00 1.00 H new ATOM 0 HD23 LEU A 62 -4.130 8.401 12.764 1.00 1.00 H new ATOM 1025 N THR A 63 -3.074 11.901 12.071 1.00 1.00 N ATOM 1026 CA THR A 63 -2.155 12.586 12.963 1.00 1.00 C ATOM 1027 C THR A 63 -2.477 12.285 14.412 1.00 1.00 C ATOM 1028 O THR A 63 -3.583 11.869 14.748 1.00 1.00 O ATOM 1029 CB THR A 63 -2.205 14.095 12.705 1.00 1.00 C ATOM 1030 OG1 THR A 63 -3.333 14.672 13.340 1.00 1.00 O ATOM 1031 CG2 THR A 63 -2.262 14.445 11.233 1.00 1.00 C ATOM 0 H THR A 63 -4.051 11.941 12.360 1.00 1.00 H new ATOM 0 HA THR A 63 -1.146 12.224 12.763 1.00 1.00 H new ATOM 0 HB THR A 63 -1.279 14.496 13.116 1.00 1.00 H new ATOM 0 HG1 THR A 63 -3.046 15.149 14.146 1.00 1.00 H new ATOM 0 HG21 THR A 63 -2.296 15.528 11.118 1.00 1.00 H new ATOM 0 HG22 THR A 63 -1.377 14.054 10.732 1.00 1.00 H new ATOM 0 HG23 THR A 63 -3.155 14.005 10.789 1.00 1.00 H new ATOM 1039 N HIS A 64 -1.484 12.484 15.265 1.00 1.00 N ATOM 1040 CA HIS A 64 -1.631 12.233 16.686 1.00 1.00 C ATOM 1041 C HIS A 64 -2.626 13.201 17.326 1.00 1.00 C ATOM 1042 O HIS A 64 -3.427 12.810 18.176 1.00 1.00 O ATOM 1043 CB HIS A 64 -0.290 12.331 17.395 1.00 1.00 C ATOM 1044 CG HIS A 64 0.413 11.010 17.509 1.00 1.00 C ATOM 1045 ND1 HIS A 64 0.392 9.924 16.701 1.00 1.00 N flip ATOM 1046 CD2 HIS A 64 1.263 10.695 18.547 1.00 1.00 C flip ATOM 1047 CE1 HIS A 64 1.220 8.983 17.260 1.00 1.00 C flip ATOM 1048 NE2 HIS A 64 1.735 9.472 18.372 1.00 1.00 N flip ATOM 0 H HIS A 64 -0.561 12.822 14.992 1.00 1.00 H new ATOM 0 HA HIS A 64 -2.018 11.220 16.796 1.00 1.00 H new ATOM 0 HB2 HIS A 64 0.349 13.031 16.856 1.00 1.00 H new ATOM 0 HB3 HIS A 64 -0.442 12.742 18.393 1.00 1.00 H new ATOM 0 HD2 HIS A 64 1.506 11.345 19.374 1.00 1.00 H new ATOM 0 HE1 HIS A 64 1.418 8.001 16.855 1.00 1.00 H new ATOM 0 HE2 HIS A 64 2.386 8.989 18.991 1.00 1.00 H new ATOM 1057 N GLN A 65 -2.555 14.468 16.927 1.00 1.00 N ATOM 1058 CA GLN A 65 -3.429 15.490 17.487 1.00 1.00 C ATOM 1059 C GLN A 65 -4.547 15.884 16.519 1.00 1.00 C ATOM 1060 O GLN A 65 -4.300 16.179 15.356 1.00 1.00 O ATOM 1061 CB GLN A 65 -2.618 16.734 17.861 1.00 1.00 C ATOM 1062 CG GLN A 65 -2.414 16.901 19.358 1.00 1.00 C ATOM 1063 CD GLN A 65 -1.101 16.296 19.830 1.00 1.00 C ATOM 1064 OE1 GLN A 65 -0.037 16.890 19.664 1.00 1.00 O ATOM 1065 NE2 GLN A 65 -1.172 15.114 20.434 1.00 1.00 N ATOM 0 H GLN A 65 -1.903 14.809 16.220 1.00 1.00 H new ATOM 0 HA GLN A 65 -3.890 15.065 18.379 1.00 1.00 H new ATOM 0 HB2 GLN A 65 -1.644 16.683 17.374 1.00 1.00 H new ATOM 0 HB3 GLN A 65 -3.123 17.618 17.471 1.00 1.00 H new ATOM 0 HG2 GLN A 65 -2.435 17.961 19.610 1.00 1.00 H new ATOM 0 HG3 GLN A 65 -3.241 16.431 19.890 1.00 1.00 H new ATOM 0 HE21 GLN A 65 -2.075 14.655 20.552 1.00 1.00 H new ATOM 0 HE22 GLN A 65 -0.323 14.666 20.780 1.00 1.00 H new ATOM 1074 N GLU A 66 -5.768 15.896 17.033 1.00 1.00 N ATOM 1075 CA GLU A 66 -6.942 16.277 16.244 1.00 1.00 C ATOM 1076 C GLU A 66 -6.867 17.753 15.855 1.00 1.00 C ATOM 1077 O GLU A 66 -7.310 18.150 14.781 1.00 1.00 O ATOM 1078 CB GLU A 66 -8.231 16.003 17.022 1.00 1.00 C ATOM 1079 CG GLU A 66 -8.207 16.494 18.461 1.00 1.00 C ATOM 1080 CD GLU A 66 -9.358 17.451 18.770 1.00 1.00 C ATOM 1081 OE1 GLU A 66 -9.638 18.332 17.931 1.00 1.00 O ATOM 1082 OE2 GLU A 66 -9.978 17.309 19.846 1.00 1.00 O ATOM 0 H GLU A 66 -5.978 15.645 17.999 1.00 1.00 H new ATOM 0 HA GLU A 66 -6.951 15.674 15.336 1.00 1.00 H new ATOM 0 HB2 GLU A 66 -9.064 16.477 16.502 1.00 1.00 H new ATOM 0 HB3 GLU A 66 -8.423 14.930 17.019 1.00 1.00 H new ATOM 0 HG2 GLU A 66 -8.259 15.639 19.135 1.00 1.00 H new ATOM 0 HG3 GLU A 66 -7.259 16.996 18.655 1.00 1.00 H new ATOM 1089 N ASP A 67 -6.314 18.556 16.759 1.00 1.00 N ATOM 1090 CA ASP A 67 -6.181 19.998 16.565 1.00 1.00 C ATOM 1091 C ASP A 67 -5.240 20.323 15.407 1.00 1.00 C ATOM 1092 O ASP A 67 -5.440 21.307 14.700 1.00 1.00 O ATOM 1093 CB ASP A 67 -5.675 20.659 17.839 1.00 1.00 C ATOM 1094 CG ASP A 67 -6.159 22.093 17.986 1.00 1.00 C ATOM 1095 OD1 ASP A 67 -5.854 22.906 17.087 1.00 1.00 O ATOM 1096 OD2 ASP A 67 -6.831 22.404 18.991 1.00 1.00 O ATOM 0 H ASP A 67 -5.944 18.225 17.650 1.00 1.00 H new ATOM 0 HA ASP A 67 -7.169 20.389 16.321 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -6.004 20.078 18.701 1.00 1.00 H new ATOM 0 HB3 ASP A 67 -4.585 20.645 17.843 1.00 1.00 H new ATOM 1101 N TYR A 68 -4.208 19.508 15.201 1.00 1.00 N ATOM 1102 CA TYR A 68 -3.271 19.758 14.110 1.00 1.00 C ATOM 1103 C TYR A 68 -4.007 19.693 12.768 1.00 1.00 C ATOM 1104 O TYR A 68 -4.848 18.831 12.551 1.00 1.00 O ATOM 1105 CB TYR A 68 -2.123 18.746 14.139 1.00 1.00 C ATOM 1106 CG TYR A 68 -0.760 19.379 14.309 1.00 1.00 C ATOM 1107 CD1 TYR A 68 -0.296 19.753 15.566 1.00 1.00 C ATOM 1108 CD2 TYR A 68 0.068 19.596 13.211 1.00 1.00 C ATOM 1109 CE1 TYR A 68 0.953 20.323 15.724 1.00 1.00 C ATOM 1110 CE2 TYR A 68 1.317 20.166 13.363 1.00 1.00 C ATOM 1111 CZ TYR A 68 1.755 20.528 14.620 1.00 1.00 C ATOM 1112 OH TYR A 68 2.997 21.099 14.771 1.00 1.00 O ATOM 0 H TYR A 68 -4.002 18.683 15.764 1.00 1.00 H new ATOM 0 HA TYR A 68 -2.847 20.754 14.235 1.00 1.00 H new ATOM 0 HB2 TYR A 68 -2.291 18.042 14.954 1.00 1.00 H new ATOM 0 HB3 TYR A 68 -2.134 18.171 13.213 1.00 1.00 H new ATOM 0 HD1 TYR A 68 -0.922 19.595 16.432 1.00 1.00 H new ATOM 0 HD2 TYR A 68 -0.271 19.314 12.225 1.00 1.00 H new ATOM 0 HE1 TYR A 68 1.300 20.607 16.707 1.00 1.00 H new ATOM 0 HE2 TYR A 68 1.948 20.328 12.501 1.00 1.00 H new ATOM 0 HH TYR A 68 3.432 21.171 13.896 1.00 1.00 H new ATOM 1122 N GLN A 69 -3.688 20.647 11.897 1.00 1.00 N ATOM 1123 CA GLN A 69 -4.334 20.754 10.591 1.00 1.00 C ATOM 1124 C GLN A 69 -3.467 20.200 9.455 1.00 1.00 C ATOM 1125 O GLN A 69 -2.258 20.444 9.391 1.00 1.00 O ATOM 1126 CB GLN A 69 -4.667 22.218 10.307 1.00 1.00 C ATOM 1127 CG GLN A 69 -3.442 23.087 10.088 1.00 1.00 C ATOM 1128 CD GLN A 69 -3.795 24.512 9.703 1.00 1.00 C ATOM 1129 OE1 GLN A 69 -3.231 25.078 8.767 1.00 1.00 O ATOM 1130 NE2 GLN A 69 -4.747 25.094 10.423 1.00 1.00 N ATOM 0 H GLN A 69 -2.982 21.361 12.073 1.00 1.00 H new ATOM 0 HA GLN A 69 -5.242 20.152 10.629 1.00 1.00 H new ATOM 0 HB2 GLN A 69 -5.304 22.273 9.424 1.00 1.00 H new ATOM 0 HB3 GLN A 69 -5.243 22.620 11.141 1.00 1.00 H new ATOM 0 HG2 GLN A 69 -2.843 23.099 10.998 1.00 1.00 H new ATOM 0 HG3 GLN A 69 -2.824 22.646 9.306 1.00 1.00 H new ATOM 0 HE21 GLN A 69 -5.188 24.587 11.191 1.00 1.00 H new ATOM 0 HE22 GLN A 69 -5.037 26.048 10.208 1.00 1.00 H new ATOM 1139 N ALA A 70 -4.099 19.441 8.566 1.00 1.00 N ATOM 1140 CA ALA A 70 -3.412 18.842 7.430 1.00 1.00 C ATOM 1141 C ALA A 70 -4.070 19.279 6.126 1.00 1.00 C ATOM 1142 O ALA A 70 -5.269 19.538 6.089 1.00 1.00 O ATOM 1143 CB ALA A 70 -3.415 17.330 7.547 1.00 1.00 C ATOM 0 H ALA A 70 -5.095 19.225 8.613 1.00 1.00 H new ATOM 0 HA ALA A 70 -2.377 19.184 7.428 1.00 1.00 H new ATOM 0 HB1 ALA A 70 -2.898 16.898 6.690 1.00 1.00 H new ATOM 0 HB2 ALA A 70 -2.906 17.035 8.465 1.00 1.00 H new ATOM 0 HB3 ALA A 70 -4.443 16.969 7.570 1.00 1.00 H new ATOM 1149 N GLN A 71 -3.270 19.386 5.067 1.00 1.00 N ATOM 1150 CA GLN A 71 -3.783 19.826 3.763 1.00 1.00 C ATOM 1151 C GLN A 71 -3.907 18.664 2.787 1.00 1.00 C ATOM 1152 O GLN A 71 -2.995 17.867 2.623 1.00 1.00 O ATOM 1153 CB GLN A 71 -2.879 20.903 3.167 1.00 1.00 C ATOM 1154 CG GLN A 71 -3.485 21.591 1.943 1.00 1.00 C ATOM 1155 CD GLN A 71 -3.730 23.066 2.159 1.00 1.00 C ATOM 1156 OE1 GLN A 71 -3.788 23.541 3.293 1.00 1.00 O ATOM 1157 NE2 GLN A 71 -3.892 23.802 1.066 1.00 1.00 N ATOM 0 H GLN A 71 -2.272 19.177 5.081 1.00 1.00 H new ATOM 0 HA GLN A 71 -4.778 20.240 3.929 1.00 1.00 H new ATOM 0 HB2 GLN A 71 -2.667 21.653 3.929 1.00 1.00 H new ATOM 0 HB3 GLN A 71 -1.926 20.454 2.888 1.00 1.00 H new ATOM 0 HG2 GLN A 71 -2.818 21.460 1.091 1.00 1.00 H new ATOM 0 HG3 GLN A 71 -4.427 21.105 1.688 1.00 1.00 H new ATOM 0 HE21 GLN A 71 -3.836 23.367 0.145 1.00 1.00 H new ATOM 0 HE22 GLN A 71 -4.073 24.803 1.147 1.00 1.00 H new ATOM 1166 N GLY A 72 -5.050 18.582 2.135 1.00 1.00 N ATOM 1167 CA GLY A 72 -5.283 17.538 1.156 1.00 1.00 C ATOM 1168 C GLY A 72 -5.965 16.318 1.736 1.00 1.00 C ATOM 1169 O GLY A 72 -6.575 15.537 1.001 1.00 1.00 O ATOM 0 H GLY A 72 -5.831 19.225 2.265 1.00 1.00 H new ATOM 0 HA2 GLY A 72 -5.894 17.938 0.347 1.00 1.00 H new ATOM 0 HA3 GLY A 72 -4.330 17.240 0.718 1.00 1.00 H new ATOM 1173 N ALA A 73 -5.873 16.146 3.052 1.00 1.00 N ATOM 1174 CA ALA A 73 -6.500 14.992 3.697 1.00 1.00 C ATOM 1175 C ALA A 73 -7.012 15.325 5.106 1.00 1.00 C ATOM 1176 O ALA A 73 -6.333 16.024 5.861 1.00 1.00 O ATOM 1177 CB ALA A 73 -5.498 13.847 3.742 1.00 1.00 C ATOM 0 H ALA A 73 -5.380 16.777 3.684 1.00 1.00 H new ATOM 0 HA ALA A 73 -7.371 14.699 3.111 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -5.956 12.982 4.221 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -5.200 13.584 2.727 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -4.620 14.154 4.310 1.00 1.00 H new ATOM 1183 N VAL A 74 -8.174 14.792 5.447 1.00 1.00 N ATOM 1184 CA VAL A 74 -8.796 15.043 6.759 1.00 1.00 C ATOM 1185 C VAL A 74 -7.950 14.518 7.919 1.00 1.00 C ATOM 1186 O VAL A 74 -7.383 13.428 7.853 1.00 1.00 O ATOM 1187 CB VAL A 74 -10.212 14.413 6.850 1.00 1.00 C ATOM 1188 CG1 VAL A 74 -10.528 14.056 8.283 1.00 1.00 C ATOM 1189 CG2 VAL A 74 -11.271 15.334 6.265 1.00 1.00 C ATOM 0 H VAL A 74 -8.716 14.179 4.838 1.00 1.00 H new ATOM 0 HA VAL A 74 -8.871 16.127 6.845 1.00 1.00 H new ATOM 0 HB VAL A 74 -10.219 13.500 6.255 1.00 1.00 H new ATOM 0 HG11 VAL A 74 -11.523 13.615 8.337 1.00 1.00 H new ATOM 0 HG12 VAL A 74 -9.793 13.340 8.650 1.00 1.00 H new ATOM 0 HG13 VAL A 74 -10.496 14.956 8.898 1.00 1.00 H new ATOM 0 HG21 VAL A 74 -12.250 14.861 6.346 1.00 1.00 H new ATOM 0 HG22 VAL A 74 -11.277 16.276 6.813 1.00 1.00 H new ATOM 0 HG23 VAL A 74 -11.046 15.527 5.216 1.00 1.00 H new ATOM 1199 N VAL A 75 -7.853 15.323 8.988 1.00 1.00 N ATOM 1200 CA VAL A 75 -7.061 14.930 10.146 1.00 1.00 C ATOM 1201 C VAL A 75 -7.906 14.226 11.203 1.00 1.00 C ATOM 1202 O VAL A 75 -8.779 14.824 11.830 1.00 1.00 O ATOM 1203 CB VAL A 75 -6.396 16.148 10.805 1.00 1.00 C ATOM 1204 CG1 VAL A 75 -5.493 15.734 11.966 1.00 1.00 C ATOM 1205 CG2 VAL A 75 -5.623 16.948 9.771 1.00 1.00 C ATOM 0 H VAL A 75 -8.307 16.233 9.068 1.00 1.00 H new ATOM 0 HA VAL A 75 -6.302 14.243 9.772 1.00 1.00 H new ATOM 0 HB VAL A 75 -7.182 16.781 11.217 1.00 1.00 H new ATOM 0 HG11 VAL A 75 -5.039 16.621 12.408 1.00 1.00 H new ATOM 0 HG12 VAL A 75 -6.085 15.215 12.720 1.00 1.00 H new ATOM 0 HG13 VAL A 75 -4.710 15.071 11.599 1.00 1.00 H new ATOM 0 HG21 VAL A 75 -5.157 17.808 10.251 1.00 1.00 H new ATOM 0 HG22 VAL A 75 -4.852 16.319 9.326 1.00 1.00 H new ATOM 0 HG23 VAL A 75 -6.305 17.292 8.993 1.00 1.00 H new ATOM 1215 N VAL A 76 -7.612 12.949 11.401 1.00 1.00 N ATOM 1216 CA VAL A 76 -8.300 12.129 12.391 1.00 1.00 C ATOM 1217 C VAL A 76 -7.288 11.491 13.329 1.00 1.00 C ATOM 1218 O VAL A 76 -6.314 10.889 12.874 1.00 1.00 O ATOM 1219 CB VAL A 76 -9.151 11.030 11.724 1.00 1.00 C ATOM 1220 CG1 VAL A 76 -10.089 10.370 12.730 1.00 1.00 C ATOM 1221 CG2 VAL A 76 -9.946 11.597 10.555 1.00 1.00 C ATOM 0 H VAL A 76 -6.890 12.451 10.880 1.00 1.00 H new ATOM 0 HA VAL A 76 -8.968 12.780 12.955 1.00 1.00 H new ATOM 0 HB VAL A 76 -8.469 10.269 11.345 1.00 1.00 H new ATOM 0 HG11 VAL A 76 -10.676 9.600 12.229 1.00 1.00 H new ATOM 0 HG12 VAL A 76 -9.504 9.918 13.531 1.00 1.00 H new ATOM 0 HG13 VAL A 76 -10.759 11.121 13.150 1.00 1.00 