USER MOD reduce.3.24.130724 H: found=0, std=0, add=962, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 78 SER OG : rot 7:sc= 0.412 USER MOD Set 1.2: A 105 HIS : no HE2:sc= -0.482! C(o=-0.07!,f=-4.1!) USER MOD Set 2.1: A 87 THR OG1 : rot -76:sc= 1.19 USER MOD Set 2.2: A 90 SER OG : rot -45:sc= -1.03! USER MOD Set 3.1: A 21 SER OG : rot 114:sc= 0.747 USER MOD Set 3.2: A 25 TYR OH : rot 33:sc= 0.0503 USER MOD Set 3.3: A 48 HIS : no HE2:sc= -4.56! C(o=-3.1!,f=-17!) USER MOD Set 3.4: A 82 THR OG1 : rot 129:sc= 0.618 USER MOD Set 4.1: A 73 TYR OH : rot 72:sc= 2.28 USER MOD Set 4.2: A 115 TYR OH : rot -167:sc= 0.98 USER MOD Set 5.1: A 67 ASN : amide:sc= -3.74 K(o=-3.2,f=-11!) USER MOD Set 5.2: A 69 GLN : amide:sc= 0.493 K(o=-3.2,f=-4.2) USER MOD Set 6.1: A 30 MET CE :methyl 173:sc= -6.76! (180deg=-6.86!) USER MOD Set 6.2: A 44 ASN : amide:sc= -3.76 K(o=-11,f=-14!) USER MOD Set 7.1: A 34 ASN : amide:sc= 0.152 X(o=0.3,f=0) USER MOD Set 7.2: A 37 GLN : amide:sc= 0.145 X(o=0.3,f=0) USER MOD Set 8.1: A 24 THR OG1 : rot 180:sc= 0.0113 USER MOD Set 8.2: A 28 GLN : amide:sc= 0 X(o=0.011,f=0.012) USER MOD Single : A 1 LYS N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0227 USER MOD Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 GLN : amide:sc= -1.13 K(o=-1.1,f=-1.7) USER MOD Single : A 11 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HD1:sc= -7.07! C(o=-7.1!,f=-4.6!) USER MOD Single : A 13 MET CE :methyl 159:sc= -1.83 (180deg=-4.11!) USER MOD Single : A 15 SER OG : rot -33:sc= 0.318 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 SER OG : rot 180:sc= -0.366 USER MOD Single : A 20 SER OG : rot -59:sc= 0.273 USER MOD Single : A 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 27 ASN : amide:sc= -5.86! C(o=-5.9!,f=-6.9!) USER MOD Single : A 29 MET CE :methyl -135:sc= -1.09 (180deg=-1.84!) USER MOD Single : A 35 MET CE :methyl 180:sc=-0.00932 (180deg=-0.00932) USER MOD Single : A 36 THR OG1 : rot 120:sc= -0.927 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 180:sc=-0.00511 USER MOD Single : A 55 GLN : amide:sc= -8.67! C(o=-8.7!,f=-5!) USER MOD Single : A 56 ASN : amide:sc= -2.32! K(o=-2.3!,f=-1.2) USER MOD Single : A 60 GLN : amide:sc= -0.566 X(o=-0.57,f=-0.089) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 THR OG1 : rot 180:sc= 0.0146 USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 ASN : amide:sc= -3.93! K(o=-3.9!,f=-1.7) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 SER OG : rot 98:sc= -0.567 USER MOD Single : A 76 ASN : amide:sc= -2.44! K(o=-2.4!,f=-0.95) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 79 MET CE :methyl -113:sc= -1.12 (180deg=-2.52!) USER MOD Single : A 80 HIS : no HD1:sc= -0.794 K(o=-0.79,f=-0.078) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.95) USER MOD Single : A 92 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -0.998 K(o=-1,f=-2.1!) USER MOD Single : A 97 TYR OH : rot 63:sc= -0.13 USER MOD Single : A 99 THR OG1 : rot 139:sc= 0.89 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 102 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 SER OG : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HD1:sc= -4.86! C(o=-4.9!,f=-1.8!) USER MOD Single : A 123 SER OG : rot 180:sc= 0 USER MOD Single : A 127 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 3.049 -1.040 -0.580 1.00 12.55 N ATOM 2 CA LYS A 1 1.813 -0.463 -1.096 1.00 1.34 C ATOM 3 C LYS A 1 1.413 -1.122 -2.411 1.00 75.52 C ATOM 4 O LYS A 1 2.254 -1.366 -3.275 1.00 4.40 O ATOM 5 CB LYS A 1 1.976 1.046 -1.298 1.00 34.51 C ATOM 6 CG LYS A 1 0.877 1.868 -0.648 1.00 13.30 C ATOM 7 CD LYS A 1 0.297 2.887 -1.615 1.00 4.53 C ATOM 8 CE LYS A 1 -1.089 2.480 -2.090 1.00 22.21 C ATOM 9 NZ LYS A 1 -1.202 2.524 -3.574 1.00 43.51 N ATOM 0 H1 LYS A 1 3.301 -0.576 0.316 1.00 12.55 H new ATOM 0 H2 LYS A 1 2.915 -2.058 -0.416 1.00 12.55 H new ATOM 0 H3 LYS A 1 3.813 -0.898 -1.271 1.00 12.55 H new ATOM 0 HA LYS A 1 1.024 -0.643 -0.365 1.00 1.34 H new ATOM 0 HB2 LYS A 1 2.939 1.357 -0.892 1.00 34.51 H new ATOM 0 HB3 LYS A 1 1.996 1.261 -2.366 1.00 34.51 H new ATOM 0 HG2 LYS A 1 0.085 1.206 -0.297 1.00 13.30 H new ATOM 0 HG3 LYS A 1 1.275 2.381 0.228 1.00 13.30 H new ATOM 0 HD2 LYS A 1 0.245 3.862 -1.130 1.00 4.53 H new ATOM 0 HD3 LYS A 1 0.960 2.994 -2.474 1.00 4.53 H new ATOM 0 HE2 LYS A 1 -1.312 1.473 -1.739 1.00 22.21 H new ATOM 0 HE3 LYS A 1 -1.833 3.143 -1.649 1.00 22.21 H new ATOM 0 HZ1 LYS A 1 -2.161 2.240 -3.858 1.00 43.51 H new ATOM 0 HZ2 LYS A 1 -1.014 3.491 -3.908 1.00 43.51 H new ATOM 0 HZ3 LYS A 1 -0.509 1.872 -3.994 1.00 43.51 H new ATOM 23 N GLU A 2 0.122 -1.408 -2.556 1.00 42.12 N ATOM 24 CA GLU A 2 -0.388 -2.039 -3.768 1.00 14.24 C ATOM 25 C GLU A 2 -1.532 -1.224 -4.365 1.00 32.12 C ATOM 26 O GLU A 2 -2.522 -0.938 -3.691 1.00 51.14 O ATOM 27 CB GLU A 2 -0.864 -3.462 -3.467 1.00 0.33 C ATOM 28 CG GLU A 2 -1.577 -4.125 -4.633 1.00 41.32 C ATOM 29 CD GLU A 2 -0.976 -5.469 -4.996 1.00 52.23 C ATOM 30 OE1 GLU A 2 -0.396 -6.121 -4.103 1.00 54.12 O ATOM 31 OE2 GLU A 2 -1.087 -5.868 -6.174 1.00 64.35 O ATOM 0 H GLU A 2 -0.588 -1.213 -1.850 1.00 42.12 H new ATOM 0 HA GLU A 2 0.423 -2.081 -4.495 1.00 14.24 H new ATOM 0 HB2 GLU A 2 -0.005 -4.071 -3.184 1.00 0.33 H new ATOM 0 HB3 GLU A 2 -1.535 -3.438 -2.608 1.00 0.33 H new ATOM 0 HG2 GLU A 2 -2.630 -4.258 -4.383 1.00 41.32 H new ATOM 0 HG3 GLU A 2 -1.536 -3.467 -5.501 1.00 41.32 H new ATOM 38 N SER A 3 -1.388 -0.853 -5.633 1.00 23.40 N ATOM 39 CA SER A 3 -2.406 -0.068 -6.320 1.00 41.25 C ATOM 40 C SER A 3 -3.718 -0.841 -6.413 1.00 10.33 C ATOM 41 O SER A 3 -3.804 -1.992 -5.985 1.00 53.02 O ATOM 42 CB SER A 3 -1.926 0.313 -7.722 1.00 42.52 C ATOM 43 OG SER A 3 -2.651 1.422 -8.226 1.00 34.41 O ATOM 0 H SER A 3 -0.576 -1.084 -6.205 1.00 23.40 H new ATOM 0 HA SER A 3 -2.580 0.840 -5.743 1.00 41.25 H new ATOM 0 HB2 SER A 3 -0.863 0.552 -7.693 1.00 42.52 H new ATOM 0 HB3 SER A 3 -2.043 -0.538 -8.393 1.00 42.52 H new ATOM 0 HG SER A 3 -2.324 1.647 -9.122 1.00 34.41 H new ATOM 49 N ARG A 4 -4.737 -0.199 -6.974 1.00 14.32 N ATOM 50 CA ARG A 4 -6.046 -0.824 -7.122 1.00 20.23 C ATOM 51 C ARG A 4 -6.120 -1.630 -8.415 1.00 72.41 C ATOM 52 O ARG A 4 -6.408 -2.827 -8.397 1.00 2.23 O ATOM 53 CB ARG A 4 -7.147 0.238 -7.106 1.00 71.41 C ATOM 54 CG ARG A 4 -8.539 -0.325 -7.343 1.00 51.11 C ATOM 55 CD ARG A 4 -9.436 -0.119 -6.133 1.00 35.43 C ATOM 56 NE ARG A 4 -9.747 -1.379 -5.461 1.00 43.41 N ATOM 57 CZ ARG A 4 -8.938 -1.962 -4.584 1.00 31.14 C ATOM 58 NH1 ARG A 4 -7.777 -1.403 -4.273 1.00 1.50 N ATOM 59 NH2 ARG A 4 -9.291 -3.108 -4.014 1.00 44.34 N ATOM 0 H ARG A 4 -4.682 0.754 -7.334 1.00 14.32 H new ATOM 0 HA ARG A 4 -6.194 -1.503 -6.282 1.00 20.23 H new ATOM 0 HB2 ARG A 4 -7.131 0.752 -6.145 1.00 71.41 H new ATOM 0 HB3 ARG A 4 -6.931 0.985 -7.870 1.00 71.41 H new ATOM 0 HG2 ARG A 4 -8.984 0.157 -8.214 1.00 51.11 H new ATOM 0 HG3 ARG A 4 -8.469 -1.389 -7.568 1.00 51.11 H new ATOM 0 HD2 ARG A 4 -8.947 0.556 -5.430 1.00 35.43 H new ATOM 0 HD3 ARG A 4 -10.362 0.363 -6.446 1.00 35.43 H new ATOM 0 HE ARG A 4 -10.633 -1.835 -5.677 1.00 43.41 H new ATOM 0 HH11 ARG A 4 -7.502 -0.522 -4.708 1.00 1.50 H new ATOM 0 HH12 ARG A 4 -7.158 -1.854 -3.599 1.00 1.50 H new ATOM 0 HH21 ARG A 4 -10.184 -3.541 -4.250 1.00 44.34 H new ATOM 0 HH22 ARG A 4 -8.669 -3.555 -3.340 1.00 44.34 H new ATOM 73 N ALA A 5 -5.859 -0.966 -9.536 1.00 73.01 N ATOM 74 CA ALA A 5 -5.895 -1.621 -10.838 1.00 11.30 C ATOM 75 C ALA A 5 -5.129 -2.939 -10.811 1.00 33.13 C ATOM 76 O ALA A 5 -5.640 -3.975 -11.238 1.00 43.33 O ATOM 77 CB ALA A 5 -5.327 -0.700 -11.908 1.00 5.15 C ATOM 0 H ALA A 5 -5.620 0.025 -9.569 1.00 73.01 H new ATOM 0 HA ALA A 5 -6.935 -1.841 -11.078 1.00 11.30 H new ATOM 0 HB1 ALA A 5 -5.360 -1.202 -12.875 1.00 5.15 H new ATOM 0 HB2 ALA A 5 -5.919 0.214 -11.953 1.00 5.15 H new ATOM 0 HB3 ALA A 5 -4.294 -0.451 -11.663 1.00 5.15 H new ATOM 83 N LYS A 6 -3.901 -2.894 -10.306 1.00 31.21 N ATOM 84 CA LYS A 6 -3.064 -4.085 -10.222 1.00 42.10 C ATOM 85 C LYS A 6 -3.880 -5.293 -9.773 1.00 64.22 C ATOM 86 O LYS A 6 -3.674 -6.408 -10.254 1.00 50.34 O ATOM 87 CB LYS A 6 -1.904 -3.851 -9.252 1.00 2.53 C ATOM 88 CG LYS A 6 -0.570 -3.626 -9.942 1.00 5.22 C ATOM 89 CD LYS A 6 0.050 -4.936 -10.398 1.00 21.12 C ATOM 90 CE LYS A 6 1.381 -5.193 -9.708 1.00 42.01 C ATOM 91 NZ LYS A 6 2.077 -6.383 -10.271 1.00 41.03 N ATOM 0 H LYS A 6 -3.463 -2.045 -9.948 1.00 31.21 H new ATOM 0 HA LYS A 6 -2.664 -4.288 -11.215 1.00 42.10 H new ATOM 0 HB2 LYS A 6 -2.131 -2.986 -8.629 1.00 2.53 H new ATOM 0 HB3 LYS A 6 -1.819 -4.710 -8.587 1.00 2.53 H new ATOM 0 HG2 LYS A 6 -0.710 -2.970 -10.801 1.00 5.22 H new ATOM 0 HG3 LYS A 6 0.112 -3.117 -9.260 1.00 5.22 H new ATOM 0 HD2 LYS A 6 -0.635 -5.757 -10.187 1.00 21.12 H new ATOM 0 HD3 LYS A 6 0.197 -4.914 -11.478 1.00 21.12 H new ATOM 0 HE2 LYS A 6 2.019 -4.316 -9.812 1.00 42.01 H new ATOM 0 HE3 LYS A 6 1.214 -5.341 -8.641 1.00 42.01 H new ATOM 0 HZ1 LYS A 6 2.980 -6.524 -9.774 1.00 41.03 H new ATOM 0 HZ2 LYS A 6 1.479 -7.225 -10.149 1.00 41.03 H new ATOM 0 HZ3 LYS A 6 2.259 -6.232 -11.284 1.00 41.03 H new ATOM 105 N LYS A 7 -4.807 -5.065 -8.850 1.00 20.15 N ATOM 106 CA LYS A 7 -5.657 -6.134 -8.337 1.00 45.33 C ATOM 107 C LYS A 7 -6.403 -6.827 -9.473 1.00 0.23 C ATOM 108 O LYS A 7 -6.532 -8.051 -9.488 1.00 21.22 O ATOM 109 CB LYS A 7 -6.656 -5.576 -7.321 1.00 61.03 C ATOM 110 CG LYS A 7 -7.294 -6.642 -6.448 1.00 20.24 C ATOM 111 CD LYS A 7 -6.688 -6.657 -5.054 1.00 73.21 C ATOM 112 CE LYS A 7 -7.748 -6.893 -3.988 1.00 42.55 C ATOM 113 NZ LYS A 7 -7.299 -6.425 -2.648 1.00 13.23 N ATOM 0 H LYS A 7 -4.990 -4.149 -8.441 1.00 20.15 H new ATOM 0 HA LYS A 7 -5.019 -6.868 -7.844 1.00 45.33 H new ATOM 0 HB2 LYS A 7 -6.148 -4.853 -6.684 1.00 61.03 H new ATOM 0 HB3 LYS A 7 -7.440 -5.037 -7.853 1.00 61.03 H new ATOM 0 HG2 LYS A 7 -8.367 -6.462 -6.378 1.00 20.24 H new ATOM 0 HG3 LYS A 7 -7.165 -7.620 -6.913 1.00 20.24 H new ATOM 0 HD2 LYS A 7 -5.930 -7.438 -4.994 1.00 73.21 H new ATOM 0 HD3 LYS A 7 -6.185 -5.709 -4.865 1.00 73.21 H new ATOM 0 HE2 LYS A 7 -8.665 -6.373 -4.266 1.00 42.55 H new ATOM 0 HE3 LYS A 7 -7.986 -7.956 -3.941 1.00 42.55 H new ATOM 0 HZ1 LYS A 7 -8.048 -6.603 -1.949 1.00 13.23 H new ATOM 0 HZ2 LYS A 7 -6.438 -6.939 -2.371 1.00 13.23 H new ATOM 0 HZ3 LYS A 7 -7.096 -5.406 -2.686 1.00 13.23 H new ATOM 127 N PHE A 8 -6.892 -6.037 -10.423 1.00 2.54 N ATOM 128 CA PHE A 8 -7.625 -6.575 -11.562 1.00 51.35 C ATOM 129 C PHE A 8 -6.710 -7.412 -12.452 1.00 12.34 C ATOM 130 O PHE A 8 -6.949 -8.601 -12.660 1.00 13.22 O ATOM 131 CB PHE A 8 -8.248 -5.439 -12.377 1.00 63.25 C ATOM 132 CG PHE A 8 -8.371 -5.750 -13.842 1.00 33.33 C ATOM 133 CD1 PHE A 8 -9.507 -6.369 -14.338 1.00 71.25 C ATOM 134 CD2 PHE A 8 -7.352 -5.423 -14.721 1.00 71.34 C ATOM 135 CE1 PHE A 8 -9.623 -6.657 -15.685 1.00 61.22 C ATOM 136 CE2 PHE A 8 -7.462 -5.708 -16.069 1.00 74.44 C ATOM 137 CZ PHE A 8 -8.600 -6.325 -16.552 1.00 20.31 C ATOM 0 H PHE A 8 -6.794 -5.022 -10.426 1.00 2.54 H new ATOM 0 HA PHE A 8 -8.419 -7.218 -11.181 1.00 51.35 H new ATOM 0 HB2 PHE A 8 -9.237 -5.215 -11.977 1.00 63.25 H new ATOM 0 HB3 PHE A 8 -7.644 -4.540 -12.254 1.00 63.25 H new ATOM 0 HD1 PHE A 8 -10.311 -6.629 -13.665 1.00 71.25 H new ATOM 0 HD2 PHE A 8 -6.461 -4.940 -14.349 1.00 71.34 H new ATOM 0 HE1 PHE A 8 -10.513 -7.141 -16.059 1.00 61.22 H new ATOM 0 HE2 PHE A 8 -6.660 -5.449 -16.744 1.00 74.44 H new ATOM 0 HZ PHE A 8 -8.690 -6.547 -17.605 1.00 20.31 H new ATOM 147 N GLN A 9 -5.663 -6.781 -12.973 1.00 61.00 N ATOM 148 CA GLN A 9 -4.713 -7.467 -13.841 1.00 30.01 C ATOM 149 C GLN A 9 -4.292 -8.803 -13.238 1.00 65.01 C ATOM 150 O GLN A 9 -4.656 -9.865 -13.743 1.00 32.25 O ATOM 151 CB GLN A 9 -3.482 -6.590 -14.079 1.00 32.42 C ATOM 152 CG GLN A 9 -3.751 -5.396 -14.979 1.00 51.35 C ATOM 153 CD GLN A 9 -3.515 -4.072 -14.279 1.00 70.12 C ATOM 154 OE1 GLN A 9 -2.551 -3.917 -13.529 1.00 10.21 O ATOM 155 NE2 GLN A 9 -4.396 -3.109 -14.521 1.00 52.41 N ATOM 0 H GLN A 9 -5.451 -5.797 -12.810 1.00 61.00 H new ATOM 0 HA GLN A 9 -5.203 -7.658 -14.795 1.00 30.01 H new ATOM 0 HB2 GLN A 9 -3.109 -6.234 -13.119 1.00 32.42 H new ATOM 0 HB3 GLN A 9 -2.693 -7.198 -14.522 1.00 32.42 H new ATOM 0 HG2 GLN A 9 -3.110 -5.457 -15.858 1.00 51.35 H new ATOM 0 HG3 GLN A 9 -4.781 -5.437 -15.332 1.00 51.35 H new ATOM 0 HE21 GLN A 9 -5.180 -3.282 -15.150 1.00 52.41 H new ATOM 0 HE22 GLN A 9 -4.289 -2.196 -14.078 1.00 52.41 H new ATOM 164 N ARG A 10 -3.521 -8.742 -12.157 1.00 35.03 N ATOM 165 CA ARG A 10 -3.049 -9.947 -11.486 1.00 60.42 C ATOM 166 C ARG A 10 -4.173 -10.970 -11.350 1.00 72.15 C ATOM 167 O ARG A 10 -3.922 -12.161 -11.170 1.00 32.23 O ATOM 168 CB ARG A 10 -2.489 -9.602 -10.105 1.00 35.21 C ATOM 169 CG ARG A 10 -0.982 -9.408 -10.089 1.00 71.15 C ATOM 170 CD ARG A 10 -0.387 -9.777 -8.740 1.00 24.32 C ATOM 171 NE ARG A 10 -0.427 -11.217 -8.499 1.00 64.24 N ATOM 172 CZ ARG A 10 -0.393 -11.761 -7.288 1.00 22.30 C ATOM 173 NH1 ARG A 10 -0.319 -10.989 -6.213 1.00 33.13 N ATOM 174 NH2 ARG A 10 -0.433 -13.080 -7.150 1.00 70.45 N ATOM 0 H ARG A 10 -3.210 -7.871 -11.727 1.00 35.03 H new ATOM 0 HA ARG A 10 -2.256 -10.383 -12.093 1.00 60.42 H new ATOM 0 HB2 ARG A 10 -2.968 -8.691 -9.746 1.00 35.21 H new ATOM 0 HB3 ARG A 10 -2.752 -10.397 -9.407 1.00 35.21 H new ATOM 0 HG2 ARG A 10 -0.527 -10.020 -10.868 1.00 71.15 H new ATOM 0 HG3 ARG A 10 -0.745 -8.369 -10.320 1.00 71.15 H new ATOM 0 HD2 ARG A 10 0.645 -9.430 -8.692 1.00 24.32 H new ATOM 0 HD3 ARG A 10 -0.933 -9.262 -7.950 1.00 24.32 H new ATOM 0 HE ARG A 10 -0.484 -11.839 -9.305 1.00 64.24 H new ATOM 0 HH11 ARG A 10 -0.288 -9.975 -6.315 1.00 33.13 H new ATOM 0 HH12 ARG A 10 -0.293 -11.409 -5.284 1.00 33.13 H new ATOM 0 HH21 ARG A 10 -0.490 -13.678 -7.975 1.00 70.45 H new ATOM 0 HH22 ARG A 10 -0.407 -13.496 -6.219 1.00 70.45 H new ATOM 188 N GLN A 11 -5.412 -10.496 -11.438 1.00 44.34 N ATOM 189 CA GLN A 11 -6.574 -11.369 -11.324 1.00 64.11 C ATOM 190 C GLN A 11 -6.830 -12.108 -12.633 1.00 62.42 C ATOM 191 O GLN A 11 -6.693 -13.330 -12.705 1.00 63.14 O ATOM 192 CB GLN A 11 -7.810 -10.559 -10.932 1.00 13.13 C ATOM 193 CG GLN A 11 -8.487 -11.057 -9.665 1.00 11.22 C ATOM 194 CD GLN A 11 -9.906 -11.532 -9.909 1.00 42.21 C ATOM 195 OE1 GLN A 11 -10.134 -12.483 -10.657 1.00 32.23 O ATOM 196 NE2 GLN A 11 -10.869 -10.870 -9.278 1.00 61.21 N ATOM 0 H GLN A 11 -5.637 -9.512 -11.588 1.00 44.34 H new ATOM 0 HA GLN A 11 -6.369 -12.105 -10.547 1.00 64.11 H new ATOM 0 HB2 GLN A 11 -7.523 -9.517 -10.795 1.00 13.13 H new ATOM 0 HB3 GLN A 11 -8.527 -10.586 -11.752 1.00 13.13 H new ATOM 0 HG2 GLN A 11 -7.902 -11.874 -9.242 1.00 11.22 H new ATOM 0 HG3 GLN A 11 -8.498 -10.257 -8.925 1.00 11.22 H new ATOM 0 HE21 GLN A 11 -10.634 -10.088 -8.667 1.00 