USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=39 USER MOD reduce.3.24.130724 removed 1411 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 174 HIS : no HD1:sc= -6.27! C(o=-20!,f=-28!) USER MOD Set 1.2: A 175 HIS : no HD1:sc= -3.95! C(o=-20!,f=-24!) USER MOD Set 1.3: A 183 HIS : no HE2:sc= -5.76! C(o=-20!,f=-25!) USER MOD Set 1.4: A 185 HIS : no HE2:sc= -4.29 K(o=-20,f=-32!) USER MOD Set 2.1: A 182 HIS : no HE2:sc= -8.14! C(o=-13!,f=-21!) USER MOD Set 2.2: A 184 HIS : no HD1:sc= -4.74! C(o=-13!,f=-17!) USER MOD Set 3.1: A 173 HIS : no HD1:sc= -3.18! C(o=-12!,f=-20!) USER MOD Set 3.2: A 177 HIS : no HD1:sc= -1.58! C(o=-12!,f=-21!) USER MOD Set 3.3: A 180 HIS : no HD1:sc= -2.33! C(o=-12!,f=-13!) USER MOD Set 3.4: A 181 HIS : no HD1:sc= -4.9! C(o=-12!,f=-12!) USER MOD Set 4.1: A 172 HIS : no HE2:sc= -10.8! C(o=-19!,f=-21!) USER MOD Set 4.2: A 176 HIS : no HD1:sc= -7.8! C(o=-19!,f=-23!) USER MOD Set 5.1: A 2 SER OG : rot -73:sc= 0.875 USER MOD Set 5.2: A 135 ASN : amide:sc= 0.762 K(o=1.6,f=0.34) USER MOD Set 6.1: A 75 THR OG1 : rot 11:sc= 1.02 USER MOD Set 6.2: A 78 THR OG1 : rot -130:sc= 1.45 USER MOD Set 7.1: A 19 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 7.2: A 20 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0528) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -170:sc= 0.0581! (180deg=-0.54!) USER MOD Single : A 3 GLN : amide:sc= -0.655 K(o=-0.65,f=-4.8!) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= -0.0157 K(o=-0.016,f=-2.5!) USER MOD Single : A 14 SER OG : rot -17:sc= 0.756 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 87:sc= 1.23 USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -2.11! K(o=-2.1!,f=-0.22) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= -0.0383 K(o=-0.038,f=-1.1) USER MOD Single : A 35 THR OG1 : rot 52:sc= 0.305 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= -0.827 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= -0.0193 K(o=-0.019,f=-1) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 66 SER OG : rot 73:sc= 0.0801 USER MOD Single : A 69 THR OG1 : rot -81:sc= 1.06 USER MOD Single : A 70 SER OG : rot 72:sc= 0.353 USER MOD Single : A 71 GLN : amide:sc= -1.09 K(o=-1.1,f=-0.014) USER MOD Single : A 73 HIS : no HD1:sc= -0.719 K(o=-0.72,f=-0.0042) USER MOD Single : A 80 TYR OH : rot -136:sc= 0.0542 USER MOD Single : A 81 GLN : amide:sc= -0.425 X(o=-0.42,f=0) USER MOD Single : A 82 SER OG : rot 7:sc= -0.353 USER MOD Single : A 85 GLN : amide:sc= -2.13! K(o=-2.1!,f=-0.19) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.75) USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 105 SER OG : rot 70:sc= 0.664 USER MOD Single : A 111 CYS SG : rot 157:sc= -0.49 USER MOD Single : A 114 SER OG : rot 175:sc= -0.36 USER MOD Single : A 117 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.153) USER MOD Single : A 119 MET CE :methyl -150:sc= -2.16 (180deg=-3.78!) USER MOD Single : A 120 GLN : amide:sc=-0.000188 K(o=-0.00019,f=-1.3) USER MOD Single : A 124 SER OG : rot 170:sc= 0 USER MOD Single : A 130 MET CE :methyl 179:sc= -2.81 (180deg=-2.93) USER MOD Single : A 132 THR OG1 : rot 73:sc= 1.22 USER MOD Single : A 133 TYR OH : rot 88:sc= 0.00357 USER MOD Single : A 137 HIS : no HD1:sc= -0.159 X(o=-0.16,f=-0.00013) USER MOD Single : A 143 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 145 ASN : amide:sc= 0.611 K(o=0.61,f=0) USER MOD Single : A 150 THR OG1 : rot 177:sc= 1.28 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= -0.519 X(o=-0.52,f=-0.98) USER MOD Single : A 158 ASN : amide:sc= -0.235 X(o=-0.24,f=-0.0012) USER MOD Single : A 163 SER OG : rot 170:sc= -1.8! USER MOD Single : A 165 LYS NZ :NH3+ -164:sc= -5.27! (180deg=-6.55!) USER MOD Single : A 167 GLN : amide:sc= -3.77! C(o=-3.8!,f=-2.