H new ATOM 0 HG21 VAL A 76 -10.539 10.804 10.100 1.00 1.00 H new ATOM 0 HG22 VAL A 76 -10.608 12.385 10.914 1.00 1.00 H new ATOM 0 HG23 VAL A 76 -9.260 12.008 9.814 1.00 1.00 H new ATOM 1231 N HIS A 77 -7.513 11.607 14.627 1.00 1.00 N ATOM 1232 CA HIS A 77 -6.589 11.025 15.610 1.00 1.00 C ATOM 1233 C HIS A 77 -7.112 9.706 16.189 1.00 1.00 C ATOM 1234 O HIS A 77 -6.393 9.025 16.917 1.00 1.00 O ATOM 1235 CB HIS A 77 -6.325 12.013 16.742 1.00 1.00 C ATOM 1236 CG HIS A 77 -7.431 12.109 17.741 1.00 1.00 C ATOM 1237 ND1 HIS A 77 -8.681 12.606 17.437 1.00 1.00 N ATOM 1238 CD2 HIS A 77 -7.479 11.745 19.043 1.00 1.00 C ATOM 1239 CE1 HIS A 77 -9.449 12.545 18.509 1.00 1.00 C ATOM 1240 NE2 HIS A 77 -8.744 12.025 19.498 1.00 1.00 N ATOM 0 H HIS A 77 -8.315 12.091 15.030 1.00 1.00 H new ATOM 0 HA HIS A 77 -5.659 10.811 15.084 1.00 1.00 H new ATOM 0 HB2 HIS A 77 -5.409 11.722 17.257 1.00 1.00 H new ATOM 0 HB3 HIS A 77 -6.150 13.000 16.314 1.00 1.00 H new ATOM 0 HD2 HIS A 77 -6.672 11.314 19.618 1.00 1.00 H new ATOM 0 HE1 HIS A 77 -10.479 12.866 18.568 1.00 1.00 H new ATOM 0 HE2 HIS A 77 -9.084 11.859 20.445 1.00 1.00 H new ATOM 1249 N ASP A 78 -8.359 9.359 15.889 1.00 1.00 N ATOM 1250 CA ASP A 78 -8.956 8.130 16.408 1.00 1.00 C ATOM 1251 C ASP A 78 -8.921 6.997 15.391 1.00 1.00 C ATOM 1252 O ASP A 78 -9.659 7.019 14.396 1.00 1.00 O ATOM 1253 CB ASP A 78 -10.389 8.388 16.848 1.00 1.00 C ATOM 1254 CG ASP A 78 -10.872 7.363 17.854 1.00 1.00 C ATOM 1255 OD1 ASP A 78 -10.538 6.171 17.696 1.00 1.00 O ATOM 1256 OD2 ASP A 78 -11.595 7.752 18.797 1.00 1.00 O ATOM 0 H ASP A 78 -8.976 9.909 15.291 1.00 1.00 H new ATOM 0 HA ASP A 78 -8.359 7.819 17.265 1.00 1.00 H new ATOM 0 HB2 ASP A 78 -10.459 9.384 17.285 1.00 1.00 H new ATOM 0 HB3 ASP A 78 -11.043 8.375 15.976 1.00 1.00 H new ATOM 1261 N VAL A 79 -8.081 6.004 15.656 1.00 1.00 N ATOM 1262 CA VAL A 79 -7.971 4.850 14.776 1.00 1.00 C ATOM 1263 C VAL A 79 -9.287 4.068 14.727 1.00 1.00 C ATOM 1264 O VAL A 79 -9.740 3.642 13.656 1.00 1.00 O ATOM 1265 CB VAL A 79 -6.838 3.907 15.223 1.00 1.00 C ATOM 1266 CG1 VAL A 79 -5.516 4.646 15.248 1.00 1.00 C ATOM 1267 CG2 VAL A 79 -7.156 3.289 16.579 1.00 1.00 C ATOM 0 H VAL A 79 -7.468 5.975 16.471 1.00 1.00 H new ATOM 0 HA VAL A 79 -7.741 5.230 13.781 1.00 1.00 H new ATOM 0 HB VAL A 79 -6.754 3.094 14.502 1.00 1.00 H new ATOM 0 HG11 VAL A 79 -4.725 3.966 15.566 1.00 1.00 H new ATOM 0 HG12 VAL A 79 -5.291 5.023 14.250 1.00 1.00 H new ATOM 0 HG13 VAL A 79 -5.579 5.481 15.946 1.00 1.00 H new ATOM 0 HG21 VAL A 79 -6.343 2.626 16.876 1.00 1.00 H new ATOM 0 HG22 VAL A 79 -7.270 4.079 17.321 1.00 1.00 H new ATOM 0 HG23 VAL A 79 -8.082 2.719 16.511 1.00 1.00 H new ATOM 1277 N ALA A 80 -9.883 3.877 15.899 1.00 1.00 N ATOM 1278 CA ALA A 80 -11.135 3.140 16.022 1.00 1.00 C ATOM 1279 C ALA A 80 -12.278 3.838 15.269 1.00 1.00 C ATOM 1280 O ALA A 80 -13.128 3.178 14.682 1.00 1.00 O ATOM 1281 CB ALA A 80 -11.498 2.965 17.485 1.00 1.00 C ATOM 0 H ALA A 80 -9.515 4.226 16.784 1.00 1.00 H new ATOM 0 HA ALA A 80 -10.990 2.159 15.569 1.00 1.00 H new ATOM 0 HB1 ALA A 80 -12.435 2.413 17.564 1.00 1.00 H new ATOM 0 HB2 ALA A 80 -10.707 2.412 17.992 1.00 1.00 H new ATOM 0 HB3 ALA A 80 -11.613 3.944 17.951 1.00 1.00 H new ATOM 1287 N ALA A 81 -12.289 5.169 15.297 1.00 1.00 N ATOM 1288 CA ALA A 81 -13.333 5.918 14.629 1.00 1.00 C ATOM 1289 C ALA A 81 -13.315 5.674 13.125 1.00 1.00 C ATOM 1290 O ALA A 81 -14.357 5.560 12.490 1.00 1.00 O ATOM 1291 CB ALA A 81 -13.196 7.410 14.919 1.00 1.00 C ATOM 0 H ALA A 81 -11.590 5.740 15.772 1.00 1.00 H new ATOM 0 HA ALA A 81 -14.289 5.569 15.019 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -13.990 7.954 14.408 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -13.272 7.580 15.993 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -12.228 7.762 14.564 1.00 1.00 H new ATOM 1297 N VAL A 82 -12.113 5.567 12.557 1.00 1.00 N ATOM 1298 CA VAL A 82 -11.979 5.299 11.137 1.00 1.00 C ATOM 1299 C VAL A 82 -12.562 3.933 10.783 1.00 1.00 C ATOM 1300 O VAL A 82 -13.264 3.776 9.774 1.00 1.00 O ATOM 1301 CB VAL A 82 -10.502 5.341 10.691 1.00 1.00 C ATOM 1302 CG1 VAL A 82 -10.325 4.644 9.349 1.00 1.00 C ATOM 1303 CG2 VAL A 82 -9.994 6.784 10.645 1.00 1.00 C ATOM 0 H VAL A 82 -11.230 5.662 13.059 1.00 1.00 H new ATOM 0 HA VAL A 82 -12.531 6.080 10.614 1.00 1.00 H new ATOM 0 HB VAL A 82 -9.903 4.802 11.424 1.00 1.00 H new ATOM 0 HG11 VAL A 82 -9.277 4.685 9.053 1.00 1.00 H new ATOM 0 HG12 VAL A 82 -10.637 3.603 9.436 1.00 1.00 H new ATOM 0 HG13 VAL A 82 -10.934 5.144 8.596 1.00 1.00 H new ATOM 0 HG21 VAL A 82 -8.951 6.793 10.328 1.00 1.00 H new ATOM 0 HG22 VAL A 82 -10.593 7.358 9.938 1.00 1.00 H new ATOM 0 HG23 VAL A 82 -10.076 7.230 11.636 1.00 1.00 H new ATOM 1313 N PHE A 83 -12.254 2.931 11.609 1.00 1.00 N ATOM 1314 CA PHE A 83 -12.735 1.570 11.391 1.00 1.00 C ATOM 1315 C PHE A 83 -14.265 1.517 11.426 1.00 1.00 C ATOM 1316 O PHE A 83 -14.906 0.900 10.586 1.00 1.00 O ATOM 1317 CB PHE A 83 -12.156 0.622 12.439 1.00 1.00 C ATOM 1318 CG PHE A 83 -11.635 -0.665 11.870 1.00 1.00 C ATOM 1319 CD1 PHE A 83 -12.351 -1.354 10.905 1.00 1.00 C ATOM 1320 CD2 PHE A 83 -10.425 -1.186 12.302 1.00 1.00 C ATOM 1321 CE1 PHE A 83 -11.870 -2.538 10.379 1.00 1.00 C ATOM 1322 CE2 PHE A 83 -9.940 -2.370 11.782 1.00 1.00 C ATOM 1323 CZ PHE A 83 -10.663 -3.047 10.819 1.00 1.00 C ATOM 0 H PHE A 83 -11.670 3.040 12.438 1.00 1.00 H new ATOM 0 HA PHE A 83 -12.401 1.251 10.404 1.00 1.00 H new ATOM 0 HB2 PHE A 83 -11.348 1.129 12.967 1.00 1.00 H new ATOM 0 HB3 PHE A 83 -12.926 0.397 13.177 1.00 1.00 H new ATOM 0 HD1 PHE A 83 -13.296 -0.961 10.560 1.00 1.00 H new ATOM 0 HD2 PHE A 83 -9.855 -0.660 13.054 1.00 1.00 H new ATOM 0 HE1 PHE A 83 -12.437 -3.065 9.625 1.00 1.00 H new ATOM 0 HE2 PHE A 83 -8.997 -2.766 12.128 1.00 1.00 H new ATOM 0 HZ PHE A 83 -10.285 -3.973 10.411 1.00 1.00 H new ATOM 1333 N ALA A 84 -14.841 2.189 12.420 1.00 1.00 N ATOM 1334 CA ALA A 84 -16.286 2.223 12.591 1.00 1.00 C ATOM 1335 C ALA A 84 -16.977 2.904 11.407 1.00 1.00 C ATOM 1336 O ALA A 84 -18.059 2.487 10.995 1.00 1.00 O ATOM 1337 CB ALA A 84 -16.647 2.930 13.895 1.00 1.00 C ATOM 0 H ALA A 84 -14.323 2.719 13.121 1.00 1.00 H new ATOM 0 HA ALA A 84 -16.641 1.193 12.634 1.00 1.00 H new ATOM 0 HB1 ALA A 84 -17.731 2.949 14.011 1.00 1.00 H new ATOM 0 HB2 ALA A 84 -16.202 2.396 14.734 1.00 1.00 H new ATOM 0 HB3 ALA A 84 -16.267 3.951 13.872 1.00 1.00 H new ATOM 1343 N TYR A 85 -16.370 3.955 10.872 1.00 1.00 N ATOM 1344 CA TYR A 85 -16.960 4.674 9.744 1.00 1.00 C ATOM 1345 C TYR A 85 -17.119 3.747 8.542 1.00 1.00 C ATOM 1346 O TYR A 85 -18.177 3.706 7.926 1.00 1.00 O ATOM 1347 CB TYR A 85 -16.099 5.884 9.369 1.00 1.00 C ATOM 1348 CG TYR A 85 -16.424 7.132 10.165 1.00 1.00 C ATOM 1349 CD1 TYR A 85 -17.705 7.670 10.143 1.00 1.00 C ATOM 1350 CD2 TYR A 85 -15.457 7.770 10.930 1.00 1.00 C ATOM 1351 CE1 TYR A 85 -18.012 8.811 10.861 1.00 1.00 C ATOM 1352 CE2 TYR A 85 -15.757 8.911 11.651 1.00 1.00 C ATOM 1353 CZ TYR A 85 -17.035 9.427 11.614 1.00 1.00 C ATOM 1354 OH TYR A 85 -17.338 10.564 12.327 1.00 1.00 O ATOM 0 H TYR A 85 -15.477 4.328 11.195 1.00 1.00 H new ATOM 0 HA TYR A 85 -17.947 5.028 10.043 1.00 1.00 H new ATOM 0 HB2 TYR A 85 -15.049 5.632 9.518 1.00 1.00 H new ATOM 0 HB3 TYR A 85 -16.229 6.096 8.308 1.00 1.00 H new ATOM 0 HD1 TYR A 85 -18.473 7.189 9.556 1.00 1.00 H new ATOM 0 HD2 TYR A 85 -14.455 7.369 10.962 1.00 1.00 H new ATOM 0 HE1 TYR A 85 -19.012 9.218 10.832 1.00 1.00 H new ATOM 0 HE2 TYR A 85 -14.993 9.396 12.241 1.00 1.00 H new ATOM 0 HH TYR A 85 -16.540 10.873 12.805 1.00 1.00 H new ATOM 1364 N ALA A 86 -16.064 2.989 8.229 1.00 1.00 N ATOM 1365 CA ALA A 86 -16.097 2.049 7.120 1.00 1.00 C ATOM 1366 C ALA A 86 -17.122 0.946 7.370 1.00 1.00 C ATOM 1367 O ALA A 86 -17.802 0.510 6.451 1.00 1.00 O ATOM 1368 CB ALA A 86 -14.730 1.428 6.924 1.00 1.00 C ATOM 0 H ALA A 86 -15.178 3.013 8.733 1.00 1.00 H new ATOM 0 HA ALA A 86 -16.383 2.597 6.222 1.00 1.00 H new ATOM 0 HB1 ALA A 86 -14.765 0.726 6.091 1.00 1.00 H new ATOM 0 HB2 ALA A 86 -14.002 2.210 6.708 1.00 1.00 H new ATOM 0 HB3 ALA A 86 -14.437 0.900 7.831 1.00 1.00 H new ATOM 1374 N LYS A 87 -17.217 0.528 8.626 1.00 1.00 N ATOM 1375 CA LYS A 87 -18.146 -0.495 9.021 1.00 1.00 C ATOM 1376 C LYS A 87 -19.579 -0.030 8.775 1.00 1.00 C ATOM 1377 O LYS A 87 -20.449 -0.818 8.371 1.00 1.00 O ATOM 1378 CB LYS A 87 -17.962 -0.852 10.500 1.00 1.00 C ATOM 1379 CG LYS A 87 -18.821 -2.026 10.958 1.00 1.00 C ATOM 1380 CD LYS A 87 -19.530 -1.720 12.264 1.00 1.00 C ATOM 1381 CE LYS A 87 -18.544 -1.511 13.400 1.00 1.00 C ATOM 1382 NZ LYS A 87 -18.006 -2.791 13.905 1.00 1.00 N ATOM 0 H LYS A 87 -16.649 0.895 9.390 1.00 1.00 H new ATOM 0 HA LYS A 87 -17.951 -1.384 8.421 1.00 1.00 H new ATOM 0 HB2 LYS A 87 -16.913 -1.088 10.680 1.00 1.00 H new ATOM 0 HB3 LYS A 87 -18.201 0.021 11.108 1.00 1.00 H new ATOM 0 HG2 LYS A 87 -19.557 -2.261 10.189 1.00 1.00 H new ATOM 0 HG3 LYS A 87 -18.195 -2.910 11.081 1.00 1.00 H new ATOM 0 HD2 LYS A 87 -20.143 -0.827 12.145 1.00 1.00 H new ATOM 0 HD3 LYS A 87 -20.205 -2.539 12.513 1.00 1.00 H new ATOM 0 HE2 LYS A 87 -17.723 -0.882 13.057 1.00 1.00 H new ATOM 0 HE3 LYS A 87 -19.035 -0.977 14.214 1.00 1.00 H new ATOM 0 HZ1 LYS A 87 -17.337 -2.605 14.679 1.00 1.00 H new ATOM 0 HZ2 LYS A 87 -18.787 -3.381 14.256 1.00 1.00 H new ATOM 0 HZ3 LYS A 87 -17.515 -3.289 13.135 1.00 1.00 H new ATOM 1396 N GLN A 88 -19.809 1.253 9.008 1.00 1.00 N ATOM 1397 CA GLN A 88 -21.118 1.861 8.809 1.00 1.00 C ATOM 1398 C GLN A 88 -21.537 1.818 7.337 1.00 1.00 C ATOM 1399 O GLN A 88 -22.705 1.592 7.021 1.00 1.00 O ATOM 1400 CB GLN A 88 -21.107 3.311 9.288 1.00 1.00 C ATOM 1401 CG GLN A 88 -21.083 3.459 10.797 1.00 1.00 C ATOM 1402 CD GLN A 88 -22.320 2.904 11.464 1.00 1.00 C ATOM 1403 OE1 GLN A 88 -22.315 1.601 11.718 1.00 1.00 O flip ATOM 1404 NE2 GLN A 88 -23.270 3.632 11.750 1.00 1.00 N flip ATOM 0 H GLN A 88 -19.096 1.902 9.340 1.00 1.00 H new ATOM 0 HA GLN A 88 -21.838 1.287 9.392 1.00 1.00 H new ATOM 0 HB2 GLN A 88 -20.236 3.815 8.869 1.00 1.00 H new ATOM 0 HB3 GLN A 88 -21.988 3.819 8.897 1.00 1.00 H new ATOM 0 HG2 GLN A 88 -20.204 2.950 11.193 1.00 1.00 H new ATOM 0 HG3 GLN A 88 -20.982 4.514 11.052 1.00 1.00 H new ATOM 0 HE21 GLN A 88 -23.231 4.629 11.536 1.00 1.00 H new ATOM 0 HE22 GLN A 88 -24.096 3.239 12.201 1.00 1.00 H new ATOM 1413 N HIS A 89 -20.579 2.046 6.452 1.00 1.00 N ATOM 1414 CA HIS A 89 -20.852 2.037 5.011 1.00 1.00 C ATOM 1415 C HIS A 89 -20.164 0.862 4.319 1.00 1.00 C ATOM 1416 O HIS A 89 -19.015 0.971 3.879 1.00 1.00 O ATOM 1417 CB HIS A 89 -20.386 3.348 4.375 1.00 1.00 C ATOM 1418 CG HIS A 89 -21.195 4.535 4.793 1.00 1.00 C ATOM 1419 ND1 HIS A 89 -22.008 5.229 3.921 1.00 1.00 N ATOM 1420 CD2 HIS A 89 -21.330 5.143 5.994 1.00 1.00 C ATOM 1421 CE1 HIS A 89 -22.605 6.213 4.567 1.00 1.00 C ATOM 1422 NE2 HIS A 89 -22.212 6.183 5.827 1.00 1.00 N ATOM 0 H HIS A 89 -19.608 2.239 6.698 1.00 1.00 H new ATOM 0 HA HIS A 89 -21.929 1.930 4.881 1.00 1.00 H new ATOM 0 HB2 HIS A 89 -19.342 3.519 4.638 1.00 1.00 H new ATOM 0 HB3 HIS A 89 -20.430 3.252 3.290 1.00 1.00 H new ATOM 0 HD2 HIS A 89 -20.836 4.863 6.913 1.00 1.00 H new ATOM 0 HE1 HIS A 89 -23.297 6.922 4.138 1.00 1.00 H new ATOM 0 HE2 HIS A 89 -22.514 6.827 6.558 1.00 1.00 H new ATOM 1431 N PRO A 90 -20.863 -0.296 4.206 1.00 1.00 N ATOM 1432 CA PRO A 90 -20.307 -1.493 3.542 1.00 1.00 