61.21 H new ATOM 0 HE22 GLN A 11 -11.843 -11.144 -9.404 1.00 61.21 H new ATOM 205 N HIS A 12 -7.203 -11.360 -13.667 1.00 20.15 N ATOM 206 CA HIS A 12 -7.478 -11.945 -14.974 1.00 54.10 C ATOM 207 C HIS A 12 -6.270 -11.809 -15.896 1.00 11.25 C ATOM 208 O HIS A 12 -5.586 -12.789 -16.186 1.00 63.41 O ATOM 209 CB HIS A 12 -8.697 -11.275 -15.609 1.00 51.14 C ATOM 210 CG HIS A 12 -9.641 -10.679 -14.611 1.00 73.02 C ATOM 211 ND1 HIS A 12 -10.817 -11.290 -14.230 1.00 13.22 N ATOM 212 CD2 HIS A 12 -9.577 -9.521 -13.913 1.00 51.04 C ATOM 213 CE1 HIS A 12 -11.436 -10.532 -13.342 1.00 33.51 C ATOM 214 NE2 HIS A 12 -10.704 -9.453 -13.132 1.00 73.21 N ATOM 0 H HIS A 12 -7.322 -10.348 -13.625 1.00 20.15 H new ATOM 0 HA HIS A 12 -7.687 -13.005 -14.833 1.00 54.10 H new ATOM 0 HB2 HIS A 12 -8.358 -10.493 -16.289 1.00 51.14 H new ATOM 0 HB3 HIS A 12 -9.233 -12.010 -16.210 1.00 51.14 H new ATOM 0 HD2 HIS A 12 -8.786 -8.787 -13.961 1.00 51.04 H new ATOM 0 HE1 HIS A 12 -12.380 -10.757 -12.868 1.00 33.51 H new ATOM 0 HE2 HIS A 12 -10.938 -8.693 -12.493 1.00 73.21 H new ATOM 222 N MET A 13 -6.015 -10.587 -16.352 1.00 62.01 N ATOM 223 CA MET A 13 -4.889 -10.323 -17.240 1.00 63.43 C ATOM 224 C MET A 13 -3.586 -10.832 -16.632 1.00 4.33 C ATOM 225 O MET A 13 -3.202 -10.425 -15.535 1.00 3.01 O ATOM 226 CB MET A 13 -4.780 -8.825 -17.530 1.00 24.04 C ATOM 227 CG MET A 13 -3.659 -8.139 -16.766 1.00 10.44 C ATOM 228 SD MET A 13 -2.026 -8.544 -17.414 1.00 53.24 S ATOM 229 CE MET A 13 -2.191 -7.997 -19.112 1.00 72.00 C ATOM 0 H MET A 13 -6.572 -9.765 -16.121 1.00 62.01 H new ATOM 0 HA MET A 13 -5.064 -10.854 -18.176 1.00 63.43 H new ATOM 0 HB2 MET A 13 -4.622 -8.681 -18.599 1.00 24.04 H new ATOM 0 HB3 MET A 13 -5.726 -8.345 -17.280 1.00 24.04 H new ATOM 0 HG2 MET A 13 -3.804 -7.060 -16.807 1.00 10.44 H new ATOM 0 HG3 MET A 13 -3.711 -8.428 -15.716 1.00 10.44 H new ATOM 0 HE1 MET A 13 -1.202 -7.827 -19.537 1.00 72.00 H new ATOM 0 HE2 MET A 13 -2.709 -8.761 -19.692 1.00 72.00 H new ATOM 0 HE3 MET A 13 -2.763 -7.069 -19.142 1.00 72.00 H new ATOM 239 N ASP A 14 -2.911 -11.722 -17.350 1.00 25.43 N ATOM 240 CA ASP A 14 -1.650 -12.286 -16.880 1.00 41.33 C ATOM 241 C ASP A 14 -0.829 -12.826 -18.047 1.00 24.44 C ATOM 242 O ASP A 14 -1.101 -13.911 -18.560 1.00 60.52 O ATOM 243 CB ASP A 14 -1.911 -13.399 -15.865 1.00 30.13 C ATOM 244 CG ASP A 14 -0.815 -13.501 -14.823 1.00 25.12 C ATOM 245 OD1 ASP A 14 -0.808 -12.677 -13.885 1.00 15.44 O ATOM 246 OD2 ASP A 14 0.037 -14.406 -14.945 1.00 1.00 O ATOM 0 H ASP A 14 -3.215 -12.069 -18.260 1.00 25.43 H new ATOM 0 HA ASP A 14 -1.082 -11.491 -16.396 1.00 41.33 H new ATOM 0 HB2 ASP A 14 -2.864 -13.218 -15.369 1.00 30.13 H new ATOM 0 HB3 ASP A 14 -2.000 -14.351 -16.389 1.00 30.13 H new ATOM 251 N SER A 15 0.177 -12.062 -18.460 1.00 51.14 N ATOM 252 CA SER A 15 1.035 -12.462 -19.569 1.00 40.15 C ATOM 253 C SER A 15 2.314 -13.118 -19.058 1.00 10.44 C ATOM 254 O SER A 15 3.186 -13.496 -19.840 1.00 23.35 O ATOM 255 CB SER A 15 1.382 -11.250 -20.437 1.00 35.13 C ATOM 256 OG SER A 15 1.991 -11.650 -21.652 1.00 25.04 O ATOM 0 H SER A 15 0.418 -11.163 -18.043 1.00 51.14 H new ATOM 0 HA SER A 15 0.491 -13.188 -20.172 1.00 40.15 H new ATOM 0 HB2 SER A 15 0.477 -10.681 -20.650 1.00 35.13 H new ATOM 0 HB3 SER A 15 2.054 -10.588 -19.891 1.00 35.13 H new ATOM 0 HG SER A 15 2.526 -12.457 -21.500 1.00 25.04 H new ATOM 262 N ASP A 16 2.418 -13.248 -17.740 1.00 33.03 N ATOM 263 CA ASP A 16 3.589 -13.859 -17.122 1.00 11.34 C ATOM 264 C ASP A 16 4.019 -15.106 -17.887 1.00 61.13 C ATOM 265 O ASP A 16 5.177 -15.234 -18.285 1.00 51.44 O ATOM 266 CB ASP A 16 3.295 -14.216 -15.664 1.00 33.11 C ATOM 267 CG ASP A 16 4.090 -15.417 -15.190 1.00 51.23 C ATOM 268 OD1 ASP A 16 5.335 -15.326 -15.152 1.00 14.20 O ATOM 269 OD2 ASP A 16 3.468 -16.448 -14.859 1.00 13.11 O ATOM 0 H ASP A 16 1.706 -12.938 -17.079 1.00 33.03 H new ATOM 0 HA ASP A 16 4.404 -13.136 -17.154 1.00 11.34 H new ATOM 0 HB2 ASP A 16 3.524 -13.359 -15.030 1.00 33.11 H new ATOM 0 HB3 ASP A 16 2.230 -14.421 -15.551 1.00 33.11 H new ATOM 274 N SER A 17 3.079 -16.024 -18.089 1.00 23.23 N ATOM 275 CA SER A 17 3.362 -17.264 -18.802 1.00 64.11 C ATOM 276 C SER A 17 3.077 -17.110 -20.293 1.00 31.41 C ATOM 277 O SER A 17 2.396 -16.174 -20.713 1.00 24.44 O ATOM 278 CB SER A 17 2.528 -18.410 -18.227 1.00 32.10 C ATOM 279 OG SER A 17 3.175 -19.657 -18.415 1.00 51.34 O ATOM 0 H SER A 17 2.115 -15.932 -17.769 1.00 23.23 H new ATOM 0 HA SER A 17 4.420 -17.495 -18.674 1.00 64.11 H new ATOM 0 HB2 SER A 17 2.358 -18.242 -17.164 1.00 32.10 H new ATOM 0 HB3 SER A 17 1.550 -18.428 -18.707 1.00 32.10 H new ATOM 0 HG SER A 17 2.622 -20.373 -18.037 1.00 51.34 H new ATOM 285 N SER A 18 3.603 -18.037 -21.088 1.00 54.42 N ATOM 286 CA SER A 18 3.408 -18.003 -22.533 1.00 64.21 C ATOM 287 C SER A 18 2.124 -18.727 -22.925 1.00 71.04 C ATOM 288 O SER A 18 1.490 -19.403 -22.115 1.00 54.11 O ATOM 289 CB SER A 18 4.604 -18.640 -23.244 1.00 52.05 C ATOM 290 OG SER A 18 5.358 -17.666 -23.946 1.00 34.50 O ATOM 0 H SER A 18 4.167 -18.820 -20.756 1.00 54.42 H new ATOM 0 HA SER A 18 3.324 -16.960 -22.840 1.00 64.21 H new ATOM 0 HB2 SER A 18 5.240 -19.141 -22.514 1.00 52.05 H new ATOM 0 HB3 SER A 18 4.254 -19.403 -23.939 1.00 52.05 H new ATOM 0 HG SER A 18 6.117 -18.098 -24.390 1.00 34.50 H new ATOM 296 N PRO A 19 1.730 -18.583 -24.200 1.00 1.15 N ATOM 297 CA PRO A 19 0.519 -19.215 -24.730 1.00 73.20 C ATOM 298 C PRO A 19 0.657 -20.730 -24.841 1.00 55.22 C ATOM 299 O PRO A 19 1.607 -21.316 -24.323 1.00 11.21 O ATOM 300 CB PRO A 19 0.370 -18.588 -26.119 1.00 24.44 C ATOM 301 CG PRO A 19 1.752 -18.182 -26.501 1.00 31.45 C ATOM 302 CD PRO A 19 2.438 -17.792 -25.220 1.00 55.15 C ATOM 0 HA PRO A 19 -0.342 -19.055 -24.081 1.00 73.20 H new ATOM 0 HB2 PRO A 19 -0.045 -19.300 -26.832 1.00 24.44 H new ATOM 0 HB3 PRO A 19 -0.303 -17.731 -26.096 1.00 24.44 H new ATOM 0 HG2 PRO A 19 2.278 -19.001 -26.992 1.00 31.45 H new ATOM 0 HG3 PRO A 19 1.734 -17.349 -27.203 1.00 31.45 H new ATOM 0 HD2 PRO A 19 3.502 -18.029 -25.245 1.00 55.15 H new ATOM 0 HD3 PRO A 19 2.354 -16.722 -25.029 1.00 55.15 H new ATOM 310 N SER A 20 -0.298 -21.358 -25.521 1.00 4.03 N ATOM 311 CA SER A 20 -0.284 -22.805 -25.697 1.00 30.41 C ATOM 312 C SER A 20 -0.524 -23.517 -24.369 1.00 1.33 C ATOM 313 O SER A 20 0.200 -24.446 -24.010 1.00 14.31 O ATOM 314 CB SER A 20 1.050 -23.255 -26.296 1.00 22.04 C ATOM 315 OG SER A 20 1.007 -24.621 -26.669 1.00 30.31 O ATOM 0 H SER A 20 -1.090 -20.887 -25.958 1.00 4.03 H new ATOM 0 HA SER A 20 -1.089 -23.070 -26.382 1.00 30.41 H new ATOM 0 HB2 SER A 20 1.285 -22.644 -27.168 1.00 22.04 H new ATOM 0 HB3 SER A 20 1.849 -23.098 -25.571 1.00 22.04 H new ATOM 0 HG SER A 20 0.802 -25.169 -25.883 1.00 30.31 H new ATOM 321 N SER A 21 -1.545 -23.073 -23.643 1.00 11.21 N ATOM 322 CA SER A 21 -1.879 -23.663 -22.352 1.00 74.32 C ATOM 323 C SER A 21 -2.935 -24.753 -22.510 1.00 71.35 C ATOM 324 O SER A 21 -4.122 -24.466 -22.665 1.00 41.42 O ATOM 325 CB SER A 21 -2.383 -22.586 -21.390 1.00 3.14 C ATOM 326 OG SER A 21 -1.524 -21.459 -21.391 1.00 43.24 O ATOM 0 H SER A 21 -2.155 -22.307 -23.927 1.00 11.21 H new ATOM 0 HA SER A 21 -0.975 -24.113 -21.941 1.00 74.32 H new ATOM 0 HB2 SER A 21 -3.389 -22.280 -21.676 1.00 3.14 H new ATOM 0 HB3 SER A 21 -2.449 -22.996 -20.382 1.00 3.14 H new ATOM 0 HG SER A 21 -2.001 -20.685 -21.757 1.00 43.24 H new ATOM 332 N SER A 22 -2.493 -26.006 -22.471 1.00 34.34 N ATOM 333 CA SER A 22 -3.398 -27.141 -22.613 1.00 55.33 C ATOM 334 C SER A 22 -3.390 -28.004 -21.356 1.00 25.43 C ATOM 335 O SER A 22 -4.425 -28.520 -20.936 1.00 75.11 O ATOM 336 CB SER A 22 -3.006 -27.984 -23.828 1.00 25.23 C ATOM 337 OG SER A 22 -1.731 -28.576 -23.647 1.00 22.25 O ATOM 0 H SER A 22 -1.514 -26.261 -22.342 1.00 34.34 H new ATOM 0 HA SER A 22 -4.406 -26.754 -22.759 1.00 55.33 H new ATOM 0 HB2 SER A 22 -3.752 -28.762 -23.991 1.00 25.23 H new ATOM 0 HB3 SER A 22 -2.997 -27.359 -24.721 1.00 25.23 H new ATOM 0 HG SER A 22 -1.504 -29.111 -24.436 1.00 22.25 H new ATOM 343 N SER A 23 -2.212 -28.157 -20.759 1.00 23.32 N ATOM 344 CA SER A 23 -2.065 -28.961 -19.551 1.00 75.31 C ATOM 345 C SER A 23 -2.779 -28.306 -18.372 1.00 41.15 C ATOM 346 O SER A 23 -3.529 -27.344 -18.542 1.00 3.34 O ATOM 347 CB SER A 23 -0.585 -29.158 -19.220 1.00 62.13 C ATOM 348 OG SER A 23 -0.021 -27.975 -18.680 1.00 35.53 O ATOM 0 H SER A 23 -1.345 -27.735 -21.092 1.00 23.32 H new ATOM 0 HA SER A 23 -2.521 -29.934 -19.735 1.00 75.31 H new ATOM 0 HB2 SER A 23 -0.474 -29.975 -18.508 1.00 62.13 H new ATOM 0 HB3 SER A 23 -0.043 -29.445 -20.121 1.00 62.13 H new ATOM 0 HG SER A 23 0.925 -28.128 -18.475 1.00 35.53 H new ATOM 354 N THR A 24 -2.540 -28.834 -17.176 1.00 72.41 N ATOM 355 CA THR A 24 -3.159 -28.303 -15.969 1.00 34.25 C ATOM 356 C THR A 24 -2.721 -26.866 -15.712 1.00 41.14 C ATOM 357 O THR A 24 -2.964 -26.314 -14.639 1.00 32.42 O ATOM 358 CB THR A 24 -2.814 -29.161 -14.736 1.00 52.43 C ATOM 359 OG1 THR A 24 -1.425 -29.507 -14.754 1.00 2.41 O ATOM 360 CG2 THR A 24 -3.657 -30.427 -14.705 1.00 1.44 C ATOM 0 H THR A 24 -1.922 -29.630 -17.018 1.00 72.41 H new ATOM 0 HA THR A 24 -4.237 -28.328 -16.130 1.00 34.25 H new ATOM 0 HB THR A 24 -3.031 -28.577 -13.842 1.00 52.43 H new ATOM 0 HG1 THR A 24 -1.213 -30.051 -13.967 1.00 2.41 H new ATOM 0 HG21 THR A 24 -3.396 -31.017 -13.826 1.00 1.44 H new ATOM 0 HG22 THR A 24 -4.713 -30.160 -14.662 1.00 1.44 H new ATOM 0 HG23 THR A 24 -3.467 -31.013 -15.604 1.00 1.44 H new ATOM 368 N TYR A 25 -2.074 -26.264 -16.704 1.00 73.04 N ATOM 369 CA TYR A 25 -1.600 -24.890 -16.585 1.00 72.33 C ATOM 370 C TYR A 25 -2.530 -24.068 -15.698 1.00 24.33 C ATOM 371 O TYR A 25 -2.161 -23.671 -14.592 1.00 31.11 O ATOM 372 CB TYR A 25 -1.493 -24.244 -17.968 1.00 12.05 C ATOM 373 CG TYR A 25 -1.504 -22.732 -17.932 1.00 21.44 C ATOM 374 CD1 TYR A 25 -2.699 -22.025 -17.984 1.00 60.31 C ATOM 375 CD2 TYR A 25 -0.319 -22.011 -17.846 1.00 74.43 C ATOM 376 CE1 TYR A 25 -2.714 -20.644 -17.952 1.00 63.32 C ATOM 377 CE2 TYR A 25 -0.325 -20.630 -17.812 1.00 62.44 C ATOM 378 CZ TYR A 25 -1.524 -19.951 -17.866 1.00 32.41 C ATOM 379 OH TYR A 25 -1.534 -18.576 -17.834 1.00 4.22 O ATOM 0 H TYR A 25 -1.866 -26.706 -17.599 1.00 73.04 H new ATOM 0 HA TYR A 25 -0.613 -24.911 -16.124 1.00 72.33 H new ATOM 0 HB2 TYR A 25 -0.574 -24.581 -18.447 1.00 12.05 H new ATOM 0 HB3 TYR A 25 -2.321 -24.591 -18.587 1.00 12.05 H new ATOM 0 HD1 TYR A 25 -3.632 -22.564 -18.051 1.00 60.31 H new ATOM 0 HD2 TYR A 25 0.622 -22.539 -17.805 1.00 74.43 H new ATOM 0 HE1 TYR A 25 -3.652 -20.110 -17.994 1.00 63.32 H new ATOM 0 HE2 TYR A 25 0.605 -20.085 -17.743 1.00 62.44 H new ATOM 0 HH TYR A 25 -2.339 -18.265 -17.369 1.00 4.22 H new ATOM 389 N CYS A 26 -3.738 -23.817 -16.190 1.00 40.11 N ATOM 390 CA CYS A 26 -4.723 -23.043 -15.444 1.00 5.21 C ATOM 391 C CYS A 26 -4.927 -23.624 -14.048 1.00 73.30 C ATOM 392 O CYS A 26 -4.750 -22.934 -13.045 1.00 63.51 O ATOM 393 CB CYS A 26 -6.054 -23.012 -16.196 1.00 75.11 C ATOM 394 SG CYS A 26 -6.139 -21.751 -17.508 1.00 1.55 S ATOM 0 H CYS A 26 -4.059 -24.139 -17.103 1.00 40.11 H new ATOM 0 HA CYS A 26 -4.348 -22.025 -15.343 1.00 5.21 H new ATOM 0 HB2 CYS A 26 -6.232 -23.993 -16.637 1.00 75.11 H new ATOM 0 HB3 CYS A 26 -6.858 -22.833 -15.482 1.00 75.11 H new ATOM 399 N ASN A 27 -5.302 -24.898 -13.993 1.00 20.31 N ATOM 400 CA ASN A 27 -5.531 -25.573 -12.721 1.00 35.14 C ATOM 401 C ASN A 27 -4.537 -25.098 -11.666 1.00 21.03 C ATOM 402 O ASN A 27 -4.894 -24.908 -10.504 1.00 12.34 O ATOM 403 CB ASN A 27 -5.421 -27.089 -12.896 1.00 44.02 C ATOM 404 CG ASN A 27 -5.458 -27.829 -11.573 1.00 13.41 C ATOM 405 OD1 ASN A 27 -5.536 -27.215 -10.508 1.00 64.32 O ATOM 406 ND2 ASN A 27 -5.403 -29.154 -11.634 1.00 75.03 N ATOM 0 H ASN A 27 -5.454 -25.483 -14.814 1.00 20.31 H new ATOM 0 HA ASN A 27 -6.538 -25.326 -12.384 1.00 35.14 H new ATOM 0 HB2 ASN A 27 -6.237 -27.439 -13.528 1.00 44.02 H new ATOM 0 HB3 ASN A 27 -4.492 -27.325 -13.415 1.00 44.02 H new ATOM 0 HD21 ASN A 27 -5.425 -29.705 -10.776 1.00 75.03 H new ATOM 0 HD22 ASN A 27 -5.339 -29.621 -12.539 1.00 75.03 H new ATOM 413 N GLN A 28 -3.288 -24.908 -12.080 1.00 74.53 N ATOM 414 CA GLN A 28 -2.242 -24.456 -11.171 1.00 14.41 C ATOM 415 C GLN A 28 -2.181 -22.932 -11.127 1.00 32.40 C ATOM 416 O GLN A 28 -2.427 -22.322 -10.087 1.00 54.54 O ATOM 417 CB GLN A 28 -0.886 -25.020 -11.598 1.00 34.32 C ATOM 418 CG GLN A 28 -0.540 -26.342 -10.931 1.00 13.33 C ATOM 419 CD GLN A 28 0.680 -27.002 -11.542 1.00 74.21 C ATOM 420 OE1 GLN A 28 1.816 -26.666 -11.207 1.00 14.32 O ATOM 421 NE2 GLN A 28 0.451 -27.949 -12.445 1.00 14.32 N ATOM 0 H GLN A 28 -2.976 -25.060 -13.039 1.00 74.53 H new ATOM 0 HA GLN A 28 -2.481 -24.822 -10.172 1.00 14.41 H new ATOM 0 HB2 GLN A 28 -0.883 -25.156 -12.679 1.00 34.32 H new ATOM 0 HB3 GLN A 28 -0.109 -24.291 -11.366 1.00 34.32 H new ATOM 0 HG2 GLN A 28 -0.363 -26.173 -9.869 1.00 13.33 H new ATOM 0 HG3 GLN A 28 -1.392 -27.018 -11.009 1.00 13.33 H new ATOM 0 HE21 GLN A 28 -0.507 -28.196 -12.693 1.00 14.32 H new ATOM 0 HE22 GLN A 28 1.233 -28.429 -12.890 1.00 14.32 H new ATOM 430 N MET A 29 -1.851 -22.325 -12.262 1.00 71.42 N ATOM 431 CA MET A 29 -1.759 -20.873 -12.353 1.00 5.12 C ATOM 432 C MET A 29 -2.760 -20.205 -11.416 1.00 50.21 C ATOM 433 O MET A 29 -2.377 -19.481 -10.497 1.00 71.42 O ATOM 434 CB MET A 29 -2.003 -20.414 -13.792 1.00 13.45 C ATOM 435 CG MET A 29 -0.915 -20.846 -14.761 1.00 33.21 C ATOM 436 SD MET A 29 0.726 -20.829 -14.015 1.00 63.13 S ATOM 437 CE MET A 29 0.814 -19.139 -13.429 1.00 23.01 C ATOM 0 H MET A 29 -1.643 -22.816 -13.131 1.00 71.42 H new ATOM 0 HA MET A 29 -0.754 -20.578 -12.051 1.00 5.12 H new ATOM 0 HB2 MET A 29 -2.960 -20.809 -14.133 1.00 13.45 H new ATOM 0 HB3 MET A 29 -2.083 -19.327 -13.809 1.00 13.45 H new ATOM 0 HG2 MET A 29 -1.135 -21.850 -15.124 1.00 33.21 H new ATOM 0 HG3 MET A 29 -0.923 -20.185 -15.628 1.00 33.21 H new ATOM 0 HE1 MET A 29 1.785 -18.715 -13.685 1.00 23.01 H new ATOM 0 HE2 MET A 29 0.026 -18.550 -13.898 1.00 23.01 H new ATOM 0 HE3 MET A 29 0.684 -19.122 -12.347 1.00 23.01 H new ATOM 447 N MET A 30 -4.044 -20.452 -11.656 1.00 23.02 N ATOM 448 CA MET A 30 -5.100 -19.874 -10.832 1.00 65.33 C ATOM 449 C MET A 30 -4.771 -20.015 -9.349 1.00 44.35 C ATOM 450 O MET A 30 -4.977 -19.086 -8.568 1.00 23.11 O ATOM 451 CB MET A 30 -6.439 -20.549 -11.136 1.00 1.43 C ATOM 452 CG MET A 30 -7.355 -19.712 -12.014 1.00 32.20 C ATOM 453 SD MET A 30 -8.201 -18.412 -11.095 1.00 74.01 S ATOM 454 CE MET A 30 -7.219 -16.984 -11.547 1.00 31.03 C ATOM 0 H MET A 30 -4.378 -21.048 -12.413 1.00 23.02 H new ATOM 0 HA MET A 30 -5.173 -18.813 -11.070 1.00 65.33 H new ATOM 0 HB2 MET A 30 -6.252 -21.504 -11.627 1.00 1.43 H new ATOM 