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 6.869 3.535 16.848 1.00 3.19 N ATOM 2 CA MET A 1 5.835 3.065 15.892 1.00 2.85 C ATOM 3 C MET A 1 6.472 2.617 14.585 1.00 2.27 C ATOM 4 O MET A 1 5.779 2.346 13.606 1.00 2.72 O ATOM 5 CB MET A 1 4.808 4.168 15.620 1.00 3.07 C ATOM 6 CG MET A 1 5.415 5.469 15.127 1.00 3.85 C ATOM 7 SD MET A 1 6.317 6.352 16.414 1.00 4.63 S ATOM 8 CE MET A 1 6.978 7.724 15.476 1.00 5.45 C ATOM 0 H1 MET A 1 6.438 3.675 17.784 1.00 3.19 H new ATOM 0 H2 MET A 1 7.626 2.825 16.918 1.00 3.19 H new ATOM 0 H3 MET A 1 7.268 4.435 16.513 1.00 3.19 H new ATOM 0 HA MET A 1 5.325 2.213 16.342 1.00 2.85 H new ATOM 0 HB2 MET A 1 4.092 3.809 14.880 1.00 3.07 H new ATOM 0 HB3 MET A 1 4.249 4.364 16.535 1.00 3.07 H new ATOM 0 HG2 MET A 1 6.089 5.258 14.297 1.00 3.85 H new ATOM 0 HG3 MET A 1 4.623 6.110 14.740 1.00 3.85 H new ATOM 0 HE1 MET A 1 7.564 8.366 16.134 1.00 5.45 H new ATOM 0 HE2 MET A 1 7.615 7.345 14.677 1.00 5.45 H new ATOM 0 HE3 MET A 1 6.158 8.298 15.045 1.00 5.45 H new ATOM 20 N SER A 2 7.799 2.544 14.575 1.00 1.75 N ATOM 21 CA SER A 2 8.528 2.115 13.390 1.00 1.66 C ATOM 22 C SER A 2 8.121 0.697 13.011 1.00 1.36 C ATOM 23 O SER A 2 8.205 0.303 11.848 1.00 1.24 O ATOM 24 CB SER A 2 10.034 2.181 13.643 1.00 2.18 C ATOM 25 OG SER A 2 10.413 3.457 14.125 1.00 2.93 O ATOM 0 H SER A 2 8.390 2.776 15.374 1.00 1.75 H new ATOM 0 HA SER A 2 8.283 2.784 12.565 1.00 1.66 H new ATOM 0 HB2 SER A 2 10.319 1.416 14.366 1.00 2.18 H new ATOM 0 HB3 SER A 2 10.571 1.963 12.720 1.00 2.18 H new ATOM 0 HG SER A 2 10.368 4.109 13.395 1.00 2.93 H new ATOM 31 N GLN A 3 7.678 -0.063 14.009 1.00 1.37 N ATOM 32 CA GLN A 3 7.246 -1.438 13.798 1.00 1.24 C ATOM 33 C GLN A 3 6.009 -1.481 12.908 1.00 0.92 C ATOM 34 O GLN A 3 5.934 -2.273 11.968 1.00 0.86 O ATOM 35 CB GLN A 3 6.946 -2.107 15.140 1.00 1.49 C ATOM 36 CG GLN A 3 8.158 -2.222 16.050 1.00 1.69 C ATOM 37 CD GLN A 3 9.117 -3.309 15.609 1.00 2.43 C ATOM 38 OE1 GLN A 3 9.229 -3.610 14.423 1.00 3.10 O ATOM 39 NE2 GLN A 3 9.812 -3.908 16.568 1.00 2.97 N ATOM 0 H GLN A 3 7.609 0.254 14.976 1.00 1.37 H new ATOM 0 HA GLN A 3 8.051 -1.980 13.301 1.00 1.24 H new ATOM 0 HB2 GLN A 3 6.170 -1.539 15.653 1.00 1.49 H new ATOM 0 HB3 GLN A 3 6.544 -3.104 14.957 1.00 1.49 H new ATOM 0 HG2 GLN A 3 8.683 -1.267 16.072 1.00 1.69 H new ATOM 0 HG3 GLN A 3 7.825 -2.427 17.068 1.00 1.69 H new ATOM 0 HE21 GLN A 3 9.687 -3.626 17.540 1.00 2.97 H new ATOM 0 HE22 GLN A 3 10.471 -4.650 16.333 1.00 2.97 H new ATOM 48 N SER A 4 5.039 -0.625 13.219 1.00 0.88 N ATOM 49 CA SER A 4 3.803 -0.550 12.449 1.00 0.77 C ATOM 50 C SER A 4 4.097 -0.255 10.983 1.00 0.62 C ATOM 51 O SER A 4 3.522 -0.873 10.089 1.00 0.64 O ATOM 52 CB SER A 4 2.890 0.538 13.019 1.00 1.02 C ATOM 53 OG SER A 4 2.635 0.323 14.396 1.00 1.34 O ATOM 0 H SER A 4 5.087 0.028 14.001 1.00 0.88 H new ATOM 0 HA SER A 4 3.301 -1.515 12.518 1.00 0.77 H new ATOM 0 HB2 SER A 4 3.353 1.515 12.880 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.949 0.551 12.470 1.00 1.02 H new ATOM 0 HG SER A 4 2.051 1.033 14.735 1.00 1.34 H new ATOM 59 N ASN A 5 5.001 0.693 10.751 1.00 0.59 N ATOM 60 CA ASN A 5 5.379 1.085 9.398 1.00 0.55 C ATOM 61 C ASN A 5 5.900 -0.106 8.600 1.00 0.43 C ATOM 62 O ASN A 5 5.555 -0.274 7.430 1.00 0.44 O ATOM 63 CB ASN A 5 6.437 2.188 9.442 1.00 0.65 C ATOM 64 CG ASN A 5 5.887 3.491 9.989 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.939 3.497 10.773 1.00 1.71 O ATOM 66 ND2 ASN A 5 6.480 4.604 9.575 1.00 0.67 N ATOM 0 H ASN A 5 5.487 1.206 11.487 1.00 0.59 H new ATOM 0 HA ASN A 5 4.487 1.463 8.899 1.00 0.55 H new ATOM 0 HB2 ASN A 5 7.274 1.862 10.060 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.828 2.354 8.438 1.00 0.65 H new ATOM 0 HD21 ASN A 5 6.152 5.511 9.908 1.00 0.67 H new ATOM 0 HD22 ASN A 5 7.263 4.553 8.924 1.00 0.67 H new ATOM 73 N ARG A 6 6.730 -0.930 9.233 1.00 0.41 N ATOM 74 CA ARG A 6 7.282 -2.100 8.562 1.00 0.41 C ATOM 75 C ARG A 6 6.190 -3.130 8.305 1.00 0.37 C ATOM 76 O ARG A 6 6.206 -3.825 7.291 1.00 0.38 O ATOM 77 CB ARG A 6 8.403 -2.731 9.387 1.00 0.54 C ATOM 78 CG ARG A 6 9.138 -3.836 8.646 1.00 0.65 C ATOM 79 CD ARG A 6 9.735 -4.854 9.601 1.00 0.83 C ATOM 80 NE ARG A 6 10.650 -4.239 10.554 1.00 1.50 