C ATOM 1433 C PRO A 90 -19.926 -1.238 2.088 1.00 1.00 C ATOM 1434 O PRO A 90 -18.985 -1.847 1.569 1.00 1.00 O ATOM 1435 CB PRO A 90 -21.441 -2.517 3.610 1.00 1.00 C ATOM 1436 CG PRO A 90 -22.377 -2.020 4.663 1.00 1.00 C ATOM 1437 CD PRO A 90 -22.242 -0.524 4.680 1.00 1.00 C ATOM 0 HA PRO A 90 -19.388 -1.819 4.029 1.00 1.00 H new ATOM 0 HB2 PRO A 90 -21.946 -2.605 2.648 1.00 1.00 H new ATOM 0 HB3 PRO A 90 -21.059 -3.507 3.862 1.00 1.00 H new ATOM 0 HG2 PRO A 90 -23.403 -2.315 4.441 1.00 1.00 H new ATOM 0 HG3 PRO A 90 -22.127 -2.443 5.636 1.00 1.00 H new ATOM 0 HD2 PRO A 90 -22.974 -0.048 4.028 1.00 1.00 H new ATOM 0 HD3 PRO A 90 -22.395 -0.119 5.680 1.00 1.00 H new ATOM 1445 N ASP A 91 -20.655 -0.349 1.438 1.00 1.00 N ATOM 1446 CA ASP A 91 -20.383 -0.032 0.046 1.00 1.00 C ATOM 1447 C ASP A 91 -19.012 0.626 -0.100 1.00 1.00 C ATOM 1448 O ASP A 91 -18.306 0.407 -1.081 1.00 1.00 O ATOM 1449 CB ASP A 91 -21.470 0.893 -0.505 1.00 1.00 C ATOM 1450 CG ASP A 91 -22.068 0.395 -1.797 1.00 1.00 C ATOM 1451 OD1 ASP A 91 -22.925 -0.512 -1.744 1.00 1.00 O ATOM 1452 OD2 ASP A 91 -21.677 0.907 -2.866 1.00 1.00 O ATOM 0 H ASP A 91 -21.436 0.164 1.848 1.00 1.00 H new ATOM 0 HA ASP A 91 -20.383 -0.961 -0.525 1.00 1.00 H new ATOM 0 HB2 ASP A 91 -22.261 0.999 0.238 1.00 1.00 H new ATOM 0 HB3 ASP A 91 -21.048 1.885 -0.665 1.00 1.00 H new ATOM 1457 N GLN A 92 -18.643 1.421 0.895 1.00 1.00 N ATOM 1458 CA GLN A 92 -17.363 2.108 0.898 1.00 1.00 C ATOM 1459 C GLN A 92 -16.238 1.158 1.286 1.00 1.00 C ATOM 1460 O GLN A 92 -16.365 0.387 2.238 1.00 1.00 O ATOM 1461 CB GLN A 92 -17.394 3.290 1.865 1.00 1.00 C ATOM 1462 CG GLN A 92 -18.235 4.454 1.393 1.00 1.00 C ATOM 1463 CD GLN A 92 -17.871 5.752 2.092 1.00 1.00 C ATOM 1464 OE1 GLN A 92 -17.244 5.743 3.150 1.00 1.00 O ATOM 1465 NE2 GLN A 92 -18.271 6.872 1.507 1.00 1.00 N ATOM 0 H GLN A 92 -19.219 1.606 1.716 1.00 1.00 H new ATOM 0 HA GLN A 92 -17.178 2.476 -0.111 1.00 1.00 H new ATOM 0 HB2 GLN A 92 -17.775 2.948 2.827 1.00 1.00 H new ATOM 0 HB3 GLN A 92 -16.374 3.637 2.030 1.00 1.00 H new ATOM 0 HG2 GLN A 92 -18.110 4.576 0.317 1.00 1.00 H new ATOM 0 HG3 GLN A 92 -19.288 4.233 1.568 1.00 1.00 H new ATOM 0 HE21 GLN A 92 -18.789 6.832 0.629 1.00 1.00 H new ATOM 0 HE22 GLN A 92 -18.061 7.774 1.935 1.00 1.00 H new ATOM 1474 N GLU A 93 -15.125 1.217 0.545 1.00 1.00 N ATOM 1475 CA GLU A 93 -13.974 0.360 0.815 1.00 1.00 C ATOM 1476 C GLU A 93 -12.803 1.198 1.318 1.00 1.00 C ATOM 1477 O GLU A 93 -12.498 2.252 0.775 1.00 1.00 O ATOM 1478 CB GLU A 93 -13.566 -0.412 -0.445 1.00 1.00 C ATOM 1479 CG GLU A 93 -12.323 -1.258 -0.254 1.00 1.00 C ATOM 1480 CD GLU A 93 -11.124 -0.717 -1.007 1.00 1.00 C ATOM 1481 OE1 GLU A 93 -10.974 0.521 -1.071 1.00 1.00 O ATOM 1482 OE2 GLU A 93 -10.335 -1.530 -1.532 1.00 1.00 O ATOM 0 H GLU A 93 -15.001 1.850 -0.245 1.00 1.00 H new ATOM 0 HA GLU A 93 -14.253 -0.359 1.585 1.00 1.00 H new ATOM 0 HB2 GLU A 93 -14.391 -1.055 -0.752 1.00 1.00 H new ATOM 0 HB3 GLU A 93 -13.394 0.295 -1.256 1.00 1.00 H new ATOM 0 HG2 GLU A 93 -12.085 -1.312 0.808 1.00 1.00 H new ATOM 0 HG3 GLU A 93 -12.527 -2.276 -0.587 1.00 1.00 H new ATOM 1489 N LEU A 94 -12.157 0.722 2.381 1.00 1.00 N ATOM 1490 CA LEU A 94 -11.029 1.439 2.964 1.00 1.00 C ATOM 1491 C LEU A 94 -9.705 0.745 2.685 1.00 1.00 C ATOM 1492 O LEU A 94 -9.533 -0.434 2.985 1.00 1.00 O ATOM 1493 CB LEU A 94 -11.212 1.585 4.478 1.00 1.00 C ATOM 1494 CG LEU A 94 -11.230 3.019 5.001 1.00 1.00 C ATOM 1495 CD1 LEU A 94 -12.422 3.776 4.448 1.00 1.00 C ATOM 1496 CD2 LEU A 94 -11.249 3.039 6.530 1.00 1.00 C ATOM 0 H LEU A 94 -12.395 -0.151 2.852 1.00 1.00 H new ATOM 0 HA LEU A 94 -11.003 2.423 2.497 1.00 1.00 H new ATOM 0 HB2 LEU A 94 -12.146 1.101 4.762 1.00 1.00 H new ATOM 0 HB3 LEU A 94 -10.408 1.044 4.978 1.00 1.00 H new ATOM 0 HG LEU A 94 -10.319 3.513 4.662 1.00 1.00 H new ATOM 0 HD11 LEU A 94 -12.416 4.796 4.833 1.00 1.00 H new ATOM 0 HD12 LEU A 94 -12.366 3.799 3.360 1.00 1.00 H new ATOM 0 HD13 LEU A 94 -13.343 3.278 4.753 1.00 1.00 H new ATOM 0 HD21 LEU A 94 -11.262 4.071 6.880 1.00 1.00 H new ATOM 0 HD22 LEU A 94 -12.139 2.523 6.890 1.00 1.00 H new ATOM 0 HD23 LEU A 94 -10.360 2.537 6.912 1.00 1.00 H new ATOM 1508 N VAL A 95 -8.766 1.522 2.136 1.00 1.00 N ATOM 1509 CA VAL A 95 -7.429 1.031 1.830 1.00 1.00 C ATOM 1510 C VAL A 95 -6.394 1.873 2.580 1.00 1.00 C ATOM 1511 O VAL A 95 -6.463 3.108 2.558 1.00 1.00 O ATOM 1512 CB VAL A 95 -7.122 1.071 0.323 1.00 1.00 C ATOM 1513 CG1 VAL A 95 -7.605 2.380 -0.276 1.00 1.00 C ATOM 1514 CG2 VAL A 95 -5.640 0.864 0.060 1.00 1.00 C ATOM 0 H VAL A 95 -8.915 2.502 1.895 1.00 1.00 H new ATOM 0 HA VAL A 95 -7.381 -0.010 2.149 1.00 1.00 H new ATOM 0 HB VAL A 95 -7.657 0.253 -0.159 1.00 1.00 H new ATOM 0 HG11 VAL A 95 -7.382 2.396 -1.343 1.00 1.00 H new ATOM 0 HG12 VAL A 95 -8.681 2.472 -0.129 1.00 1.00 H new ATOM 0 HG13 VAL A 95 -7.099 3.212 0.213 1.00 1.00 H new ATOM 0 HG21 VAL A 95 -5.453 0.897 -1.013 1.00 1.00 H new ATOM 0 HG22 VAL A 95 -5.070 1.652 0.552 1.00 1.00 H new ATOM 0 HG23 VAL A 95 -5.333 -0.106 0.452 1.00 1.00 H new ATOM 1524 N ILE A 96 -5.461 1.226 3.270 1.00 1.00 N ATOM 1525 CA ILE A 96 -4.457 1.975 4.035 1.00 1.00 C ATOM 1526 C ILE A 96 -3.055 1.892 3.417 1.00 1.00 C ATOM 1527 O ILE A 96 -2.517 0.808 3.149 1.00 1.00 O ATOM 1528 CB ILE A 96 -4.388 1.499 5.501 1.00 1.00 C ATOM 1529 CG1 ILE A 96 -4.104 2.694 6.404 1.00 1.00 C ATOM 1530 CG2 ILE A 96 -3.334 0.421 5.706 1.00 1.00 C ATOM 1531 CD1 ILE A 96 -4.092 2.334 7.862 1.00 1.00 C ATOM 0 H ILE A 96 -5.374 0.211 3.319 1.00 1.00 H new ATOM 0 HA ILE A 96 -4.784 3.014 4.004 1.00 1.00 H new ATOM 0 HB ILE A 96 -5.350 1.056 5.758 1.00 1.00 H new ATOM 0 HG12 ILE A 96 -3.141 3.127 6.134 1.00 1.00 H new ATOM 0 HG13 ILE A 96 -4.858 3.462 6.231 1.00 1.00 H new ATOM 0 HG21 ILE A 96 -3.323 0.118 6.753 1.00 1.00 H new ATOM 0 HG22 ILE A 96 -3.569 -0.441 5.081 1.00 1.00 H new ATOM 0 HG23 ILE A 96 -2.355 0.813 5.431 1.00 1.00 H new ATOM 0 HD11 ILE A 96 -3.885 3.225 8.455 1.00 1.00 H new ATOM 0 HD12 ILE A 96 -5.063 1.928 8.144 1.00 1.00 H new ATOM 0 HD13 ILE A 96 -3.319 1.588 8.046 1.00 1.00 H new ATOM 1543 N ALA A 97 -2.459 3.060 3.199 1.00 1.00 N ATOM 1544 CA ALA A 97 -1.117 3.160 2.639 1.00 1.00 C ATOM 1545 C ALA A 97 -0.118 3.510 3.723 1.00 1.00 C ATOM 1546 O ALA A 97 0.426 4.615 3.746 1.00 1.00 O ATOM 1547 CB ALA A 97 -1.085 4.194 1.517 1.00 1.00 C ATOM 0 H ALA A 97 -2.891 3.961 3.405 1.00 1.00 H new ATOM 0 HA ALA A 97 -0.840 2.193 2.219 1.00 1.00 H new ATOM 0 HB1 ALA A 97 -0.076 4.257 1.109 1.00 1.00 H new ATOM 0 HB2 ALA A 97 -1.777 3.897 0.729 1.00 1.00 H new ATOM 0 HB3 ALA A 97 -1.379 5.167 1.911 1.00 1.00 H new ATOM 1553 N GLY A 98 0.114 2.558 4.633 1.00 1.00 N ATOM 1554 CA GLY A 98 1.054 2.786 5.734 1.00 1.00 C ATOM 1555 C GLY A 98 0.446 3.573 6.878 1.00 1.00 C ATOM 1556 O GLY A 98 -0.728 3.940 6.829 1.00 1.00 O ATOM 0 H GLY A 98 -0.327 1.638 4.630 1.00 1.00 H new ATOM 0 HA2 GLY A 98 1.407 1.825 6.108 1.00 1.00 H new ATOM 0 HA3 GLY A 98 1.926 3.320 5.356 1.00 1.00 H new ATOM 1560 N GLY A 99 1.233 3.834 7.918 1.00 1.00 N ATOM 1561 CA GLY A 99 2.619 3.388 7.965 1.00 1.00 C ATOM 1562 C GLY A 99 2.755 1.951 8.430 1.00 1.00 C ATOM 1563 O GLY A 99 1.765 1.287 8.701 1.00 1.00 O ATOM 0 H GLY A 99 0.931 4.354 8.742 1.00 1.00 H new ATOM 0 HA2 GLY A 99 3.063 3.489 6.975 1.00 1.00 H new ATOM 0 HA3 GLY A 99 3.183 4.037 8.635 1.00 1.00 H new ATOM 1567 N ALA A 100 3.997 1.476 8.504 1.00 1.00 N ATOM 1568 CA ALA A 100 4.289 0.108 8.917 1.00 1.00 C ATOM 1569 C ALA A 100 3.860 -0.157 10.365 1.00 1.00 C ATOM 1570 O ALA A 100 3.357 -1.237 10.675 1.00 1.00 O ATOM 1571 CB ALA A 100 5.768 -0.191 8.732 1.00 1.00 C ATOM 0 H ALA A 100 4.825 2.028 8.280 1.00 1.00 H new ATOM 0 HA ALA A 100 3.709 -0.561 8.282 1.00 1.00 H new ATOM 0 HB1 ALA A 100 5.974 -1.215 9.044 1.00 1.00 H new ATOM 0 HB2 ALA A 100 6.035 -0.071 7.682 1.00 1.00 H new ATOM 0 HB3 ALA A 100 6.357 0.498 9.337 1.00 1.00 H new ATOM 1577 N GLN A 101 4.033 0.828 11.237 1.00 1.00 N ATOM 1578 CA GLN A 101 3.642 0.673 12.644 1.00 1.00 C ATOM 1579 C GLN A 101 2.139 0.483 12.715 1.00 1.00 C ATOM 1580 O GLN A 101 1.622 -0.330 13.484 1.00 1.00 O ATOM 1581 CB GLN A 101 4.064 1.897 13.450 1.00 1.00 C ATOM 1582 CG GLN A 101 5.333 1.680 14.258 1.00 1.00 C ATOM 1583 CD GLN A 101 5.120 1.882 15.751 1.00 1.00 C ATOM 1584 OE1 GLN A 101 5.466 1.028 16.567 1.00 1.00 O ATOM 1585 NE2 GLN A 101 4.562 3.032 16.112 1.00 1.00 N ATOM 0 H GLN A 101 4.436 1.736 11.005 1.00 1.00 H new ATOM 0 HA GLN A 101 4.140 -0.198 13.070 1.00 1.00 H new ATOM 0 HB2 GLN A 101 4.214 2.736 12.771 1.00 1.00 H new ATOM 0 HB3 GLN A 101 3.255 2.174 14.126 1.00 1.00 H new ATOM 0 HG2 GLN A 101 5.703 0.670 14.081 1.00 1.00 H new ATOM 0 HG3 GLN A 101 6.103 2.368 13.909 1.00 1.00 H new ATOM 0 HE21 GLN A 101 4.290 3.712 15.402 1.00 1.00 H new ATOM 0 HE22 GLN A 101 4.405 3.235 17.099 1.00 1.00 H new ATOM 1594 N ILE A 102 1.433 1.238 11.872 1.00 1.00 N ATOM 1595 CA ILE A 102 -0.011 1.158 11.777 1.00 1.00 C ATOM 1596 C ILE A 102 -0.415 -0.210 11.251 1.00 1.00 C ATOM 1597 O ILE A 102 -1.381 -0.815 11.718 1.00 1.00 O ATOM 1598 CB ILE A 102 -0.561 2.257 10.835 1.00 1.00 C ATOM 1599 CG1 ILE A 102 -1.097 3.433 11.639 1.00 1.00 C ATOM 1600 CG2 ILE A 102 -1.650 1.696 9.933 1.00 1.00 C ATOM 1601 CD1 ILE A 102 -0.252 4.676 11.513 1.00 1.00 C ATOM 0 H ILE A 102 1.853 1.919 11.240 1.00 1.00 H new ATOM 0 HA ILE A 102 -0.431 1.309 12.771 1.00 1.00 H new ATOM 0 HB ILE A 102 0.259 2.609 10.209 1.00 1.00 H new ATOM 0 HG12 ILE A 102 -2.112 3.657 11.310 1.00 1.00 H new ATOM 0 HG13 ILE A 102 -1.158 3.148 12.689 1.00 1.00 H new ATOM 0 HG21 ILE A 102 -2.023 2.484 9.279 1.00 1.00 H new ATOM 0 HG22 ILE A 102 -1.241 0.887 9.329 1.00 1.00 H new ATOM 0 HG23 ILE A 102 -2.468 1.314 10.544 1.00 1.00 H new ATOM 0 HD11 ILE A 102 -0.690 5.476 12.110 1.00 1.00 H new ATOM 0 HD12 ILE A 102 0.757 4.468 11.869 1.00 1.00 H new ATOM 0 HD13 ILE A 102 -0.212 4.984 10.468 1.00 1.00 H new ATOM 1613 N PHE A 103 0.334 -0.676 10.245 1.00 1.00 N ATOM 1614 CA PHE A 103 0.076 -1.951 9.595 1.00 1.00 C ATOM 1615 C PHE A 103 0.168 -3.126 10.562 1.00 1.00 C ATOM 1616 O PHE A 103 -0.686 -4.009 10.547 1.00 1.00 O ATOM 1617 CB PHE A 103 1.078 -2.153 8.467 1.00 1.00 C ATOM 1618 CG PHE A 103 0.528 -2.901 7.300 1.00 1.00 C ATOM 1619 CD1 PHE A 103 -0.055 -4.146 7.460 1.00 1.00 C ATOM 1620 CD2 PHE A 103 0.592 -2.351 6.031 1.00 1.00 C ATOM 1621 CE1 PHE A 103 -0.565 -4.832 6.375 1.00 1.00 C ATOM 1622 CE2 PHE A 103 0.083 -3.032 4.940 1.00 1.00 C ATOM 1623 CZ PHE A 103 -0.495 -4.274 5.113 1.00 1.00 C ATOM 0 H PHE A 103 1.135 -0.173 9.864 1.00 1.00 H new ATOM 0 HA PHE A 103 -0.943 -1.921 9.208 1.00 1.00 H new ATOM 0 HB2 PHE A 103 1.431 -1.179 8.129 1.00 1.00 H new ATOM 0 HB3 PHE A 103 1.944 -2.689 8.855 1.00 1.00 H new ATOM 0 HD1 PHE A 103 -0.112 -4.586 8.445 1.00 1.00 H new ATOM 0 HD2 PHE A 103 1.044 -1.380 5.892 1.00 1.00 H new ATOM 0 HE1 PHE A 103 -1.018 -5.803 6.513 1.00 1.00 H new ATOM 0 HE2 PHE A 103 0.138 -2.593 3.955 1.00 1.00 H new ATOM 0 HZ PHE A 103 -0.892 -4.809 4.263 1.00 1.00 H new ATOM 1633 N THR A 104 1.207 -3.160 11.381 1.00 1.00 N ATOM 1634 CA THR A 104 1.374 -4.258 12.312 1.00 1.00 C ATOM 1635 C THR A 104 0.201 -4.322 13.290 1.00 1.00 C ATOM 1636 O THR A 104 -0.320 -5.400 13.552 1.00 1.00 O ATOM 1637 CB THR A 104 2.687 -4.129 13.083 1.00 1.00 C ATOM 1638 OG1 THR A 104 2.749 -5.101 14.101 1.00 1.00 O ATOM 1639 CG2 THR A 104 