0 HB3 MET A 30 -6.948 -20.767 -10.197 1.00 1.43 H new ATOM 0 HG2 MET A 30 -6.771 -19.263 -12.817 1.00 32.20 H new ATOM 0 HG3 MET A 30 -8.095 -20.361 -12.483 1.00 32.20 H new ATOM 0 HE1 MET A 30 -7.689 -16.081 -11.158 1.00 31.03 H new ATOM 0 HE2 MET A 30 -6.219 -17.082 -11.126 1.00 31.03 H new ATOM 0 HE3 MET A 30 -7.150 -16.918 -12.633 1.00 31.03 H new ATOM 464 N ARG A 31 -4.259 -21.181 -8.969 1.00 50.21 N ATOM 465 CA ARG A 31 -3.903 -21.442 -7.580 1.00 33.33 C ATOM 466 C ARG A 31 -2.716 -20.585 -7.152 1.00 25.30 C ATOM 467 O ARG A 31 -2.660 -20.105 -6.020 1.00 24.23 O ATOM 468 CB ARG A 31 -3.573 -22.923 -7.386 1.00 34.55 C ATOM 469 CG ARG A 31 -2.995 -23.244 -6.017 1.00 64.22 C ATOM 470 CD ARG A 31 -2.233 -24.560 -6.029 1.00 60.41 C ATOM 471 NE ARG A 31 -1.976 -25.056 -4.680 1.00 22.23 N ATOM 472 CZ ARG A 31 -1.338 -26.193 -4.424 1.00 34.15 C ATOM 473 NH1 ARG A 31 -0.895 -26.948 -5.420 1.00 13.53 N ATOM 474 NH2 ARG A 31 -1.143 -26.577 -3.169 1.00 24.24 N ATOM 0 H ARG A 31 -4.082 -21.960 -9.604 1.00 50.21 H new ATOM 0 HA ARG A 31 -4.759 -21.183 -6.957 1.00 33.33 H new ATOM 0 HB2 ARG A 31 -4.479 -23.511 -7.536 1.00 34.55 H new ATOM 0 HB3 ARG A 31 -2.862 -23.232 -8.153 1.00 34.55 H new ATOM 0 HG2 ARG A 31 -2.329 -22.440 -5.704 1.00 64.22 H new ATOM 0 HG3 ARG A 31 -3.800 -23.295 -5.284 1.00 64.22 H new ATOM 0 HD2 ARG A 31 -2.803 -25.304 -6.586 1.00 60.41 H new ATOM 0 HD3 ARG A 31 -1.286 -24.426 -6.552 1.00 60.41 H new ATOM 0 HE ARG A 31 -2.304 -24.499 -3.891 1.00 22.23 H new ATOM 0 HH11 ARG A 31 -1.044 -26.656 -6.386 1.00 13.53 H new ATOM 0 HH12 ARG A 31 -0.406 -27.820 -5.220 1.00 13.53 H new ATOM 0 HH21 ARG A 31 -1.483 -25.999 -2.400 1.00 24.24 H new ATOM 0 HH22 ARG A 31 -0.653 -27.450 -2.973 1.00 24.24 H new ATOM 488 N ARG A 32 -1.768 -20.398 -8.065 1.00 71.31 N ATOM 489 CA ARG A 32 -0.581 -19.601 -7.782 1.00 22.11 C ATOM 490 C ARG A 32 -0.947 -18.133 -7.581 1.00 23.43 C ATOM 491 O ARG A 32 -0.275 -17.412 -6.843 1.00 52.54 O ATOM 492 CB ARG A 32 0.432 -19.734 -8.921 1.00 1.34 C ATOM 493 CG ARG A 32 1.728 -20.411 -8.507 1.00 4.22 C ATOM 494 CD ARG A 32 1.550 -21.914 -8.362 1.00 21.03 C ATOM 495 NE ARG A 32 2.678 -22.655 -8.920 1.00 33.52 N ATOM 496 CZ ARG A 32 2.795 -22.954 -10.209 1.00 21.22 C ATOM 497 NH1 ARG A 32 1.859 -22.576 -11.068 1.00 71.42 N ATOM 498 NH2 ARG A 32 3.851 -23.632 -10.641 1.00 30.05 N ATOM 0 H ARG A 32 -1.799 -20.788 -9.007 1.00 71.31 H new ATOM 0 HA ARG A 32 -0.134 -19.975 -6.861 1.00 22.11 H new ATOM 0 HB2 ARG A 32 -0.021 -20.301 -9.734 1.00 1.34 H new ATOM 0 HB3 ARG A 32 0.659 -18.742 -9.312 1.00 1.34 H new ATOM 0 HG2 ARG A 32 2.500 -20.205 -9.248 1.00 4.22 H new ATOM 0 HG3 ARG A 32 2.073 -19.992 -7.562 1.00 4.22 H new ATOM 0 HD2 ARG A 32 1.437 -22.166 -7.307 1.00 21.03 H new ATOM 0 HD3 ARG A 32 0.632 -22.220 -8.863 1.00 21.03 H new ATOM 0 HE ARG A 32 3.416 -22.960 -8.285 1.00 33.52 H new ATOM 0 HH11 ARG A 32 1.046 -22.054 -10.740 1.00 71.42 H new ATOM 0 HH12 ARG A 32 1.951 -22.807 -12.057 1.00 71.42 H new ATOM 0 HH21 ARG A 32 4.574 -23.924 -9.983 1.00 30.05 H new ATOM 0 HH22 ARG A 32 3.940 -23.861 -11.631 1.00 30.05 H new ATOM 512 N ARG A 33 -2.015 -17.699 -8.241 1.00 60.35 N ATOM 513 CA ARG A 33 -2.469 -16.318 -8.137 1.00 1.24 C ATOM 514 C ARG A 33 -3.293 -16.111 -6.869 1.00 61.11 C ATOM 515 O ARG A 33 -3.999 -15.113 -6.732 1.00 21.00 O ATOM 516 CB ARG A 33 -3.298 -15.936 -9.364 1.00 61.45 C ATOM 517 CG ARG A 33 -2.558 -16.119 -10.680 1.00 31.54 C ATOM 518 CD ARG A 33 -1.674 -14.923 -10.993 1.00 3.45 C ATOM 519 NE ARG A 33 -0.627 -15.253 -11.956 1.00 0.40 N ATOM 520 CZ ARG A 33 0.521 -14.590 -12.050 1.00 33.31 C ATOM 521 NH1 ARG A 33 0.768 -13.568 -11.243 1.00 12.22 N ATOM 522 NH2 ARG A 33 1.424 -14.951 -12.952 1.00 41.34 N ATOM 0 H ARG A 33 -2.583 -18.284 -8.854 1.00 60.35 H new ATOM 0 HA ARG A 33 -1.589 -15.676 -8.088 1.00 1.24 H new ATOM 0 HB2 ARG A 33 -4.206 -16.539 -9.381 1.00 61.45 H new ATOM 0 HB3 ARG A 33 -3.608 -14.895 -9.273 1.00 61.45 H new ATOM 0 HG2 ARG A 33 -1.948 -17.021 -10.633 1.00 31.54 H new ATOM 0 HG3 ARG A 33 -3.277 -16.262 -11.486 1.00 31.54 H new ATOM 0 HD2 ARG A 33 -2.287 -14.113 -11.388 1.00 3.45 H new ATOM 0 HD3 ARG A 33 -1.218 -14.559 -10.072 1.00 3.45 H new ATOM 0 HE ARG A 33 -0.785 -16.035 -12.591 1.00 0.40 H new ATOM 0 HH11 ARG A 33 0.076 -13.289 -10.548 1.00 12.22 H new ATOM 0 HH12 ARG A 33 1.650 -13.061 -11.317 1.00 12.22 H new ATOM 0 HH21 ARG A 33 1.237 -15.738 -13.574 1.00 41.34 H new ATOM 0 HH22 ARG A 33 2.305 -14.442 -13.024 1.00 41.34 H new ATOM 536 N ASN A 34 -3.197 -17.062 -5.946 1.00 34.24 N ATOM 537 CA ASN A 34 -3.935 -16.985 -4.690 1.00 2.02 C ATOM 538 C ASN A 34 -5.434 -16.867 -4.946 1.00 12.23 C ATOM 539 O ASN A 34 -6.108 -16.017 -4.365 1.00 11.41 O ATOM 540 CB ASN A 34 -3.452 -15.792 -3.863 1.00 44.41 C ATOM 541 CG ASN A 34 -2.142 -16.073 -3.152 1.00 71.10 C ATOM 542 OD1 ASN A 34 -1.088 -16.166 -3.782 1.00 13.41 O ATOM 543 ND2 ASN A 34 -2.203 -16.211 -1.833 1.00 31.13 N ATOM 0 H ASN A 34 -2.616 -17.895 -6.044 1.00 34.24 H new ATOM 0 HA ASN A 34 -3.751 -17.903 -4.133 1.00 2.02 H new ATOM 0 HB2 ASN A 34 -3.330 -14.927 -4.515 1.00 44.41 H new ATOM 0 HB3 ASN A 34 -4.213 -15.532 -3.127 1.00 44.41 H new ATOM 0 HD21 ASN A 34 -1.354 -16.402 -1.300 1.00 31.13 H new ATOM 0 HD22 ASN A 34 -3.099 -16.126 -1.352 1.00 31.13 H new ATOM 550 N MET A 35 -5.949 -17.726 -5.819 1.00 34.33 N ATOM 551 CA MET A 35 -7.370 -17.719 -6.150 1.00 65.51 C ATOM 552 C MET A 35 -8.068 -18.948 -5.576 1.00 22.03 C ATOM 553 O MET A 35 -9.297 -19.018 -5.542 1.00 1.21 O ATOM 554 CB MET A 35 -7.561 -17.672 -7.667 1.00 62.53 C ATOM 555 CG MET A 35 -7.040 -16.395 -8.306 1.00 60.32 C ATOM 556 SD MET A 35 -8.361 -15.249 -8.744 1.00 11.23 S ATOM 557 CE MET A 35 -8.208 -14.039 -7.432 1.00 3.11 C ATOM 0 H MET A 35 -5.405 -18.435 -6.310 1.00 34.33 H new ATOM 0 HA MET A 35 -7.817 -16.829 -5.707 1.00 65.51 H new ATOM 0 HB2 MET A 35 -7.054 -18.526 -8.115 1.00 62.53 H new ATOM 0 HB3 MET A 35 -8.622 -17.776 -7.895 1.00 62.53 H new ATOM 0 HG2 MET A 35 -6.351 -15.904 -7.618 1.00 60.32 H new ATOM 0 HG3 MET A 35 -6.471 -16.647 -9.201 1.00 60.32 H new ATOM 0 HE1 MET A 35 -8.960 -13.262 -7.564 1.00 3.11 H new ATOM 0 HE2 MET A 35 -8.356 -14.527 -6.468 1.00 3.11 H new ATOM 0 HE3 MET A 35 -7.215 -13.592 -7.464 1.00 3.11 H new ATOM 567 N THR A 36 -7.276 -19.916 -5.125 1.00 34.44 N ATOM 568 CA THR A 36 -7.819 -21.143 -4.553 1.00 44.50 C ATOM 569 C THR A 36 -7.748 -21.117 -3.030 1.00 74.35 C ATOM 570 O THR A 36 -8.150 -22.072 -2.366 1.00 70.34 O ATOM 571 CB THR A 36 -7.067 -22.384 -5.070 1.00 3.42 C ATOM 572 OG1 THR A 36 -5.726 -22.389 -4.567 1.00 11.03 O ATOM 573 CG2 THR A 36 -7.043 -22.408 -6.591 1.00 11.33 C ATOM 0 H THR A 36 -6.257 -19.874 -5.145 1.00 34.44 H new ATOM 0 HA THR A 36 -8.862 -21.204 -4.865 1.00 44.50 H new ATOM 0 HB THR A 36 -7.591 -23.272 -4.717 1.00 3.42 H new ATOM 0 HG1 THR A 36 -5.580 -23.198 -4.034 1.00 11.03 H new ATOM 0 HG21 THR A 36 -6.507 -23.293 -6.933 1.00 11.33 H new ATOM 0 HG22 THR A 36 -8.064 -22.434 -6.971 1.00 11.33 H new ATOM 0 HG23 THR A 36 -6.541 -21.514 -6.961 1.00 11.33 H new ATOM 581 N GLN A 37 -7.237 -20.019 -2.484 1.00 45.04 N ATOM 582 CA GLN A 37 -7.114 -19.871 -1.039 1.00 54.30 C ATOM 583 C GLN A 37 -8.481 -19.658 -0.396 1.00 60.02 C ATOM 584 O GLN A 37 -9.130 -18.637 -0.617 1.00 40.44 O ATOM 585 CB GLN A 37 -6.191 -18.699 -0.702 1.00 1.15 C ATOM 586 CG GLN A 37 -4.727 -19.092 -0.586 1.00 0.33 C ATOM 587 CD GLN A 37 -3.983 -18.273 0.451 1.00 34.22 C ATOM 588 OE1 GLN A 37 -4.001 -17.042 0.417 1.00 33.50 O ATOM 589 NE2 GLN A 37 -3.324 -18.954 1.381 1.00 1.24 N ATOM 0 H GLN A 37 -6.901 -19.219 -3.020 1.00 45.04 H new ATOM 0 HA GLN A 37 -6.684 -20.790 -0.640 1.00 54.30 H new ATOM 0 HB2 GLN A 37 -6.293 -17.934 -1.471 1.00 1.15 H new ATOM 0 HB3 GLN A 37 -6.514 -18.251 0.238 1.00 1.15 H new ATOM 0 HG2 GLN A 37 -4.658 -20.149 -0.327 1.00 0.33 H new ATOM 0 HG3 GLN A 37 -4.244 -18.969 -1.555 1.00 0.33 H new ATOM 0 HE21 GLN A 37 -3.336 -19.974 1.371 1.00 1.24 H new ATOM 0 HE22 GLN A 37 -2.805 -18.457 2.105 1.00 1.24 H new ATOM 598 N GLY A 38 -8.913 -20.631 0.401 1.00 4.20 N ATOM 599 CA GLY A 38 -10.200 -20.531 1.063 1.00 11.11 C ATOM 600 C GLY A 38 -11.280 -21.324 0.354 1.00 22.22 C ATOM 601 O GLY A 38 -12.185 -21.862 0.993 1.00 42.34 O ATOM 0 H GLY A 38 -8.394 -21.486 0.600 1.00 4.20 H new ATOM 0 HA2 GLY A 38 -10.106 -20.887 2.089 1.00 11.11 H new ATOM 0 HA3 GLY A 38 -10.498 -19.484 1.115 1.00 11.11 H new ATOM 605 N ARG A 39 -11.186 -21.397 -0.970 1.00 0.55 N ATOM 606 CA ARG A 39 -12.164 -22.128 -1.766 1.00 11.50 C ATOM 607 C ARG A 39 -11.645 -22.365 -3.181 1.00 51.41 C ATOM 608 O ARG A 39 -10.657 -21.761 -3.601 1.00 54.20 O ATOM 609 CB ARG A 39 -13.487 -21.360 -1.818 1.00 64.42 C ATOM 610 CG ARG A 39 -13.314 -19.851 -1.852 1.00 11.41 C ATOM 611 CD ARG A 39 -13.935 -19.247 -3.102 1.00 13.34 C ATOM 612 NE ARG A 39 -15.248 -18.665 -2.834 1.00 71.30 N ATOM 613 CZ ARG A 39 -15.804 -17.727 -3.592 1.00 13.54 C ATOM 614 NH1 ARG A 39 -15.165 -17.266 -4.658 1.00 13.30 N ATOM 615 NH2 ARG A 39 -17.002 -17.247 -3.283 1.00 75.11 N ATOM 0 H ARG A 39 -10.442 -20.959 -1.514 1.00 0.55 H new ATOM 0 HA ARG A 39 -12.331 -23.095 -1.292 1.00 11.50 H new ATOM 0 HB2 ARG A 39 -14.045 -21.673 -2.701 1.00 64.42 H new ATOM 0 HB3 ARG A 39 -14.088 -21.629 -0.949 1.00 64.42 H new ATOM 0 HG2 ARG A 39 -13.774 -19.411 -0.967 1.00 11.41 H new ATOM 0 HG3 ARG A 39 -12.253 -19.604 -1.816 1.00 11.41 H new ATOM 0 HD2 ARG A 39 -13.273 -18.479 -3.501 1.00 13.34 H new ATOM 0 HD3 ARG A 39 -14.029 -20.016 -3.868 1.00 13.34 H new ATOM 0 HE ARG A 39 -15.766 -18.997 -2.020 1.00 71.30 H new ATOM 0 HH11 ARG A 39 -14.244 -17.632 -4.898 1.00 13.30 H new ATOM 0 HH12 ARG A 39 -15.595 -16.546 -5.238 1.00 13.30 H new ATOM 0 HH21 ARG A 39 -17.496 -17.599 -2.463 1.00 75.11 H new ATOM 0 HH22 ARG A 39 -17.429 -16.527 -3.866 1.00 75.11 H new ATOM 629 N CYS A 40 -12.317 -23.248 -3.912 1.00 40.20 N ATOM 630 CA CYS A 40 -11.924 -23.566 -5.279 1.00 72.43 C ATOM 631 C CYS A 40 -12.613 -22.637 -6.274 1.00 15.31 C ATOM 632 O CYS A 40 -13.835 -22.663 -6.422 1.00 15.02 O ATOM 633 CB CYS A 40 -12.266 -25.022 -5.604 1.00 45.02 C ATOM 634 SG CYS A 40 -10.811 -26.080 -5.894 1.00 50.22 S ATOM 0 H CYS A 40 -13.137 -23.756 -3.580 1.00 40.20 H new ATOM 0 HA CYS A 40 -10.846 -23.424 -5.363 1.00 72.43 H new ATOM 0 HB2 CYS A 40 -12.848 -25.440 -4.782 1.00 45.02 H new ATOM 0 HB3 CYS A 40 -12.902 -25.046 -6.489 1.00 45.02 H new ATOM 639 N LYS A 41 -11.821 -21.815 -6.954 1.00 71.33 N ATOM 640 CA LYS A 41 -12.353 -20.878 -7.936 1.00 45.34 C ATOM 641 C LYS A 41 -13.248 -21.593 -8.943 1.00 32.24 C ATOM 642 O LYS A 41 -12.882 -22.619 -9.516 1.00 61.15 O ATOM 643 CB LYS A 41 -11.209 -20.171 -8.668 1.00 11.32 C ATOM 644 CG LYS A 41 -11.467 -18.695 -8.917 1.00 1.33 C ATOM 645 CD LYS A 41 -11.866 -17.975 -7.639 1.00 73.23 C ATOM 646 CE LYS A 41 -10.998 -16.751 -7.395 1.00 12.54 C ATOM 647 NZ LYS A 41 -11.733 -15.689 -6.653 1.00 53.44 N ATOM 0 H LYS A 41 -10.808 -21.779 -6.843 1.00 71.33 H new ATOM 0 HA LYS A 41 -12.952 -20.137 -7.406 1.00 45.34 H new ATOM 0 HB2 LYS A 41 -10.294 -20.278 -8.085 1.00 11.32 H new ATOM 0 HB3 LYS A 41 -11.038 -20.668 -9.623 1.00 11.32 H new ATOM 0 HG2 LYS A 41 -10.571 -18.233 -9.331 1.00 1.33 H new ATOM 0 HG3 LYS A 41 -12.256 -18.583 -9.660 1.00 1.33 H new ATOM 0 HD2 LYS A 41 -12.912 -17.674 -7.701 1.00 73.23 H new ATOM 0 HD3 LYS A 41 -11.780 -18.658 -6.794 1.00 73.23 H new ATOM 0 HE2 LYS A 41 -10.112 -17.041 -6.831 1.00 12.54 H new ATOM 0 HE3 LYS A 41 -10.653 -16.354 -8.350 1.00 12.54 H new ATOM 0 HZ1 LYS A 41 -11.107 -14.871 -6.506 1.00 53.44 H new ATOM 0 HZ2 LYS A 41 -12.565 -15.394 -7.203 1.00 53.44 H new ATOM 0 HZ3 LYS A 41 -12.041 -16.059 -5.731 1.00 53.44 H new ATOM 661 N PRO A 42 -14.450 -21.041 -9.164 1.00 51.52 N ATOM 662 CA PRO A 42 -15.422 -21.609 -10.103 1.00 44.34 C ATOM 663 C PRO A 42 -14.978 -21.463 -11.555 1.00 71.21 C ATOM 664 O PRO A 42 -14.966 -22.435 -12.311 1.00 42.43 O ATOM 665 CB PRO A 42 -16.687 -20.786 -9.846 1.00 22.42 C ATOM 666 CG PRO A 42 -16.192 -19.491 -9.302 1.00 11.23 C ATOM 667 CD PRO A 42 -14.953 -19.818 -8.515 1.00 42.14 C ATOM 0 HA PRO A 42 -15.556 -22.680 -9.952 1.00 44.34 H new ATOM 0 HB2 PRO A 42 -17.256 -20.638 -10.764 1.00 22.42 H new ATOM 0 HB3 PRO A 42 -17.348 -21.286 -9.138 1.00 22.42 H new ATOM 0 HG2 PRO A 42 -15.970 -18.790 -10.106 1.00 11.23 H new ATOM 0 HG3 PRO A 42 -16.944 -19.021 -8.668 1.00 11.23 H new ATOM 0 HD2 PRO A 42 -14.223 -19.010 -8.560 1.00 42.14 H new ATOM 0 HD3 PRO A 42 -15.178 -19.985 -7.462 1.00 42.14 H new ATOM 675 N VAL A 43 -14.614 -20.244 -11.938 1.00 41.44 N ATOM 676 CA VAL A 43 -14.168 -19.971 -13.300 1.00 21.44 C ATOM 677 C VAL A 43 -13.217 -18.780 -13.339 1.00 34.14 C ATOM 678 O VAL A 43 -13.171 -17.979 -12.406 1.00 33.31 O ATOM 679 CB VAL A 43 -15.359 -19.694 -14.236 1.00 33.43 C ATOM 680 CG1 VAL A 43 -14.895 -19.618 -15.682 1.00 54.43 C ATOM 681 CG2 VAL A 43 -16.429 -20.763 -14.066 1.00 50.32 C ATOM 0 H VAL A 43 -14.619 -19.429 -11.325 1.00 41.44 H new ATOM 0 HA VAL A 43 -13.644 -20.862 -13.646 1.00 21.44 H new ATOM 0 HB VAL A 43 -15.794 -18.731 -13.968 1.00 33.43 H new ATOM 0 HG11 VAL A 43 -15.750 -19.422 -16.329 1.00 54.43 H new ATOM 0 HG12 VAL A 43 -14.167 -18.814 -15.789 1.00 54.43 H new ATOM 0 HG13 VAL A 43 -14.435 -20.564 -15.967 1.00 54.43 H new ATOM 0 HG21 VAL A 43 -17.264 -20.552 -14.735 1.00 50.32 H new ATOM 0 HG22 VAL A 43 -16.009 -21.740 -14.307 1.00 50.32 H new ATOM 0 HG23 VAL A 43 -16.782 -20.764 -13.035 1.00 50.32 H new ATOM 691 N ASN A 44 -12.460 -18.670 -14.425 1.00 52.53 N ATOM 692 CA ASN A 44 -11.510 -17.575 -14.586 1.00 64.34 C ATOM 693 C ASN A 44 -10.981 -17.520 -16.017 1.00 11.05 C ATOM 694 O ASN A 44 -11.098 -18.485 -16.772 1.00 74.50 O ATOM 695 CB ASN A 44 -10.346 -17.735 -13.606 1.00 44.14 C ATOM 696 CG ASN A 44 -10.409 -16.738 -12.465 1.00 55.15 C ATOM 697 OD1 ASN A 44 -10.698 -17.101 -11.325 1.00 11.41 O ATOM 698 ND2 ASN A 44 -10.140 -15.474 -12.769 1.00 42.40 N ATOM 0 H ASN A 44 -12.485 -19.325 -15.206 1.00 52.53 H new ATOM 0 HA ASN A 44 -12.030 -16.641 -14.373 1.00 64.34 H new ATOM 0 HB2 ASN A 44 -10.352 -18.747 -13.201 1.00 44.14 H new ATOM 0 HB3 ASN A 44 -9.405 -17.611 -14.141 1.00 44.14 H new ATOM 0 HD21 ASN A 44 -10.168 -14.758 -12.043 1.00 42.40 H new ATOM 0 HD22 ASN A 44 -9.905 -15.219 -13.728 1.00 42.40 H new ATOM 705 N THR A 45 -10.397 -16.383 -16.383 1.00 15.15 N ATOM 706 CA THR A 45 -9.851 -16.201 -17.721 1.00 52.53 C ATOM 707 C THR A 45 -8.572 -15.372 -17.685 1.00 62.50 C ATOM 708 O THR A 45 -8.578 -14.221 -17.250 1.00 51.31 O ATOM 709 CB THR A 45 -10.867 -15.514 -18.654 1.00 31.41 C ATOM 710 OG1 THR A 45 -12.173 -16.065 -18.446 1.00 4.42 O ATOM 711 CG2 