N ATOM 81 CZ ARG A 6 11.465 -4.931 11.342 1.00 2.14 C ATOM 82 NH1 ARG A 6 11.497 -6.255 11.270 1.00 2.16 N ATOM 83 NH2 ARG A 6 12.255 -4.301 12.198 1.00 3.18 N ATOM 0 H ARG A 6 7.032 -0.810 10.200 1.00 0.41 H new ATOM 0 HA ARG A 6 7.697 -1.772 7.609 1.00 0.41 H new ATOM 0 HB2 ARG A 6 9.115 -1.957 9.673 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.985 -3.136 10.309 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.450 -4.337 7.964 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.930 -3.401 8.037 1.00 0.65 H new ATOM 0 HD2 ARG A 6 8.933 -5.357 10.141 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.264 -5.618 9.032 1.00 0.83 H new ATOM 0 HE ARG A 6 10.665 -3.221 10.619 1.00 1.50 H new ATOM 0 HH11 ARG A 6 10.895 -6.744 10.608 1.00 2.16 H new ATOM 0 HH12 ARG A 6 12.124 -6.784 11.876 1.00 2.16 H new ATOM 0 HH21 ARG A 6 12.238 -3.283 12.253 1.00 3.18 H new ATOM 0 HH22 ARG A 6 12.880 -4.834 12.802 1.00 3.18 H new ATOM 97 N GLU A 7 5.245 -3.223 9.235 1.00 0.36 N ATOM 98 CA GLU A 7 4.137 -4.161 9.110 1.00 0.37 C ATOM 99 C GLU A 7 3.366 -3.913 7.820 1.00 0.29 C ATOM 100 O GLU A 7 2.899 -4.850 7.172 1.00 0.29 O ATOM 101 CB GLU A 7 3.202 -4.035 10.313 1.00 0.46 C ATOM 102 CG GLU A 7 3.464 -5.067 11.396 1.00 0.60 C ATOM 103 CD GLU A 7 2.534 -4.911 12.581 1.00 1.39 C ATOM 104 OE1 GLU A 7 2.815 -4.055 13.446 1.00 2.00 O ATOM 105 OE2 GLU A 7 1.525 -5.643 12.645 1.00 1.58 O ATOM 0 H GLU A 7 5.225 -2.659 10.085 1.00 0.36 H new ATOM 0 HA GLU A 7 4.543 -5.172 9.081 1.00 0.37 H new ATOM 0 HB2 GLU A 7 3.305 -3.038 10.740 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.171 -4.131 9.973 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.349 -6.067 10.977 1.00 0.60 H new ATOM 0 HG3 GLU A 7 4.497 -4.980 11.734 1.00 0.60 H new ATOM 112 N LEU A 8 3.238 -2.642 7.453 1.00 0.27 N ATOM 113 CA LEU A 8 2.531 -2.266 6.236 1.00 0.28 C ATOM 114 C LEU A 8 3.291 -2.755 5.012 1.00 0.28 C ATOM 115 O LEU A 8 2.699 -3.057 3.978 1.00 0.39 O ATOM 116 CB LEU A 8 2.357 -0.750 6.173 1.00 0.31 C ATOM 117 CG LEU A 8 1.862 -0.104 7.467 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.777 1.406 7.312 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.516 -0.684 7.873 1.00 0.35 C ATOM 0 H LEU A 8 3.615 -1.855 7.982 1.00 0.27 H new ATOM 0 HA LEU A 8 1.546 -2.733 6.248 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.312 -0.300 5.902 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.655 -0.513 5.374 1.00 0.31 H new ATOM 0 HG LEU A 8 2.579 -0.324 8.258 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.423 1.848 8.243 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.764 1.803 7.074 1.00 0.36 H new ATOM 0 HD13 LEU A 8 1.083 1.651 6.507 1.00 0.36 H new ATOM 0 HD21 LEU A 8 0.180 -0.212 8.796 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.213 -0.498 7.084 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.615 -1.758 8.030 1.00 0.35 H new ATOM 131 N VAL A 9 4.612 -2.823 5.140 1.00 0.26 N ATOM 132 CA VAL A 9 5.465 -3.287 4.056 1.00 0.28 C ATOM 133 C VAL A 9 5.464 -4.809 3.992 1.00 0.29 C ATOM 134 O VAL A 9 4.940 -5.398 3.051 1.00 0.31 O ATOM 135 CB VAL A 9 6.915 -2.793 4.233 1.00 0.32 C ATOM 136 CG1 VAL A 9 7.798 -3.301 3.104 1.00 0.38 C ATOM 137 CG2 VAL A 9 6.959 -1.274 4.311 1.00 0.31 C ATOM 0 H VAL A 9 5.115 -2.561 5.988 1.00 0.26 H new ATOM 0 HA VAL A 9 5.064 -2.879 3.128 1.00 0.28 H new ATOM 0 HB VAL A 9 7.300 -3.193 5.171 1.00 0.32 H new ATOM 0 HG11 VAL A 9 8.817 -2.941 3.248 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.795 -4.391 3.102 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.416 -2.936 2.151 1.00 0.38 H new ATOM 0 HG21 VAL A 9 7.991 -0.946 4.436 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.552 -0.851 3.393 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.365 -0.936 5.160 1.00 0.31 H new ATOM 147 N VAL A 10 6.058 -5.430 5.009 1.00 0.30 N ATOM 148 CA VAL A 10 6.148 -6.885 5.103 1.00 0.32 C ATOM 149 C VAL A 10 4.852 -7.571 4.679 1.00 0.35 C ATOM 150 O VAL A 10 4.846 -8.381 