2.894 -2.767 13.740 1.00 1.00 C ATOM 0 H THR A 104 1.937 -2.449 11.419 1.00 1.00 H new ATOM 0 HA THR A 104 1.401 -5.181 11.733 1.00 1.00 H new ATOM 0 HB THR A 104 3.469 -4.265 12.336 1.00 1.00 H new ATOM 0 HG1 THR A 104 3.595 -5.011 14.588 1.00 1.00 H new ATOM 0 HG21 THR A 104 3.848 -2.758 14.266 1.00 1.00 H new ATOM 0 HG22 THR A 104 2.894 -1.990 12.975 1.00 1.00 H new ATOM 0 HG23 THR A 104 2.087 -2.578 14.448 1.00 1.00 H new ATOM 1647 N ALA A 105 -0.197 -3.177 13.837 1.00 1.00 N ATOM 1648 CA ALA A 105 -1.294 -3.124 14.800 1.00 1.00 C ATOM 1649 C ALA A 105 -2.635 -3.539 14.180 1.00 1.00 C ATOM 1650 O ALA A 105 -3.466 -4.146 14.845 1.00 1.00 O ATOM 1651 CB ALA A 105 -1.416 -1.726 15.392 1.00 1.00 C ATOM 0 H ALA A 105 0.224 -2.271 13.630 1.00 1.00 H new ATOM 0 HA ALA A 105 -1.057 -3.838 15.588 1.00 1.00 H new ATOM 0 HB1 ALA A 105 -2.238 -1.704 16.107 1.00 1.00 H new ATOM 0 HB2 ALA A 105 -0.487 -1.463 15.898 1.00 1.00 H new ATOM 0 HB3 ALA A 105 -1.610 -1.009 14.594 1.00 1.00 H new ATOM 1657 N PHE A 106 -2.864 -3.151 12.918 1.00 1.00 N ATOM 1658 CA PHE A 106 -4.141 -3.439 12.252 1.00 1.00 C ATOM 1659 C PHE A 106 -4.037 -4.555 11.195 1.00 1.00 C ATOM 1660 O PHE A 106 -4.999 -4.803 10.467 1.00 1.00 O ATOM 1661 CB PHE A 106 -4.691 -2.169 11.606 1.00 1.00 C ATOM 1662 CG PHE A 106 -4.833 -1.032 12.569 1.00 1.00 C ATOM 1663 CD1 PHE A 106 -5.297 -1.262 13.855 1.00 1.00 C ATOM 1664 CD2 PHE A 106 -4.507 0.261 12.199 1.00 1.00 C ATOM 1665 CE1 PHE A 106 -5.428 -0.220 14.754 1.00 1.00 C ATOM 1666 CE2 PHE A 106 -4.637 1.306 13.094 1.00 1.00 C ATOM 1667 CZ PHE A 106 -5.099 1.066 14.373 1.00 1.00 C ATOM 0 H PHE A 106 -2.191 -2.643 12.344 1.00 1.00 H new ATOM 0 HA PHE A 106 -4.821 -3.797 13.025 1.00 1.00 H new ATOM 0 HB2 PHE A 106 -4.031 -1.868 10.793 1.00 1.00 H new ATOM 0 HB3 PHE A 106 -5.663 -2.386 11.164 1.00 1.00 H new ATOM 0 HD1 PHE A 106 -5.559 -2.265 14.158 1.00 1.00 H new ATOM 0 HD2 PHE A 106 -4.147 0.456 11.200 1.00 1.00 H new ATOM 0 HE1 PHE A 106 -5.788 -0.412 15.754 1.00 1.00 H new ATOM 0 HE2 PHE A 106 -4.377 2.310 12.793 1.00 1.00 H new ATOM 0 HZ PHE A 106 -5.203 1.882 15.073 1.00 1.00 H new ATOM 1677 N LYS A 107 -2.894 -5.228 11.113 1.00 1.00 N ATOM 1678 CA LYS A 107 -2.718 -6.301 10.137 1.00 1.00 C ATOM 1679 C LYS A 107 -3.707 -7.430 10.403 1.00 1.00 C ATOM 1680 O LYS A 107 -4.315 -7.970 9.474 1.00 1.00 O ATOM 1681 CB LYS A 107 -1.296 -6.841 10.209 1.00 1.00 C ATOM 1682 CG LYS A 107 -1.227 -8.334 10.466 1.00 1.00 C ATOM 1683 CD LYS A 107 0.206 -8.825 10.517 1.00 1.00 C ATOM 1684 CE LYS A 107 0.969 -8.187 11.668 1.00 1.00 C ATOM 1685 NZ LYS A 107 2.349 -8.728 11.789 1.00 1.00 N ATOM 0 H LYS A 107 -2.081 -5.053 11.704 1.00 1.00 H new ATOM 0 HA LYS A 107 -2.902 -5.897 9.141 1.00 1.00 H new ATOM 0 HB2 LYS A 107 -0.783 -6.618 9.273 1.00 1.00 H new ATOM 0 HB3 LYS A 107 -0.757 -6.319 11.000 1.00 1.00 H new ATOM 0 HG2 LYS A 107 -1.725 -8.565 11.407 1.00 1.00 H new ATOM 0 HG3 LYS A 107 -1.766 -8.864 9.681 1.00 1.00 H new ATOM 0 HD2 LYS A 107 0.217 -9.909 10.627 1.00 1.00 H new ATOM 0 HD3 LYS A 107 0.705 -8.595 9.576 1.00 1.00 H new ATOM 0 HE2 LYS A 107 1.014 -7.108 11.519 1.00 1.00 H new ATOM 0 HE3 LYS A 107 0.430 -8.358 12.600 1.00 1.00 H new ATOM 0 HZ1 LYS A 107 2.834 -8.267 12.585 1.00 1.00 H new ATOM 0 HZ2 LYS A 107 2.306 -9.754 11.957 1.00 1.00 H new ATOM 0 HZ3 LYS A 107 2.873 -8.542 10.910 1.00 1.00 H new ATOM 1699 N ASP A 108 -3.863 -7.770 11.677 1.00 1.00 N ATOM 1700 CA ASP A 108 -4.772 -8.823 12.095 1.00 1.00 C ATOM 1701 C ASP A 108 -6.222 -8.457 11.791 1.00 1.00 C ATOM 1702 O ASP A 108 -7.044 -9.325 11.501 1.00 1.00 O ATOM 1703 CB ASP A 108 -4.609 -9.078 13.588 1.00 1.00 C ATOM 1704 CG ASP A 108 -3.329 -9.822 13.902 1.00 1.00 C ATOM 1705 OD1 ASP A 108 -2.741 -10.417 12.973 1.00 1.00 O ATOM 1706 OD2 ASP A 108 -2.914 -9.814 15.080 1.00 1.00 O ATOM 0 H ASP A 108 -3.363 -7.323 12.445 1.00 1.00 H new ATOM 0 HA ASP A 108 -4.526 -9.726 11.537 1.00 1.00 H new ATOM 0 HB2 ASP A 108 -4.615 -8.127 14.121 1.00 1.00 H new ATOM 0 HB3 ASP A 108 -5.461 -9.653 13.952 1.00 1.00 H new ATOM 1711 N ASP A 109 -6.521 -7.167 11.896 1.00 1.00 N ATOM 1712 CA ASP A 109 -7.880 -6.650 11.684 1.00 1.00 C ATOM 1713 C ASP A 109 -8.261 -6.507 10.204 1.00 1.00 C ATOM 1714 O ASP A 109 -9.388 -6.128 9.896 1.00 1.00 O ATOM 1715 CB ASP A 109 -8.044 -5.293 12.392 1.00 1.00 C ATOM 1716 CG ASP A 109 -7.943 -5.403 13.895 1.00 1.00 C ATOM 1717 OD1 ASP A 109 -6.808 -5.398 14.415 1.00 1.00 O ATOM 1718 OD2 ASP A 109 -8.999 -5.495 14.557 1.00 1.00 O ATOM 0 H ASP A 109 -5.836 -6.448 12.129 1.00 1.00 H new ATOM 0 HA ASP A 109 -8.557 -7.390 12.111 1.00 1.00 H new ATOM 0 HB2 ASP A 109 -7.280 -4.605 12.030 1.00 1.00 H new ATOM 0 HB3 ASP A 109 -9.011 -4.864 12.127 1.00 1.00 H new ATOM 1723 N VAL A 110 -7.344 -6.784 9.287 1.00 1.00 N ATOM 1724 CA VAL A 110 -7.658 -6.656 7.867 1.00 1.00 C ATOM 1725 C VAL A 110 -7.662 -8.011 7.178 1.00 1.00 C ATOM 1726 O VAL A 110 -6.709 -8.776 7.272 1.00 1.00 O ATOM 1727 CB VAL A 110 -6.650 -5.729 7.156 1.00 1.00 C ATOM 1728 CG1 VAL A 110 -6.824 -5.808 5.641 1.00 1.00 C ATOM 1729 CG2 VAL A 110 -6.815 -4.302 7.661 1.00 1.00 C ATOM 0 H VAL A 110 -6.394 -7.093 9.493 1.00 1.00 H new ATOM 0 HA VAL A 110 -8.655 -6.220 7.800 1.00 1.00 H new ATOM 0 HB VAL A 110 -5.637 -6.058 7.387 1.00 1.00 H new ATOM 0 HG11 VAL A 110 -6.104 -5.147 5.157 1.00 1.00 H new ATOM 0 HG12 VAL A 110 -6.657 -6.832 5.308 1.00 1.00 H new ATOM 0 HG13 VAL A 110 -7.835 -5.501 5.374 1.00 1.00 H new ATOM 0 HG21 VAL A 110 -6.101 -3.652 7.155 1.00 1.00 H new ATOM 0 HG22 VAL A 110 -7.828 -3.958 7.454 1.00 1.00 H new ATOM 0 HG23 VAL A 110 -6.634 -4.273 8.736 1.00 1.00 H new ATOM 1739 N ASP A 111 -8.767 -8.293 6.507 1.00 1.00 N ATOM 1740 CA ASP A 111 -8.959 -9.556 5.802 1.00 1.00 C ATOM 1741 C ASP A 111 -8.014 -9.737 4.618 1.00 1.00 C ATOM 1742 O ASP A 111 -7.599 -10.856 4.328 1.00 1.00 O ATOM 1743 CB ASP A 111 -10.411 -9.660 5.317 1.00 1.00 C ATOM 1744 CG ASP A 111 -11.254 -10.522 6.235 1.00 1.00 C ATOM 1745 OD1 ASP A 111 -10.719 -11.503 6.793 1.00 1.00 O ATOM 1746 OD2 ASP A 111 -12.452 -10.209 6.400 1.00 1.00 O ATOM 0 H ASP A 111 -9.559 -7.654 6.434 1.00 1.00 H new ATOM 0 HA ASP A 111 -8.731 -10.350 6.514 1.00 1.00 H new ATOM 0 HB2 ASP A 111 -10.846 -8.662 5.256 1.00 1.00 H new ATOM 0 HB3 ASP A 111 -10.428 -10.077 4.310 1.00 1.00 H new ATOM 1751 N THR A 112 -7.702 -8.653 3.915 1.00 1.00 N ATOM 1752 CA THR A 112 -6.846 -8.763 2.742 1.00 1.00 C ATOM 1753 C THR A 112 -5.567 -7.928 2.847 1.00 1.00 C ATOM 1754 O THR A 112 -5.598 -6.727 3.124 1.00 1.00 O ATOM 1755 CB THR A 112 -7.628 -8.351 1.503 1.00 1.00 C ATOM 1756 OG1 THR A 112 -8.458 -9.417 1.072 1.00 1.00 O ATOM 1757 CG2 THR A 112 -6.744 -7.964 0.337 1.00 1.00 C ATOM 0 H THR A 112 -8.021 -7.709 4.131 1.00 1.00 H new ATOM 0 HA THR A 112 -6.535 -9.805 2.672 1.00 1.00 H new ATOM 0 HB THR A 112 -8.211 -7.479 1.799 1.00 1.00 H new ATOM 0 HG1 THR A 112 -8.958 -9.141 0.276 1.00 1.00 H new ATOM 0 HG21 THR A 112 -7.366 -7.681 -0.513 1.00 1.00 H new ATOM 0 HG22 THR A 112 -6.114 -7.121 0.622 1.00 1.00 H new ATOM 0 HG23 THR A 112 -6.115 -8.810 0.061 1.00 1.00 H new ATOM 1765 N LEU A 113 -4.434 -8.600 2.595 1.00 1.00 N ATOM 1766 CA LEU A 113 -3.128 -7.954 2.625 1.00 1.00 C ATOM 1767 C LEU A 113 -2.507 -7.934 1.232 1.00 1.00 C ATOM 1768 O LEU A 113 -2.406 -8.968 0.580 1.00 1.00 O ATOM 1769 CB LEU A 113 -2.199 -8.667 3.600 1.00 1.00 C ATOM 1770 CG LEU A 113 -2.357 -8.257 5.057 1.00 1.00 C ATOM 1771 CD1 LEU A 113 -3.492 -9.034 5.696 1.00 1.00 C ATOM 1772 CD2 LEU A 113 -1.054 -8.470 5.817 1.00 1.00 C ATOM 0 H LEU A 113 -4.404 -9.594 2.368 1.00 1.00 H new ATOM 0 HA LEU A 113 -3.266 -6.926 2.961 1.00 1.00 H new ATOM 0 HB2 LEU A 113 -2.368 -9.741 3.520 1.00 1.00 H new ATOM 0 HB3 LEU A 113 -1.168 -8.483 3.296 1.00 1.00 H new ATOM 0 HG LEU A 113 -2.600 -7.195 5.100 1.00 1.00 H new ATOM 0 HD11 LEU A 113 -3.597 -8.733 6.738 1.00 1.00 H new ATOM 0 HD12 LEU A 113 -4.420 -8.827 5.163 1.00 1.00 H new ATOM 0 HD13 LEU A 113 -3.276 -10.101 5.646 1.00 1.00 H new ATOM 0 HD21 LEU A 113 -1.186 -8.171 6.857 1.00 1.00 H new ATOM 0 HD22 LEU A 113 -0.776 -9.523 5.774 1.00 1.00 H new ATOM 0 HD23 LEU A 113 -0.266 -7.868 5.364 1.00 1.00 H new ATOM 1784 N LEU A 114 -2.073 -6.759 0.790 1.00 1.00 N ATOM 1785 CA LEU A 114 -1.445 -6.636 -0.522 1.00 1.00 C ATOM 1786 C LEU A 114 0.065 -6.441 -0.364 1.00 1.00 C ATOM 1787 O LEU A 114 0.529 -5.552 0.364 1.00 1.00 O ATOM 1788 CB LEU A 114 -2.061 -5.454 -1.277 1.00 1.00 C ATOM 1789 CG LEU A 114 -2.952 -5.829 -2.464 1.00 1.00 C ATOM 1790 CD1 LEU A 114 -4.299 -6.335 -1.978 1.00 1.00 C ATOM 1791 CD2 LEU A 114 -3.126 -4.644 -3.390 1.00 1.00 C ATOM 0 H LEU A 114 -2.143 -5.886 1.313 1.00 1.00 H new ATOM 0 HA LEU A 114 -1.618 -7.549 -1.092 1.00 1.00 H new ATOM 0 HB2 LEU A 114 -2.649 -4.862 -0.575 1.00 1.00 H new ATOM 0 HB3 LEU A 114 -1.255 -4.814 -1.637 1.00 1.00 H new ATOM 0 HG LEU A 114 -2.468 -6.630 -3.022 1.00 1.00 H new ATOM 0 HD11 LEU A 114 -4.920 -6.597 -2.835 1.00 1.00 H new ATOM 0 HD12 LEU A 114 -4.153 -7.216 -1.353 1.00 1.00 H new ATOM 0 HD13 LEU A 114 -4.792 -5.556 -1.397 1.00 1.00 H new ATOM 0 HD21 LEU A 114 -3.762 -4.928 -4.228 1.00 1.00 H new ATOM 0 HD22 LEU A 114 -3.589 -3.821 -2.845 1.00 1.00 H new ATOM 0 HD23 LEU A 114 -2.152 -4.328 -3.764 1.00 1.00 H new ATOM 1803 N VAL A 115 0.841 -7.297 -1.027 1.00 1.00 N ATOM 1804 CA VAL A 115 2.282 -7.226 -0.923 1.00 1.00 C ATOM 1805 C VAL A 115 2.958 -7.027 -2.275 1.00 1.00 C ATOM 1806 O VAL A 115 2.672 -7.743 -3.239 1.00 1.00 O ATOM 1807 CB VAL A 115 2.854 -8.489 -0.262 1.00 1.00 C ATOM 1808 CG1 VAL A 115 4.303 -8.260 0.151 1.00 1.00 C ATOM 1809 CG2 VAL A 115 2.011 -8.895 0.933 1.00 1.00 C ATOM 0 H VAL A 115 0.492 -8.038 -1.634 1.00 1.00 H new ATOM 0 HA VAL A 115 2.494 -6.356 -0.302 1.00 1.00 H new ATOM 0 HB VAL A 115 2.828 -9.303 -0.987 1.00 1.00 H new ATOM 0 HG11 VAL A 115 4.695 -9.163 0.618 1.00 1.00 H new ATOM 0 HG12 VAL A 115 4.899 -8.019 -0.729 1.00 1.00 H new ATOM 0 HG13 VAL A 115 4.353 -7.434 0.860 1.00 1.00 H new ATOM 0 HG21 VAL A 115 2.432 -9.792 1.388 1.00 1.00 H new ATOM 0 HG22 VAL A 115 2.003 -8.087 1.664 1.00 1.00 H new ATOM 0 HG23 VAL A 115 0.991 -9.099 0.606 1.00 1.00 H new ATOM 1819 N THR A 116 3.865 -6.058 -2.344 1.00 1.00 N ATOM 1820 CA THR A 116 4.597 -5.779 -3.569 1.00 1.00 C ATOM 1821 C THR A 116 6.078 -6.030 -3.354 1.00 1.00 C ATOM 1822 O THR A 116 6.664 -5.555 -2.388 1.00 1.00 O ATOM 1823 CB THR A 116 4.378 -4.337 -4.008 1.00 1.00 C ATOM 1824 OG1 THR A 116 3.377 -4.265 -5.006 1.00 1.00 O ATOM 1825 CG2 THR A 116 5.630 -3.692 -4.580 1.00 1.00 C ATOM 0 H THR A 116 4.110 -5.452 -1.561 1.00 1.00 H new ATOM 0 HA THR A 116 4.227 -6.442 -4.351 1.00 1.00 H new ATOM 0 HB THR A 116 4.082 -3.801 -3.106 1.00 1.00 H new ATOM 0 HG1 THR A 116 2.493 -4.340 -4.589 1.00 1.00 H new ATOM 0 HG21 THR A 116 5.409 -2.666 -4.874 1.00 1.00 H new ATOM 0 HG22 THR A 116 6.416 -3.692 -3.825 1.00 1.00 H new ATOM 0 HG23 THR A 116 5.964 -4.255 -5.451 1.00 1.00 H new ATOM 1833 N ARG A 117 6.673 -6.805 -4.247 1.00 1.00 N ATOM 1834 CA ARG A 117 8.091 -7.145 -4.137 1.00 1.00 C ATOM 1835 C ARG A 117 8.897 -6.592 -5.300 1.00 1.00 C ATOM 1836 O ARG A 117 8.509 -6.708 -6.463 1.00 1.00 O ATOM 1837 CB ARG A 117 8.259 -8.661 -4.057 1.00 1.00 C ATOM 1838 CG ARG A 117 9.583 -9.105 -3.454 1.00 1.00 C ATOM 1839 CD ARG A 117 9.688 -10.617 -3.446 1.00 1.00 C ATOM 1840 NE ARG A 117 8.697 -11.229 -2.580 1.00 1.00 