THR A 45 -10.465 -15.686 -20.111 1.00 54.41 C ATOM 0 H THR A 45 -10.290 -15.574 -15.770 1.00 15.15 H new ATOM 0 HA THR A 45 -9.627 -17.195 -18.108 1.00 52.53 H new ATOM 0 HB THR A 45 -10.881 -14.449 -18.420 1.00 31.41 H new ATOM 0 HG1 THR A 45 -12.813 -15.622 -19.041 1.00 4.42 H new ATOM 0 HG21 THR A 45 -11.197 -15.193 -20.751 1.00 54.41 H new ATOM 0 HG22 THR A 45 -9.483 -15.241 -20.273 1.00 54.41 H new ATOM 0 HG23 THR A 45 -10.427 -16.748 -20.355 1.00 54.41 H new ATOM 719 N PHE A 46 -7.475 -15.966 -18.145 1.00 53.32 N ATOM 720 CA PHE A 46 -6.187 -15.282 -18.165 1.00 33.11 C ATOM 721 C PHE A 46 -5.944 -14.620 -19.518 1.00 64.20 C ATOM 722 O PHE A 46 -6.770 -14.715 -20.426 1.00 65.00 O ATOM 723 CB PHE A 46 -5.058 -16.267 -17.856 1.00 33.52 C ATOM 724 CG PHE A 46 -5.007 -16.687 -16.415 1.00 21.25 C ATOM 725 CD1 PHE A 46 -5.355 -15.801 -15.408 1.00 53.22 C ATOM 726 CD2 PHE A 46 -4.610 -17.968 -16.066 1.00 64.11 C ATOM 727 CE1 PHE A 46 -5.309 -16.184 -14.081 1.00 15.11 C ATOM 728 CE2 PHE A 46 -4.562 -18.357 -14.741 1.00 12.13 C ATOM 729 CZ PHE A 46 -4.911 -17.463 -13.747 1.00 34.52 C ATOM 0 H PHE A 46 -7.452 -16.919 -18.509 1.00 53.32 H new ATOM 0 HA PHE A 46 -6.203 -14.507 -17.399 1.00 33.11 H new ATOM 0 HB2 PHE A 46 -5.178 -17.152 -18.480 1.00 33.52 H new ATOM 0 HB3 PHE A 46 -4.105 -15.812 -18.128 1.00 33.52 H new ATOM 0 HD1 PHE A 46 -5.666 -14.799 -15.663 1.00 53.22 H new ATOM 0 HD2 PHE A 46 -4.335 -18.671 -16.839 1.00 64.11 H new ATOM 0 HE1 PHE A 46 -5.584 -15.484 -13.306 1.00 15.11 H new ATOM 0 HE2 PHE A 46 -4.252 -19.359 -14.483 1.00 12.13 H new ATOM 0 HZ PHE A 46 -4.873 -17.764 -12.711 1.00 34.52 H new ATOM 739 N VAL A 47 -4.803 -13.949 -19.645 1.00 14.21 N ATOM 740 CA VAL A 47 -4.449 -13.271 -20.886 1.00 53.02 C ATOM 741 C VAL A 47 -2.947 -13.332 -21.137 1.00 23.24 C ATOM 742 O VAL A 47 -2.154 -12.803 -20.356 1.00 73.23 O ATOM 743 CB VAL A 47 -4.896 -11.797 -20.868 1.00 31.10 C ATOM 744 CG1 VAL A 47 -4.374 -11.065 -22.095 1.00 62.40 C ATOM 745 CG2 VAL A 47 -6.412 -11.701 -20.785 1.00 20.21 C ATOM 0 H VAL A 47 -4.108 -13.861 -18.903 1.00 14.21 H new ATOM 0 HA VAL A 47 -4.970 -13.791 -21.690 1.00 53.02 H new ATOM 0 HB VAL A 47 -4.475 -11.319 -19.983 1.00 31.10 H new ATOM 0 HG11 VAL A 47 -4.700 -10.025 -22.065 1.00 62.40 H new ATOM 0 HG12 VAL A 47 -3.285 -11.104 -22.106 1.00 62.40 H new ATOM 0 HG13 VAL A 47 -4.763 -11.541 -22.995 1.00 62.40 H new ATOM 0 HG21 VAL A 47 -6.710 -10.653 -20.773 1.00 20.21 H new ATOM 0 HG22 VAL A 47 -6.856 -12.195 -21.650 1.00 20.21 H new ATOM 0 HG23 VAL A 47 -6.758 -12.187 -19.873 1.00 20.21 H new ATOM 755 N HIS A 48 -2.561 -13.981 -22.231 1.00 5.23 N ATOM 756 CA HIS A 48 -1.152 -14.110 -22.585 1.00 63.34 C ATOM 757 C HIS A 48 -0.650 -12.852 -23.288 1.00 75.43 C ATOM 758 O HIS A 48 0.385 -12.873 -23.953 1.00 1.24 O ATOM 759 CB HIS A 48 -0.940 -15.329 -23.484 1.00 32.31 C ATOM 760 CG HIS A 48 -1.052 -16.635 -22.758 1.00 53.25 C ATOM 761 ND1 HIS A 48 -0.239 -16.980 -21.700 1.00 65.02 N ATOM 762 CD2 HIS A 48 -1.891 -17.681 -22.943 1.00 61.13 C ATOM 763 CE1 HIS A 48 -0.570 -18.183 -21.267 1.00 15.14 C ATOM 764 NE2 HIS A 48 -1.571 -18.630 -22.004 1.00 21.21 N ATOM 0 H HIS A 48 -3.203 -14.425 -22.887 1.00 5.23 H new ATOM 0 HA HIS A 48 -0.583 -14.242 -21.665 1.00 63.34 H new ATOM 0 HB2 HIS A 48 -1.673 -15.307 -24.291 1.00 32.31 H new ATOM 0 HB3 HIS A 48 0.045 -15.263 -23.946 1.00 32.31 H new ATOM 0 HD1 HIS A 48 0.503 -16.397 -21.312 1.00 65.02 H new ATOM 0 HD2 HIS A 48 -2.667 -17.755 -23.690 1.00 61.13 H new ATOM 0 HE1 HIS A 48 -0.102 -18.711 -20.450 1.00 15.14 H new ATOM 772 N GLU A 49 -1.393 -11.760 -23.137 1.00 60.02 N ATOM 773 CA GLU A 49 -1.024 -10.494 -23.759 1.00 64.04 C ATOM 774 C GLU A 49 -0.671 -9.451 -22.703 1.00 21.03 C ATOM 775 O GLU A 49 -1.131 -9.506 -21.562 1.00 23.20 O ATOM 776 CB GLU A 49 -2.166 -9.980 -24.638 1.00 42.31 C ATOM 777 CG GLU A 49 -1.769 -9.769 -26.090 1.00 13.23 C ATOM 778 CD GLU A 49 -1.928 -8.328 -26.534 1.00 50.32 C ATOM 779 OE1 GLU A 49 -1.996 -7.440 -25.659 1.00 21.24 O ATOM 780 OE2 GLU A 49 -1.984 -8.088 -27.759 1.00 30.13 O ATOM 0 H GLU A 49 -2.253 -11.727 -22.590 1.00 60.02 H new ATOM 0 HA GLU A 49 -0.146 -10.667 -24.381 1.00 64.04 H new ATOM 0 HB2 GLU A 49 -2.993 -10.689 -24.596 1.00 42.31 H new ATOM 0 HB3 GLU A 49 -2.532 -9.038 -24.230 1.00 42.31 H new ATOM 0 HG2 GLU A 49 -0.732 -10.075 -26.228 1.00 13.23 H new ATOM 0 HG3 GLU A 49 -2.378 -10.411 -26.726 1.00 13.23 H new ATOM 787 N PRO A 50 0.166 -8.477 -23.090 1.00 11.12 N ATOM 788 CA PRO A 50 0.599 -7.403 -22.192 1.00 5.54 C ATOM 789 C PRO A 50 -0.530 -6.434 -21.858 1.00 73.15 C ATOM 790 O PRO A 50 -1.451 -6.241 -22.654 1.00 3.51 O ATOM 791 CB PRO A 50 1.694 -6.692 -22.991 1.00 65.02 C ATOM 792 CG PRO A 50 1.368 -6.977 -24.417 1.00 0.14 C ATOM 793 CD PRO A 50 0.753 -8.349 -24.434 1.00 53.23 C ATOM 0 HA PRO A 50 0.936 -7.789 -21.230 1.00 5.54 H new ATOM 0 HB2 PRO A 50 1.697 -5.620 -22.792 1.00 65.02 H new ATOM 0 HB3 PRO A 50 2.683 -7.067 -22.728 1.00 65.02 H new ATOM 0 HG2 PRO A 50 0.677 -6.234 -24.815 1.00 0.14 H new ATOM 0 HG3 PRO A 50 2.264 -6.943 -25.037 1.00 0.14 H new ATOM 0 HD2 PRO A 50 -0.004 -8.440 -25.213 1.00 53.23 H new ATOM 0 HD3 PRO A 50 1.499 -9.121 -24.622 1.00 53.23 H new ATOM 801 N LEU A 51 -0.455 -5.828 -20.679 1.00 43.40 N ATOM 802 CA LEU A 51 -1.471 -4.878 -20.240 1.00 55.15 C ATOM 803 C LEU A 51 -1.490 -3.646 -21.140 1.00 73.21 C ATOM 804 O LEU A 51 -2.534 -3.271 -21.675 1.00 2.44 O ATOM 805 CB LEU A 51 -1.217 -4.461 -18.791 1.00 3.10 C ATOM 806 CG LEU A 51 -2.172 -3.415 -18.215 1.00 75.25 C ATOM 807 CD1 LEU A 51 -3.490 -4.060 -17.814 1.00 0.02 C ATOM 808 CD2 LEU A 51 -1.538 -2.710 -17.026 1.00 45.51 C ATOM 0 H LEU A 51 0.299 -5.978 -20.009 1.00 43.40 H new ATOM 0 HA LEU A 51 -2.442 -5.368 -20.305 1.00 55.15 H new ATOM 0 HB2 LEU A 51 -1.265 -5.351 -18.164 1.00 3.10 H new ATOM 0 HB3 LEU A 51 -0.200 -4.074 -18.718 1.00 3.10 H new ATOM 0 HG LEU A 51 -2.374 -2.672 -18.986 1.00 75.25 H new ATOM 0 HD11 LEU A 51 -4.157 -3.301 -17.406 1.00 0.02 H new ATOM 0 HD12 LEU A 51 -3.952 -4.517 -18.689 1.00 0.02 H new ATOM 0 HD13 LEU A 51 -3.306 -4.825 -17.059 1.00 0.02 H new ATOM 0 HD21 LEU A 51 -2.232 -1.969 -16.630 1.00 45.51 H new ATOM 0 HD22 LEU A 51 -1.306 -3.441 -16.251 1.00 45.51 H new ATOM 0 HD23 LEU A 51 -0.621 -2.214 -17.344 1.00 45.51 H new ATOM 820 N VAL A 52 -0.328 -3.022 -21.305 1.00 32.21 N ATOM 821 CA VAL A 52 -0.210 -1.835 -22.143 1.00 10.24 C ATOM 822 C VAL A 52 -1.187 -1.888 -23.312 1.00 43.10 C ATOM 823 O VAL A 52 -1.867 -0.906 -23.611 1.00 32.50 O ATOM 824 CB VAL A 52 1.221 -1.674 -22.690 1.00 33.11 C ATOM 825 CG1 VAL A 52 1.574 -2.832 -23.610 1.00 72.43 C ATOM 826 CG2 VAL A 52 1.368 -0.344 -23.413 1.00 12.21 C ATOM 0 H VAL A 52 0.545 -3.319 -20.869 1.00 32.21 H new ATOM 0 HA VAL A 52 -0.448 -0.978 -21.513 1.00 10.24 H new ATOM 0 HB VAL A 52 1.916 -1.684 -21.850 1.00 33.11 H new ATOM 0 HG11 VAL A 52 2.588 -2.701 -23.987 1.00 72.43 H new ATOM 0 HG12 VAL A 52 1.511 -3.769 -23.056 1.00 72.43 H new ATOM 0 HG13 VAL A 52 0.876 -2.857 -24.447 1.00 72.43 H new ATOM 0 HG21 VAL A 52 2.385 -0.247 -23.793 1.00 12.21 H new ATOM 0 HG22 VAL A 52 0.664 -0.302 -24.244 1.00 12.21 H new ATOM 0 HG23 VAL A 52 1.160 0.472 -22.720 1.00 12.21 H new ATOM 836 N ASP A 53 -1.251 -3.040 -23.970 1.00 21.20 N ATOM 837 CA ASP A 53 -2.146 -3.223 -25.107 1.00 10.33 C ATOM 838 C ASP A 53 -3.604 -3.102 -24.675 1.00 52.40 C ATOM 839 O ASP A 53 -4.393 -2.400 -25.307 1.00 55.43 O ATOM 840 CB ASP A 53 -1.906 -4.585 -25.759 1.00 23.34 C ATOM 841 CG ASP A 53 -2.386 -4.632 -27.196 1.00 34.33 C ATOM 842 OD1 ASP A 53 -3.569 -4.310 -27.437 1.00 43.31 O ATOM 843 OD2 ASP A 53 -1.580 -4.991 -28.079 1.00 51.11 O ATOM 0 H ASP A 53 -0.694 -3.862 -23.736 1.00 21.20 H new ATOM 0 HA ASP A 53 -1.934 -2.439 -25.834 1.00 10.33 H new ATOM 0 HB2 ASP A 53 -0.842 -4.817 -25.727 1.00 23.34 H new ATOM 0 HB3 ASP A 53 -2.418 -5.356 -25.183 1.00 23.34 H new ATOM 848 N VAL A 54 -3.956 -3.791 -23.594 1.00 65.55 N ATOM 849 CA VAL A 54 -5.319 -3.761 -23.078 1.00 64.40 C ATOM 850 C VAL A 54 -5.702 -2.358 -22.621 1.00 73.51 C ATOM 851 O VAL A 54 -6.869 -1.971 -22.687 1.00 64.45 O ATOM 852 CB VAL A 54 -5.495 -4.739 -21.901 1.00 5.13 C ATOM 853 CG1 VAL A 54 -6.872 -4.580 -21.276 1.00 10.24 C ATOM 854 CG2 VAL A 54 -5.271 -6.172 -22.360 1.00 42.45 C ATOM 0 H VAL A 54 -3.315 -4.377 -23.059 1.00 65.55 H new ATOM 0 HA VAL A 54 -5.974 -4.066 -23.894 1.00 64.40 H new ATOM 0 HB VAL A 54 -4.749 -4.504 -21.142 1.00 5.13 H new ATOM 0 HG11 VAL A 54 -6.978 -5.279 -20.446 1.00 10.24 H new ATOM 0 HG12 VAL A 54 -6.989 -3.560 -20.909 1.00 10.24 H new ATOM 0 HG13 VAL A 54 -7.637 -4.786 -22.024 1.00 10.24 H new ATOM 0 HG21 VAL A 54 -5.399 -6.849 -21.515 1.00 42.45 H new ATOM 0 HG22 VAL A 54 -5.992 -6.422 -23.138 1.00 42.45 H new ATOM 0 HG23 VAL A 54 -4.261 -6.274 -22.756 1.00 42.45 H new ATOM 864 N GLN A 55 -4.713 -1.602 -22.158 1.00 2.40 N ATOM 865 CA GLN A 55 -4.947 -0.241 -21.690 1.00 15.23 C ATOM 866 C GLN A 55 -5.349 0.671 -22.845 1.00 24.23 C ATOM 867 O GLN A 55 -6.255 1.493 -22.714 1.00 24.44 O ATOM 868 CB GLN A 55 -3.696 0.308 -21.002 1.00 63.45 C ATOM 869 CG GLN A 55 -3.140 -0.611 -19.926 1.00 75.33 C ATOM 870 CD GLN A 55 -2.811 0.125 -18.643 1.00 14.22 C ATOM 871 OE1 GLN A 55 -2.318 1.253 -18.670 1.00 15.33 O ATOM 872 NE2 GLN A 55 -3.083 -0.510 -17.509 1.00 20.31 N ATOM 0 H GLN A 55 -3.742 -1.908 -22.097 1.00 2.40 H new ATOM 0 HA GLN A 55 -5.765 -0.268 -20.971 1.00 15.23 H new ATOM 0 HB2 GLN A 55 -2.925 0.482 -21.753 1.00 63.45 H new ATOM 0 HB3 GLN A 55 -3.931 1.275 -20.556 1.00 63.45 H new ATOM 0 HG2 GLN A 55 -3.865 -1.396 -19.714 1.00 75.33 H new ATOM 0 HG3 GLN A 55 -2.241 -1.100 -20.301 1.00 75.33 H new ATOM 0 HE21 GLN A 55 -3.492 -1.444 -17.533 1.00 20.31 H new ATOM 0 HE22 GLN A 55 -2.883 -0.063 -16.614 1.00 20.31 H new ATOM 881 N ASN A 56 -4.667 0.520 -23.976 1.00 30.53 N ATOM 882 CA ASN A 56 -4.952 1.330 -25.154 1.00 41.20 C ATOM 883 C ASN A 56 -6.374 1.086 -25.651 1.00 44.52 C ATOM 884 O ASN A 56 -6.931 1.897 -26.392 1.00 34.54 O ATOM 885 CB ASN A 56 -3.950 1.019 -26.267 1.00 61.35 C ATOM 886 CG ASN A 56 -2.544 1.472 -25.924 1.00 12.42 C ATOM 887 OD1 ASN A 56 -2.240 2.665 -25.955 1.00 21.15 O ATOM 888 ND2 ASN A 56 -1.679 0.520 -25.594 1.00 53.13 N ATOM 0 H ASN A 56 -3.913 -0.156 -24.101 1.00 30.53 H new ATOM 0 HA ASN A 56 -4.859 2.379 -24.874 1.00 41.20 H new ATOM 0 HB2 ASN A 56 -3.946 -0.054 -26.459 1.00 61.35 H new ATOM 0 HB3 ASN A 56 -4.271 1.506 -27.188 1.00 61.35 H new ATOM 0 HD21 ASN A 56 -0.719 0.765 -25.353 1.00 53.13 H new ATOM 0 HD22 ASN A 56 -1.975 -0.456 -25.582 1.00 53.13 H new ATOM 895 N VAL A 57 -6.955 -0.035 -25.238 1.00 61.43 N ATOM 896 CA VAL A 57 -8.312 -0.386 -25.640 1.00 11.22 C ATOM 897 C VAL A 57 -9.311 0.672 -25.183 1.00 23.31 C ATOM 898 O VAL A 57 -10.199 1.069 -25.937 1.00 12.41 O ATOM 899 CB VAL A 57 -8.731 -1.753 -25.068 1.00 33.11 C ATOM 900 CG1 VAL A 57 -10.192 -2.039 -25.383 1.00 3.34 C ATOM 901 CG2 VAL A 57 -7.835 -2.855 -25.612 1.00 23.12 C ATOM 0 H VAL A 57 -6.507 -0.716 -24.625 1.00 61.43 H new ATOM 0 HA VAL A 57 -8.316 -0.440 -26.729 1.00 11.22 H new ATOM 0 HB VAL A 57 -8.617 -1.724 -23.984 1.00 33.11 H new ATOM 0 HG11 VAL A 57 -10.470 -3.009 -24.971 1.00 3.34 H new ATOM 0 HG12 VAL A 57 -10.818 -1.264 -24.941 1.00 3.34 H new ATOM 0 HG13 VAL A 57 -10.336 -2.049 -26.463 1.00 3.34 H new ATOM 0 HG21 VAL A 57 -8.145 -3.814 -25.197 1.00 23.12 H new ATOM 0 HG22 VAL A 57 -7.916 -2.886 -26.699 1.00 23.12 H new ATOM 0 HG23 VAL A 57 -6.801 -2.655 -25.330 1.00 23.12 H new ATOM 911 N CYS A 58 -9.159 1.124 -23.943 1.00 3.41 N ATOM 912 CA CYS A 58 -10.046 2.137 -23.384 1.00 35.54 C ATOM 913 C CYS A 58 -10.008 3.414 -24.217 1.00 53.21 C ATOM 914 O CYS A 58 -10.915 4.244 -24.143 1.00 61.12 O ATOM 915 CB CYS A 58 -9.654 2.446 -21.937 1.00 54.05 C ATOM 916 SG CYS A 58 -11.068 2.577 -20.796 1.00 23.14 S ATOM 0 H CYS A 58 -8.429 0.805 -23.306 1.00 3.41 H new ATOM 0 HA CYS A 58 -11.062 1.744 -23.402 1.00 35.54 H new ATOM 0 HB2 CYS A 58 -8.983 1.665 -21.579 1.00 54.05 H new ATOM 0 HB3 CYS A 58 -9.095 3.382 -21.915 1.00 54.05 H new ATOM 921 N PHE A 59 -8.953 3.565 -25.010 1.00 43.31 N ATOM 922 CA PHE A 59 -8.795 4.742 -25.857 1.00 72.44 C ATOM 923 C PHE A 59 -9.102 4.407 -27.314 1.00 42.54 C ATOM 924 O PHE A 59 -9.278 5.301 -28.142 1.00 71.23 O ATOM 925 CB PHE A 59 -7.374 5.296 -25.738 1.00 31.03 C ATOM 926 CG PHE A 59 -6.845 5.291 -24.332 1.00 13.51 C ATOM 927 CD1 PHE A 59 -7.600 5.811 -23.292 1.00 60.32 C ATOM 928 CD2 PHE A 59 -5.594 4.768 -24.050 1.00 31.42 C ATOM 929 CE1 PHE A 59 -7.115 5.808 -21.998 1.00 14.41 C ATOM 930 CE2 PHE A 59 -5.104 4.762 -22.757 1.00 53.23 C ATOM 931 CZ PHE A 59 -5.867 5.282 -21.730 1.00 4.51 C ATOM 0 H PHE A 59 -8.194 2.887 -25.084 1.00 43.31 H new ATOM 0 HA PHE A 59 -9.502 5.500 -25.519 1.00 72.44 H new ATOM 0 HB2 PHE A 59 -6.709 4.708 -26.370 1.00 31.03 H new ATOM 0 HB3 PHE A 59 -7.357 6.317 -26.121 1.00 31.03 H new ATOM 0 HD1 PHE A 59 -8.578 6.223 -23.495 1.00 60.32 H new ATOM 0 HD2 PHE A 59 -4.994 4.360 -24.850 1.00 31.42 H new ATOM 0 HE1 PHE A 59 -7.712 6.217 -21.196 1.00 14.41 H new ATOM 0 HE2 PHE A 59 -4.127 4.352 -22.551 1.00 53.23 H new ATOM 0 HZ PHE A 59 -5.488 5.277 -20.719 1.00 4.51 H new ATOM 941 N GLN A 60 -9.163 3.115 -27.619 1.00 2.14 N ATOM 942 CA GLN A 60 -9.447 2.663 -28.975 1.00 63.24 C ATOM 943 C GLN A 60 -10.945 2.698 -29.259 1.00 21.55 C ATOM 944 O GLN A 60 -11.401 3.414 -30.149 1.00 2.43 O ATOM 945 CB GLN A 60 -8.908 1.247 -29.187 1.00 33.33 C ATOM 946 CG GLN A 60 -7.471 1.210 -29.680 1.00 21.51 C ATOM 947 CD GLN A 60 -7.362 0.780 -31.130 1.00 32.55 C ATOM 948 OE1 GLN A 60 -7.336 1.613 -32.036 1.00 30.41 O ATOM 949 NE2 GLN A 60 -7.298 -0.527 -31.356 1.00 60.34 N ATOM 0 H GLN A 60 -9.019 2.363 -26.945 1.00 2.14 H new ATOM 0 HA GLN A 60 -8.949 3.341 -29.668 1.00 63.24 H new ATOM 0 HB2 GLN A 60 -8.975 0.697 -28.248 1.00 33.33 H new ATOM 0 HB3 GLN A 60 -9.543 0.729 -29.906 1.00 33.33 H new ATOM 0 HG2 GLN A 60 -7.025 2.198 -29.564 1.00 21.51 H new ATOM 0 HG3 GLN A 60 -6.895 0.525 -29.058 1.00 21.51 H new ATOM 0 HE21 GLN A 60 -7.323 -1.182 -30.574 1.00 60.34 H new ATOM 0 HE22 GLN A 60 -7.224 -0.876 -32.311 1.00 60.34 H new ATOM 958 N GLU A 61 -11.705 1.918 -28.495 1.00 44.04 N ATOM 959 CA GLU A 61 -13.152 1.860 -28.666 1.00 64.42 C ATOM 960 C GLU A 61 -13.861 1.900 -27.316 1.00 0.53 C ATOM 961 O GLU A 61 -13.223 1.847 -26.264 1.00 42.31 O ATOM 962 CB GLU A 61 -13.547 0.591 -29.424 1.00 71.51 C ATOM 963 CG GLU A 61 -14.827 0.737 -30.229 1.00 74.53 C ATOM 964 CD GLU A 61 -14.980 -0.343 -31.283 1.00 72.10 C ATOM 965 OE1 GLU A 61 -14.618 -1.504 -30.999 1.00 23.01 O ATOM 966 OE2 GLU A 61 -15.462 -0.028 -32.391 1.00 45.41 