3.754 1.00 0.36 O ATOM 151 CB VAL A 10 6.491 -7.326 6.541 1.00 0.37 C ATOM 152 CG1 VAL A 10 6.564 -8.842 6.640 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.796 -6.695 6.999 1.00 0.38 C ATOM 0 H VAL A 10 6.490 -4.938 5.791 1.00 0.30 H new ATOM 0 HA VAL A 10 6.943 -7.186 4.421 1.00 0.32 H new ATOM 0 HB VAL A 10 5.694 -6.981 7.200 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.807 -9.129 7.663 1.00 0.42 H new ATOM 0 HG12 VAL A 10 5.602 -9.272 6.362 1.00 0.42 H new ATOM 0 HG13 VAL A 10 7.336 -9.214 5.966 1.00 0.42 H new ATOM 0 HG21 VAL A 10 8.020 -7.019 8.015 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.603 -7.004 6.334 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.703 -5.609 6.976 1.00 0.38 H new ATOM 163 N ASP A 11 3.759 -7.245 5.363 1.00 0.39 N ATOM 164 CA ASP A 11 2.463 -7.848 5.067 1.00 0.46 C ATOM 165 C ASP A 11 2.046 -7.610 3.617 1.00 0.44 C ATOM 166 O ASP A 11 1.453 -8.486 2.987 1.00 0.50 O ATOM 167 CB ASP A 11 1.393 -7.306 6.016 1.00 0.55 C ATOM 168 CG ASP A 11 0.120 -8.129 5.981 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.582 -8.096 4.948 1.00 0.84 O ATOM 170 OD2 ASP A 11 -0.176 -8.807 6.987 1.00 0.92 O ATOM 0 H ASP A 11 3.745 -6.567 6.125 1.00 0.39 H new ATOM 0 HA ASP A 11 2.562 -8.924 5.214 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.786 -7.292 7.033 1.00 0.55 H new ATOM 0 HB3 ASP A 11 1.163 -6.274 5.749 1.00 0.55 H new ATOM 175 N PHE A 12 2.353 -6.428 3.087 1.00 0.41 N ATOM 176 CA PHE A 12 1.996 -6.106 1.708 1.00 0.42 C ATOM 177 C PHE A 12 2.830 -6.929 0.732 1.00 0.37 C ATOM 178 O PHE A 12 2.339 -7.352 -0.315 1.00 0.41 O ATOM 179 CB PHE A 12 2.185 -4.613 1.427 1.00 0.44 C ATOM 180 CG PHE A 12 1.518 -4.161 0.157 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.197 -4.201 -1.050 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.210 -3.704 0.172 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.583 -3.793 -2.220 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.410 -3.297 -0.995 1.00 0.68 C ATOM 185 CZ PHE A 12 0.278 -3.341 -2.192 1.00 0.60 C ATOM 0 H PHE A 12 2.843 -5.685 3.585 1.00 0.41 H new ATOM 0 HA PHE A 12 0.944 -6.353 1.569 1.00 0.42 H new ATOM 0 HB2 PHE A 12 1.786 -4.039 2.263 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.251 -4.393 1.368 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.217 -4.555 -1.077 1.00 0.46 H new ATOM 0 HD2 PHE A 12 -0.331 -3.665 1.106 1.00 0.62 H new ATOM 0 HE1 PHE A 12 2.123 -3.828 -3.155 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -1.431 -2.945 -0.971 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.204 -3.022 -3.105 1.00 0.60 H new ATOM 195 N LEU A 13 4.091 -7.155 1.086 1.00 0.33 N ATOM 196 CA LEU A 13 4.993 -7.930 0.247 1.00 0.32 C ATOM 197 C LEU A 13 4.600 -9.400 0.262 1.00 0.33 C ATOM 198 O LEU A 13 4.693 -10.088 -0.754 1.00 0.35 O ATOM 199 CB LEU A 13 6.439 -7.766 0.724 1.00 0.32 C ATOM 200 CG LEU A 13 6.939 -6.321 0.785 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.388 -6.275 1.237 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.777 -5.641 -0.566 1.00 0.38 C ATOM 0 H LEU A 13 4.510 -6.811 1.950 1.00 0.33 H new ATOM 0 HA LEU A 13 4.918 -7.558 -0.775 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.531 -8.209 1.716 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.091 -8.333 0.060 1.00 0.32 H new ATOM 0 HG LEU A 13 6.336 -5.781 1.515 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.725 -5.239 1.274 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.474 -6.720 2.228 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.006 -6.833 0.534 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.138 -4.615 -0.502 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.353 -6.182 -1.317 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.724 -5.638 -0.848 1.00 0.38 H new ATOM 214 N SER A 14 4.158 -9.873 1.423 1.00 0.34 N ATOM 215 CA SER A 14 3.737 -11.258 1.569 1.00 0.38 C ATOM 216 C SER A 14 2.390 -11.468 0.890 1.00 0.39 C ATOM 217 O SER A 14 2.046 -12.584 0.502 1.00 0.41 O ATOM 218 CB SER A 14 3.648 -11.642 3.048 1.00 0.45 C ATOM 219 OG SER A 14 2.651 -10.888 3.713 1.00 1.14 O ATOM 0 H SER A 14 4.083 -9.316 2.274 1.00 0.34 H new ATOM 0 HA SER A 14 4.479 -11.898 1.092 1.00 0.38 H new ATOM 0 HB2 SER A 14 3.424 -12.705 3.138 1.00 0.45 H new ATOM 0 HB3 SER A 14 4.613 -11.478 3.528 1.00 0.45 H new ATOM 0 HG SER A 14 2.423 -10.101 3.175 1.00 1.14 H new ATOM 225 N TYR A 15 1.630 -10.384 0.751 1.00 0.42 N ATOM 226 CA TYR A 15 0.325 -10.444 0.105 1.00 0.47 C ATOM 227 C TYR A 15 0.494 -10.670 -1.390 1.00 0.45 C ATOM 228 O TYR A 15 -0.291 -11.381 -2.017 1.00 0.52 O ATOM 229 CB TYR A 15 -0.460 -9.154 0.355 1.00 0.55 C ATOM 230 CG TYR A 15 -1.839 -9.153 -0.269 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.881 -9.875 0.300 1.00 0.79 C ATOM 232 CD2 TYR A 15 -2.098 -8.433 -1.429 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.141 -9.879 -0.268 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.356 -8.431 -2.002 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.373 -9.157 -1.418 1.00 1.02 C ATOM 236 OH TYR A 15 -5.627 -9.159 -1.987 1.00 1.20 O ATOM 0 H TYR A 15 1.897 -9.455 1.077 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.234 -11.277 0.531 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.557 -9.000 1.430 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.108 -8.311 -0.038 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.703 -10.443 1.201 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -1.303 -7.866 -1.890 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.940 -10.445 0.188 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.542 -7.864 -2.902 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.622 -8.600 -2.792 1.00 1.20 H new ATOM 246 N LYS A 16 1.532 -10.058 -1.953 1.00 0.40 N ATOM 247 CA LYS A 16 1.824 -10.190 -3.373 1.00 0.41 C ATOM 248 C LYS A 16 2.494 -11.528 -3.660 1.00 0.35 C ATOM 249 O LYS A 16 2.216 -12.166 -4.675 1.00 0.39 O ATOM 250 CB LYS A 16 2.719 -9.041 -3.840 1.00 0.49 C ATOM 251 CG LYS A 16 1.981 -7.722 -4.009 1.00 0.90 C ATOM 252 CD LYS A 16 0.999 -7.778 -5.169 1.00 0.83 C ATOM 253 CE LYS A 16 0.329 -6.433 -5.401 1.00 1.35 C ATOM 254 NZ LYS A 16 -0.643 -6.484 -6.528 1.00 1.39 N ATOM 0 H LYS A 16 2.186 -9.464 -1.443 1.00 0.40 H new ATOM 0 HA LYS A 16 0.884 -10.149 -3.923 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.527 -8.906 -3.121 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.180 -9.314 -4.789 1.00 0.49 H new ATOM 0 HG2 LYS A 16 1.447 -7.482 -3.090 1.00 0.90 H new ATOM 0 HG3 LYS A 16 2.700 -6.920 -4.178 1.00 0.90 H new ATOM 0 HD2 LYS A 16 1.522 -8.086 -6.075 1.00 0.83 H new ATOM 0 HD3 LYS A 16 0.240 -8.533 -4.967 1.00 0.83 H new ATOM 0 HE2 LYS A 16 -0.185 -6.122 -4.492 1.00 1.35 H new ATOM 0 HE3 LYS A 16 1.089 -5.680 -5.611 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 -1.078 -5.548 -6.654 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 -0.148 -6.756 -7.401 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 -1.383 -7.184 -6.317 1.00 1.39 H new ATOM 268 N LEU A 17 3.379 -11.947 -2.759 1.00 0.30 N ATOM 269 CA LEU A 17 4.079 -13.215 -2.916 1.00 0.27 C ATOM 270 C LEU A 17 3.099 -14.375 -2.811 1.00 0.31 C ATOM 271 O LEU A 17 3.176 -15.335 -3.575 1.00 0.32 O ATOM 272 CB LEU A 17 5.181 -13.357 -1.865 1.00 0.25 C ATOM 273 CG LEU A 17 6.355 -12.389 -2.026 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.233 -12.403 -0.787 1.00 0.29 C ATOM 275 CD2 LEU A 17 7.172 -12.743 -3.260 1.00 0.25 C ATOM 0 H LEU A 17 3.626 -11.428 -1.916 1.00 0.30 H new ATOM 0 HA LEU A 17 4.540 -13.233 -3.903 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.742 -13.212 -0.878 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.564 -14.377 -1.897 1.00 0.25 H new ATOM 0 HG LEU A 17 5.955 -11.383 -2.153 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.062 -11.708 -0.921 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.644 -12.102 0.080 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.624 -13.408 -0.629 1.00 0.29 H new ATOM 0 HD21 LEU A 17 8.003 -12.044 -3.359 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.560 -13.757 -3.161 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.539 -12.682 -4.145 1.00 0.25 H new ATOM 287 N SER A 18 2.175 -14.277 -1.857 1.00 0.37 N ATOM 288 CA SER A 18 1.169 -15.313 -1.661 1.00 0.44 C ATOM 289 C SER A 18 0.337 -15.487 -2.925 1.00 0.47 C ATOM 290 O SER A 18 -0.104 -16.591 -3.245 1.00 0.51 O ATOM 291 CB SER A 18 0.260 -14.964 -0.480 1.00 0.54 C ATOM 292 OG SER A 18 0.962 -15.049 0.747 1.00 1.26 O ATOM 0 H SER A 18 2.104 -13.492 -1.210 1.00 0.37 H new ATOM 0 HA SER A 18 1.680 -16.250 -1.442 1.00 0.44 H new ATOM 0 HB2 SER A 18 -0.135 -13.956 -0.607 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.594 -15.641 -0.462 1.00 0.54 H new ATOM 0 HG SER A 18 1.402 -14.193 0.932 1.00 1.26 H new ATOM 298 N GLN A 19 0.127 -14.386 -3.642 1.00 0.48 N ATOM 299 CA GLN A 19 -0.644 -14.414 -4.879 1.00 0.53 C ATOM 300 C GLN A 19 0.159 -15.080 -5.990 1.00 0.48 C ATOM 301 O GLN A 19 -0.404 -15.603 -6.952 1.00 0.55 O ATOM 302 CB GLN A 19 -1.030 -12.994 -5.296 1.00 0.59 C ATOM 303 CG GLN A 19 -1.943 -12.943 -6.510 1.00 0.71 C ATOM 304 CD GLN A 19 -2.240 -11.525 -6.950 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.204 -10.911 -6.496 1.00 1.72 O ATOM 306 NE2 GLN A 19 -1.409 -10.996 -7.840 1.00 1.65 N ATOM 0 H GLN A 19 0.481 -13.464 -3.387 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.552 -14.991 -4.706 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.524 -12.500 -4.459 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.123 -12.428 -5.510 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.479 -13.486 -7.333 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -2.879 -13.452 -6.279 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -0.622 -11.542 -8.190 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -1.558 -10.044 -8.174 1.00 1.65 H new ATOM 315 N LYS A 20 1.480 -15.053 -5.847 1.00 0.41 N ATOM 316 CA LYS A 20 2.372 -15.652 -6.831 1.00 0.40 C ATOM 317 C LYS A 20 2.618 -17.125 -6.518 1.00 0.44 C ATOM 318 O LYS A 20 3.229 -17.843 -7.311 1.00 0.48 O ATOM 319 CB LYS A 20 3.698 -14.890 -6.873 1.00 0.36 C ATOM 320 CG LYS A 20 3.569 -13.471 -7.406 1.00 0.68 C ATOM 321 CD LYS A 20 3.240 -13.464 -8.892 1.00 0.61 C ATOM 322 CE LYS A 20 3.203 -12.053 -9.456 1.00 1.06 C ATOM 323 NZ LYS A 20 2.112 -11.240 -8.854 1.00 1.87 N ATOM 0 H LYS A 20 1.957 -14.621 -5.056 1.00 0.41 H new ATOM 0 HA LYS A 20 1.895 -15.588 -7.809 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.119 -14.855 -5.868 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.404 -15.440 -7.495 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.789 -12.944 -6.857 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.500 -12.930 -7.235 1.00 0.68 H new ATOM 0 HD2 LYS A 20 3.983 -14.052 -9.431 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.275 -13.945 -9.053 1.00 0.61 H new ATOM 0 HE2 LYS A 20 4.161 -11.565 -9.275 1.00 1.06 H new ATOM 0 HE3 LYS A 20 3.067 -12.098 -10.537 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 2.046 -10.327 -9.348 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 1.210 -11.749 -8.944 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.317 -11.075 -7.848 1.00 1.87 H new ATOM 337 N GLY A 21 2.140 -17.569 -5.358 1.00 0.48 N ATOM 338 CA GLY A 21 2.311 -18.956 -4.962 1.00 0.54 C ATOM 339 C GLY A 21 3.519 -19.169 -4.070 1.00 0.53 C ATOM 340 O GLY A 21 3.952 -20.302 -3.862 1.00 0.67 O ATOM 0 H GLY A 21 1.637 -16.992 -4.685 1.00 0.48 H new ATOM 0 HA2 GLY A 21 1.416 -19.293 -4.439 1.00 0.54 H new ATOM 0 HA3 GLY A 21 2.411 -19.574 -5.854 1.00 0.54 H new ATOM 344 N TYR A 22 4.062 -18.078 -3.540 1.00 0.43 N ATOM 345 CA TYR A 22 5.228 -18.149 -2.667 1.00 0.42 C ATOM 346 C TYR A 22 4.837 -17.896 -1.212 1.00 0.43 C ATOM 347 O TYR A 22 3.881 -17.172 -0.934 1.00 0.46 O ATOM 348 CB TYR A 22 6.285 -17.136 -3.113 1.00 0.40 C ATOM 349 CG TYR A 22 6.796 -17.365 -4.521 1.00 