N ATOM 1841 CZ ARG A 117 8.773 -11.238 -1.252 1.00 1.00 C ATOM 1842 NH1 ARG A 117 9.774 -10.625 -0.632 1.00 1.00 N ATOM 1843 NH2 ARG A 117 7.844 -11.862 -0.540 1.00 1.00 N ATOM 0 H ARG A 117 6.202 -7.211 -5.055 1.00 1.00 H new ATOM 0 HA ARG A 117 8.472 -6.687 -3.224 1.00 1.00 H new ATOM 0 HB2 ARG A 117 7.444 -9.076 -3.464 1.00 1.00 H new ATOM 0 HB3 ARG A 117 8.169 -9.080 -5.059 1.00 1.00 H new ATOM 0 HG2 ARG A 117 10.409 -8.681 -4.025 1.00 1.00 H new ATOM 0 HG3 ARG A 117 9.671 -8.724 -2.437 1.00 1.00 H new ATOM 0 HD2 ARG A 117 9.564 -10.994 -4.461 1.00 1.00 H new ATOM 0 HD3 ARG A 117 10.685 -10.909 -3.118 1.00 1.00 H new ATOM 0 HE ARG A 117 7.893 -11.680 -3.017 1.00 1.00 H new ATOM 0 HH11 ARG A 117 10.491 -10.143 -1.174 1.00 1.00 H new ATOM 0 HH12 ARG A 117 9.826 -10.636 0.387 1.00 1.00 H new ATOM 0 HH21 ARG A 117 7.072 -12.334 -1.011 1.00 1.00 H new ATOM 0 HH22 ARG A 117 7.901 -11.870 0.478 1.00 1.00 H new ATOM 1857 N LEU A 118 10.022 -5.987 -4.974 1.00 1.00 N ATOM 1858 CA LEU A 118 10.898 -5.402 -5.980 1.00 1.00 C ATOM 1859 C LEU A 118 12.159 -6.242 -6.146 1.00 1.00 C ATOM 1860 O LEU A 118 12.823 -6.587 -5.158 1.00 1.00 O ATOM 1861 CB LEU A 118 11.261 -3.982 -5.592 1.00 1.00 C ATOM 1862 CG LEU A 118 10.639 -2.896 -6.455 1.00 1.00 C ATOM 1863 CD1 LEU A 118 10.692 -1.549 -5.745 1.00 1.00 C ATOM 1864 CD2 LEU A 118 11.355 -2.835 -7.795 1.00 1.00 C ATOM 0 H LEU A 118 10.356 -5.885 -4.016 1.00 1.00 H new ATOM 0 HA LEU A 118 10.369 -5.384 -6.933 1.00 1.00 H new ATOM 0 HB2 LEU A 118 10.961 -3.817 -4.557 1.00 1.00 H new ATOM 0 HB3 LEU A 118 12.345 -3.878 -5.630 1.00 1.00 H new ATOM 0 HG LEU A 118 9.590 -3.137 -6.630 1.00 1.00 H new ATOM 0 HD11 LEU A 118 10.242 -0.785 -6.379 1.00 1.00 H new ATOM 0 HD12 LEU A 118 10.142 -1.611 -4.806 1.00 1.00 H new ATOM 0 HD13 LEU A 118 11.730 -1.286 -5.541 1.00 1.00 H new ATOM 0 HD21 LEU A 118 10.907 -2.056 -8.412 1.00 1.00 H new ATOM 0 HD22 LEU A 118 12.409 -2.610 -7.634 1.00 1.00 H new ATOM 0 HD23 LEU A 118 11.263 -3.796 -8.301 1.00 1.00 H new ATOM 1876 N ALA A 119 12.505 -6.567 -7.398 1.00 1.00 N ATOM 1877 CA ALA A 119 13.703 -7.367 -7.670 1.00 1.00 C ATOM 1878 C ALA A 119 14.957 -6.627 -7.229 1.00 1.00 C ATOM 1879 O ALA A 119 15.872 -7.229 -6.678 1.00 1.00 O ATOM 1880 CB ALA A 119 13.782 -7.714 -9.156 1.00 1.00 C ATOM 0 H ALA A 119 11.980 -6.292 -8.228 1.00 1.00 H new ATOM 0 HA ALA A 119 13.635 -8.293 -7.098 1.00 1.00 H new ATOM 0 HB1 ALA A 119 14.676 -8.308 -9.344 1.00 1.00 H new ATOM 0 HB2 ALA A 119 12.900 -8.286 -9.444 1.00 1.00 H new ATOM 0 HB3 ALA A 119 13.827 -6.796 -9.742 1.00 1.00 H new ATOM 1886 N GLY A 120 14.969 -5.316 -7.451 1.00 1.00 N ATOM 1887 CA GLY A 120 16.102 -4.508 -7.040 1.00 1.00 C ATOM 1888 C GLY A 120 16.125 -4.330 -5.541 1.00 1.00 C ATOM 1889 O GLY A 120 15.150 -4.648 -4.865 1.00 1.00 O ATOM 0 H GLY A 120 14.216 -4.800 -7.907 1.00 1.00 H new ATOM 0 HA2 GLY A 120 17.028 -4.980 -7.368 1.00 1.00 H new ATOM 0 HA3 GLY A 120 16.053 -3.533 -7.525 1.00 1.00 H new ATOM 1893 N SER A 121 17.228 -3.824 -4.998 1.00 1.00 N ATOM 1894 CA SER A 121 17.339 -3.625 -3.557 1.00 1.00 C ATOM 1895 C SER A 121 17.926 -2.259 -3.247 1.00 1.00 C ATOM 1896 O SER A 121 18.721 -1.720 -4.010 1.00 1.00 O ATOM 1897 CB SER A 121 18.211 -4.716 -2.939 1.00 1.00 C ATOM 1898 OG SER A 121 17.435 -5.841 -2.576 1.00 1.00 O ATOM 0 H SER A 121 18.053 -3.546 -5.530 1.00 1.00 H new ATOM 0 HA SER A 121 16.339 -3.680 -3.127 1.00 1.00 H new ATOM 0 HB2 SER A 121 18.982 -5.016 -3.649 1.00 1.00 H new ATOM 0 HB3 SER A 121 18.722 -4.323 -2.060 1.00 1.00 H new ATOM 0 HG SER A 121 17.997 -6.485 -2.096 1.00 1.00 H new ATOM 1904 N PHE A 122 17.499 -1.695 -2.123 1.00 1.00 N ATOM 1905 CA PHE A 122 17.966 -0.384 -1.694 1.00 1.00 C ATOM 1906 C PHE A 122 18.425 -0.429 -0.236 1.00 1.00 C ATOM 1907 O PHE A 122 17.912 -1.218 0.560 1.00 1.00 O ATOM 1908 CB PHE A 122 16.869 0.659 -1.874 1.00 1.00 C ATOM 1909 CG PHE A 122 17.067 1.524 -3.090 1.00 1.00 C ATOM 1910 CD1 PHE A 122 18.076 2.472 -3.126 1.00 1.00 C ATOM 1911 CD2 PHE A 122 16.247 1.379 -4.198 1.00 1.00 C ATOM 1912 CE1 PHE A 122 18.264 3.262 -4.245 1.00 1.00 C ATOM 1913 CE2 PHE A 122 16.429 2.166 -5.319 1.00 1.00 C ATOM 1914 CZ PHE A 122 17.439 3.108 -5.343 1.00 1.00 C ATOM 0 H PHE A 122 16.827 -2.129 -1.490 1.00 1.00 H new ATOM 0 HA PHE A 122 18.816 -0.102 -2.315 1.00 1.00 H new ATOM 0 HB2 PHE A 122 15.906 0.155 -1.948 1.00 1.00 H new ATOM 0 HB3 PHE A 122 16.830 1.293 -0.988 1.00 1.00 H new ATOM 0 HD1 PHE A 122 18.723 2.596 -2.270 1.00 1.00 H new ATOM 0 HD2 PHE A 122 15.457 0.643 -4.185 1.00 1.00 H new ATOM 0 HE1 PHE A 122 19.054 3.998 -4.261 1.00 1.00 H new ATOM 0 HE2 PHE A 122 15.782 2.045 -6.175 1.00 1.00 H new ATOM 0 HZ PHE A 122 17.584 3.723 -6.219 1.00 1.00 H new ATOM 1924 N GLU A 123 19.388 0.412 0.111 1.00 1.00 N ATOM 1925 CA GLU A 123 19.891 0.453 1.483 1.00 1.00 C ATOM 1926 C GLU A 123 19.059 1.416 2.331 1.00 1.00 C ATOM 1927 O GLU A 123 18.662 2.475 1.863 1.00 1.00 O ATOM 1928 CB GLU A 123 21.354 0.880 1.478 1.00 1.00 C ATOM 1929 CG GLU A 123 22.310 -0.245 1.129 1.00 1.00 C ATOM 1930 CD GLU A 123 22.903 -0.911 2.356 1.00 1.00 C ATOM 1931 OE1 GLU A 123 23.648 -0.239 3.099 1.00 1.00 O ATOM 1932 OE2 GLU A 123 22.618 -2.108 2.573 1.00 1.00 O ATOM 0 H GLU A 123 19.835 1.070 -0.528 1.00 1.00 H new ATOM 0 HA GLU A 123 19.810 -0.542 1.920 1.00 1.00 H new ATOM 0 HB2 GLU A 123 21.485 1.693 0.763 1.00 1.00 H new ATOM 0 HB3 GLU A 123 21.613 1.275 2.461 1.00 1.00 H new ATOM 0 HG2 GLU A 123 21.784 -0.992 0.534 1.00 1.00 H new ATOM 0 HG3 GLU A 123 23.116 0.148 0.509 1.00 1.00 H new ATOM 1939 N GLY A 124 18.795 1.040 3.580 1.00 1.00 N ATOM 1940 CA GLY A 124 18.007 1.897 4.442 1.00 1.00 C ATOM 1941 C GLY A 124 18.080 1.493 5.903 1.00 1.00 C ATOM 1942 O GLY A 124 18.563 0.411 6.230 1.00 1.00 O ATOM 0 H GLY A 124 19.109 0.167 4.004 1.00 1.00 H new ATOM 0 HA2 GLY A 124 18.352 2.926 4.337 1.00 1.00 H new ATOM 0 HA3 GLY A 124 16.967 1.875 4.116 1.00 1.00 H new ATOM 1946 N ASP A 125 17.584 2.358 6.781 1.00 1.00 N ATOM 1947 CA ASP A 125 17.598 2.083 8.217 1.00 1.00 C ATOM 1948 C ASP A 125 16.289 1.431 8.704 1.00 1.00 C ATOM 1949 O ASP A 125 16.134 1.155 9.899 1.00 1.00 O ATOM 1950 CB ASP A 125 17.853 3.371 9.002 1.00 1.00 C ATOM 1951 CG ASP A 125 19.184 4.001 8.659 1.00 1.00 C ATOM 1952 OD1 ASP A 125 19.292 4.590 7.563 1.00 1.00 O ATOM 1953 OD2 ASP A 125 20.119 3.911 9.482 1.00 1.00 O ATOM 0 H ASP A 125 17.168 3.254 6.527 1.00 1.00 H new ATOM 0 HA ASP A 125 18.406 1.374 8.396 1.00 1.00 H new ATOM 0 HB2 ASP A 125 17.053 4.083 8.797 1.00 1.00 H new ATOM 0 HB3 ASP A 125 17.821 3.155 10.070 1.00 1.00 H new ATOM 1958 N THR A 126 15.352 1.186 7.786 1.00 1.00 N ATOM 1959 CA THR A 126 14.080 0.590 8.148 1.00 1.00 C ATOM 1960 C THR A 126 13.920 -0.795 7.531 1.00 1.00 C ATOM 1961 O THR A 126 14.089 -0.981 6.325 1.00 1.00 O ATOM 1962 CB THR A 126 12.914 1.499 7.737 1.00 1.00 C ATOM 1963 OG1 THR A 126 13.260 2.861 7.905 1.00 1.00 O ATOM 1964 CG2 THR A 126 11.645 1.243 8.522 1.00 1.00 C ATOM 0 H THR A 126 15.456 1.393 6.793 1.00 1.00 H new ATOM 0 HA THR A 126 14.066 0.479 9.232 1.00 1.00 H new ATOM 0 HB THR A 126 12.722 1.266 6.690 1.00 1.00 H new ATOM 0 HG1 THR A 126 13.603 3.218 7.059 1.00 1.00 H new ATOM 0 HG21 THR A 126 10.863 1.920 8.180 1.00 1.00 H new ATOM 0 HG22 THR A 126 11.325 0.212 8.370 1.00 1.00 H new ATOM 0 HG23 THR A 126 11.833 1.412 9.582 1.00 1.00 H new ATOM 1972 N LYS A 127 13.572 -1.766 8.371 1.00 1.00 N ATOM 1973 CA LYS A 127 13.379 -3.137 7.921 1.00 1.00 C ATOM 1974 C LYS A 127 11.953 -3.602 8.226 1.00 1.00 C ATOM 1975 O LYS A 127 11.389 -3.243 9.264 1.00 1.00 O ATOM 1976 CB LYS A 127 14.388 -4.062 8.603 1.00 1.00 C ATOM 1977 CG LYS A 127 15.607 -3.337 9.137 1.00 1.00 C ATOM 1978 CD LYS A 127 16.754 -4.300 9.416 1.00 1.00 C ATOM 1979 CE LYS A 127 17.860 -3.636 10.219 1.00 1.00 C ATOM 1980 NZ LYS A 127 19.163 -4.355 10.050 1.00 1.00 N ATOM 0 H LYS A 127 13.418 -1.626 9.370 1.00 1.00 H new ATOM 0 HA LYS A 127 13.536 -3.174 6.843 1.00 1.00 H new ATOM 0 HB2 LYS A 127 13.895 -4.582 9.425 1.00 1.00 H new ATOM 0 HB3 LYS A 127 14.710 -4.823 7.892 1.00 1.00 H new ATOM 0 HG2 LYS A 127 15.929 -2.586 8.416 1.00 1.00 H new ATOM 0 HG3 LYS A 127 15.344 -2.808 10.053 1.00 1.00 H new ATOM 0 HD2 LYS A 127 16.378 -5.166 9.961 1.00 1.00 H new ATOM 0 HD3 LYS A 127 17.159 -4.667 8.473 1.00 1.00 H new ATOM 0 HE2 LYS A 127 17.971 -2.599 9.901 1.00 1.00 H new ATOM 0 HE3 LYS A 127 17.586 -3.619 11.274 1.00 1.00 H new ATOM 0 HZ1 LYS A 127 19.898 -3.878 10.610 1.00 1.00 H new ATOM 0 HZ2 LYS A 127 19.062 -5.337 10.376 1.00 1.00 H new ATOM 0 HZ3 LYS A 127 19.435 -4.350 9.046 1.00 1.00 H new ATOM 1994 N MET A 128 11.377 -4.389 7.327 1.00 1.00 N ATOM 1995 CA MET A 128 10.020 -4.899 7.511 1.00 1.00 C ATOM 1996 C MET A 128 9.982 -6.005 8.569 1.00 1.00 C ATOM 1997 O MET A 128 10.891 -6.830 8.677 1.00 1.00 O ATOM 1998 CB MET A 128 9.457 -5.426 6.183 1.00 1.00 C ATOM 1999 CG MET A 128 9.688 -6.913 5.951 1.00 1.00 C ATOM 2000 SD MET A 128 11.430 -7.353 5.846 1.00 1.00 S ATOM 2001 CE MET A 128 11.329 -9.146 5.779 1.00 1.00 C ATOM 0 H MET A 128 11.826 -4.690 6.462 1.00 1.00 H new ATOM 0 HA MET A 128 9.400 -4.072 7.857 1.00 1.00 H new ATOM 0 HB2 MET A 128 8.386 -5.227 6.152 1.00 1.00 H new ATOM 0 HB3 MET A 128 9.909 -4.868 5.363 1.00 1.00 H new ATOM 0 HG2 MET A 128 9.226 -7.477 6.762 1.00 1.00 H new ATOM 0 HG3 MET A 128 9.188 -7.212 5.030 1.00 1.00 H new ATOM 0 HE1 MET A 128 12.333 -9.565 5.712 1.00 1.00 H new ATOM 0 HE2 MET A 128 10.841 -9.517 6.680 1.00 1.00 H new ATOM 0 HE3 MET A 128 10.752 -9.445 4.904 1.00 1.00 H new ATOM 2011 N ILE A 129 8.914 -6.011 9.365 1.00 1.00 N ATOM 2012 CA ILE A 129 8.755 -7.011 10.417 1.00 1.00 C ATOM 2013 C ILE A 129 8.469 -8.394 9.824 1.00 1.00 C ATOM 2014 O ILE A 129 8.066 -8.541 8.679 1.00 1.00 O ATOM 2015 CB ILE A 129 7.624 -6.628 11.390 1.00 1.00 C ATOM 2016 CG1 ILE A 129 6.347 -6.351 10.593 1.00 1.00 C ATOM 2017 CG2 ILE A 129 8.006 -5.427 12.235 1.00 1.00 C ATOM 2018 CD1 ILE A 129 5.910 -4.903 10.642 1.00 1.00 C ATOM 0 H ILE A 129 8.150 -5.338 9.302 1.00 1.00 H new ATOM 0 HA ILE A 129 9.695 -7.046 10.968 1.00 1.00 H new ATOM 0 HB ILE A 129 7.450 -7.459 12.074 1.00 1.00 H new ATOM 0 HG12 ILE A 129 6.506 -6.640 9.554 1.00 1.00 H new ATOM 0 HG13 ILE A 129 5.544 -6.979 10.979 1.00 1.00 H new ATOM 0 HG21 ILE A 129 7.187 -5.182 12.911 1.00 1.00 H new ATOM 0 HG22 ILE A 129 8.898 -5.660 12.816 1.00 1.00 H new ATOM 0 HG23 ILE A 129 8.208 -4.575 11.586 1.00 1.00 H new ATOM 0 HD11 ILE A 129 4.999 -4.778 10.056 1.00 1.00 H new ATOM 0 HD12 ILE A 129 5.719 -4.615 11.676 1.00 1.00 H new ATOM 0 HD13 ILE A 129 6.697 -4.271 10.229 1.00 1.00 H new ATOM 2030 N PRO A 130 8.688 -9.447 10.631 1.00 1.00 N ATOM 2031 CA PRO A 130 8.462 -10.819 10.194 1.00 1.00 C ATOM 2032 C PRO A 130 7.008 -11.057 9.798 1.00 1.00 C ATOM 2033 O PRO A 130 6.101 -10.490 10.409 1.00 1.00 O ATOM 2034 CB PRO A 130 8.838 -11.658 11.421 1.00 1.00 C ATOM 2035 CG PRO A 130 9.671 -10.767 12.281 1.00 1.00 C ATOM 2036 CD PRO A 130 9.185 -9.373 12.021 1.00 1.00 C ATOM 0 HA PRO A 130 9.045 -11.070 9.308 1.00 1.00 H new ATOM 0 HB2 PRO A 130 7.948 -11.994 11.953 1.00 1.00 H new ATOM 0 HB3 PRO A 130 9.392 -12.551 11.130 1.00 1.00 H new ATOM 0 HG2 PRO A 130 9.563 -11.028 13.334 1.00 1.00 H new ATOM 0 HG3 PRO A 130 10.728 -10.864 12.035 1.00 1.00 H new ATOM 0 HD2 PRO A 130 8.397 -9.084 12.716 1.00 1.00 H new ATOM 0 HD3 PRO A 130 9.986 -8.641 12.125 1.00 1.00 H new ATOM 2044 N LEU A 131 6.815 -11.896 8.786 1.00 1.00 N ATOM 2045 CA LEU A 131 5.476 -12.207 8.310 1.00 1.00 C ATOM 2046 C LEU A 131 5.061 -13.627 8.703 1.00 1.00 C ATOM 2047 O LEU A 131 5.800 -14.591 8.474 1.00 1.00 O ATOM 2048 CB LEU A 131 5.393 -12.038 6.785 1.00 1.00 C ATOM 2049 CG LEU A 131 5.933 -10.708 6.249 1.00 1.00 C ATOM 2050 CD1 LEU A 131 7.457 -10.711 6.267 1.00 1.00 C ATOM 2051 CD2 LEU A 131 5.412 -10.441 4.837 1.00 1.00 C ATOM 0 H LEU A 131 7.566 -12.370 8.283 1.00 1.00 H new ATOM 0 HA LEU A 131 4.787 -11.508 8.783 1.00 1.00 H new ATOM 0 HB2 LEU A 131 5.944 -12.852 6.314 1.00 1.00 H new ATOM 0 HB3 LEU A 131 4.352 -12.139 6.480 1.00 1.00 H new ATOM 0 HG LEU A 131 5.579 -9.906 6.897 1.00 1.00 H new ATOM 0 HD11 LEU A 131 7.827 -9.760 5.884 1.00 1.00 H new ATOM 0 HD12 LEU A 131 7.809 -10.852 7.289 1.00 1.00 H new ATOM 0 HD13 LEU A 131 7.827 -11.523 5.641 1.00 1.00 H new ATOM 0 HD21 LEU A 131 5.808 -9.492 4.476 1.00 1.00 H new ATOM 0 HD22 LEU A 131 5.733 -11.244 4.173 1.00 1.00 H new ATOM 0 HD23 LEU A 131 4.323 -10.397 4.853 1.00 1.00 H new ATOM 2063 N ASN A 132 3.882 -13.756 9.294 1.00 1.00 N ATOM 2064 CA ASN A 132 3.389 -15.062 9.707 1.00 1.00 C ATOM 2065 C ASN A 132 2.661 -15.735 8.550 1.00 1.00 C ATOM 2066 O ASN A 132 1.572 -15.334 8.169 1.00 1.00 O ATOM 2067 CB ASN A 132 2.462 -14.909 10.916 1.00 1.00 C ATOM 2068 CG ASN A 132 2.264 -16.217 11.652 1.00 1.00 C ATOM 2069 OD1 ASN A 132 1.232 -16.874 11.506 1.00 1.00 O ATOM 2070 ND2 ASN A 132 3.240 -16.589 12.473 1.00 1.00 N ATOM 0 H ASN A 132 3.253 -12.979 9.497 1.00 1.00 H new ATOM 0 HA ASN A 132 4.232 -15.691 9.994 1.00 1.00 H new ATOM 0 HB2 ASN A 132 2.878 -14.169 11.599 1.00 1.00 H new ATOM 0 HB3 ASN A 132 1.495 -14.530 10.585 1.00 1.00 H new ATOM 0 HD21 ASN A 132 3.152 -17.450 13.013 1.00 1.00 H new ATOM 0 HD22 ASN A 132 4.078 -16.014 12.563 1.00 1.00 H new ATOM 2077 N TRP A 133 3.291 -16.759 7.994 1.00 1.00 N ATOM 2078 CA TRP A 133 2.712 -17.489 6.878 1.00 1.00 C ATOM 2079 C TRP A 133 1.380 -18.106 7.254 1.00 1.00 C ATOM 2080 O TRP A 133 0.454 -18.141 6.448 1.00 1.00 O ATOM 2081 CB TRP A 133 3.672 -18.589 6.429 1.00 1.00 C ATOM 2082 CG TRP A 133 4.666 -18.123 5.407 1.00 1.00 C ATOM 2083 CD1 TRP A 133 5.072 -16.842 5.171 1.00 1.00 C ATOM 2084 CD2 TRP A 133 5.382 -18.950 4.488 1.00 1.00 C ATOM 2085 NE1 TRP A 133 6.001 -16.823 4.159 1.00 1.00 N ATOM 2086 CE2 TRP A 133 6.207 -18.105 3.723 1.00 1.00 C ATOM 2087 CE3 TRP A 133 5.406 -20.323 4.237 1.00 1.00 C ATOM 2088 CZ2 TRP A 133 7.046 -18.589 2.727 1.00 1.00 C ATOM 2089 CZ3 TRP A 133 6.240 -20.804 3.247 1.00 1.00 C ATOM 2090 CH2 TRP A 133 7.051 -19.939 2.503 1.00 1.00 C ATOM 0 H TRP A 133 4.202 -17.102 8.297 1.00 1.00 H new ATOM 0 HA TRP A 133 2.545 -16.784 6.064 1.00 1.00 H new ATOM 0 HB2 TRP A 133 4.206 -18.973 7.298 1.00 1.00 H new ATOM 0 HB3 TRP A 133 3.097 -19.418 6.016 1.00 1.00 H new ATOM 0 HD1 TRP A 133 4.716 -15.971 5.701 1.00 1.00 H new ATOM 0 HE1 TRP A 133 6.462 -15.990 3.792 1.00 1.00 H new ATOM 0 HE3 TRP A 133 4.784 -20.997 4.807 1.00 1.00 H new ATOM 0 HZ2 TRP A 133 7.672 -17.924 2.150 1.00 1.00 H new ATOM 0 HZ3 TRP A 133 6.267 -21.864 3.044 1.00 1.00 H new ATOM 0 HH2 TRP A 133 7.694 -20.345 1.736 1.00 1.00 H new ATOM 2101 N ASP A 134 1.299 -18.621 8.476 1.00 1.00 N ATOM 2102 CA ASP A 134 0.083 -19.267 8.957 1.00 1.00 C ATOM 2103 C ASP A 134 -1.091 -18.299 9.065 1.00 1.00 C ATOM 2104 O ASP A 134 -2.236 -18.685 8.831 1.00 1.00 O ATOM 2105 CB ASP A 134 0.345 -19.900 10.327 1.00 1.00 C ATOM 2106 CG ASP A 134 -0.864 -20.650 10.859 1.00 1.00 C ATOM 2107 OD1 ASP A 134 -1.431 -21.462 10.096 1.00 1.00 O ATOM 2108 OD2 ASP A 134 -1.240 -20.436 12.031 1.00 1.00 O ATOM 0 H ASP A 134 2.062 -18.604 9.152 1.00 1.00 H new ATOM 0 HA ASP A 134 -0.187 -20.030 8.227 1.00 1.00 H new ATOM 0 HB2 ASP A 134 1.190 -20.585 10.252 1.00 1.00 H new ATOM 0 HB3 ASP A 134 0.627 -19.122 11.036 1.00 1.00 H new ATOM 2113 N ASP A 135 -0.807 -17.057 9.437 1.00 1.00 N ATOM 2114 CA ASP A 135 -1.846 -16.045 9.593 1.00 1.00 C ATOM 2115 C ASP A 135 -2.553 -15.711 8.270 1.00 1.00 C ATOM 2116 O ASP A 135 -3.759 -15.459 8.255 1.00 1.00 O ATOM 2117 CB ASP A 135 -1.275 -14.776 10.208 1.00 1.00 C ATOM 2118 CG ASP A 135 -1.113 -14.879 11.719 1.00 1.00 C ATOM 2119 OD1 ASP A 135 -1.518 -15.911 12.292 1.00 1.00 O ATOM 2120 OD2 ASP A 135 -0.582 -13.923 12.323 1.00 1.00 O ATOM 0 H ASP A 135 0.137 -16.725 9.637 1.00 1.00 H new ATOM 0 HA ASP A 135 -2.593 -16.471 10.264 1.00 1.00 H new ATOM 0 HB2 ASP A 135 -0.306 -14.562 9.756 1.00 1.00 H new ATOM 0 HB3 ASP A 135 -1.929 -13.936 9.973 1.00 1.00 H new ATOM 2125 N PHE A 136 -1.806 -15.703 7.164 1.00 1.00 N ATOM 2126 CA PHE A 136 -2.390 -15.378 5.851 1.00 1.00 C ATOM 2127 C PHE A 136 -1.756 -16.195 4.721 1.00 1.00 C ATOM 2128 O PHE A 136 -0.615 -16.648 4.828 1.00 1.00 O ATOM 2129 CB PHE A 136 -2.200 -13.888 5.577 1.00 1.00 C ATOM 2130 CG PHE A 136 -3.112 -13.022 6.392 1.00 1.00 C ATOM 2131 CD1 PHE A 136 -4.468 -12.978 6.113 1.00 1.00 C ATOM 2132 CD2 PHE A 136 -2.621 -12.256 7.439 1.00 1.00 C ATOM 2133 CE1 PHE A 136 -5.319 -12.186 6.861 1.00 1.00 C ATOM 2134 CE2 PHE A 136 -3.468 -11.463 8.191 1.00 1.00 C ATOM 2135 CZ PHE A 136 -4.818 -11.429 7.902 1.00 1.00 C ATOM 0 H PHE A 136 -0.808 -15.914 7.145 1.00 1.00 H new ATOM 0 HA PHE A 136 -3.450 -15.630 5.880 1.00 1.00 H new ATOM 0 HB2 PHE A 136 -1.166 -13.615 5.786 1.00 1.00 H new ATOM 0 HB3 PHE A 136 -2.373 -13.694 4.519 1.00 1.00 H new ATOM 0 HD1 PHE A 136 -4.865 -13.570 5.301 1.00 1.00 H new ATOM 0 HD2 PHE A 136 -1.566 -12.279 7.669 1.00 1.00 H new ATOM 0 HE1 PHE A 136 -6.374 -12.159 6.632 1.00 1.00 H new ATOM 0 HE2 PHE A 136 -3.074 -10.871 9.004 1.00 1.00 H new ATOM 0 HZ PHE A 136 -5.481 -10.811 8.489 1.00 1.00 H new ATOM 2145 N THR A 137 -2.503 -16.353 3.630 1.00 1.00 N ATOM 2146 CA THR A 137 -2.026 -17.099 2.478 1.00 1.00 C ATOM 2147 C THR A 137 -2.226 -16.271 1.213 1.00 1.00 C ATOM 2148 O THR A 137 -3.052 -15.374 1.176 1.00 1.00 O ATOM 2149 CB THR A 137 -2.764 -18.442 2.377 1.00 1.00 C ATOM 2150 OG1 THR A 137 -2.352 -19.154 1.233 1.00 1.00 O ATOM 2151 CG2 THR A 137 -4.273 -18.302 2.325 1.00 1.00 C ATOM 0 H THR A 137 -3.443 -15.971 3.524 1.00 1.00 H new ATOM 0 HA THR A 137 -0.962 -17.305 2.594 1.00 1.00 H new ATOM 0 HB THR A 137 -2.505 -18.981 3.288 1.00 1.00 H new ATOM 0 HG1 THR A 137 -2.832 -20.007 1.188 1.00 1.00 H new ATOM 0 HG21 THR A 137 -4.728 -19.290 2.254 1.00 1.00 H new ATOM 0 HG22 THR A 137 -4.624 -17.805 3.230 1.00 1.00 H new ATOM 0 HG23 THR A 137 -4.554 -17.710 1.454 1.00 1.00 H new ATOM 2159 N LYS A 138 -1.447 -16.565 0.176 1.00 1.00 N ATOM 2160 CA LYS A 138 -1.559 -15.808 -1.060 1.00 1.00 C ATOM 2161 C LYS A 138 -2.696 -16.336 -1.931 1.00 1.00 C ATOM 2162 O LYS A 138 -2.641 -17.477 -2.398 1.00 1.00 O ATOM 2163 CB LYS A 138 -0.245 -15.882 -1.837 1.00 1.00 C ATOM 2164 CG LYS A 138 0.159 -17.316 -2.176 1.00 1.00 C ATOM 2165 CD LYS A 138 1.643 -17.545 -1.922 1.00 1.00 C ATOM 2166 CE LYS A 138 1.963 -19.022 -1.757 1.00 1.00 C ATOM 2167 NZ LYS A 138 1.998 -19.435 -0.329 1.00 1.00 N ATOM 0 H LYS A 138 -0.746 -17.306 0.168 1.00 1.00 H new ATOM 0 HA LYS A 138 -1.776 -14.772 -0.801 1.00 1.00 H new ATOM 0 HB2 LYS A 138 -0.340 -15.308 -2.759 1.00 1.00 H new ATOM 0 HB3 LYS A 138 0.546 -15.415 -1.250 1.00 1.00 H new ATOM 0 HG2 LYS A 138 -0.427 -18.013 -1.577 1.00 1.00 H new ATOM 0 HG3 LYS A 138 -0.070 -17.524 -3.221 1.00 1.00 H new ATOM 0 HD2 LYS A 138 2.221 -17.138 -2.751 1.00 1.00 H new ATOM 0 HD3 LYS A 138 1.947 -17.004 -1.026 1.00 1.00 H new ATOM 0 HE2 LYS A 138 1.217 -19.615 -2.286 1.00 1.00 H new ATOM 0 HE3 LYS A 138 2.927 -19.237 -2.219 1.00 1.00 H new ATOM 0 HZ1 LYS A 138 2.220 -20.449 -0.266 1.00 1.00 H new ATOM 0 HZ2 LYS A 138 2.728 -18.889 0.172 1.00 1.00 H new ATOM 0 HZ3 LYS A 138 1.071 -19.256 0.107 1.00 1.00 H new ATOM 2181 N VAL A 139 -3.697 -15.505 -2.169 1.00 1.00 N ATOM 2182 CA VAL A 139 -4.824 -15.872 -3.012 1.00 1.00 C ATOM 2183 C VAL A 139 -4.362 -16.116 -4.438 1.00 1.00 C ATOM 2184 O VAL A 139 -4.789 -17.071 -5.089 1.00 1.00 O ATOM 2185 CB VAL A 139 -5.955 -14.828 -3.012 1.00 1.00 C ATOM 2186 CG1 VAL A 139 -6.910 -15.083 -1.861 1.00 1.00 C ATOM 2187 CG2 VAL A 139 -5.409 -13.402 -2.947 1.00 1.00 C ATOM 0 H VAL A 139 -3.752 -14.561 -1.786 1.00 1.00 H new ATOM 0 HA VAL A 139 -5.233 -16.787 -2.585 1.00 1.00 H new ATOM 0 HB VAL A 139 -6.498 -14.930 -3.952 1.00 1.00 H new ATOM 0 HG11 VAL A 139 -7.704 -14.336 -1.875 1.00 1.00 H new ATOM 0 HG12 VAL A 139 -7.345 -16.077 -1.963 1.00 1.00 H new ATOM 0 HG13 VAL A 139 -6.368 -15.019 -0.917 1.00 1.00 H new ATOM 0 HG21 VAL A 139 -6.238 -12.694 -2.949 1.00 1.00 H new ATOM 0 HG22 VAL A 139 -4.827 -13.276 -2.034 1.00 1.00 H new ATOM 0 HG23 VAL A 139 -4.772 -13.217 -3.812 1.00 1.00 H new ATOM 2197 N SER A 140 -3.488 -15.240 -4.917 1.00 1.00 N ATOM 2198 CA SER A 140 -2.962 -15.348 -6.269 1.00 1.00 C ATOM 2199 C SER A 140 -1.612 -14.636 -6.392 1.00 1.00 C ATOM 2200 O SER A 140 -1.237 -13.840 -5.534 1.00 1.00 O ATOM 2201 CB SER A 140 -3.959 -14.753 -7.270 1.00 1.00 C ATOM 2202 OG SER A 140 -4.569 -15.766 -8.059 1.00 1.00 O ATOM 0 H SER A 140 -3.129 -14.446 -4.387 1.00 1.00 H new ATOM 0 HA SER A 140 -2.814 -16.404 -6.492 1.00 1.00 H new ATOM 0 HB2 SER A 140 -4.727 -14.196 -6.733 1.00 1.00 H new ATOM 0 HB3 SER A 140 -3.446 -14.044 -7.919 1.00 1.00 H new ATOM 0 HG SER A 140 -5.201 -15.356 -8.686 1.00 1.00 H new ATOM 2208 N SER A 141 -0.901 -14.923 -7.488 1.00 1.00 N ATOM 2209 CA SER A 141 0.399 -14.309 -7.730 1.00 1.00 C ATOM 2210 C SER A 141 0.529 -13.821 -9.164 1.00 1.00 C ATOM 2211 O SER A 141 -0.080 -14.374 -10.075 1.00 1.00 O ATOM 2212 CB SER A 141 1.520 -15.303 -7.430 1.00 1.00 C ATOM 2213 OG SER A 141 1.009 -16.479 -6.827 1.00 1.00 O ATOM 0 H SER A 141 -1.205 -15.572 -8.214 1.00 1.00 H new ATOM 0 HA SER A 141 0.482 -13.449 -7.065 1.00 1.00 H new ATOM 0 HB2 SER A 141 2.040 -15.560 -8.353 1.00 1.00 H new ATOM 0 HB3 SER A 141 2.253 -14.841 -6.769 1.00 1.00 H new ATOM 0 HG SER A 141 1.745 -17.100 -6.646 1.00 1.00 H new ATOM 2219 N ARG A 142 1.324 -12.767 -9.353 1.00 1.00 N ATOM 2220 CA ARG A 142 1.544 -12.183 -10.672 1.00 1.00 C ATOM 2221 C ARG A 142 3.032 -11.964 -10.932 1.00 1.00 C ATOM 2222 O ARG A 142 3.790 -11.635 -10.025 1.00 1.00 O ATOM 2223 CB ARG A 142 0.788 -10.859 -10.808 1.00 1.00 C ATOM 2224 CG ARG A 142 -0.180 -10.821 -11.981 1.00 1.00 C ATOM 2225 CD ARG A 142 -1.627 -10.845 -11.500 1.00 1.00 C ATOM 2226 NE ARG A 142 -2.068 -9.522 -11.052 1.00 1.00 N ATOM 2227 CZ ARG A 142 -3.344 -9.155 -10.951 1.00 1.00 C ATOM 2228 NH1 ARG A 142 -4.317 -10.016 -11.222 1.00 1.00 N ATOM 2229 NH2 ARG A 142 -3.649 -7.922 -10.571 1.00 1.00 N ATOM 0 H ARG A 142 1.829 -12.299 -8.601 1.00 1.00 H new ATOM 0 HA ARG A 142 1.163 -12.884 -11.415 1.00 1.00 H new ATOM 0 HB2 ARG A 142 0.236 -10.671 -9.887 1.00 1.00 H new ATOM 0 HB3 ARG A 142 1.509 -10.049 -10.918 1.00 1.00 H new ATOM 0 HG2 ARG A 142 -0.005 -9.922 -12.572 1.00 1.00 H new ATOM 0 HG3 ARG A 142 0.003 -11.673 -12.635 1.00 1.00 H new ATOM 0 HD2 ARG A 142 -2.273 -11.191 -12.307 1.00 1.00 H new ATOM 0 HD3 ARG A 142 -1.728 -11.559 -10.682 1.00 1.00 H new ATOM 0 HE ARG A 142 -1.353 -8.839 -10.802 1.00 1.00 H new ATOM 0 HH11 ARG A 142 -4.090 -10.968 -11.510 1.00 1.00 H new ATOM 0 HH12 ARG A 142 -5.292 -9.726 -11.142 1.00 1.00 H new ATOM 0 HH21 ARG A 142 -2.907 -7.256 -10.357 1.00 1.00 H new ATOM 0 HH22 ARG A 142 -4.626 -7.639 -10.493 1.00 1.00 H new ATOM 2243 N THR A 143 3.453 -12.160 -12.180 1.00 1.00 N ATOM 2244 CA THR A 143 4.850 -11.990 -12.548 1.00 1.00 C ATOM 2245 C THR A 143 5.024 -10.867 -13.570 1.00 1.00 C ATOM 2246 O THR A 143 4.331 -10.829 -14.592 1.00 1.00 O ATOM 2247 CB THR A 143 5.433 -13.282 -13.110 1.00 1.00 C ATOM 2248 OG1 THR A 143 4.685 -14.411 -12.666 1.00 1.00 O ATOM 2249 CG2 THR A 143 6.864 -13.498 -12.698 1.00 1.00 C ATOM 0 H THR A 143 2.844 -12.436 -12.950 1.00 1.00 H new ATOM 0 HA THR A 143 5.388 -11.724 -11.638 1.00 1.00 H new ATOM 0 HB THR A 143 5.383 -13.182 -14.194 1.00 1.00 H new ATOM 0 HG1 THR A 143 5.075 -15.229 -13.039 1.00 1.00 H new ATOM 0 HG21 THR A 143 7.229 -14.432 -13.126 1.00 1.00 H new ATOM 0 HG22 THR A 143 7.475 -12.671 -13.058 1.00 1.00 H new ATOM 0 HG23 THR A 143 6.926 -13.548 -11.611 1.00 1.00 H new ATOM 2257 N VAL A 144 5.946 -9.945 -13.285 1.00 1.00 N ATOM 2258 CA VAL A 144 6.210 -8.827 -14.185 1.00 1.00 C ATOM 2259 C VAL A 144 7.649 -8.869 -14.705 1.00 1.00 C ATOM 2260 O VAL A 144 8.593 -9.000 -13.926 1.00 1.00 O ATOM 2261 CB VAL A 144 5.948 -7.476 -13.485 1.00 1.00 C ATOM 2262 CG1 VAL A 144 6.167 -6.321 -14.450 1.00 1.00 C ATOM 2263 CG2 VAL A 144 4.540 -7.448 -12.906 1.00 1.00 C ATOM 0 H VAL A 144 6.519 -9.952 -12.441 1.00 1.00 H new ATOM 0 HA VAL A 144 5.528 -8.921 -15.030 1.00 1.00 H new ATOM 0 HB VAL A 144 6.657 -7.363 -12.664 1.00 1.00 H new ATOM 0 HG11 VAL A 144 5.977 -5.378 -13.938 1.00 1.00 H new ATOM 0 HG12 VAL A 144 7.196 -6.338 -14.810 1.00 1.00 H new ATOM 0 HG13 VAL A 144 5.485 -6.418 -15.295 1.00 1.00 H new ATOM 0 HG21 VAL A 144 4.367 -6.490 -12.415 1.00 1.00 H new ATOM 0 HG22 VAL A 144 3.814 -7.581 -13.708 1.00 1.00 H new ATOM 0 HG23 VAL A 144 4.429 -8.253 -12.180 1.00 1.00 H new ATOM 2273 N GLU A 145 7.799 -8.780 -16.021 1.00 1.00 N ATOM 2274 CA GLU A 145 9.119 -8.838 -16.658 1.00 1.00 C ATOM 2275 C GLU A 145 9.470 -7.530 -17.358 1.00 1.00 C ATOM 2276 O GLU A 145 8.605 -6.851 -17.922 1.00 1.00 O ATOM 2277 CB GLU A 145 9.147 -9.992 -17.666 1.00 1.00 C ATOM 2278 CG GLU A 145 8.639 -11.313 -17.109 1.00 1.00 C ATOM 2279 CD GLU A 145 9.404 -12.499 -17.674 1.00 1.00 C ATOM 2280 OE1 GLU A 145 10.646 -12.407 -17.779 1.00 1.00 O ATOM 2281 OE2 GLU A 145 8.761 -13.511 -18.023 1.00 1.00 O ATOM 0 H GLU A 145 7.023 -8.667 -16.674 1.00 1.00 H new ATOM 0 HA GLU A 145 9.863 -9.003 -15.879 1.00 1.00 H new ATOM 0 HB2 GLU A 145 8.544 -9.719 -18.532 1.00 1.00 H new ATOM 0 HB3 GLU A 145 10.169 -10.128 -18.019 1.00 1.00 H new ATOM 0 HG2 GLU A 145 8.729 -11.307 -16.023 1.00 1.00 H new ATOM 0 HG3 GLU A 145 7.579 -11.421 -17.341 1.00 1.00 H new ATOM 2288 N ASP A 146 10.739 -7.168 -17.309 1.00 1.00 N ATOM 2289 CA ASP A 146 11.215 -5.935 -17.930 1.00 1.00 C ATOM 2290 C ASP A 146 12.700 -6.057 -18.298 1.00 1.00 C ATOM 2291 O ASP A 146 13.356 -7.026 -17.919 1.00 1.00 O ATOM 2292 CB ASP A 146 11.010 -4.743 -16.990 1.00 1.00 C ATOM 2293 CG ASP A 146 9.917 -3.808 -17.463 1.00 1.00 C ATOM 2294 OD1 ASP A 146 8.734 -4.081 -17.173 1.00 1.00 O ATOM 2295 OD2 ASP A 146 10.247 -2.785 -18.100 1.00 1.00 O ATOM 0 H ASP A 146 11.466 -7.711 -16.844 1.00 1.00 H new ATOM 0 HA ASP A 146 10.637 -5.769 -18.839 1.00 1.00 H new ATOM 0 HB2 ASP A 146 10.763 -5.109 -15.994 1.00 1.00 H new ATOM 0 HB3 ASP A 146 11.945 -4.189 -16.903 1.00 1.00 H new ATOM 2300 N THR A 147 13.201 -5.075 -19.030 1.00 1.00 N ATOM 2301 CA THR A 147 14.588 -5.079 -19.471 1.00 1.00 C ATOM 2302 C THR A 147 15.546 -5.050 -18.281 1.00 1.00 C ATOM 2303 O THR A 147 16.521 -5.808 -18.253 1.00 1.00 O ATOM 2304 CB THR A 147 14.849 -3.885 -20.384 1.00 1.00 C ATOM 2305 OG1 THR A 147 16.210 -3.858 -20.816 1.00 1.00 O ATOM 2306 CG2 THR A 147 14.566 -2.548 -19.720 1.00 1.00 C ATOM 0 H THR A 147 12.666 -4.261 -19.333 1.00 1.00 H new ATOM 0 HA THR A 147 14.766 -6.001 -20.025 1.00 1.00 H new ATOM 0 HB THR A 147 14.167 -4.018 -21.224 1.00 1.00 H new ATOM 0 HG1 THR A 147 16.352 -3.085 -21.401 1.00 1.00 H new ATOM 0 HG21 THR A 147 14.772 -1.741 -20.424 1.00 1.00 H new ATOM 0 HG22 THR A 147 13.520 -2.507 -19.417 1.00 1.00 H new ATOM 0 HG23 THR A 147 15.203 -2.435 -18.843 1.00 1.00 H new ATOM 2314 N ASN A 148 15.278 -4.191 -17.311 1.00 1.00 N ATOM 2315 CA ASN A 148 16.133 -4.087 -16.130 1.00 1.00 C ATOM 2316 C ASN A 148 15.663 -5.052 -15.051 1.00 1.00 C ATOM 2317 O ASN A 148 14.475 -5.089 -14.716 1.00 1.00 O ATOM 2318 CB ASN A 148 16.118 -2.656 -15.591 1.00 1.00 C ATOM 2319 CG ASN A 148 17.423 -2.289 -14.893 1.00 1.00 C ATOM 2320 OD1 ASN A 148 18.502 -2.728 -15.291 1.00 1.00 O ATOM 2321 ND2 ASN A 148 17.321 -1.481 -13.845 1.00 1.00 N ATOM 0 H ASN A 148 14.480 -3.556 -17.314 1.00 1.00 H new ATOM 0 HA ASN A 148 17.152 -4.347 -16.416 1.00 1.00 H new ATOM 0 HB2 ASN A 148 15.940 -1.962 -16.413 1.00 1.00 H new ATOM 0 HB3 ASN A 148 15.290 -2.542 -14.892 1.00 1.00 H new ATOM 0 HD21 ASN A 148 18.158 -1.200 -13.334 1.00 1.00 H new ATOM 0 HD22 ASN A 148 16.406 -1.141 -13.550 1.00 1.00 H new ATOM 2328 N PRO A 149 16.581 -5.855 -14.469 1.00 1.00 N ATOM 2329 CA PRO A 149 16.216 -6.825 -13.407 1.00 1.00 C ATOM 2330 C PRO A 149 15.540 -6.133 -12.229 1.00 1.00 C ATOM 2331 O PRO A 149 14.616 -6.672 -11.628 1.00 1.00 O ATOM 2332 CB PRO A 149 17.573 -7.402 -12.978 1.00 1.00 C ATOM 2333 CG PRO A 149 18.480 -7.161 -14.133 1.00 1.00 C ATOM 2334 CD PRO A 149 18.024 -5.884 -14.766 1.00 1.00 C ATOM 0 HA PRO A 149 15.509 -7.579 -13.754 1.00 1.00 H new ATOM 0 HB2 PRO A 149 17.943 -6.912 -12.077 1.00 1.00 H new ATOM 0 HB3 PRO A 149 17.496 -8.466 -12.753 1.00 1.00 H new ATOM 0 HG2 PRO A 149 19.516 -7.083 -13.804 1.00 1.00 H new ATOM 0 HG3 PRO A 149 18.432 -7.986 -14.844 1.00 1.00 H new ATOM 0 HD2 PRO A 149 18.539 -5.020 -14.345 1.00 1.00 H new ATOM 0 HD3 PRO A 149 18.214 -5.877 -15.839 1.00 1.00 H new ATOM 2342 N ALA A 150 16.000 -4.926 -11.918 1.00 1.00 N ATOM 2343 CA ALA A 150 15.432 -4.152 -10.823 1.00 1.00 C ATOM 2344 C ALA A 150 13.986 -3.793 -11.130 1.00 1.00 C ATOM 2345 O ALA A 150 13.117 -3.769 -10.243 1.00 1.00 O ATOM 2346 CB ALA A 150 16.253 -2.880 -10.594 1.00 1.00 C ATOM 0 H ALA A 150 16.765 -4.463 -12.409 1.00 1.00 H new ATOM 0 HA ALA A 150 15.459 -4.756 -9.916 1.00 1.00 H new ATOM 0 HB1 ALA A 150 15.819 -2.310 -9.773 1.00 1.00 H new ATOM 0 HB2 ALA A 150 17.280 -3.149 -10.346 1.00 1.00 H new ATOM 0 HB3 ALA A 150 16.246 -2.274 -11.500 1.00 1.00 H new ATOM 2352 N LEU A 151 13.736 -3.503 -12.401 1.00 1.00 N ATOM 2353 CA LEU A 151 12.408 -3.123 -12.890 1.00 1.00 C ATOM 2354 C LEU A 151 11.416 -4.282 -12.720 1.00 1.00 C ATOM 2355 O LEU A 151 10.252 -4.052 -12.408 1.00 1.00 O ATOM 2356 CB LEU A 151 12.485 -2.701 -14.355 1.00 1.00 C ATOM 2357 CG LEU A 151 12.558 -1.196 -14.615 1.00 1.00 C ATOM 2358 CD1 LEU A 151 12.798 -0.926 -16.086 1.00 1.00 C ATOM 2359 CD2 LEU A 151 11.276 -0.506 -14.148 1.00 1.00 C ATOM 0 H LEU A 151 14.450 -3.524 -13.129 1.00 1.00 H new ATOM 0 HA LEU A 151 12.053 -2.278 -12.300 1.00 1.00 H new ATOM 0 HB2 LEU A 151 13.361 -3.170 -14.802 1.00 1.00 H new ATOM 0 HB3 LEU A 151 11.612 -3.097 -14.873 1.00 1.00 H new ATOM 0 HG LEU A 151 13.394 -0.789 -14.046 1.00 1.00 H new ATOM 0 HD11 LEU A 151 12.847 0.150 -16.255 1.00 1.00 H new ATOM 0 HD12 LEU A 151 13.738 -1.385 -16.392 1.00 1.00 H new ATOM 0 HD13 LEU A 151 11.981 -1.348 -16.671 1.00 1.00 H new ATOM 0 HD21 LEU A 151 11.348 0.564 -14.342 1.00 1.00 H new ATOM 0 HD22 LEU A 151 10.424 -0.917 -14.690 1.00 1.00 H new ATOM 0 HD23 LEU A 151 11.141 -0.673 -13.079 1.00 1.00 H new ATOM 2371 N THR A 152 11.883 -5.507 -12.941 1.00 1.00 N ATOM 2372 CA THR A 152 11.037 -6.686 -12.817 1.00 1.00 C ATOM 2373 C THR A 152 10.579 -6.862 -11.377 1.00 1.00 C ATOM 2374 O THR A 152 11.375 -6.708 -10.447 1.00 1.00 O ATOM 2375 CB THR A 152 11.778 -7.937 -13.277 1.00 1.00 C ATOM 2376 OG1 THR A 152 11.524 -8.197 -14.646 1.00 1.00 O ATOM 2377 CG2 THR A 152 11.401 -9.179 -12.487 1.00 1.00 C ATOM 0 H THR A 152 12.847 -5.708 -13.208 1.00 1.00 H new ATOM 0 HA THR A 152 10.165 -6.542 -13.455 1.00 1.00 H new ATOM 0 HB THR A 152 12.835 -7.728 -13.109 1.00 1.00 H new ATOM 0 HG1 THR A 152 12.010 -9.002 -14.922 1.00 1.00 H new ATOM 0 HG21 THR A 152 11.963 -10.034 -12.863 1.00 1.00 H new ATOM 0 HG22 THR A 152 11.636 -9.026 -11.434 1.00 1.00 H new ATOM 0 HG23 THR A 152 10.333 -9.370 -12.596 1.00 1.00 H new ATOM 2385 N HIS A 153 9.305 -7.181 -11.201 1.00 1.00 N ATOM 2386 CA HIS A 153 8.754 -7.369 -9.863 1.00 1.00 C ATOM 2387 C HIS A 153 7.611 -8.377 -9.863 1.00 1.00 C ATOM 2388 O HIS A 153 7.028 -8.677 -10.908 1.00 1.00 O ATOM 2389 CB HIS A 153 8.260 -6.039 -9.298 1.00 1.00 C ATOM 2390 CG HIS A 153 7.456 -5.229 -10.270 1.00 1.00 C ATOM 2391 ND1 HIS A 153 7.621 -3.964 -10.723 1.00 1.00 N flip ATOM 2392 CD2 HIS A 153 6.334 -5.718 -10.905 1.00 1.00 C flip ATOM 2393 CE1 HIS A 153 6.606 -3.714 -11.612 1.00 1.00 C flip ATOM 2394 NE2 HIS A 153 5.844 -4.788 -11.705 1.00 1.00 N flip ATOM 0 H HIS A 153 8.637 -7.315 -11.960 1.00 1.00 H new ATOM 0 HA HIS A 153 9.554 -7.758 -9.234 1.00 1.00 H new ATOM 0 HB2 HIS A 153 7.654 -6.234 -8.413 1.00 1.00 H new ATOM 0 HB3 HIS A 153 9.119 -5.452 -8.973 1.00 1.00 H new ATOM 0 HD1 HIS A 153 8.362 -3.317 -10.454 1.00 1.00 H new ATOM 0 HD2 HIS A 153 5.921 -6.706 -10.770 1.00 1.00 H new ATOM 0 HE1 HIS A 153 6.455 -2.789 -12.148 1.00 1.00 H new ATOM 2403 N THR A 154 7.283 -8.893 -8.681 1.00 1.00 N ATOM 2404 CA THR A 154 6.191 -9.859 -8.556 1.00 1.00 C ATOM 2405 C THR A 154 5.091 -9.310 -7.647 1.00 1.00 C ATOM 2406 O THR A 154 5.356 -8.887 -6.522 1.00 1.00 O ATOM 2407 CB THR A 154 6.721 -11.181 -7.997 1.00 1.00 C ATOM 2408 OG1 THR A 154 8.127 -11.296 -8.173 1.00 1.00 O ATOM 2409 CG2 THR A 154 6.082 -12.394 -8.642 1.00 1.00 C ATOM 0 H THR A 154 7.751 -8.663 -7.804 1.00 1.00 H new ATOM 0 HA THR A 154 5.769 -10.035 -9.545 1.00 1.00 H new ATOM 0 HB THR A 154 6.465 -11.161 -6.938 1.00 1.00 H new ATOM 0 HG1 THR A 154 8.434 -12.150 -7.804 1.00 1.00 H new ATOM 0 HG21 THR A 154 6.499 -13.301 -8.204 1.00 1.00 H new ATOM 0 HG22 THR A 154 5.005 -12.371 -8.473 1.00 1.00 H new ATOM 0 HG23 THR A 154 6.282 -12.384 -9.714 1.00 1.00 H new ATOM 2417 N TYR A 155 3.856 -9.331 -8.136 1.00 1.00 N ATOM 2418 CA TYR A 155 2.721 -8.836 -7.360 1.00 1.00 C ATOM 2419 C TYR A 155 1.906 -10.002 -6.834 1.00 1.00 C ATOM 2420 O TYR A 155 1.535 -10.906 -7.581 1.00 1.00 O ATOM 2421 CB TYR A 155 1.845 -7.928 -8.216 1.00 1.00 C ATOM 2422 CG TYR A 155 1.513 -6.617 -7.551 1.00 1.00 C ATOM 2423 CD1 TYR A 155 0.648 -6.565 -6.466 1.00 1.00 C ATOM 2424 CD2 TYR A 155 2.063 -5.428 -8.012 1.00 1.00 C ATOM 2425 CE1 TYR A 155 0.339 -5.362 -5.857 1.00 1.00 C ATOM 2426 CE2 TYR A 155 1.760 -4.221 -7.409 1.00 1.00 C ATOM 2427 CZ TYR A 155 0.897 -4.194 -6.332 1.00 1.00 C ATOM 2428 OH TYR A 155 0.598 -2.992 -5.738 1.00 1.00 O ATOM 0 H TYR A 155 3.614 -9.684 -9.062 1.00 1.00 H new ATOM 0 HA TYR A 155 3.100 -8.257 -6.517 1.00 1.00 H new ATOM 0 HB2 TYR A 155 2.353 -7.730 -9.160 1.00 1.00 H new ATOM 0 HB3 TYR A 155 0.919 -8.450 -8.456 1.00 1.00 H new ATOM 0 HD1 TYR A 155 0.210 -7.478 -6.092 1.00 1.00 H new ATOM 0 HD2 TYR A 155 2.738 -5.446 -8.855 1.00 1.00 H new ATOM 0 HE1 TYR A 155 -0.336 -5.338 -5.014 1.00 1.00 H new ATOM 0 HE2 TYR A 155 2.196 -3.305 -7.779 1.00 1.00 H new ATOM 0 HH TYR A 155 1.007 -2.263 -6.250 1.00 1.00 H new ATOM 2438 N GLU A 156 1.619 -9.981 -5.540 1.00 1.00 N ATOM 2439 CA GLU A 156 0.847 -11.052 -4.925 1.00 1.00 C ATOM 2440 C GLU A 156 -0.198 -10.507 -3.968 1.00 1.00 C ATOM 2441 O GLU