O ATOM 0 H GLU A 61 -11.343 1.319 -27.753 1.00 44.04 H new ATOM 0 HA GLU A 61 -13.459 2.731 -29.244 1.00 64.42 H new ATOM 0 HB2 GLU A 61 -12.735 0.311 -30.096 1.00 71.51 H new ATOM 0 HB3 GLU A 61 -13.667 -0.225 -28.712 1.00 71.51 H new ATOM 0 HG2 GLU A 61 -15.682 0.704 -29.554 1.00 74.53 H new ATOM 0 HG3 GLU A 61 -14.839 1.714 -30.711 1.00 74.53 H new ATOM 973 N LYS A 62 -15.186 1.996 -27.353 1.00 23.13 N ATOM 974 CA LYS A 62 -15.984 2.044 -26.134 1.00 32.54 C ATOM 975 C LYS A 62 -17.238 1.186 -26.271 1.00 12.03 C ATOM 976 O LYS A 62 -17.698 0.914 -27.380 1.00 13.32 O ATOM 977 CB LYS A 62 -16.374 3.488 -25.811 1.00 22.23 C ATOM 978 CG LYS A 62 -15.221 4.326 -25.287 1.00 2.31 C ATOM 979 CD LYS A 62 -15.527 5.812 -25.374 1.00 40.02 C ATOM 980 CE LYS A 62 -14.919 6.434 -26.622 1.00 73.12 C ATOM 981 NZ LYS A 62 -13.619 7.100 -26.333 1.00 52.11 N ATOM 0 H LYS A 62 -15.730 2.042 -28.215 1.00 23.13 H new ATOM 0 HA LYS A 62 -15.380 1.647 -25.318 1.00 32.54 H new ATOM 0 HB2 LYS A 62 -16.774 3.957 -26.710 1.00 22.23 H new ATOM 0 HB3 LYS A 62 -17.174 3.483 -25.071 1.00 22.23 H new ATOM 0 HG2 LYS A 62 -15.015 4.056 -24.251 1.00 2.31 H new ATOM 0 HG3 LYS A 62 -14.320 4.105 -25.859 1.00 2.31 H new ATOM 0 HD2 LYS A 62 -16.607 5.963 -25.380 1.00 40.02 H new ATOM 0 HD3 LYS A 62 -15.140 6.317 -24.489 1.00 40.02 H new ATOM 0 HE2 LYS A 62 -14.772 5.662 -27.377 1.00 73.12 H new ATOM 0 HE3 LYS A 62 -15.614 7.161 -27.041 1.00 73.12 H new ATOM 0 HZ1 LYS A 62 -13.237 7.511 -27.209 1.00 52.11 H new ATOM 0 HZ2 LYS A 62 -13.764 7.854 -25.631 1.00 52.11 H new ATOM 0 HZ3 LYS A 62 -12.947 6.401 -25.957 1.00 52.11 H new ATOM 995 N VAL A 63 -17.788 0.764 -25.136 1.00 62.45 N ATOM 996 CA VAL A 63 -18.990 -0.061 -25.130 1.00 53.12 C ATOM 997 C VAL A 63 -19.921 0.333 -23.989 1.00 1.22 C ATOM 998 O VAL A 63 -19.502 0.971 -23.023 1.00 3.54 O ATOM 999 CB VAL A 63 -18.645 -1.556 -25.003 1.00 62.53 C ATOM 1000 CG1 VAL A 63 -17.539 -1.934 -25.977 1.00 42.30 C ATOM 1001 CG2 VAL A 63 -18.245 -1.891 -23.574 1.00 71.01 C ATOM 0 H VAL A 63 -17.420 0.980 -24.210 1.00 62.45 H new ATOM 0 HA VAL A 63 -19.494 0.108 -26.082 1.00 53.12 H new ATOM 0 HB VAL A 63 -19.532 -2.138 -25.254 1.00 62.53 H new ATOM 0 HG11 VAL A 63 -17.309 -2.994 -25.873 1.00 42.30 H new ATOM 0 HG12 VAL A 63 -17.868 -1.733 -26.997 1.00 42.30 H new ATOM 0 HG13 VAL A 63 -16.647 -1.346 -25.761 1.00 42.30 H new ATOM 0 HG21 VAL A 63 -18.005 -2.952 -23.503 1.00 71.01 H new ATOM 0 HG22 VAL A 63 -17.372 -1.301 -23.293 1.00 71.01 H new ATOM 0 HG23 VAL A 63 -19.071 -1.660 -22.901 1.00 71.01 H new ATOM 1011 N THR A 64 -21.188 -0.052 -24.106 1.00 11.33 N ATOM 1012 CA THR A 64 -22.179 0.261 -23.084 1.00 54.53 C ATOM 1013 C THR A 64 -22.158 -0.771 -21.963 1.00 14.11 C ATOM 1014 O THR A 64 -21.683 -1.892 -22.146 1.00 74.11 O ATOM 1015 CB THR A 64 -23.598 0.327 -23.680 1.00 34.10 C ATOM 1016 OG1 THR A 64 -23.526 0.478 -25.102 1.00 52.31 O ATOM 1017 CG2 THR A 64 -24.384 1.484 -23.081 1.00 21.21 C ATOM 0 H THR A 64 -21.552 -0.581 -24.898 1.00 11.33 H new ATOM 0 HA THR A 64 -21.917 1.238 -22.678 1.00 54.53 H new ATOM 0 HB THR A 64 -24.112 -0.604 -23.440 1.00 34.10 H new ATOM 0 HG1 THR A 64 -24.432 0.517 -25.473 1.00 52.31 H new ATOM 0 HG21 THR A 64 -25.383 1.510 -23.517 1.00 21.21 H new ATOM 0 HG22 THR A 64 -24.463 1.350 -22.002 1.00 21.21 H new ATOM 0 HG23 THR A 64 -23.870 2.422 -23.294 1.00 21.21 H new ATOM 1025 N CYS A 65 -22.677 -0.386 -20.801 1.00 64.33 N ATOM 1026 CA CYS A 65 -22.718 -1.279 -19.649 1.00 40.51 C ATOM 1027 C CYS A 65 -24.082 -1.223 -18.967 1.00 3.24 C ATOM 1028 O CYS A 65 -24.905 -0.359 -19.269 1.00 74.23 O ATOM 1029 CB CYS A 65 -21.620 -0.907 -18.650 1.00 71.04 C ATOM 1030 SG CYS A 65 -20.119 -1.931 -18.781 1.00 2.40 S ATOM 0 H CYS A 65 -23.075 0.538 -20.633 1.00 64.33 H new ATOM 0 HA CYS A 65 -22.549 -2.296 -20.002 1.00 40.51 H new ATOM 0 HB2 CYS A 65 -21.348 0.138 -18.798 1.00 71.04 H new ATOM 0 HB3 CYS A 65 -22.019 -0.993 -17.639 1.00 71.04 H new ATOM 1035 N LYS A 66 -24.313 -2.150 -18.043 1.00 54.15 N ATOM 1036 CA LYS A 66 -25.576 -2.207 -17.316 1.00 24.22 C ATOM 1037 C LYS A 66 -26.134 -0.807 -17.083 1.00 44.33 C ATOM 1038 O LYS A 66 -27.212 -0.470 -17.569 1.00 52.24 O ATOM 1039 CB LYS A 66 -25.383 -2.920 -15.975 1.00 72.03 C ATOM 1040 CG LYS A 66 -24.961 -4.373 -16.114 1.00 12.51 C ATOM 1041 CD LYS A 66 -25.115 -5.125 -14.803 1.00 61.41 C ATOM 1042 CE LYS A 66 -24.801 -6.604 -14.970 1.00 24.35 C ATOM 1043 NZ LYS A 66 -25.077 -7.374 -13.725 1.00 2.53 N ATOM 0 H LYS A 66 -23.642 -2.872 -17.780 1.00 54.15 H new ATOM 0 HA LYS A 66 -26.290 -2.767 -17.920 1.00 24.22 H new ATOM 0 HB2 LYS A 66 -24.631 -2.386 -15.394 1.00 72.03 H new ATOM 0 HB3 LYS A 66 -26.314 -2.873 -15.411 1.00 72.03 H new ATOM 0 HG2 LYS A 66 -25.562 -4.856 -16.884 1.00 12.51 H new ATOM 0 HG3 LYS A 66 -23.923 -4.422 -16.443 1.00 12.51 H new ATOM 0 HD2 LYS A 66 -24.451 -4.693 -14.054 1.00 61.41 H new ATOM 0 HD3 LYS A 66 -26.133 -5.007 -14.432 1.00 61.41 H new ATOM 0 HE2 LYS A 66 -25.395 -7.011 -15.788 1.00 24.35 H new ATOM 0 HE3 LYS A 66 -23.753 -6.724 -15.246 1.00 24.35 H new ATOM 0 HZ1 LYS A 66 -24.850 -8.377 -13.880 1.00 2.53 H new ATOM 0 HZ2 LYS A 66 -24.492 -7.002 -12.950 1.00 2.53 H new ATOM 0 HZ3 LYS A 66 -26.082 -7.281 -13.475 1.00 2.53 H new ATOM 1057 N ASN A 67 -25.391 0.005 -16.338 1.00 44.21 N ATOM 1058 CA ASN A 67 -25.811 1.370 -16.042 1.00 73.04 C ATOM 1059 C ASN A 67 -26.202 2.108 -17.320 1.00 21.44 C ATOM 1060 O ASN A 67 -27.173 2.863 -17.341 1.00 4.04 O ATOM 1061 CB ASN A 67 -24.692 2.127 -15.325 1.00 63.11 C ATOM 1062 CG ASN A 67 -23.705 2.753 -16.292 1.00 73.20 C ATOM 1063 OD1 ASN A 67 -23.690 3.969 -16.480 1.00 2.43 O ATOM 1064 ND2 ASN A 67 -22.876 1.921 -16.912 1.00 3.25 N ATOM 0 H ASN A 67 -24.495 -0.259 -15.928 1.00 44.21 H new ATOM 0 HA ASN A 67 -26.683 1.322 -15.390 1.00 73.04 H new ATOM 0 HB2 ASN A 67 -25.127 2.906 -14.699 1.00 63.11 H new ATOM 0 HB3 ASN A 67 -24.162 1.444 -14.661 1.00 63.11 H new ATOM 0 HD21 ASN A 67 -22.191 2.284 -17.575 1.00 3.25 H new ATOM 0 HD22 ASN A 67 -22.924 0.919 -16.725 1.00 3.25 H new ATOM 1071 N GLY A 68 -25.438 1.882 -18.384 1.00 60.23 N ATOM 1072 CA GLY A 68 -25.720 2.531 -19.651 1.00 11.41 C ATOM 1073 C GLY A 68 -24.677 3.569 -20.016 1.00 25.43 C ATOM 1074 O GLY A 68 -24.980 4.551 -20.692 1.00 3.24 O ATOM 0 H GLY A 68 -24.629 1.261 -18.391 1.00 60.23 H new ATOM 0 HA2 GLY A 68 -25.770 1.778 -20.438 1.00 11.41 H new ATOM 0 HA3 GLY A 68 -26.700 3.006 -19.602 1.00 11.41 H new ATOM 1078 N GLN A 69 -23.445 3.350 -19.566 1.00 11.32 N ATOM 1079 CA GLN A 69 -22.354 4.276 -19.847 1.00 52.04 C ATOM 1080 C GLN A 69 -21.155 3.541 -20.437 1.00 71.01 C ATOM 1081 O GLN A 69 -21.174 2.320 -20.585 1.00 71.21 O ATOM 1082 CB GLN A 69 -21.940 5.012 -18.572 1.00 63.10 C ATOM 1083 CG GLN A 69 -22.866 6.159 -18.203 1.00 40.43 C ATOM 1084 CD GLN A 69 -22.311 7.022 -17.087 1.00 61.01 C ATOM 1085 OE1 GLN A 69 -21.788 8.110 -17.329 1.00 64.03 O ATOM 1086 NE2 GLN A 69 -22.422 6.540 -15.855 1.00 32.12 N ATOM 0 H GLN A 69 -23.178 2.540 -19.006 1.00 11.32 H new ATOM 0 HA GLN A 69 -22.707 5.003 -20.578 1.00 52.04 H new ATOM 0 HB2 GLN A 69 -21.909 4.301 -17.746 1.00 63.10 H new ATOM 0 HB3 GLN A 69 -20.929 5.399 -18.698 1.00 63.10 H new ATOM 0 HG2 GLN A 69 -23.040 6.778 -19.083 1.00 40.43 H new ATOM 0 HG3 GLN A 69 -23.833 5.757 -17.900 1.00 40.43 H new ATOM 0 HE21 GLN A 69 -22.863 5.633 -15.700 1.00 32.12 H new ATOM 0 HE22 GLN A 69 -22.066 7.076 -15.064 1.00 32.12 H new ATOM 1095 N GLY A 70 -20.112 4.294 -20.773 1.00 1.11 N ATOM 1096 CA GLY A 70 -18.919 3.697 -21.343 1.00 63.33 C ATOM 1097 C GLY A 70 -17.991 3.132 -20.286 1.00 3.30 C ATOM 1098 O GLY A 70 -16.775 3.308 -20.360 1.00 14.25 O ATOM 0 H GLY A 70 -20.072 5.307 -20.660 1.00 1.11 H new ATOM 0 HA2 GLY A 70 -19.207 2.902 -22.031 1.00 63.33 H new ATOM 0 HA3 GLY A 70 -18.385 4.446 -21.927 1.00 63.33 H new ATOM 1102 N ASN A 71 -18.565 2.453 -19.298 1.00 40.14 N ATOM 1103 CA ASN A 71 -17.781 1.863 -18.220 1.00 22.13 C ATOM 1104 C ASN A 71 -16.990 0.657 -18.719 1.00 35.04 C ATOM 1105 O ASN A 71 -16.104 0.153 -18.028 1.00 72.22 O ATOM 1106 CB ASN A 71 -18.695 1.446 -17.066 1.00 22.22 C ATOM 1107 CG ASN A 71 -17.923 0.860 -15.899 1.00 42.51 C ATOM 1108 OD1 ASN A 71 -17.626 1.554 -14.926 1.00 41.13 O ATOM 1109 ND2 ASN A 71 -17.593 -0.423 -15.992 1.00 15.41 N ATOM 0 H ASN A 71 -19.570 2.298 -19.222 1.00 40.14 H new ATOM 0 HA ASN A 71 -17.077 2.614 -17.863 1.00 22.13 H new ATOM 0 HB2 ASN A 71 -19.262 2.312 -16.725 1.00 22.22 H new ATOM 0 HB3 ASN A 71 -19.417 0.713 -17.425 1.00 22.22 H new ATOM 0 HD21 ASN A 71 -17.072 -0.872 -15.238 1.00 15.41 H new ATOM 0 HD22 ASN A 71 -17.860 -0.960 -16.817 1.00 15.41 H new ATOM 1116 N CYS A 72 -17.317 0.199 -19.923 1.00 11.44 N ATOM 1117 CA CYS A 72 -16.639 -0.947 -20.515 1.00 50.14 C ATOM 1118 C CYS A 72 -16.118 -0.609 -21.909 1.00 64.33 C ATOM 1119 O CYS A 72 -16.491 0.408 -22.494 1.00 4.25 O ATOM 1120 CB CYS A 72 -17.588 -2.145 -20.590 1.00 41.32 C ATOM 1121 SG CYS A 72 -19.353 -1.695 -20.614 1.00 0.34 S ATOM 0 H CYS A 72 -18.048 0.605 -20.508 1.00 11.44 H new ATOM 0 HA CYS A 72 -15.790 -1.204 -19.881 1.00 50.14 H new ATOM 0 HB2 CYS A 72 -17.359 -2.721 -21.487 1.00 41.32 H new ATOM 0 HB3 CYS A 72 -17.402 -2.797 -19.736 1.00 41.32 H new ATOM 1126 N TYR A 73 -15.254 -1.470 -22.436 1.00 4.01 N ATOM 1127 CA TYR A 73 -14.679 -1.263 -23.760 1.00 0.42 C ATOM 1128 C TYR A 73 -14.180 -2.578 -24.349 1.00 64.31 C ATOM 1129 O TYR A 73 -13.750 -3.475 -23.623 1.00 3.32 O ATOM 1130 CB TYR A 73 -13.531 -0.255 -23.688 1.00 43.42 C ATOM 1131 CG TYR A 73 -13.745 0.836 -22.663 1.00 32.32 C ATOM 1132 CD1 TYR A 73 -13.707 0.555 -21.303 1.00 21.13 C ATOM 1133 CD2 TYR A 73 -13.985 2.147 -23.054 1.00 51.15 C ATOM 1134 CE1 TYR A 73 -13.903 1.548 -20.363 1.00 31.14 C ATOM 1135 CE2 TYR A 73 -14.181 3.147 -22.121 1.00 61.23 C ATOM 1136 CZ TYR A 73 -14.140 2.842 -20.777 1.00 5.13 C ATOM 1137 OH TYR A 73 -14.334 3.834 -19.843 1.00 50.33 O ATOM 0 H TYR A 73 -14.937 -2.318 -21.966 1.00 4.01 H new ATOM 0 HA TYR A 73 -15.460 -0.868 -24.410 1.00 0.42 H new ATOM 0 HB2 TYR A 73 -12.608 -0.785 -23.454 1.00 43.42 H new ATOM 0 HB3 TYR A 73 -13.397 0.201 -24.669 1.00 43.42 H new ATOM 0 HD1 TYR A 73 -13.521 -0.457 -20.975 1.00 21.13 H new ATOM 0 HD2 TYR A 73 -14.019 2.389 -24.106 1.00 51.15 H new ATOM 0 HE1 TYR A 73 -13.871 1.312 -19.310 1.00 31.14 H new ATOM 0 HE2 TYR A 73 -14.365 4.161 -22.442 1.00 61.23 H new ATOM 0 HH TYR A 73 -13.482 4.042 -19.405 1.00 50.33 H new ATOM 1147 N LYS A 74 -14.239 -2.687 -25.672 1.00 51.30 N ATOM 1148 CA LYS A 74 -13.792 -3.891 -26.362 1.00 41.54 C ATOM 1149 C LYS A 74 -12.518 -3.621 -27.157 1.00 2.25 C ATOM 1150 O LYS A 74 -12.388 -2.584 -27.807 1.00 12.43 O ATOM 1151 CB LYS A 74 -14.889 -4.404 -27.297 1.00 70.44 C ATOM 1152 CG LYS A 74 -16.046 -5.067 -26.571 1.00 34.14 C ATOM 1153 CD LYS A 74 -16.956 -5.812 -27.533 1.00 62.40 C ATOM 1154 CE LYS A 74 -18.423 -5.591 -27.198 1.00 21.41 C ATOM 1155 NZ LYS A 74 -19.263 -5.494 -28.423 1.00 52.34 N ATOM 0 H LYS A 74 -14.592 -1.955 -26.288 1.00 51.30 H new ATOM 0 HA LYS A 74 -13.577 -4.652 -25.611 1.00 41.54 H new ATOM 0 HB2 LYS A 74 -15.271 -3.571 -27.887 1.00 70.44 H new ATOM 0 HB3 LYS A 74 -14.454 -5.117 -27.997 1.00 70.44 H new ATOM 0 HG2 LYS A 74 -15.659 -5.761 -25.825 1.00 34.14 H new ATOM 0 HG3 LYS A 74 -16.621 -4.312 -26.036 1.00 34.14 H new ATOM 0 HD2 LYS A 74 -16.760 -5.479 -28.552 1.00 62.40 H new ATOM 0 HD3 LYS A 74 -16.730 -6.878 -27.497 1.00 62.40 H new ATOM 0 HE2 LYS A 74 -18.781 -6.412 -26.576 1.00 21.41 H new ATOM 0 HE3 LYS A 74 -18.528 -4.678 -26.612 1.00 21.41 H new ATOM 0 HZ1 LYS A 74 -20.256 -5.344 -28.152 1.00 52.34 H new ATOM 0 HZ2 LYS A 74 -18.938 -4.695 -29.005 1.00 52.34 H new ATOM 0 HZ3 LYS A 74 -19.183 -6.375 -28.969 1.00 52.34 H new ATOM 1169 N SER A 75 -11.580 -4.561 -27.100 1.00 74.52 N ATOM 1170 CA SER A 75 -10.315 -4.424 -27.813 1.00 15.25 C ATOM 1171 C SER A 75 -10.521 -4.570 -29.317 1.00 64.22 C ATOM 1172 O SER A 75 -11.121 -5.539 -29.781 1.00 43.44 O ATOM 1173 CB SER A 75 -9.312 -5.468 -27.319 1.00 42.32 C ATOM 1174 OG SER A 75 -9.712 -6.775 -27.691 1.00 65.33 O ATOM 0 H SER A 75 -11.672 -5.426 -26.567 1.00 74.52 H new ATOM 0 HA SER A 75 -9.919 -3.428 -27.614 1.00 15.25 H new ATOM 0 HB2 SER A 75 -8.326 -5.254 -27.733 1.00 42.32 H new ATOM 0 HB3 SER A 75 -9.223 -5.406 -26.234 1.00 42.32 H new ATOM 0 HG SER A 75 -9.233 -7.045 -28.502 1.00 65.33 H new ATOM 1180 N ASN A 76 -10.017 -3.600 -30.074 1.00 32.41 N ATOM 1181 CA ASN A 76 -10.145 -3.620 -31.527 1.00 10.15 C ATOM 1182 C ASN A 76 -9.125 -4.568 -32.150 1.00 30.03 C ATOM 1183 O ASN A 76 -9.008 -4.654 -33.372 1.00 74.41 O ATOM 1184 CB ASN A 76 -9.962 -2.211 -32.094 1.00 60.04 C ATOM 1185 CG ASN A 76 -11.265 -1.614 -32.591 1.00 24.01 C ATOM 1186 OD1 ASN A 76 -11.822 -2.060 -33.594 1.00 41.52 O ATOM 1187 ND2 ASN A 76 -11.756 -0.600 -31.889 1.00 11.14 N ATOM 0 H ASN A 76 -9.517 -2.791 -29.706 1.00 32.41 H new ATOM 0 HA ASN A 76 -11.144 -3.977 -31.775 1.00 10.15 H new ATOM 0 HB2 ASN A 76 -9.540 -1.565 -31.325 1.00 60.04 H new ATOM 0 HB3 ASN A 76 -9.244 -2.242 -32.913 1.00 60.04 H new ATOM 0 HD21 ASN A 76 -12.629 -0.158 -32.175 1.00 11.14 H new ATOM 0 HD22 ASN A 76 -11.260 -0.263 -31.064 1.00 11.14 H new ATOM 1194 N SER A 77 -8.389 -5.278 -31.301 1.00 1.25 N ATOM 1195 CA SER A 77 -7.376 -6.218 -31.767 1.00 53.43 C ATOM 1196 C SER A 77 -7.355 -7.470 -30.896 1.00 42.12 C ATOM 1197 O SER A 77 -7.232 -7.387 -29.674 1.00 70.52 O ATOM 1198 CB SER A 77 -5.997 -5.557 -31.764 1.00 44.50 C ATOM 1199 OG SER A 77 -5.954 -4.469 -30.857 1.00 14.32 O ATOM 0 H SER A 77 -8.475 -5.220 -30.286 1.00 1.25 H new ATOM 0 HA SER A 77 -7.628 -6.510 -32.786 1.00 53.43 H new ATOM 0 HB2 SER A 77 -5.239 -6.291 -31.492 1.00 44.50 H new ATOM 0 HB3 SER A 77 -5.756 -5.207 -32.768 1.00 44.50 H new ATOM 0 HG SER A 77 -5.061 -4.065 -30.873 1.00 14.32 H new ATOM 1205 N SER A 78 -7.475 -8.629 -31.535 1.00 32.42 N ATOM 1206 CA SER A 78 -7.473 -9.900 -30.819 1.00 74.03 C ATOM 1207 C SER A 78 -6.262 -10.003 -29.898 1.00 43.00 C ATOM 1208 O SER A 78 -5.214 -9.416 -30.165 1.00 64.24 O ATOM 1209 CB SER A 78 -7.477 -11.067 -31.809 1.00 4.22 C ATOM 1210 OG SER A 78 -8.541 -10.945 -32.737 1.00 25.40 O ATOM 0 H SER A 78 -7.575 -8.715 -32.546 1.00 32.42 H new ATOM 0 HA SER A 78 -8.375 -9.947 -30.209 1.00 74.03 H new ATOM 0 HB2 SER A 78 -6.527 -11.099 -32.342 1.00 4.22 H new ATOM 0 HB3 SER A 78 -7.570 -12.008 -31.267 1.00 4.22 H new ATOM 0 HG SER A 78 -8.986 -10.081 -32.613 1.00 25.40 H new ATOM 1216 N MET A 79 -6.414 -10.753 -28.812 1.00 33.42 N ATOM 1217 CA MET A 79 -5.333 -10.935 -27.851 1.00 4.23 C ATOM 1218 C MET A 79 -5.300 -12.370 -27.334 1.00 4.42 C ATOM 1219 O MET A 79 -6.343 -12.988 -27.123 1.00 74.34 O ATOM 1220 CB MET A 79 -5.493 -9.962 -26.681 1.00 22.34 C ATOM 1221 CG MET A 79 -4.764 -8.644 -26.882 1.00 40.31 C ATOM 1222 SD MET A 79 -5.886 -7.275 -27.227 1.00 34.34 S ATOM 1223 CE MET A 79 -5.734 -6.324 -25.717 1.00 5.40 C ATOM 0 H MET A 79 -7.276 -11.245 -28.575 1.00 33.42 H new ATOM 0 HA MET A 79 -4.391 -10.729 -28.359 1.00 4.23 H new ATOM 0 HB2 MET A 79 -6.553 -9.761 -26.529 1.00 22.34 H new ATOM 0 HB3 MET A 79 -5.124 -10.437 -25.772 1.00 22.34 H new ATOM 0 HG2 MET A 79 -4.182 -8.415 -25.989 1.00 40.31 H new ATOM 0 HG3 MET A 79 -4.057 -8.746 -27.706 1.00 40.31 H new ATOM 0 HE1 MET A 79 -6.678 -6.351 -25.173 1.00 5.40 H new ATOM 0 HE2 MET A 79 -4.946 -6.750 -25.096 1.00 5.40 H new ATOM 0 HE3 MET A 79 -5.485 -5.291 -25.961 1.00 5.40 H new ATOM 1233 N HIS A 80 -4.095 -12.893 -27.131 1.00 62.42 N ATOM 1234 CA HIS A 80 -3.927 -14.256 -26.638 1.00 44.05 C ATOM 1235 C HIS A 80 -4.458 -14.388 -25.215 1.00 33.25 C ATOM 1236 O HIS A 80 -4.200 -13.536 -24.364 1.00 25.52 O ATOM 1237 CB HIS A 80 -2.452 -14.659 -26.684 1.00 75.14 C ATOM 1238 CG HIS A 80 -1.767 -14.280 -27.961 1.00 75.44 C ATOM 1239 ND1 HIS A 80 -0.548 -13.638 -27.999 1.00 63.44 N ATOM 1240 CD2 HIS A 80 -2.138 -14.458 -29.251 1.00 64.51 C ATOM 1241 CE1 HIS A 80 -0.198 -13.436 -29.257 1.00 70.42 C ATOM 1242 NE2 HIS A 80 -1.146 -13.925 -30.037 1.00 24.22 N ATOM 0 H HIS A 80 -3.221 -12.395 -27.300 1.00 62.42 H new ATOM 0 HA HIS A 80 -4.499 -14.923 -27.283 1.00 44.05 H new ATOM 0 HB2 HIS A 80 -1.930 -14.192 -25.849 1.00 75.14 H new ATOM 0 HB3 HIS A 80 -2.374 -15.737 -26.546 1.00 75.14 H new ATOM 0 HD2 HIS A 80 -3.045 -14.931 -29.597 1.00 64.51 H new ATOM 0 HE1 HIS A 80 0.709 -12.953 -29.591 1.00 70.42 H new ATOM 0 HE2 HIS A 80 -1.142 -13.909 -31.057 1.00 24.22 H new ATOM 1250 N ILE A 81 -5.202 -15.460 -24.963 1.00 53.02 N ATOM 1251 CA ILE A 81 -5.770 -15.703 -23.643 1.00 5.14 C ATOM 1252 C ILE A 81 -5.969 -17.194 -23.396 1.00 73.40 C ATOM 1253 O ILE A 81 -6.013 -17.990 -24.335 1.00 32.43 O ATOM 1254 CB ILE A 81 -7.118 -14.980 -23.467 1.00 50.15 C ATOM 1255 CG1 ILE A 81 -8.170 -15.583 -24.400 1.00 71.42 C ATOM 1256 CG2 ILE A 81 -6.959 -13.490 -23.733 1.00 62.41 C ATOM 1257 CD1 ILE A 81 -8.103 -15.048 -25.814 1.00 23.55 C ATOM 0 H ILE A 81 -5.425 -16.174 -25.656 1.00 53.02 H new ATOM 0 HA ILE A 81 -5.059 -15.309 -22.917 1.00 5.14 H new ATOM 0 HB ILE A 81 -7.453 -15.112 -22.438 1.00 50.15 H new ATOM 0 HG12 ILE A 81 -8.045 -16.666 -24.424 1.00 71.42 H new ATOM 0 HG13 ILE A 81 -9.161 -15.385 -23.992 1.00 71.42 H new ATOM 0 HG21 ILE A 81 -7.920 -12.993 -23.605 1.00 62.41 H new ATOM 0 HG22 ILE A 81 -6.237 -13.070 -23.032 1.00 62.41 H new ATOM 0 HG23 ILE A 81 -6.605 -13.338 -24.753 1.00 62.41 H new ATOM 0 HD11 ILE A 81 -8.878 -15.520 -26.419 1.00 23.55 H new ATOM 0 HD12 ILE A 81 -8.258 -13.969 -25.803 1.00 23.55 H new ATOM 0 HD13 ILE A 81 -7.125 -15.269 -26.241 1.00 23.55 H new ATOM 1269 N THR A 82 -6.092 -17.568 -22.126 1.00 10.41 N ATOM 1270 CA THR A 82 -6.288 -18.963 -21.755 1.00 31.22 C ATOM 1271 C THR A 82 -7.495 -19.124 -20.837 1.00 43.12 C ATOM 1272 O THR A 82 -7.476 -18.683 -19.688 1.00 43.31 O ATOM 1273 CB THR A 82 -5.043 -19.538 -21.053 1.00 34.12 C ATOM 1274 OG1 THR A 82 -3.934 -19.554 -21.958 1.00 1.21 O ATOM 1275 CG2 THR A 82 -5.311 -20.947 -20.546 1.00 25.25 C ATOM 0 H THR A 82 -6.059 -16.923 -21.337 1.00 10.41 H new ATOM 0 HA THR A 82 -6.462 -19.514 -22.679 1.00 31.22 H new ATOM 0 HB THR A 82 -4.806 -18.901 -20.201 1.00 34.12 H new ATOM 0 HG1 THR A 82 -3.160 -19.127 -21.534 1.00 1.21 H new ATOM 0 HG21 THR A 82 -4.418 -21.333 -20.054 1.00 25.25 H new ATOM 0 HG22 THR A 82 -6.137 -20.927 -19.835 1.00 25.25 H new ATOM 0 HG23 THR A 82 -5.570 -21.592 -21.385 1.00 25.25 H new ATOM 1283 N ASP A 83 -8.542 -19.758 -21.351 1.00 75.52 N ATOM 1284 CA ASP A 83 -9.758 -19.979 -20.577 1.00 32.03 C ATOM 1285 C ASP A 83 -9.505 -20.959 -19.435 1.00 71.04 C ATOM 1286 O ASP A 83 -8.893 -22.010 -19.629 1.00 52.13 O ATOM 1287 CB ASP A 83 -10.875 -20.506 -21.479 1.00 50.44 C ATOM 1288 CG ASP A 83 -12.218 -19.874 -21.168 1.00 24.02 C ATOM 1289 OD1 ASP A 83 -12.271 -18.634 -21.028 1.00 34.55 O ATOM 1290 OD2 ASP A 83 -13.214 -20.619 -21.063 1.00 74.43 O ATOM 0 H ASP A 83 -8.574 -20.128 -22.301 1.00 75.52 H new ATOM 0 HA ASP A 83 -10.066 -19.024 -20.151 1.00 32.03 H new ATOM 0 HB2 ASP A 83 -10.618 -20.313 -22.521 1.00 50.44 H new ATOM 0 HB3 ASP A 83 -10.951 -21.587 -21.365 1.00 50.44 H new ATOM 1295 N CYS A 84 -9.979 -20.608 -18.245 1.00 1.34 N ATOM 1296 CA CYS A 84 -9.803 -21.454 -17.071 1.00 32.40 C ATOM 1297 C CYS A 84 -11.126 -21.646 -16.335 1.00 54.33 C ATOM 1298 O CYS A 84 -11.576 -20.762 -15.606 1.00 55.32 O ATOM 1299 CB CYS A 84 -8.766 -20.844 -16.127 1.00 24.24 C ATOM 1300 SG CYS A 84 -7.264 -20.240 -16.962 1.00 61.24 S ATOM 0 H CYS A 84 -10.489 -19.742 -18.068 1.00 1.34 H new ATOM 0 HA CYS A 84 -9.449 -22.429 -17.407 1.00 32.40 H new ATOM 0 HB2 CYS A 84 -9.225 -20.017 -15.586 1.00 24.24 H new ATOM 0 HB3 CYS A 84 -8.481 -21.591 -15.386 1.00 24.24 H new ATOM 1305 N ARG A 85 -11.744 -22.806 -16.532 1.00 0.01 N ATOM 1306 CA ARG A 85 -13.016 -23.113 -15.888 1.00 65.43 C ATOM 1307 C ARG A 85 -12.973 -24.489 -15.229 1.00 3.20 C ATOM 1308 O ARG A 85 -12.460 -25.450 -15.805 1.00 14.41 O ATOM 1309 CB ARG A 85 -14.154 -23.060 -16.909 1.00 21.41 C ATOM 1310 CG ARG A 85 -15.465 -23.627 -16.389 1.00 10.33 C ATOM 1311 CD ARG A 85 -16.637 -23.212 -17.264 1.00 72.02 C ATOM 1312 NE ARG A 85 -17.918 -23.620 -16.693 1.00 10.41 N ATOM 1313 CZ ARG A 85 -19.082 -23.081 -17.039 1.00 42.21 C ATOM 1314 NH1 ARG A 85 -19.126 -22.118 -17.950 1.00 23.13 N ATOM 1315 NH2 ARG A 85 -20.205 -23.505 -16.474 1.00 70.44 N ATOM 0 H ARG A 85 -11.385 -23.548 -17.132 1.00 0.01 H new ATOM 0 HA ARG A 85 -13.194 -22.365 -15.116 1.00 65.43 H new ATOM 0 HB2 ARG A 85 -14.311 -22.025 -17.213 1.00 21.41 H new ATOM 0 HB3 ARG A 85 -13.857 -23.612 -17.801 1.00 21.41 H new ATOM 0 HG2 ARG A 85 -15.404 -24.715 -16.353 1.00 10.33 H new ATOM 0 HG3 ARG A 85 -15.632 -23.283 -15.368 1.00 10.33 H new ATOM 0 HD2 ARG A 85 -16.627 -22.130 -17.395 1.00 72.02 H new ATOM 0 HD3 ARG A 85 -16.524 -23.654 -18.254 1.00 72.02 H new ATOM 0 HE ARG A 85 -17.919 -24.359 -15.990 1.00 10.41 H new ATOM 0 HH11 ARG A 85 -18.265 -21.789 -18.387 1.00 23.13 H new ATOM 0 HH12 ARG A 85 -20.021 -21.706 -18.214 1.00 23.13 H new ATOM 0 HH21 ARG A 85 -20.175 -24.246 -15.773 1.00 70.44 H new ATOM 0 HH22 ARG A 85 -21.098 -23.090 -16.740 1.00 70.44 H new ATOM 1329 N LEU A 86 -13.513 -24.576 -14.019 1.00 11.14 N ATOM 1330 CA LEU A 86 -13.537 -25.834 -13.280 1.00 3.41 C ATOM 1331 C LEU A 86 -14.128 -26.953 -14.130 1.00 71.51 C ATOM 1332 O LEU A 86 -15.003 -26.719 -14.964 1.00 70.15 O ATOM 1333 CB LEU A 86 -14.345 -25.676 -11.991 1.00 3.43 C ATOM 1334 CG LEU A 86 -13.533 -25.543 -10.702 1.00 2.42 C ATOM 1335 CD1 LEU A 86 -14.445 -25.614 -9.487 1.00 3.52 C ATOM 1336 CD2 LEU A 86 -12.463 -26.622 -10.632 1.00 22.43 C ATOM 0 H LEU A 86 -13.940 -23.791 -13.528 1.00 11.14 H new ATOM 0 HA LEU A 86 -12.510 -26.098 -13.027 1.00 3.41 H new ATOM 0 HB2 LEU A 86 -14.980 -24.795 -12.089 1.00 3.43 H new ATOM 0 HB3 LEU A 86 -15.007 -26.537 -11.893 1.00 3.43 H new ATOM 0 HG LEU A 86 -13.040 -24.571 -10.704 1.00 2.42 H new ATOM 0 HD11 LEU A 86 -13.850 -25.518 -8.579 1.00 3.52 H new ATOM 0 HD12 LEU A 86 -15.173 -24.804 -9.531 1.00 3.52 H new ATOM 0 HD13 LEU A 86 -14.967 -26.571 -9.479 1.00 3.52 H new ATOM 0 HD21 LEU A 86 -11.895 -26.512 -9.708 1.00 22.43 H new ATOM 0 HD22 LEU A 86 -12.935 -27.604 -10.653 1.00 22.43 H new ATOM 0 HD23 LEU A 86 -11.791 -26.524 -11.485 1.00 22.43 H new ATOM 1348 N THR A 87 -13.646 -28.173 -13.912 1.00 31.14 N ATOM 1349 CA THR A 87 -14.127 -29.330 -14.656 1.00 51.24 C ATOM 1350 C THR A 87 -15.069 -30.177 -13.809 1.00 14.45 C ATOM 1351 O THR A 87 -14.885 -30.305 -12.599 1.00 41.11 O ATOM 1352 CB THR A 87 -12.960 -30.210 -15.142 1.00 33.42 C ATOM 1353 OG1 THR A 87 -12.646 -31.197 -14.152 1.00 52.42 O ATOM 1354 CG2 THR A 87 -11.729 -29.366 -15.432 1.00 1.52 C ATOM 0 H THR A 87 -12.922 -28.385 -13.225 1.00 31.14 H new ATOM 0 HA THR A 87 -14.668 -28.946 -15.521 1.00 51.24 H new ATOM 0 HB THR A 87 -13.266 -30.704 -16.064 1.00 33.42 H new ATOM 0 HG1 THR A 87 -12.154 -30.777 -13.416 1.00 52.42 H new ATOM 0 HG21 THR A 87 -10.919 -30.010 -15.774 1.00 1.52 H new ATOM 0 HG22 THR A 87 -11.963 -28.635 -16.206 1.00 1.52 H new ATOM 0 HG23 THR A 87 -11.422 -28.847 -14.524 1.00 1.52 H new ATOM 1362 N ASN A 88 -16.079 -30.753 -14.452 1.00 35.44 N ATOM 1363 CA ASN A 88 -17.051 -31.589 -13.755 1.00 53.24 C ATOM 1364 C ASN A 88 -16.352 -32.666 -12.932 1.00 62.12 C ATOM 1365 O ASN A 88 -15.899 -33.676 -13.469 1.00 63.10 O ATOM 1366 CB ASN A 88 -18.008 -32.238 -14.758 1.00 1.23 C ATOM 1367 CG ASN A 88 -19.357 -32.559 -14.145 1.00 13.25 C ATOM 1368 OD1 ASN A 88 -19.437 -33.113 -13.048 1.00 53.30 O ATOM 1369 ND2 ASN A 88 -20.426 -32.211 -14.852 1.00 31.41 N ATOM 0 H ASN A 88 -16.246 -30.657 -15.454 1.00 35.44 H new ATOM 0 HA ASN A 88 -17.621 -30.953 -13.078 1.00 53.24 H new ATOM 0 HB2 ASN A 88 -18.148 -31.570 -15.608 1.00 1.23 H new ATOM 0 HB3 ASN A 88 -17.560 -33.154 -15.143 1.00 1.23 H new ATOM 0 HD21 ASN A 88 -21.361 -32.401 -14.490 1.00 31.41 H new ATOM 0 HD22 ASN A 88 -20.312 -31.754 -15.757 1.00 31.41 H new ATOM 1376 N GLY A 89 -16.268 -32.443 -11.624 1.00 13.00 N ATOM 1377 CA GLY A 89 -15.623 -33.403 -10.747 1.00 74.04 C ATOM 1378 C GLY A 89 -14.444 -32.808 -10.004 1.00 32.14 C ATOM 1379 O GLY A 89 -13.814 -33.479 -9.186 1.00 75.42 O ATOM 0 H GLY A 89 -16.635 -31.614 -11.156 1.00 13.00 H new ATOM 0 HA2 GLY A 89 -16.350 -33.779 -10.027 1.00 74.04 H new ATOM 0 HA3 GLY A 89 -15.285 -34.257 -11.334 1.00 74.04 H new ATOM 1383 N SER A 90 -14.143 -31.545 -10.288 1.00 72.10 N ATOM 1384 CA SER A 90 -13.028 -30.861 -9.644 1.00 21.31 C ATOM 1385 C SER A 90 -13.526 -29.915 -8.556 1.00 53.20 C ATOM 1386 O SER A 90 -14.135 -28.885 -8.845 1.00 41.54 O ATOM 1387 CB SER A 90 -12.213 -30.083 -10.679 1.00 20.13 C ATOM 1388 OG SER A 90 -11.881 -30.902 -11.787 1.00 3.24 O ATOM 0 H SER A 90 -14.656 -30.974 -10.960 1.00 72.10 H new ATOM 0 HA SER A 90 -12.390 -31.614 -9.182 1.00 21.31 H new ATOM 0 HB2 SER A 90 -12.783 -29.218 -11.020 1.00 20.13 H new ATOM 0 HB3 SER A 90 -11.302 -29.703 -10.218 1.00 20.13 H new ATOM 0 HG SER A 90 -11.565 -31.773 -11.467 1.00 3.24 H new ATOM 1394 N ARG A 91 -13.263 -30.272 -7.303 1.00 73.54 N ATOM 1395 CA ARG A 91 -13.685 -29.457 -6.171 1.00 55.32 C ATOM 1396 C ARG A 91 -12.567 -29.337 -5.140 1.00 60.12 C ATOM 1397 O ARG A 91 -11.644 -30.151 -5.114 1.00 25.12 O ATOM 1398 CB ARG A 91 -14.932 -30.057 -5.519 1.00 74.24 C ATOM 1399 CG ARG A 91 -16.120 -29.110 -5.490 1.00 15.32 C ATOM 1400 CD ARG A 91 -15.755 -27.778 -4.852 1.00 73.15 C ATOM 1401 NE ARG A 91 -16.934 -26.960 -4.581 1.00 11.04 N ATOM 1402 CZ ARG A 91 -16.901 -25.637 -4.471 1.00 42.52 C ATOM 1403 NH1 ARG A 91 -15.754 -24.985 -4.610 1.00 74.24 N ATOM 1404 NH2 ARG A 91 -18.016 -24.962 -4.223 1.00 11.23 N ATOM 0 H ARG A 91 -12.759 -31.121 -7.046 1.00 73.54 H new ATOM 0 HA ARG A 91 -13.922 -28.460 -6.543 1.00 55.32 H new ATOM 0 HB2 ARG A 91 -15.213 -30.962 -6.057 1.00 74.24 H new ATOM 0 HB3 ARG A 91 -14.691 -30.355 -4.499 1.00 74.24 H new ATOM 0 HG2 ARG A 91 -16.478 -28.942 -6.506 1.00 15.32 H new ATOM 0 HG3 ARG A 91 -16.939 -29.568 -4.935 1.00 15.32 H new ATOM 0 HD2 ARG A 91 -15.216 -27.957 -3.921 1.00 73.15 H new ATOM 0 HD3 ARG A 91 -15.079 -27.233 -5.511 1.00 73.15 H new ATOM 0 HE ARG A 91 -17.832 -27.431 -4.470 1.00 11.04 H new ATOM 0 HH11 ARG A 91 -14.895 -25.500 -4.802 1.00 74.24 H new ATOM 0 HH12 ARG A 91 -15.731 -23.969 -4.525 1.00 74.24 H new ATOM 0 HH21 ARG A 91 -18.900 -25.459 -4.117 1.00 11.23 H new ATOM 0 HH22 ARG A 91 -17.989 -23.946 -4.139 1.00 11.23 H new ATOM 1418 N TYR A 92 -12.657 -28.318 -4.294 1.00 4.55 N ATOM 1419 CA TYR A 92 -11.651 -28.089 -3.263 1.00 31.54 C ATOM 1420 C TYR A 92 -11.418 -29.353 -2.440 1.00 21.00 C ATOM 1421 O TYR A 92 -12.353 -30.055 -2.054 1.00 1.23 O ATOM 1422 CB TYR A 92 -12.081 -26.943 -2.346 1.00 11.11 C ATOM 1423 CG TYR A 92 -10.974 -26.438 -1.448 1.00 14.00 C ATOM 1424 CD1 TYR A 92 -10.576 -27.160 -0.330 1.00 35.53 C ATOM 1425 CD2 TYR A 92 -10.327 -25.238 -1.717 1.00 34.31 C ATOM 1426 CE1 TYR A 92 -9.566 -26.703 0.494 1.00 13.21 C ATOM 1427 CE2 TYR A 92 -9.315 -24.774 -0.900 1.00 13.35 C ATOM 1428 CZ TYR A 92 -8.938 -25.509 0.205 1.00 75.33 C ATOM 1429 OH TYR A 92 -7.932 -25.049 1.022 1.00 23.22 O ATOM 0 H TYR A 92 -13.416 -27.637 -4.301 1.00 4.55 H new ATOM 0 HA TYR A 92 -10.717 -27.820 -3.756 1.00 31.54 H new ATOM 0 HB2 TYR A 92 -12.447 -26.118 -2.957 1.00 11.11 H new ATOM 0 HB3 TYR A 92 -12.915 -27.276 -1.728 1.00 11.11 H new ATOM 0 HD1 TYR A 92 -11.065 -28.095 -0.101 1.00 35.53 H new ATOM 0 HD2 TYR A 92 -10.621 -24.658 -2.580 1.00 34.31 H new ATOM 0 HE1 TYR A 92 -9.270 -27.277 1.359 1.00 13.21 H new ATOM 0 HE2 TYR A 92 -8.821 -23.840 -1.125 1.00 13.35 H new ATOM 0 HH TYR A 92 -7.595 -24.196 0.677 1.00 23.22 H new ATOM 1439 N PRO A 93 -10.139 -29.651 -2.164 1.00 54.34 N ATOM 1440 CA PRO A 93 -9.018 -28.823 -2.619 1.00 72.34 C ATOM 1441 C PRO A 93 -8.814 -28.903 -4.128 1.00 42.04 C ATOM 1442 O PRO A 93 -8.234 -28.003 -4.734 1.00 1.21 O ATOM 1443 CB PRO A 93 -7.815 -29.421 -1.885 1.00 15.43 C ATOM 1444 CG PRO A 93 -8.203 -30.833 -1.609 1.00 43.54 C ATOM 1445 CD PRO A 93 -9.690 -30.818 -1.388 1.00 20.32 C ATOM 0 HA PRO A 93 -9.181 -27.766 -2.409 1.00 72.34 H new ATOM 0 HB2 PRO A 93 -6.914 -29.370 -2.496 1.00 15.43 H new ATOM 0 HB3 PRO A 93 -7.606 -28.880 -0.962 1.00 15.43 H new ATOM 0 HG2 PRO A 93 -7.939 -31.481 -2.445 1.00 43.54 H new ATOM 0 HG3 PRO A 93 -7.682 -31.217 -0.732 1.00 43.54 H new ATOM 0 HD2 PRO A 93 -10.158 -31.738 -1.739 1.00 20.32 H new ATOM 0 HD3 PRO A 93 -9.938 -30.717 -0.331 1.00 20.32 H new ATOM 1453 N ASN A 94 -9.295 -29.986 -4.730 1.00 23.43 N ATOM 1454 CA ASN A 94 -9.164 -30.183 -6.169 1.00 33.22 C ATOM 1455 C ASN A 94 -9.723 -28.987 -6.934 1.00 60.52 C ATOM 1456 O ASN A 94 -10.919 -28.699 -6.871 1.00 65.41 O ATOM 1457 CB ASN A 94 -9.889 -31.461 -6.598 1.00 4.05 C ATOM 1458 CG ASN A 94 -9.987 -32.475 -5.474 1.00 3.31 C ATOM 1459 OD1 ASN A 94 -10.727 -32.280 -4.510 1.00 54.20 O ATOM 1460 ND2 ASN A 94 -9.237 -33.564 -5.593 1.00 73.44 N ATOM 0 H ASN A 94 -9.779 -30.741 -4.244 1.00 23.43 H new ATOM 0 HA ASN A 94 -8.104 -30.279 -6.403 1.00 33.22 H new ATOM 0 HB2 ASN A 94 -10.891 -31.208 -6.944 1.00 4.05 H new ATOM 0 HB3 ASN A 94 -9.364 -31.908 -7.442 1.00 4.05 H new ATOM 0 HD21 ASN A 94 -9.260 -34.281 -4.868 1.00 73.44 H new ATOM 0 HD22 ASN A 94 -8.638 -33.684 -6.410 1.00 73.44 H new ATOM 1467 N CYS A 95 -8.850 -28.295 -7.658 1.00 2.34 N ATOM 