A 156 0.010 -9.485 -3.309 1.00 1.00 O ATOM 2442 CB GLU A 156 1.767 -12.025 -4.197 1.00 1.00 C ATOM 2443 CG GLU A 156 2.940 -12.489 -5.053 1.00 1.00 C ATOM 2444 CD GLU A 156 3.630 -13.725 -4.500 1.00 1.00 C ATOM 2445 OE1 GLU A 156 3.038 -14.408 -3.638 1.00 1.00 O ATOM 2446 OE2 GLU A 156 4.767 -14.003 -4.933 1.00 1.00 O ATOM 0 H GLU A 156 1.906 -9.241 -4.900 1.00 1.00 H new ATOM 0 HA GLU A 156 0.328 -11.583 -5.723 1.00 1.00 H new ATOM 0 HB2 GLU A 156 2.149 -11.549 -3.294 1.00 1.00 H new ATOM 0 HB3 GLU A 156 1.190 -12.894 -3.879 1.00 1.00 H new ATOM 0 HG2 GLU A 156 2.585 -12.699 -6.062 1.00 1.00 H new ATOM 0 HG3 GLU A 156 3.666 -11.680 -5.133 1.00 1.00 H new ATOM 2453 N VAL A 157 -1.329 -11.205 -3.865 1.00 1.00 N ATOM 2454 CA VAL A 157 -2.404 -10.801 -2.969 1.00 1.00 C ATOM 2455 C VAL A 157 -2.662 -11.883 -1.928 1.00 1.00 C ATOM 2456 O VAL A 157 -2.796 -13.068 -2.260 1.00 1.00 O ATOM 2457 CB VAL A 157 -3.705 -10.526 -3.747 1.00 1.00 C ATOM 2458 CG1 VAL A 157 -4.025 -9.038 -3.733 1.00 1.00 C ATOM 2459 CG2 VAL A 157 -3.593 -11.051 -5.171 1.00 1.00 C ATOM 0 H VAL A 157 -1.521 -12.055 -4.394 1.00 1.00 H new ATOM 0 HA VAL A 157 -2.091 -9.882 -2.473 1.00 1.00 H new ATOM 0 HB VAL A 157 -4.525 -11.052 -3.259 1.00 1.00 H new ATOM 0 HG11 VAL A 157 -4.947 -8.859 -4.287 1.00 1.00 H new ATOM 0 HG12 VAL A 157 -4.149 -8.702 -2.703 1.00 1.00 H new ATOM 0 HG13 VAL A 157 -3.209 -8.486 -4.199 1.00 1.00 H new ATOM 0 HG21 VAL A 157 -4.520 -10.849 -5.707 1.00 1.00 H new ATOM 0 HG22 VAL A 157 -2.765 -10.555 -5.678 1.00 1.00 H new ATOM 0 HG23 VAL A 157 -3.413 -12.126 -5.149 1.00 1.00 H new ATOM 2469 N TRP A 158 -2.695 -11.478 -0.658 1.00 1.00 N ATOM 2470 CA TRP A 158 -2.902 -12.415 0.445 1.00 1.00 C ATOM 2471 C TRP A 158 -4.251 -12.208 1.131 1.00 1.00 C ATOM 2472 O TRP A 158 -4.690 -11.085 1.339 1.00 1.00 O ATOM 2473 CB TRP A 158 -1.779 -12.292 1.472 1.00 1.00 C ATOM 2474 CG TRP A 158 -0.408 -12.510 0.890 1.00 1.00 C ATOM 2475 CD1 TRP A 158 0.148 -11.838 -0.161 1.00 1.00 C ATOM 2476 CD2 TRP A 158 0.571 -13.463 1.320 1.00 1.00 C ATOM 2477 NE1 TRP A 158 1.411 -12.318 -0.412 1.00 1.00 N ATOM 2478 CE2 TRP A 158 1.694 -13.315 0.484 1.00 1.00 C ATOM 2479 CE3 TRP A 158 0.607 -14.428 2.331 1.00 1.00 C ATOM 2480 CZ2 TRP A 158 2.838 -14.096 0.629 1.00 1.00 C ATOM 2481 CZ3 TRP A 158 1.743 -15.202 2.474 1.00 1.00 C ATOM 2482 CH2 TRP A 158 2.845 -15.032 1.627 1.00 1.00 C ATOM 0 H TRP A 158 -2.581 -10.507 -0.368 1.00 1.00 H new ATOM 0 HA TRP A 158 -2.895 -13.417 0.016 1.00 1.00 H new ATOM 0 HB2 TRP A 158 -1.819 -11.302 1.926 1.00 1.00 H new ATOM 0 HB3 TRP A 158 -1.946 -13.016 2.270 1.00 1.00 H new ATOM 0 HD1 TRP A 158 -0.334 -11.045 -0.714 1.00 1.00 H new ATOM 0 HE1 TRP A 158 2.036 -11.986 -1.146 1.00 1.00 H new ATOM 0 HE3 TRP A 158 -0.238 -14.566 2.989 1.00 1.00 H new ATOM 0 HZ2 TRP A 158 3.689 -13.967 -0.023 1.00 1.00 H new ATOM 0 HZ3 TRP A 158 1.781 -15.950 3.252 1.00 1.00 H new ATOM 0 HH2 TRP A 158 3.718 -15.652 1.764 1.00 1.00 H new ATOM 2493 N GLN A 159 -4.881 -13.322 1.502 1.00 1.00 N ATOM 2494 CA GLN A 159 -6.165 -13.298 2.195 1.00 1.00 C ATOM 2495 C GLN A 159 -6.199 -14.364 3.283 1.00 1.00 C ATOM 2496 O GLN A 159 -5.494 -15.366 3.206 1.00 1.00 O ATOM 2497 CB GLN A 159 -7.303 -13.517 1.204 1.00 1.00 C ATOM 2498 CG GLN A 159 -7.618 -12.298 0.339 1.00 1.00 C ATOM 2499 CD GLN A 159 -9.109 -12.123 0.101 1.00 1.00 C ATOM 2500 OE1 GLN A 159 -9.573 -12.030 -1.035 1.00 1.00 O ATOM 2501 NE2 GLN A 159 -9.866 -12.071 1.191 1.00 1.00 N ATOM 0 H GLN A 159 -4.517 -14.260 1.331 1.00 1.00 H new ATOM 0 HA GLN A 159 -6.291 -12.321 2.662 1.00 1.00 H new ATOM 0 HB2 GLN A 159 -7.049 -14.355 0.554 1.00 1.00 H new ATOM 0 HB3 GLN A 159 -8.200 -13.801 1.754 1.00 1.00 H new ATOM 0 HG2 GLN A 159 -7.223 -11.403 0.820 1.00 1.00 H new ATOM 0 HG3 GLN A 159 -7.109 -12.396 -0.620 1.00 1.00 H new ATOM 0 HE21 GLN A 159 -9.438 -12.153 2.113 1.00 1.00 H new ATOM 0 HE22 GLN A 159 -10.875 -11.950 1.106 1.00 1.00 H new ATOM 2510 N LYS A 160 -7.030 -14.155 4.292 1.00 1.00 N ATOM 2511 CA LYS A 160 -7.151 -15.115 5.384 1.00 1.00 C ATOM 2512 C LYS A 160 -7.767 -16.415 4.885 1.00 1.00 C ATOM 2513 O LYS A 160 -8.743 -16.395 4.139 1.00 1.00 O ATOM 2514 CB LYS A 160 -8.012 -14.539 6.504 1.00 1.00 C ATOM 2515 CG LYS A 160 -8.731 -15.613 7.309 1.00 1.00 C ATOM 2516 CD LYS A 160 -9.201 -15.087 8.656 1.00 1.00 C ATOM 2517 CE LYS A 160 -10.260 -15.992 9.264 1.00 1.00 C ATOM 2518 NZ LYS A 160 -11.075 -15.273 10.283 1.00 1.00 N ATOM 0 H LYS A 160 -7.629 -13.334 4.380 1.00 1.00 H new ATOM 0 HA LYS A 160 -6.152 -15.320 5.770 1.00 1.00 H new ATOM 0 HB2 LYS A 160 -7.384 -13.950 7.172 1.00 1.00 H new ATOM 0 HB3 LYS A 160 -8.748 -13.858 6.076 1.00 1.00 H new ATOM 0 HG2 LYS A 160 -9.587 -15.980 6.743 1.00 1.00 H new ATOM 0 HG3 LYS A 160 -8.063 -16.461 7.462 1.00 1.00 H new ATOM 0 HD2 LYS A 160 -8.352 -15.010 9.335 1.00 1.00 H new ATOM 0 HD3 LYS A 160 -9.605 -14.082 8.535 1.00 1.00 H new ATOM 0 HE2 LYS A 160 -10.912 -16.371 8.477 1.00 1.00 H new ATOM 0 HE3 LYS A 160 -9.781 -16.856 9.724 1.00 1.00 H new ATOM 0 HZ1 LYS A 160 -11.787 -15.920 10.677 1.00 1.00 H new ATOM 0 HZ2 LYS A 160 -10.456 -14.933 11.046 1.00 1.00 H new ATOM 0 HZ3 LYS A 160 -11.552 -14.463 9.838 1.00 1.00 H new ATOM 2532 N LYS A 161 -7.199 -17.536 5.311 1.00 1.00 N ATOM 2533 CA LYS A 161 -7.709 -18.838 4.904 1.00 1.00 C ATOM 2534 C LYS A 161 -9.092 -19.088 5.499 1.00 1.00 C ATOM 2535 O LYS A 161 -9.319 -18.813 6.679 1.00 1.00 O ATOM 2536 CB LYS A 161 -6.751 -19.960 5.339 1.00 1.00 C ATOM 2537 CG LYS A 161 -6.526 -20.019 6.838 1.00 1.00 C ATOM 2538 CD LYS A 161 -6.710 -21.421 7.379 1.00 1.00 C ATOM 2539 CE LYS A 161 -5.465 -22.275 7.150 1.00 1.00 C ATOM 2540 NZ LYS A 161 -5.626 -23.655 7.703 1.00 1.00 N ATOM 0 H LYS A 161 -6.391 -17.570 5.933 1.00 1.00 H new ATOM 0 HA LYS A 161 -7.785 -18.839 3.817 1.00 1.00 H new ATOM 0 HB2 LYS A 161 -7.149 -20.917 5.002 1.00 1.00 H new ATOM 0 HB3 LYS A 161 -5.791 -19.820 4.841 1.00 1.00 H new ATOM 0 HG2 LYS A 161 -5.520 -19.670 7.069 1.00 1.00 H new ATOM 0 HG3 LYS A 161 -7.220 -19.343 7.337 1.00 1.00 H new ATOM 0 HD2 LYS A 161 -6.930 -21.375 8.446 1.00 1.00 H new ATOM 0 HD3 LYS A 161 -7.568 -21.889 6.896 1.00 1.00 H new ATOM 0 HE2 LYS A 161 -5.257 -22.334 6.082 1.00 1.00 H new ATOM 0 HE3 LYS A 161 -4.605 -21.795 7.616 1.00 1.00 H new ATOM 0 HZ1 LYS A 161 -4.760 -24.203 7.527 1.00 1.00 H new ATOM 0 HZ2 LYS A 161 -5.799 -23.601 8.727 1.00 1.00 H new ATOM 0 HZ3 LYS A 161 -6.431 -24.123 7.240 1.00 1.00 H new ATOM 2554 N ALA A 162 -10.009 -19.605 4.688 1.00 1.00 N ATOM 2555 CA ALA A 162 -11.363 -19.885 5.147 1.00 1.00 C ATOM 2556 C ALA A 162 -11.437 -21.262 5.791 1.00 1.00 C ATOM 2557 O ALA A 162 -12.478 -21.563 6.418 1.00 1.00 O ATOM 2558 CB ALA A 162 -12.334 -19.791 3.983 1.00 1.00 C ATOM 2559 OXT ALA A 162 -10.461 -22.033 5.671 1.00 1.00 O ATOM 0 H ALA A 162 -9.838 -19.838 3.710 1.00 1.00 H new ATOM 0 HA ALA A 162 -11.638 -19.144 5.897 1.00 1.00 H new ATOM 0 HB1 ALA A 162 -13.344 -20.002 4.334 1.00 1.00 H new ATOM 0 HB2 ALA A 162 -12.299 -18.787 3.560 1.00 1.00 H new ATOM 0 HB3 ALA A 162 -12.057 -20.517 3.218 1.00 1.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 3.250 5.745 12.477 1.00 1.00 P HETATM 2567 O1A NDP A 170 4.045 6.713 13.257 1.00 1.00 O HETATM 2568 O2A NDP A 170 2.820 4.506 13.163 1.00 1.00 O HETATM 2569 O5B NDP A 170 2.035 6.457 11.734 1.00 1.00 O HETATM 2570 C5B NDP A 170 2.261 7.533 10.809 1.00 1.00 C HETATM 2571 C4B NDP A 170 1.724 8.823 11.382 1.00 1.00 C HETATM 2572 O4B NDP A 170 0.294 8.694 11.613 1.00 1.00 O HETATM 2573 C3B NDP A 170 2.311 9.225 12.728 1.00 1.00 C HETATM 2574 O3B NDP A 170 3.495 10.002 12.533 1.00 1.00 O HETATM 2575 C2B NDP A 170 1.197 10.059 13.342 1.00 1.00 C HETATM 2576 O2B NDP A 170 1.211 11.417 12.939 1.00 1.00 O HETATM 2577 C1B NDP A 170 -0.050 9.342 12.823 1.00 1.00 C HETATM 2578 N9A NDP A 170 -0.571 8.336 13.752 1.00 1.00 N HETATM 2579 C8A NDP A 170 -0.008 7.131 14.096 1.00 1.00 C HETATM 2580 N7A NDP A 170 -0.722 6.442 14.951 1.00 1.00 N HETATM 2581 C5A NDP A 170 -1.828 7.248 15.187 1.00 1.00 C HETATM 2582 C6A NDP A 170 -2.907 7.128 16.076 1.00 1.00 C HETATM 2583 N6A NDP A 170 -3.111 6.057 16.842 1.00 1.00 N HETATM 2584 N1A NDP A 170 -3.773 8.161 16.165 1.00 1.00 N HETATM 2585 C2A NDP A 170 -3.562 9.235 15.398 1.00 1.00 C HETATM 2586 N3A NDP A 170 -2.590 9.464 14.516 1.00 1.00 N HETATM 2587 C4A NDP A 170 -1.742 8.413 14.459 1.00 1.00 C HETATM 2588 O3 NDP A 170 4.106 5.317 11.135 1.00 1.00 O HETATM 2589 PN NDP A 170 5.662 4.875 10.830 1.00 1.00 P HETATM 2590 O1N NDP A 170 6.489 6.095 10.849 1.00 1.00 O HETATM 2591 O2N NDP A 170 6.029 3.788 11.760 1.00 1.00 O HETATM 2592 O5D NDP A 170 5.437 4.334 9.346 1.00 1.00 O HETATM 2593 C5D NDP A 170 5.406 5.241 8.228 1.00 1.00 C HETATM 2594 C4D NDP A 170 6.705 5.185 7.465 1.00 1.00 C HETATM 2595 O4D NDP A 170 7.061 3.795 7.230 1.00 1.00 O HETATM 2596 C3D NDP A 170 6.666 5.831 6.086 1.00 1.00 C HETATM 2597 O3D NDP A 170 7.017 7.223 6.162 1.00 1.00 O HETATM 2598 C2D NDP A 170 7.730 5.043 5.327 1.00 1.00 C HETATM 2599 O2D NDP A 170 9.056 5.513 5.531 1.00 1.00 O HETATM 2600 C1D NDP A 170 7.540 3.641 5.900 1.00 1.00 C HETATM 2601 N1N NDP A 170 6.575 2.838 5.159 1.00 1.00 N HETATM 2602 C2N NDP A 170 6.748 2.056 4.106 1.00 1.00 C HETATM 2603 C3N NDP A 170 5.845 1.361 3.497 1.00 1.00 C HETATM 2604 C7N NDP A 170 6.421 0.670 2.378 1.00 1.00 C HETATM 2605 O7N NDP A 170 5.698 -0.413 2.257 1.00 1.00 O HETATM 2606 N7N NDP A 170 7.480 0.975 1.588 1.00 1.00 N HETATM 2607 C4N NDP A 170 4.447 1.417 4.041 1.00 1.00 C HETATM 2608 C5N NDP A 170 4.194 2.250 5.180 1.00 1.00 C HETATM 2609 C6N NDP A 170 5.180 2.987 5.789 1.00 1.00 C HETATM 2610 P2B NDP A 170 2.224 12.629 13.483 1.00 1.00 P HETATM 2611 O1X NDP A 170 3.020 12.859 12.139 1.00 1.00 O HETATM 2612 O2X NDP A 170 1.221 13.762 13.679 1.00 1.00 O HETATM 2613 O3X NDP A 170 3.091 11.844 14.462 1.00 1.00 O HETATM 0 HO3N NDP A 170 7.142 7.579 5.257 1.00 1.00 H new HETATM 0 HO3A NDP A 170 3.714 10.477 13.361 1.00 1.00 H new HETATM 0 HO2N NDP A 170 9.681 4.961 5.017 1.00 1.00 H new HETATM 0 H72N NDP A 170 7.745 0.350 0.826 1.00 1.00 H new HETATM 0 H71N NDP A 170 8.012 1.829 1.755 1.00 1.00 H new HETATM 0 H62A NDP A 170 -3.914 6.025 17.471 1.00 1.00 H new HETATM 0 H61A NDP A 170 -2.465 5.269 16.800 1.00 1.00 H new HETATM 0 H52N NDP A 170 4.578 4.984 7.567 1.00 1.00 H new HETATM 0 H52A NDP A 170 3.327 7.631 10.605 1.00 1.00 H new HETATM 0 H51N NDP A 170 5.229 6.257 8.581 1.00 1.00 H new HETATM 0 H51A NDP A 170 1.773 7.316 9.859 1.00 1.00 H new HETATM 0 H42N NDP A 170 3.790 1.746 3.236 1.00 1.00 H new HETATM 0 H41N NDP A 170 4.150 0.401 4.300 1.00 1.00 H new HETATM 0 H8A NDP A 170 0.943 6.781 13.695 1.00 1.00 H new HETATM 0 H6N NDP A 170 4.989 3.627 6.651 1.00 1.00 H new HETATM 0 H5N NDP A 170 3.180 2.300 5.578 1.00 1.00 H new HETATM 0 H4D NDP A 170 7.415 5.732 8.085 1.00 1.00 H new HETATM 0 H4B NDP A 170 1.993 9.578 10.644 1.00 1.00 H new HETATM 0 H3D NDP A 170 5.682 5.803 5.617 1.00 1.00 H new HETATM 0 H3B NDP A 170 2.606 8.383 13.355 1.00 1.00 H new HETATM 0 H2N NDP A 170 7.761 1.991 3.710 1.00 1.00 H new HETATM 0 H2D NDP A 170 7.612 5.119 4.246 1.00 1.00 H new HETATM 0 H2B NDP A 170 1.274 10.121 14.427 1.00 1.00 H new HETATM 0 H2A NDP A 170 -4.290 10.039 15.510 1.00 1.00 H new HETATM 0 H1D NDP A 170 8.496 3.121 5.844 1.00 1.00 H new HETATM 0 H1B NDP A 170 -0.830 10.092 12.692 1.00 1.00 H new