1468 CA CYS A 95 -9.254 -27.130 -8.436 1.00 30.21 C ATOM 1469 C CYS A 95 -9.005 -27.358 -9.924 1.00 52.52 C ATOM 1470 O CYS A 95 -8.963 -26.410 -10.709 1.00 33.42 O ATOM 1471 CB CYS A 95 -8.496 -25.888 -7.965 1.00 2.41 C ATOM 1472 SG CYS A 95 -9.228 -25.078 -6.507 1.00 14.22 S ATOM 0 H CYS A 95 -7.857 -28.521 -7.722 1.00 2.34 H new ATOM 0 HA CYS A 95 -10.322 -26.974 -8.284 1.00 30.21 H new ATOM 0 HB2 CYS A 95 -7.468 -26.169 -7.734 1.00 2.41 H new ATOM 0 HB3 CYS A 95 -8.454 -25.169 -8.783 1.00 2.41 H new ATOM 1477 N ALA A 96 -8.841 -28.620 -10.305 1.00 31.21 N ATOM 1478 CA ALA A 96 -8.599 -28.973 -11.698 1.00 40.34 C ATOM 1479 C ALA A 96 -9.508 -28.180 -12.631 1.00 41.52 C ATOM 1480 O ALA A 96 -10.689 -28.495 -12.779 1.00 0.41 O ATOM 1481 CB ALA A 96 -8.799 -30.466 -11.907 1.00 72.44 C ATOM 0 H ALA A 96 -8.871 -29.416 -9.668 1.00 31.21 H new ATOM 0 HA ALA A 96 -7.566 -28.719 -11.937 1.00 40.34 H new ATOM 0 HB1 ALA A 96 -8.615 -30.715 -12.952 1.00 72.44 H new ATOM 0 HB2 ALA A 96 -8.104 -31.018 -11.274 1.00 72.44 H new ATOM 0 HB3 ALA A 96 -9.822 -30.736 -11.644 1.00 72.44 H new ATOM 1487 N TYR A 97 -8.951 -27.149 -13.258 1.00 25.43 N ATOM 1488 CA TYR A 97 -9.712 -26.309 -14.174 1.00 72.00 C ATOM 1489 C TYR A 97 -9.564 -26.797 -15.612 1.00 22.22 C ATOM 1490 O TYR A 97 -8.874 -27.782 -15.877 1.00 33.13 O ATOM 1491 CB TYR A 97 -9.252 -24.854 -14.067 1.00 64.35 C ATOM 1492 CG TYR A 97 -9.266 -24.317 -12.654 1.00 41.44 C ATOM 1493 CD1 TYR A 97 -10.393 -24.447 -11.852 1.00 41.11 C ATOM 1494 CD2 TYR A 97 -8.153 -23.678 -12.122 1.00 11.42 C ATOM 1495 CE1 TYR A 97 -10.411 -23.957 -10.561 1.00 0.43 C ATOM 1496 CE2 TYR A 97 -8.162 -23.186 -10.831 1.00 4.40 C ATOM 1497 CZ TYR A 97 -9.293 -23.327 -10.055 1.00 22.35 C ATOM 1498 OH TYR A 97 -9.306 -22.837 -8.769 1.00 22.33 O ATOM 0 H TYR A 97 -7.975 -26.875 -13.148 1.00 25.43 H new ATOM 0 HA TYR A 97 -10.764 -26.372 -13.895 1.00 72.00 H new ATOM 0 HB2 TYR A 97 -8.242 -24.771 -14.468 1.00 64.35 H new ATOM 0 HB3 TYR A 97 -9.895 -24.232 -14.690 1.00 64.35 H new ATOM 0 HD1 TYR A 97 -11.270 -24.940 -12.245 1.00 41.11 H new ATOM 0 HD2 TYR A 97 -7.266 -23.564 -12.728 1.00 11.42 H new ATOM 0 HE1 TYR A 97 -11.295 -24.066 -9.951 1.00 0.43 H new ATOM 0 HE2 TYR A 97 -7.288 -22.694 -10.432 1.00 4.40 H new ATOM 0 HH TYR A 97 -9.426 -23.577 -8.138 1.00 22.33 H new ATOM 1508 N ARG A 98 -10.216 -26.100 -16.537 1.00 24.03 N ATOM 1509 CA ARG A 98 -10.158 -26.461 -17.948 1.00 24.51 C ATOM 1510 C ARG A 98 -9.387 -25.414 -18.746 1.00 51.12 C ATOM 1511 O ARG A 98 -9.913 -24.346 -19.061 1.00 11.34 O ATOM 1512 CB ARG A 98 -11.570 -26.614 -18.516 1.00 1.23 C ATOM 1513 CG ARG A 98 -12.006 -28.060 -18.685 1.00 23.01 C ATOM 1514 CD ARG A 98 -12.732 -28.272 -20.004 1.00 21.40 C ATOM 1515 NE ARG A 98 -12.950 -29.688 -20.287 1.00 21.40 N ATOM 1516 CZ ARG A 98 -13.122 -30.175 -21.511 1.00 35.22 C ATOM 1517 NH1 ARG A 98 -13.102 -29.364 -22.559 1.00 70.14 N ATOM 1518 NH2 ARG A 98 -13.315 -31.476 -21.688 1.00 35.13 N ATOM 0 H ARG A 98 -10.791 -25.282 -16.334 1.00 24.03 H new ATOM 0 HA ARG A 98 -9.635 -27.414 -18.032 1.00 24.51 H new ATOM 0 HB2 ARG A 98 -12.274 -26.106 -17.857 1.00 1.23 H new ATOM 0 HB3 ARG A 98 -11.620 -26.113 -19.483 1.00 1.23 H new ATOM 0 HG2 ARG A 98 -11.134 -28.712 -18.640 1.00 23.01 H new ATOM 0 HG3 ARG A 98 -12.659 -28.343 -17.859 1.00 23.01 H new ATOM 0 HD2 ARG A 98 -13.692 -27.756 -19.977 1.00 21.40 H new ATOM 0 HD3 ARG A 98 -12.153 -27.826 -20.812 1.00 21.40 H new ATOM 0 HE ARG A 98 -12.971 -30.339 -19.502 1.00 21.40 H new ATOM 0 HH11 ARG A 98 -12.954 -28.363 -22.427 1.00 70.14 H new ATOM 0 HH12 ARG A 98 -13.234 -29.740 -23.498 1.00 70.14 H new ATOM 0 HH21 ARG A 98 -13.331 -32.103 -20.884 1.00 35.13 H new ATOM 0 HH22 ARG A 98 -13.447 -31.849 -22.628 1.00 35.13 H new ATOM 1532 N THR A 99 -8.136 -25.727 -19.071 1.00 55.31 N ATOM 1533 CA THR A 99 -7.293 -24.813 -19.831 1.00 2.23 C ATOM 1534 C THR A 99 -7.651 -24.837 -21.312 1.00 65.23 C ATOM 1535 O THR A 99 -7.390 -25.819 -22.008 1.00 4.14 O ATOM 1536 CB THR A 99 -5.801 -25.160 -19.669 1.00 2.32 C ATOM 1537 OG1 THR A 99 -5.526 -25.520 -18.310 1.00 73.44 O ATOM 1538 CG2 THR A 99 -4.925 -23.984 -20.073 1.00 43.34 C ATOM 0 H THR A 99 -7.685 -26.607 -18.819 1.00 55.31 H new ATOM 0 HA THR A 99 -7.472 -23.814 -19.434 1.00 2.23 H new ATOM 0 HB THR A 99 -5.574 -26.003 -20.321 1.00 2.32 H new ATOM 0 HG1 THR A 99 -4.914 -26.285 -18.292 1.00 73.44 H new ATOM 0 HG21 THR A 99 -3.876 -24.253 -19.950 1.00 43.34 H new ATOM 0 HG22 THR A 99 -5.115 -23.730 -21.116 1.00 43.34 H new ATOM 0 HG23 THR A 99 -5.156 -23.125 -19.443 1.00 43.34 H new ATOM 1546 N SER A 100 -8.249 -23.751 -21.790 1.00 2.51 N ATOM 1547 CA SER A 100 -8.645 -23.649 -23.189 1.00 53.15 C ATOM 1548 C SER A 100 -7.852 -22.557 -23.901 1.00 12.32 C ATOM 1549 O SER A 100 -8.148 -21.367 -23.790 1.00 2.24 O ATOM 1550 CB SER A 100 -10.144 -23.359 -23.297 1.00 64.34 C ATOM 1551 OG SER A 100 -10.786 -24.300 -24.140 1.00 64.42 O ATOM 0 H SER A 100 -8.470 -22.929 -21.228 1.00 2.51 H new ATOM 0 HA SER A 100 -8.430 -24.603 -23.672 1.00 53.15 H new ATOM 0 HB2 SER A 100 -10.595 -23.387 -22.305 1.00 64.34 H new ATOM 0 HB3 SER A 100 -10.296 -22.353 -23.688 1.00 64.34 H new ATOM 0 HG SER A 100 -11.743 -24.094 -24.191 1.00 64.42 H new ATOM 1557 N PRO A 101 -6.819 -22.970 -24.650 1.00 52.42 N ATOM 1558 CA PRO A 101 -5.962 -22.043 -25.395 1.00 65.22 C ATOM 1559 C PRO A 101 -6.687 -21.402 -26.573 1.00 62.04 C ATOM 1560 O PRO A 101 -7.210 -22.095 -27.446 1.00 20.51 O ATOM 1561 CB PRO A 101 -4.821 -22.936 -25.891 1.00 34.21 C ATOM 1562 CG PRO A 101 -5.409 -24.304 -25.949 1.00 52.22 C ATOM 1563 CD PRO A 101 -6.409 -24.373 -24.828 1.00 53.34 C ATOM 0 HA PRO A 101 -5.631 -21.208 -24.777 1.00 65.22 H new ATOM 0 HB2 PRO A 101 -4.465 -22.616 -26.870 1.00 34.21 H new ATOM 0 HB3 PRO A 101 -3.967 -22.900 -25.214 1.00 34.21 H new ATOM 0 HG2 PRO A 101 -5.889 -24.482 -26.911 1.00 52.22 H new ATOM 0 HG3 PRO A 101 -4.638 -25.065 -25.832 1.00 52.22 H new ATOM 0 HD2 PRO A 101 -7.256 -25.010 -25.084 1.00 53.34 H new ATOM 0 HD3 PRO A 101 -5.966 -24.781 -23.919 1.00 53.34 H new ATOM 1571 N LYS A 102 -6.714 -20.074 -26.593 1.00 52.24 N ATOM 1572 CA LYS A 102 -7.374 -19.338 -27.665 1.00 43.34 C ATOM 1573 C LYS A 102 -6.954 -17.871 -27.657 1.00 21.32 C ATOM 1574 O LYS A 102 -6.567 -17.334 -26.620 1.00 15.44 O ATOM 1575 CB LYS A 102 -8.894 -19.445 -27.525 1.00 42.15 C ATOM 1576 CG LYS A 102 -9.466 -20.739 -28.078 1.00 2.11 C ATOM 1577 CD LYS A 102 -10.947 -20.606 -28.389 1.00 51.11 C ATOM 1578 CE LYS A 102 -11.453 -21.785 -29.205 1.00 73.41 C ATOM 1579 NZ LYS A 102 -12.818 -21.539 -29.748 1.00 62.25 N ATOM 0 H LYS A 102 -6.286 -19.485 -25.879 1.00 52.24 H new ATOM 0 HA LYS A 102 -7.071 -19.779 -28.614 1.00 43.34 H new ATOM 0 HB2 LYS A 102 -9.160 -19.361 -26.471 1.00 42.15 H new ATOM 0 HB3 LYS A 102 -9.358 -18.603 -28.039 1.00 42.15 H new ATOM 0 HG2 LYS A 102 -8.927 -21.019 -28.983 1.00 2.11 H new ATOM 0 HG3 LYS A 102 -9.316 -21.542 -27.356 1.00 2.11 H new ATOM 0 HD2 LYS A 102 -11.511 -20.538 -27.458 1.00 51.11 H new ATOM 0 HD3 LYS A 102 -11.123 -19.680 -28.937 1.00 51.11 H new ATOM 0 HE2 LYS A 102 -10.765 -21.979 -30.027 1.00 73.41 H new ATOM 0 HE3 LYS A 102 -11.466 -22.679 -28.582 1.00 73.41 H new ATOM 0 HZ1 LYS A 102 -13.127 -22.366 -30.298 1.00 62.25 H new ATOM 0 HZ2 LYS A 102 -13.480 -21.378 -28.962 1.00 62.25 H new ATOM 0 HZ3 LYS A 102 -12.801 -20.701 -30.363 1.00 62.25 H new ATOM 1593 N GLU A 103 -7.034 -17.230 -28.819 1.00 32.43 N ATOM 1594 CA GLU A 103 -6.663 -15.826 -28.943 1.00 3.21 C ATOM 1595 C GLU A 103 -7.780 -15.024 -29.604 1.00 12.11 C ATOM 1596 O GLU A 103 -8.166 -15.297 -30.741 1.00 22.03 O ATOM 1597 CB GLU A 103 -5.372 -15.686 -29.753 1.00 31.30 C ATOM 1598 CG GLU A 103 -5.542 -16.005 -31.229 1.00 15.41 C ATOM 1599 CD GLU A 103 -4.223 -16.035 -31.975 1.00 41.33 C ATOM 1600 OE1 GLU A 103 -3.475 -17.022 -31.816 1.00 44.05 O ATOM 1601 OE2 GLU A 103 -3.938 -15.072 -32.718 1.00 13.25 O ATOM 0 H GLU A 103 -7.352 -17.661 -29.687 1.00 32.43 H new ATOM 0 HA GLU A 103 -6.499 -15.430 -27.941 1.00 3.21 H new ATOM 0 HB2 GLU A 103 -4.998 -14.667 -29.651 1.00 31.30 H new ATOM 0 HB3 GLU A 103 -4.615 -16.348 -29.332 1.00 31.30 H new ATOM 0 HG2 GLU A 103 -6.036 -16.971 -31.333 1.00 15.41 H new ATOM 0 HG3 GLU A 103 -6.196 -15.261 -31.685 1.00 15.41 H new ATOM 1608 N ARG A 104 -8.296 -14.034 -28.883 1.00 10.21 N ATOM 1609 CA ARG A 104 -9.370 -13.193 -29.398 1.00 32.13 C ATOM 1610 C ARG A 104 -9.518 -11.926 -28.560 1.00 61.21 C ATOM 1611 O ARG A 104 -8.992 -11.838 -27.450 1.00 64.13 O ATOM 1612 CB ARG A 104 -10.690 -13.966 -29.410 1.00 33.11 C ATOM 1613 CG ARG A 104 -11.336 -14.048 -30.784 1.00 3.55 C ATOM 1614 CD ARG A 104 -12.186 -15.300 -30.926 1.00 71.11 C ATOM 1615 NE ARG A 104 -11.641 -16.221 -31.920 1.00 35.20 N ATOM 1616 CZ ARG A 104 -12.340 -17.210 -32.467 1.00 14.41 C ATOM 1617 NH1 ARG A 104 -13.605 -17.404 -32.118 1.00 41.45 N ATOM 1618 NH2 ARG A 104 -11.775 -18.006 -33.365 1.00 23.12 N ATOM 0 H ARG A 104 -7.988 -13.795 -27.941 1.00 10.21 H new ATOM 0 HA ARG A 104 -9.115 -12.906 -30.418 1.00 32.13 H new ATOM 0 HB2 ARG A 104 -10.513 -14.976 -29.040 1.00 33.11 H new ATOM 0 HB3 ARG A 104 -11.386 -13.491 -28.719 1.00 33.11 H new ATOM 0 HG2 ARG A 104 -11.955 -13.166 -30.949 1.00 3.55 H new ATOM 0 HG3 ARG A 104 -10.562 -14.043 -31.552 1.00 3.55 H new ATOM 0 HD2 ARG A 104 -12.252 -15.805 -29.962 1.00 71.11 H new ATOM 0 HD3 ARG A 104 -13.200 -15.019 -31.209 1.00 71.11 H new ATOM 0 HE ARG A 104 -10.671 -16.098 -32.210 1.00 35.20 H new ATOM 0 HH11 ARG A 104 -14.043 -16.793 -31.428 1.00 41.45 H new ATOM 0 HH12 ARG A 104 -14.139 -18.164 -32.539 1.00 41.45 H new ATOM 0 HH21 ARG A 104 -10.803 -17.859 -33.637 1.00 23.12 H new ATOM 0 HH22 ARG A 104 -12.313 -18.765 -33.784 1.00 23.12 H new ATOM 1632 N HIS A 105 -10.237 -10.947 -29.099 1.00 40.15 N ATOM 1633 CA HIS A 105 -10.454 -9.684 -28.402 1.00 31.41 C ATOM 1634 C HIS A 105 -10.986 -9.927 -26.993 1.00 12.04 C ATOM 1635 O HIS A 105 -11.204 -11.070 -26.590 1.00 13.14 O ATOM 1636 CB HIS A 105 -11.431 -8.807 -29.184 1.00 52.44 C ATOM 1637 CG HIS A 105 -11.147 -8.757 -30.654 1.00 42.10 C ATOM 1638 ND1 HIS A 105 -10.626 -7.646 -31.283 1.00 13.52 N ATOM 1639 CD2 HIS A 105 -11.312 -9.691 -31.620 1.00 2.13 C ATOM 1640 CE1 HIS A 105 -10.485 -7.897 -32.572 1.00 30.41 C ATOM 1641 NE2 HIS A 105 -10.893 -9.132 -32.802 1.00 74.23 N ATOM 0 H HIS A 105 -10.679 -11.004 -30.016 1.00 40.15 H new ATOM 0 HA HIS A 105 -9.496 -9.169 -28.327 1.00 31.41 H new ATOM 0 HB2 HIS A 105 -12.444 -9.180 -29.031 1.00 52.44 H new ATOM 0 HB3 HIS A 105 -11.400 -7.794 -28.782 1.00 52.44 H new ATOM 0 HD1 HIS A 105 -10.387 -6.767 -30.824 1.00 13.52 H new ATOM 0 HD2 HIS A 105 -11.701 -10.690 -31.486 1.00 2.13 H new ATOM 0 HE1 HIS A 105 -10.102 -7.210 -33.312 1.00 30.41 H new ATOM 1649 N ILE A 106 -11.192 -8.845 -26.249 1.00 22.32 N ATOM 1650 CA ILE A 106 -11.698 -8.941 -24.885 1.00 74.45 C ATOM 1651 C ILE A 106 -12.415 -7.660 -24.474 1.00 3.24 C ATOM 1652 O ILE A 106 -12.240 -6.612 -25.096 1.00 0.30 O ATOM 1653 CB ILE A 106 -10.565 -9.228 -23.883 1.00 10.33 C ATOM 1654 CG1 ILE A 106 -9.202 -9.041 -24.553 1.00 33.01 C ATOM 1655 CG2 ILE A 106 -10.697 -10.636 -23.322 1.00 12.32 C ATOM 1656 CD1 ILE A 106 -8.090 -8.716 -23.581 1.00 11.04 C ATOM 0 H ILE A 106 -11.016 -7.892 -26.568 1.00 22.32 H new ATOM 0 HA ILE A 106 -12.404 -9.771 -24.868 1.00 74.45 H new ATOM 0 HB ILE A 106 -10.643 -8.521 -23.057 1.00 10.33 H new ATOM 0 HG12 ILE A 106 -8.945 -9.951 -25.095 1.00 33.01 H new ATOM 0 HG13 ILE A 106 -9.275 -8.241 -25.290 1.00 33.01 H new ATOM 0 HG21 ILE A 106 -9.889 -10.823 -22.615 1.00 12.32 H new ATOM 0 HG22 ILE A 106 -11.655 -10.736 -22.812 1.00 12.32 H new ATOM 0 HG23 ILE A 106 -10.642 -11.359 -24.136 1.00 12.32 H new ATOM 0 HD11 ILE A 106 -7.154 -8.597 -24.126 1.00 11.04 H new ATOM 0 HD12 ILE A 106 -8.325 -7.790 -23.056 1.00 11.04 H new ATOM 0 HD13 ILE A 106 -7.989 -9.526 -22.859 1.00 11.04 H new ATOM 1668 N ILE A 107 -13.220 -7.751 -23.420 1.00 42.25 N ATOM 1669 CA ILE A 107 -13.960 -6.598 -22.924 1.00 12.24 C ATOM 1670 C ILE A 107 -13.713 -6.386 -21.434 1.00 21.01 C ATOM 1671 O ILE A 107 -14.019 -7.251 -20.613 1.00 73.24 O ATOM 1672 CB ILE A 107 -15.473 -6.754 -23.164 1.00 73.12 C ATOM 1673 CG1 ILE A 107 -15.733 -7.790 -24.260 1.00 53.31 C ATOM 1674 CG2 ILE A 107 -16.092 -5.415 -23.536 1.00 43.31 C ATOM 1675 CD1 ILE A 107 -17.185 -7.877 -24.677 1.00 42.10 C ATOM 0 H ILE A 107 -13.376 -8.611 -22.894 1.00 42.25 H new ATOM 0 HA ILE A 107 -13.600 -5.731 -23.477 1.00 12.24 H new ATOM 0 HB ILE A 107 -15.938 -7.103 -22.242 1.00 73.12 H new ATOM 0 HG12 ILE A 107 -15.127 -7.544 -25.132 1.00 53.31 H new ATOM 0 HG13 ILE A 107 -15.405 -8.768 -23.909 1.00 53.31 H new ATOM 0 HG21 ILE A 107 -17.162 -5.542 -23.702 1.00 43.31 H new ATOM 0 HG22 ILE A 107 -15.933 -4.703 -22.726 1.00 43.31 H new ATOM 0 HG23 ILE A 107 -15.625 -5.039 -24.446 1.00 43.31 H new ATOM 0 HD11 ILE A 107 -17.295 -8.631 -25.457 1.00 42.10 H new ATOM 0 HD12 ILE A 107 -17.795 -8.153 -23.817 1.00 42.10 H new ATOM 0 HD13 ILE A 107 -17.513 -6.910 -25.059 1.00 42.10 H new ATOM 1687 N VAL A 108 -13.158 -5.228 -21.090 1.00 42.04 N ATOM 1688 CA VAL A 108 -12.872 -4.900 -19.699 1.00 22.22 C ATOM 1689 C VAL A 108 -13.424 -3.527 -19.333 1.00 43.01 C ATOM 1690 O VAL A 108 -13.752 -2.726 -20.207 1.00 44.55 O ATOM 1691 CB VAL A 108 -11.358 -4.925 -19.416 1.00 41.11 C ATOM 1692 CG1 VAL A 108 -10.930 -6.296 -18.916 1.00 72.44 C ATOM 1693 CG2 VAL A 108 -10.577 -4.535 -20.662 1.00 73.02 C ATOM 0 H VAL A 108 -12.897 -4.501 -21.756 1.00 42.04 H new ATOM 0 HA VAL A 108 -13.361 -5.659 -19.088 1.00 22.22 H new ATOM 0 HB VAL A 108 -11.140 -4.196 -18.635 1.00 41.11 H new ATOM 0 HG11 VAL A 108 -9.857 -6.294 -18.722 1.00 72.44 H new ATOM 0 HG12 VAL A 108 -11.465 -6.531 -17.996 1.00 72.44 H new ATOM 0 HG13 VAL A 108 -11.160 -7.047 -19.672 1.00 72.44 H new ATOM 0 HG21 VAL A 108 -9.509 -4.558 -20.444 1.00 73.02 H new ATOM 0 HG22 VAL A 108 -10.799 -5.238 -21.465 1.00 73.02 H new ATOM 0 HG23 VAL A 108 -10.863 -3.529 -20.971 1.00 73.02 H new ATOM 1703 N ALA A 109 -13.523 -3.262 -18.035 1.00 11.04 N ATOM 1704 CA ALA A 109 -14.033 -1.984 -17.552 1.00 61.35 C ATOM 1705 C ALA A 109 -12.926 -1.163 -16.900 1.00 14.14 C ATOM 1706 O ALA A 109 -12.543 -1.416 -15.757 1.00 64.23 O ATOM 1707 CB ALA A 109 -15.175 -2.208 -16.573 1.00 12.24 C ATOM 0 H ALA A 109 -13.257 -3.915 -17.298 1.00 11.04 H new ATOM 0 HA ALA A 109 -14.409 -1.423 -18.408 1.00 61.35 H new ATOM 0 HB1 ALA A 109 -15.546 -1.246 -16.220 1.00 12.24 H new ATOM 0 HB2 ALA A 109 -15.981 -2.747 -17.071 1.00 12.24 H new ATOM 0 HB3 ALA A 109 -14.818 -2.792 -15.725 1.00 12.24 H new ATOM 1713 N CYS A 110 -12.416 -0.178 -17.632 1.00 35.22 N ATOM 1714 CA CYS A 110 -11.353 0.680 -17.125 1.00 42.40 C ATOM 1715 C CYS A 110 -11.931 1.916 -16.440 1.00 65.41 C ATOM 1716 O CYS A 110 -13.032 2.358 -16.763 1.00 75.41 O ATOM 1717 CB CYS A 110 -10.424 1.103 -18.265 1.00 3.34 C ATOM 1718 SG CYS A 110 -11.093 0.780 -19.928 1.00 45.40 S ATOM 0 H CYS A 110 -12.722 0.045 -18.579 1.00 35.22 H new ATOM 0 HA CYS A 110 -10.782 0.113 -16.390 1.00 42.40 H new ATOM 0 HB2 CYS A 110 -10.212 2.168 -18.171 1.00 3.34 H new ATOM 0 HB3 CYS A 110 -9.474 0.579 -18.159 1.00 3.34 H new ATOM 1723 N GLU A 111 -11.178 2.467 -15.493 1.00 63.03 N ATOM 1724 CA GLU A 111 -11.616 3.651 -14.763 1.00 23.42 C ATOM 1725 C GLU A 111 -10.466 4.249 -13.957 1.00 34.44 C ATOM 1726 O GLU A 111 -9.357 3.716 -13.947 1.00 35.02 O ATOM 1727 CB GLU A 111 -12.779 3.301 -13.832 1.00 4.13 C ATOM 1728 CG GLU A 111 -13.728 4.461 -13.582 1.00 73.33 C ATOM 1729 CD GLU A 111 -13.798 4.853 -12.119 1.00 50.43 C ATOM 1730 OE1 GLU A 111 -13.806 3.945 -11.262 1.00 14.42 O ATOM 1731 OE2 GLU A 111 -13.844 6.068 -11.832 1.00 34.41 O ATOM 0 H GLU A 111 -10.263 2.113 -15.214 1.00 63.03 H new ATOM 0 HA GLU A 111 -11.951 4.392 -15.489 1.00 23.42 H new ATOM 0 HB2 GLU A 111 -13.339 2.470 -14.261 1.00 4.13 H new ATOM 0 HB3 GLU A 111 -12.379 2.957 -12.878 1.00 4.13 H new ATOM 0 HG2 GLU A 111 -13.407 5.321 -14.170 1.00 73.33 H new ATOM 0 HG3 GLU A 111 -14.725 4.191 -13.930 1.00 73.33 H new ATOM 1738 N GLY A 112 -10.741 5.361 -13.281 1.00 64.23 N ATOM 1739 CA GLY A 112 -9.720 6.014 -12.482 1.00 74.11 C ATOM 1740 C GLY A 112 -8.769 6.843 -13.322 1.00 11.45 C ATOM 1741 O GLY A 112 -9.141 7.340 -14.385 1.00 4.12 O ATOM 0 H GLY A 112 -11.652 5.821 -13.272 1.00 64.23 H new ATOM 0 HA2 GLY A 112 -10.198 6.654 -11.741 1.00 74.11 H new ATOM 0 HA3 GLY A 112 -9.154 5.260 -11.935 1.00 74.11 H new ATOM 1745 N SER A 113 -7.539 6.995 -12.843 1.00 5.44 N ATOM 1746 CA SER A 113 -6.532 7.775 -13.554 1.00 15.52 C ATOM 1747 C SER A 113 -5.131 7.249 -13.262 1.00 5.23 C ATOM 1748 O SER A 113 -4.701 7.158 -12.111 1.00 41.55 O ATOM 1749 CB SER A 113 -6.628 9.251 -13.160 1.00 31.32 C ATOM 1750 OG SER A 113 -6.323 10.093 -14.258 1.00 24.31 O ATOM 0 H SER A 113 -7.215 6.588 -11.965 1.00 5.44 H new ATOM 0 HA SER A 113 -6.721 7.678 -14.623 1.00 15.52 H new ATOM 0 HB2 SER A 113 -7.633 9.469 -12.798 1.00 31.32 H new ATOM 0 HB3 SER A 113 -5.942 9.457 -12.338 1.00 31.32 H new ATOM 0 HG SER A 113 -6.393 11.030 -13.981 1.00 24.31 H new ATOM 1756 N PRO A 114 -4.399 6.893 -14.328 1.00 50.31 N ATOM 1757 CA PRO A 114 -4.900 6.996 -15.702 1.00 12.21 C ATOM 1758 C PRO A 114 -6.000 5.982 -15.995 1.00 71.31 C ATOM 1759 O PRO A 114 -6.398 5.213 -15.120 1.00 31.41 O ATOM 1760 CB PRO A 114 -3.662 6.704 -16.554 1.00 14.12 C ATOM 1761 CG PRO A 114 -2.786 5.877 -15.678 1.00 11.23 C ATOM 1762 CD PRO A 114 -3.026 6.363 -14.275 1.00 35.41 C ATOM 0 HA PRO A 114 -5.350 7.969 -15.900 1.00 12.21 H new ATOM 0 HB2 PRO A 114 -3.926 6.170 -17.467 1.00 14.12 H new ATOM 0 HB3 PRO A 114 -3.163 7.625 -16.856 1.00 14.12 H new ATOM 0 HG2 PRO A 114 -3.029 4.818 -15.771 1.00 11.23 H new ATOM 0 HG3 PRO A 114 -1.738 5.990 -15.956 1.00 11.23 H new ATOM 0 HD2 PRO A 114 -2.935 5.555 -13.549 1.00 35.41 H new ATOM 0 HD3 PRO A 114 -2.309 7.132 -13.988 1.00 35.41 H new ATOM 1770 N TYR A 115 -6.487 5.985 -17.231 1.00 32.01 N ATOM 1771 CA TYR A 115 -7.543 5.066 -17.639 1.00 20.22 C ATOM 1772 C TYR A 115 -6.989 3.661 -17.855 1.00 22.11 C ATOM 1773 O TYR A 115 -6.372 3.375 -18.881 1.00 74.14 O ATOM 1774 CB TYR A 115 -8.215 5.564 -18.920 1.00 22.34 C ATOM 1775 CG TYR A 115 -9.719 5.670 -18.812 1.00 52.51 C ATOM 1776 CD1 TYR A 115 -10.321 6.120 -17.643 1.00 55.24 C ATOM 1777 CD2 TYR A 115 -10.538 5.321 -19.878 1.00 73.14 C ATOM 1778 CE1 TYR A 115 -11.696 6.219 -17.540 1.00 64.22 C ATOM 1779 CE2 TYR A 115 -11.913 5.418 -19.785 1.00 31.23 C ATOM 1780 CZ TYR A 115 -12.487 5.867 -18.614 1.00 30.03 C ATOM 1781 OH TYR A 115 -13.856 5.963 -18.516 1.00 12.51 O ATOM 0 H TYR A 115 -6.167 6.614 -17.968 1.00 32.01 H new ATOM 0 HA TYR A 115 -8.284 5.026 -16.840 1.00 20.22 H new ATOM 0 HB2 TYR A 115 -7.808 6.542 -19.178 1.00 22.34 H new ATOM 0 HB3 TYR A 115 -7.964 4.889 -19.738 1.00 22.34 H new ATOM 0 HD1 TYR A 115 -9.704 6.397 -16.801 1.00 55.24 H new ATOM 0 HD2 TYR A 115 -10.092 4.968 -20.796 1.00 73.14 H new ATOM 0 HE1 TYR A 115 -12.148 6.570 -16.624 1.00 64.22 H new ATOM 0 HE2 TYR A 115 -12.535 5.144 -20.624 1.00 31.23 H new ATOM 0 HH TYR A 115 -14.272 5.489 -19.267 1.00 12.51 H new ATOM 1791 N VAL A 116 -7.214 2.787 -16.879 1.00 64.41 N ATOM 1792 CA VAL A 116 -6.739 1.410 -16.961 1.00 52.44 C ATOM 1793 C VAL A 116 -7.834 0.427 -16.564 1.00 72.12 C ATOM 1794 O VAL A 116 -8.767 0.760 -15.832 1.00 64.14 O ATOM 1795 CB VAL A 116 -5.511 1.185 -16.060 1.00 3.50 C ATOM 1796 CG1 VAL A 116 -4.744 2.485 -15.868 1.00 0.01 C ATOM 1797 CG2 VAL A 116 -5.933 0.603 -14.720 1.00 13.13 C ATOM 0 H VAL A 116 -7.722 3.008 -16.022 1.00 64.41 H new ATOM 0 HA VAL A 116 -6.455 1.234 -17.999 1.00 52.44 H new ATOM 0 HB VAL A 116 -4.850 0.470 -16.549 1.00 3.50 H new ATOM 0 HG11 VAL A 116 -3.880 2.306 -15.229 1.00 0.01 H new ATOM 0 HG12 VAL A 116 -4.408 2.856 -16.836 1.00 0.01 H new ATOM 0 HG13 VAL A 116 -5.394 3.225 -15.401 1.00 0.01 H new ATOM 0 HG21 VAL A 116 -5.052 0.450 -14.096 1.00 13.13 H new ATOM 0 HG22 VAL A 116 -6.615 1.292 -14.223 1.00 13.13 H new ATOM 0 HG23 VAL A 116 -6.434 -0.352 -14.880 1.00 13.13 H new ATOM 1807 N PRO A 117 -7.721 -0.815 -17.057 1.00 23.51 N ATOM 1808 CA PRO A 117 -8.692 -1.874 -16.766 1.00 20.22 C ATOM 1809 C PRO A 117 -8.626 -2.338 -15.315 1.00 33.22 C ATOM 1810 O PRO A 117 -7.616 -2.886 -14.873 1.00 34.03 O ATOM 1811 CB PRO A 117 -8.276 -3.006 -17.709 1.00 21.14 C ATOM 1812 CG PRO A 117 -6.827 -2.774 -17.963 1.00 44.30 C ATOM 1813 CD PRO A 117 -6.635 -1.282 -17.935 1.00 72.55 C ATOM 0 HA PRO A 117 -9.718 -1.537 -16.910 1.00 20.22 H new ATOM 0 HB2 PRO A 117 -8.447 -3.982 -17.255 1.00 21.14 H new ATOM 0 HB3 PRO A 117 -8.849 -2.980 -18.636 1.00 21.14 H new ATOM 0 HG2 PRO A 117 -6.215 -3.261 -17.204 1.00 44.30 H new ATOM 0 HG3 PRO A 117 -6.528 -3.188 -18.926 1.00 44.30 H new ATOM 0 HD2 PRO A 117 -5.655 -1.010 -17.542 1.00 72.55 H new ATOM 0 HD3 PRO A 117 -6.710 -0.848 -18.932 1.00 72.55 H new ATOM 1821 N VAL A 118 -9.710 -2.116 -14.578 1.00 1.15 N ATOM 1822 CA VAL A 118 -9.776 -2.513 -13.176 1.00 43.02 C ATOM 1823 C VAL A 118 -10.806 -3.617 -12.966 1.00 25.23 C ATOM 1824 O VAL A 118 -11.067 -4.030 -11.835 1.00 63.33 O ATOM 1825 CB VAL A 118 -10.128 -1.318 -12.270 1.00 70.12 C ATOM 1826 CG1 VAL A 118 -9.075 -0.227 -12.392 1.00 55.22 C ATOM 1827 CG2 VAL A 118 -11.509 -0.779 -12.613 1.00 23.33 C ATOM 0 H VAL A 118 -10.554 -1.663 -14.928 1.00 1.15 H new ATOM 0 HA VAL A 118 -8.788 -2.885 -12.905 1.00 43.02 H new ATOM 0 HB VAL A 118 -10.143 -1.660 -11.235 1.00 70.12 H new ATOM 0 HG11 VAL A 118 -9.341 0.609 -11.745 1.00 55.22 H new ATOM 0 HG12 VAL A 118 -8.104 -0.623 -12.093 1.00 55.22 H new ATOM 0 HG13 VAL A 118 -9.024 0.116 -13.425 1.00 55.22 H new ATOM 0 HG21 VAL A 118 -11.742 0.065 -11.964 1.00 23.33 H new ATOM 0 HG22 VAL A 118 -11.524 -0.452 -13.653 1.00 23.33 H new ATOM 0 HG23 VAL A 118 -12.252 -1.564 -12.469 1.00 23.33 H new ATOM 1837 N HIS A 119 -11.388 -4.092 -14.062 1.00 30.50 N ATOM 1838 CA HIS A 119 -12.390 -5.151 -13.998 1.00 5.00 C ATOM 1839 C HIS A 119 -12.499 -5.877 -15.335 1.00 61.14 C ATOM 1840 O HIS A 119 -12.509 -5.250 -16.395 1.00 2.12 O ATOM 1841 CB HIS A 119 -13.749 -4.572 -13.606 1.00 34.31 C ATOM 1842 CG HIS A 119 -14.900 -5.210 -14.321 1.00 34.21 C ATOM 1843 ND1 HIS A 119 -15.892 -5.915 -13.672 1.00 72.11 N ATOM 1844 CD2 HIS A 119 -15.216 -5.245 -15.637 1.00 25.21 C ATOM 1845 CE1 HIS A 119 -16.766 -6.358 -14.558 1.00 55.41 C ATOM 1846 NE2 HIS A 119 -16.379 -5.964 -15.758 1.00 31.20 N ATOM 0 H HIS A 119 -11.184 -3.761 -15.005 1.00 30.50 H new ATOM 0 HA HIS A 119 -12.077 -5.869 -13.240 1.00 5.00 H new ATOM 0 HB2 HIS A 119 -13.889 -4.690 -12.531 1.00 34.31 H new ATOM 0 HB3 HIS A 119 -13.752 -3.502 -13.812 1.00 34.31 H new ATOM 0 HD2 HIS A 119 -14.657 -4.791 -16.442 1.00 25.21 H new ATOM 0 HE1 HIS A 119 -17.647 -6.943 -14.339 1.00 55.41 H new ATOM 0 HE2 HIS A 119 -16.865 -6.162 -16.632 1.00 31.20 H new ATOM 1854 N PHE A 120 -12.580 -7.202 -15.279 1.00 21.32 N ATOM 1855 CA PHE A 120 -12.687 -8.014 -16.486 1.00 3.14 C ATOM 1856 C PHE A 120 -14.138 -8.404 -16.752 1.00 24.32 C ATOM 1857 O PHE A 120 -14.850 -8.842 -15.848 1.00 2.21 O ATOM 1858 CB PHE A 120 -11.824 -9.271 -16.358 1.00 44.14 C ATOM 1859 CG PHE A 120 -11.323 -9.790 -17.676 1.00 21.11 C ATOM 1860 CD1 PHE A 120 -12.181 -10.434 -18.553 1.00 41.20 C ATOM 1861 CD2 PHE A 120 -9.995 -9.634 -18.037 1.00 44.14 C ATOM 1862 CE1 PHE A 120 -11.722 -10.913 -19.766 1.00 34.15 C ATOM 1863 CE2 PHE A 120 -9.530 -10.111 -19.249 1.00 14.11 C ATOM 1864 CZ PHE A 120 -10.396 -10.750 -20.114 1.00 61.45 C ATOM 0 H PHE A 120 -12.574 -7.737 -14.410 1.00 21.32 H new ATOM 0 HA PHE A 120 -12.329 -7.420 -17.327 1.00 3.14 H new ATOM 0 HB2 PHE A 120 -10.972 -9.053 -15.715 1.00 44.14 H new ATOM 0 HB3 PHE A 120 -12.404 -10.052 -15.866 1.00 44.14 H new ATOM 0 HD1 PHE A 120 -13.220 -10.563 -18.286 1.00 41.20 H new ATOM 0 HD2 PHE A 120 -9.314 -9.134 -17.364 1.00 44.14 H new ATOM 0 HE1 PHE A 120 -12.400 -11.414 -20.441 1.00 34.15 H new ATOM 0 HE2 PHE A 120 -8.492 -9.984 -19.518 1.00 14.11 H new ATOM 0 HZ PHE A 120 -10.036 -11.122 -21.062 1.00 61.45 H new ATOM 1874 N ASP A 121 -14.568 -8.242 -17.998 1.00 33.21 N ATOM 1875 CA ASP A 121 -15.934 -8.578 -18.385 1.00 2.23 C ATOM 1876 C ASP A 121 -15.992 -9.960 -19.028 1.00 52.32 C ATOM 1877 O ASP A 121 -16.465 -10.919 -18.420 1.00 14.03 O ATOM 1878 CB ASP A 121 -16.486 -7.528 -19.351 1.00 24.14 C ATOM 1879 CG ASP A 121 -17.947 -7.216 -19.094 1.00 21.51 C ATOM 1880 OD1 ASP A 121 -18.801 -8.065 -19.426 1.00 10.51 O ATOM 1881 OD2 ASP A 121 -18.236 -6.124 -18.562 1.00 34.22 O ATOM 0 H ASP A 121 -13.991 -7.880 -18.758 1.00 33.21 H new ATOM 0 HA ASP A 121 -16.548 -8.590 -17.485 1.00 2.23 H new ATOM 0 HB2 ASP A 121 -15.901 -6.613 -19.261 1.00 24.14 H new ATOM 0 HB3 ASP A 121 -16.368 -7.883 -20.375 1.00 24.14 H new ATOM 1886 N ALA A 122 -15.509 -10.053 -20.263 1.00 1.03 N ATOM 1887 CA ALA A 122 -15.505 -11.317 -20.988 1.00 74.22 C ATOM 1888 C ALA A 122 -14.716 -11.202 -22.288 1.00 30.12 C ATOM 1889 O ALA A 122 -14.253 -10.121 -22.650 1.00 42.31 O ATOM 1890 CB ALA A 122 -16.931 -11.767 -21.272 1.00 40.43 C ATOM 0 H ALA A 122 -15.116 -9.268 -20.782 1.00 1.03 H new ATOM 0 HA ALA A 122 -15.017 -12.065 -20.363 1.00 74.22 H new ATOM 0 HB1 ALA A 122 -16.913 -12.712 -21.814 1.00 40.43 H new ATOM 0 HB2 ALA A 122 -17.465 -11.898 -20.331 1.00 40.43 H new ATOM 0 HB3 ALA A 122 -17.437 -11.013 -21.875 1.00 40.43 H new ATOM 1896 N SER A 123 -14.566 -12.324 -22.985 1.00 1.21 N ATOM 1897 CA SER A 123 -13.828 -12.349 -24.242 1.00 72.35 C ATOM 1898 C SER A 123 -14.781 -12.297 -25.433 1.00 34.14 C ATOM 1899 O SER A 123 -15.830 -12.943 -25.432 1.00 44.31 O ATOM 1900 CB SER A 123 -12.961 -13.607 -24.324 1.00 61.00 C ATOM 1901 OG SER A 123 -13.753 -14.779 -24.237 1.00 63.01 O ATOM 0 H SER A 123 -14.946 -13.227 -22.700 1.00 1.21 H new ATOM 0 HA SER A 123 -13.185 -11.470 -24.274 1.00 72.35 H new ATOM 0 HB2 SER A 123 -12.405 -13.609 -25.262 1.00 61.00 H new ATOM 0 HB3 SER A 123 -12.227 -13.600 -23.518 1.00 61.00 H new ATOM 0 HG SER A 123 -13.176 -15.569 -24.294 1.00 63.01 H new ATOM 1907 N VAL A 124 -14.409 -11.523 -26.447 1.00 73.02 N ATOM 1908 CA VAL A 124 -15.229 -11.386 -27.645 1.00 14.01 C ATOM 1909 C VAL A 124 -14.936 -12.501 -28.643 1.00 4.34 C ATOM 1910 O VAL A 124 -14.082 -13.354 -28.401 1.00 51.50 O ATOM 1911 CB VAL A 124 -15.000 -10.026 -28.330 1.00 2.53 C ATOM 1912 CG1 VAL A 124 -16.239 -9.601 -29.103 1.00 11.35 C ATOM 1913 CG2 VAL A 124 -14.614 -8.971 -27.303 1.00 70.31 C ATOM 0 H VAL A 124 -13.545 -10.981 -26.463 1.00 73.02 H new ATOM 0 HA VAL A 124 -16.269 -11.453 -27.325 1.00 14.01 H new ATOM 0 HB VAL A 124 -14.178 -10.130 -29.038 1.00 2.53 H new ATOM 0 HG11 VAL A 124 -16.058 -8.638 -29.580 1.00 11.35 H new ATOM 0 HG12 VAL A 124 -16.466 -10.346 -29.865 1.00 11.35 H new ATOM 0 HG13 VAL A 124 -17.083 -9.514 -28.419 1.00 11.35 H new ATOM 0 HG21 VAL A 124 -14.456 -8.016 -27.804 1.00 70.31 H new ATOM 0 HG22 VAL A 124 -15.413 -8.868 -26.569 1.00 70.31 H new ATOM 0 HG23 VAL A 124 -13.696 -9.273 -26.799 1.00 70.31 H new ATOM 1923 N GLU A 125 -15.649 -12.487 -29.764 1.00 43.54 N ATOM 1924 CA GLU A 125 -15.464 -13.497 -30.799 1.00 61.40 C ATOM 1925 C GLU A 125 -14.774 -12.903 -32.023 1.00 41.14 C ATOM 1926 O GLU A 125 -13.964 -13.563 -32.675 1.00 32.24 O ATOM 1927 CB GLU A 125 -16.812 -14.099 -31.202 1.00 22.34 C ATOM 1928 CG GLU A 125 -16.707 -15.509 -31.759 1.00 23.01 C ATOM 1929 CD GLU A 125 -17.770 -15.806 -32.798 1.00 61.15 C ATOM 1930 OE1 GLU A 125 -18.234 -14.855 -33.461 1.00 73.45 O ATOM 1931 OE2 GLU A 125 -18.137 -16.990 -32.949 1.00 30.41 O ATOM 0 H GLU A 125 -16.360 -11.788 -29.979 1.00 43.54 H new ATOM 0 HA GLU A 125 -14.829 -14.284 -30.392 1.00 61.40 H new ATOM 0 HB2 GLU A 125 -17.470 -14.109 -30.333 1.00 22.34 H new ATOM 0 HB3 GLU A 125 -17.279 -13.456 -31.948 1.00 22.34 H new ATOM 0 HG2 GLU A 125 -15.721 -15.648 -32.203 1.00 23.01 H new ATOM 0 HG3 GLU A 125 -16.792 -16.226 -30.942 1.00 23.01 H new ATOM 1938 N ASP A 126 -15.101 -11.653 -32.331 1.00 11.45 N ATOM 1939 CA ASP A 126 -14.513 -10.968 -33.476 1.00 53.21 C ATOM 1940 C ASP A 126 -14.826 -9.475 -33.436 1.00 22.21 C ATOM 1941 O ASP A 126 -15.542 -9.004 -32.552 1.00 60.43 O ATOM 1942 CB ASP A 126 -15.031 -11.575 -34.781 1.00 1.01 C ATOM 1943 CG ASP A 126 -13.922 -11.823 -35.784 1.00 63.11 C ATOM 1944 OD1 ASP A 126 -13.374 -10.837 -36.320 1.00 2.45 O ATOM 1945 OD2 ASP A 126 -13.601 -13.004 -36.033 1.00 42.22 O ATOM 0 H ASP A 126 -15.771 -11.093 -31.803 1.00 11.45 H new ATOM 0 HA ASP A 126 -13.432 -11.096 -33.428 1.00 53.21 H new ATOM 0 HB2 ASP A 126 -15.538 -12.515 -34.565 1.00 1.01 H new ATOM 0 HB3 ASP A 126 -15.772 -10.907 -35.220 1.00 1.01 H new ATOM 1950 N SER A 127 -14.283 -8.736 -34.398 1.00 1.00 N ATOM 1951 CA SER A 127 -14.500 -7.296 -34.470 1.00 4.33 C ATOM 1952 C SER A 127 -15.866 -6.981 -35.072 1.00 64.21 C ATOM 1953 O SER A 127 -16.507 -7.847 -35.665 1.00 53.32 O ATOM 1954 CB SER A 127 -13.399 -6.634 -35.301 1.00 4.25 C ATOM 1955 OG SER A 127 -13.382 -5.231 -35.100 1.00 71.01 O ATOM 0 H SER A 127 -13.690 -9.111 -35.138 1.00 1.00 H new ATOM 0 HA SER A 127 -14.469 -6.898 -33.456 1.00 4.33 H new ATOM 0 HB2 SER A 127 -12.431 -7.055 -35.029 1.00 4.25 H new ATOM 0 HB3 SER A 127 -13.556 -6.851 -36.358 1.00 4.25 H new ATOM 0 HG SER A 127 -12.669 -4.832 -35.641 1.00 71.01 H new TER 1961 SER A 127