0.48 C ATOM 350 CD1 TYR A 22 7.336 -18.590 -4.896 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.737 -16.356 -5.476 1.00 0.47 C ATOM 352 CE1 TYR A 22 7.803 -18.802 -6.179 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.201 -16.562 -6.762 1.00 0.57 C ATOM 354 CZ TYR A 22 7.733 -17.786 -7.108 1.00 0.69 C ATOM 355 OH TYR A 22 8.195 -17.995 -8.388 1.00 0.81 O ATOM 0 H TYR A 22 3.713 -17.133 -3.700 1.00 0.43 H new ATOM 0 HA TYR A 22 5.646 -19.153 -2.738 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.864 -16.133 -3.048 1.00 0.40 H new ATOM 0 HB3 TYR A 22 7.126 -17.174 -2.421 1.00 0.40 H new ATOM 0 HD1 TYR A 22 7.391 -19.390 -4.172 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.322 -15.395 -5.209 1.00 0.47 H new ATOM 0 HE1 TYR A 22 8.221 -19.759 -6.453 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.147 -15.768 -7.492 1.00 0.57 H new ATOM 0 HH TYR A 22 8.072 -17.180 -8.917 1.00 0.81 H new ATOM 365 N SER A 23 5.583 -18.500 -0.288 1.00 0.45 N ATOM 366 CA SER A 23 5.314 -18.344 1.140 1.00 0.49 C ATOM 367 C SER A 23 6.363 -17.452 1.801 1.00 0.43 C ATOM 368 O SER A 23 7.559 -17.738 1.745 1.00 0.44 O ATOM 369 CB SER A 23 5.286 -19.713 1.825 1.00 0.59 C ATOM 370 OG SER A 23 4.921 -19.594 3.188 1.00 1.41 O ATOM 0 H SER A 23 6.378 -19.102 -0.503 1.00 0.45 H new ATOM 0 HA SER A 23 4.340 -17.868 1.251 1.00 0.49 H new ATOM 0 HB2 SER A 23 4.580 -20.365 1.312 1.00 0.59 H new ATOM 0 HB3 SER A 23 6.267 -20.182 1.748 1.00 0.59 H new ATOM 0 HG SER A 23 4.909 -20.482 3.602 1.00 1.41 H new ATOM 376 N TRP A 24 5.904 -16.373 2.433 1.00 0.43 N ATOM 377 CA TRP A 24 6.800 -15.432 3.104 1.00 0.41 C ATOM 378 C TRP A 24 7.473 -16.069 4.317 1.00 0.47 C ATOM 379 O TRP A 24 8.601 -15.721 4.664 1.00 0.53 O ATOM 380 CB TRP A 24 6.025 -14.182 3.537 1.00 0.44 C ATOM 381 CG TRP A 24 6.839 -13.227 4.361 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.893 -13.156 5.724 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.714 -12.206 3.872 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.752 -12.156 6.111 1.00 0.57 N ATOM 385 CE2 TRP A 24 8.269 -11.558 4.992 1.00 0.50 C ATOM 386 CE3 TRP A 24 8.085 -11.778 2.595 1.00 0.39 C ATOM 387 CZ2 TRP A 24 9.174 -10.506 4.871 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.982 -10.733 2.476 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.519 -10.108 3.608 1.00 0.48 C ATOM 0 H TRP A 24 4.916 -16.128 2.495 1.00 0.43 H new ATOM 0 HA TRP A 24 7.578 -15.150 2.394 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.661 -13.664 2.649 1.00 0.44 H new ATOM 0 HB3 TRP A 24 5.149 -14.488 4.109 1.00 0.44 H new ATOM 0 HD1 TRP A 24 6.341 -13.793 6.399 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.969 -11.900 7.074 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.678 -12.255 1.716 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.589 -10.022 5.743 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 9.274 -10.393 1.493 1.00 0.43 H new ATOM 0 HH2 TRP A 24 10.219 -9.296 3.482 1.00 0.48 H new ATOM 400 N SER A 25 6.775 -17.000 4.958 1.00 0.54 N ATOM 401 CA SER A 25 7.302 -17.672 6.142 1.00 0.63 C ATOM 402 C SER A 25 8.540 -18.503 5.817 1.00 0.63 C ATOM 403 O SER A 25 9.261 -18.929 6.720 1.00 0.75 O ATOM 404 CB SER A 25 6.229 -18.566 6.763 1.00 0.75 C ATOM 405 OG SER A 25 5.092 -17.812 7.141 1.00 1.20 O ATOM 0 H SER A 25 5.843 -17.307 4.678 1.00 0.54 H new ATOM 0 HA SER A 25 7.592 -16.900 6.855 1.00 0.63 H new ATOM 0 HB2 SER A 25 5.937 -19.337 6.050 1.00 0.75 H new ATOM 0 HB3 SER A 25 6.637 -19.076 7.635 1.00 0.75 H new ATOM 0 HG SER A 25 4.420 -18.408 7.534 1.00 1.20 H new ATOM 411 N GLN A 26 8.788 -18.730 4.531 1.00 0.61 N ATOM 412 CA GLN A 26 9.939 -19.523 4.112 1.00 0.73 C ATOM 413 C GLN A 26 11.130 -18.642 3.746 1.00 0.79 C ATOM 414 O GLN A 26 12.273 -19.101 3.751 1.00 0.93 O ATOM 415 CB GLN A 26 9.569 -20.420 2.930 1.00 0.80 C ATOM 416 CG GLN A 26 10.663 -21.410 2.565 1.00 1.25 C ATOM 417 CD GLN A 26 10.136 -22.638 1.849 1.00 1.53 C ATOM 418 OE1 GLN A 26 10.834 -23.240 1.035 1.00 1.91 O ATOM 419 NE2 GLN A 26 8.901 -23.022 2.152 1.00 2.26 N ATOM 0 H GLN A 26 8.212 -18.379 3.766 1.00 0.61 H new ATOM 0 HA GLN A 26 10.231 -20.146 4.958 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.657 -20.968 3.169 1.00 0.80 H new ATOM 0 HB3 GLN A 26 9.348 -19.796 2.064 1.00 0.80 H new ATOM 0 HG2 GLN A 26 11.398 -20.914 1.931 1.00 1.25 H new ATOM 0 HG3 GLN A 26 11.182 -21.720 3.472 1.00 1.25 H new ATOM 0 HE21 GLN A 26 8.355 -22.494 2.833 1.00 2.26 H new ATOM 0 HE22 GLN A 26 8.498 -23.845 1.703 1.00 2.26 H new ATOM 428 N PHE A 27 10.865 -17.378 3.431 1.00 0.76 N ATOM 429 CA PHE A 27 11.931 -16.449 3.068 1.00 0.92 C ATOM 430 C PHE A 27 12.317 -15.584 4.260 1.00 0.98 C ATOM 431 O PHE A 27 13.406 -15.011 4.298 1.00 1.18 O ATOM 432 CB PHE A 27 11.497 -15.561 1.900 1.00 0.99 C ATOM 433 CG PHE A 27 10.938 -16.324 0.734 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.684 -17.311 0.108 1.00 1.07 C ATOM 435 CD2 PHE A 27 9.664 -16.053 0.263 1.00 0.93 C ATOM 436 CE1 PHE A 27 11.168 -18.013 -0.965 1.00 1.13 C ATOM 437 CE2 PHE A 27 9.143 -16.751 -0.808 1.00 0.96 C ATOM 438 CZ PHE A 27 9.896 -17.732 -1.423 1.00 1.05 C ATOM 0 H PHE A 27 9.928 -16.975 3.419 1.00 0.76 H new ATOM 0 HA PHE A 27 12.799 -17.033 2.762 1.00 0.92 H new ATOM 0 HB2 PHE A 27 10.746 -14.854 2.253 1.00 0.99 H new ATOM 0 HB3 PHE A 27 12.353 -14.976 1.563 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.679 -17.534 0.463 1.00 1.07 H new ATOM 0 HD2 PHE A 27 9.071 -15.286 0.739 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.759 -18.780 -1.444 1.00 1.13 H new ATOM 0 HE2 PHE A 27 8.148 -16.530 -1.165 1.00 0.96 H new ATOM 0 HZ PHE A 27 9.490 -18.279 -2.261 1.00 1.05 H new ATOM 448 N SER A 28 11.416 -15.496 5.230 1.00 0.93 N ATOM 449 CA SER A 28 11.657 -14.703 6.427 1.00 1.07 C ATOM 450 C SER A 28 12.051 -15.601 7.594 1.00 1.04 C ATOM 451 O SER A 28 11.482 -16.677 7.779 1.00 1.02 O ATOM 452 CB SER A 28 10.409 -13.893 6.783 1.00 1.21 C ATOM 453 OG SER A 28 10.633 -13.081 7.922 1.00 1.73 O ATOM 0 H SER A 28 10.510 -15.965 5.210 1.00 0.93 H new ATOM 0 HA SER A 28 12.479 -14.016 6.227 1.00 1.07 H new ATOM 0 HB2 SER A 28 10.125 -13.267 5.937 1.00 1.21 H new ATOM 0 HB3 SER A 28 9.575 -14.569 6.973 1.00 1.21 H new ATOM 0 HG SER A 28 9.820 -12.573 8.126 1.00 1.73 H new ATOM 459 N ASP A 29 13.031 -15.157 8.375 1.00 1.25 N ATOM 460 CA ASP A 29 13.497 -15.926 9.523 1.00 1.33 C ATOM 461 C ASP A 29 12.430 -15.977 10.608 1.00 1.40 C ATOM 462 O ASP A 29 11.953 -14.942 11.073 1.00 1.62 O ATOM 463 CB ASP A 29 14.785 -15.323 10.083 1.00 1.63 C ATOM 464 CG ASP A 29 15.925 -15.373 9.089 1.00 1.96 C ATOM 465 OD1 ASP A 29 16.078 -14.409 8.311 1.00 2.16 O ATOM 466 OD2 ASP A 29 16.667 -16.378 9.089 1.00 2.43 O ATOM 0 H ASP A 29 13.516 -14.271 8.234 1.00 1.25 H new ATOM 0 HA ASP A 29 13.700 -16.943 9.189 1.00 1.33 H new ATOM 0 HB2 ASP A 29 14.603 -14.288 10.371 1.00 1.63 H new ATOM 0 HB3 ASP A 29 15.071 -15.860 10.987 1.00 1.63 H new ATOM 471 N VAL A 30 12.060 -17.188 11.003 1.00 1.40 N ATOM 472 CA VAL A 30 11.048 -17.383 12.031 1.00 1.63 C ATOM 473 C VAL A 30 11.673 -17.926 13.311 1.00 1.66 C ATOM 474 O VAL A 30 11.566 -17.317 14.376 1.00 1.79 O ATOM 475 CB VAL A 30 9.952 -18.354 11.549 1.00 1.89 C ATOM 476 CG1 VAL A 30 8.849 -18.485 12.589 1.00 2.24 C ATOM 477 CG2 VAL A 30 9.382 -17.895 10.216 1.00 1.95 C ATOM 0 H VAL A 30 12.448 -18.053 10.625 1.00 1.40 H new ATOM 0 HA VAL A 30 10.598 -16.411 12.235 1.00 1.63 H new ATOM 0 HB VAL A 30 10.404 -19.336 11.410 1.00 1.89 H new ATOM 0 HG11 VAL A 30 8.087 -19.175 12.226 1.00 2.24 H new ATOM 0 HG12 VAL A 30 9.270 -18.865 13.520 1.00 2.24 H new ATOM 0 HG13 VAL A 30 8.399 -17.508 12.767 1.00 2.24 H new ATOM 0 HG21 VAL A 30 8.610 -18.592 9.891 1.00 1.95 H new ATOM 0 HG22 VAL A 30 8.949 -16.901 10.328 1.00 1.95 H new ATOM 0 HG23 VAL A 30 10.178 -17.862 9.472 1.00 1.95 H new ATOM 487 N GLU A 31 12.330 -19.076 13.194 1.00 1.67 N ATOM 488 CA GLU A 31 12.974 -19.722 14.334 1.00 1.83 C ATOM 489 C GLU A 31 14.194 -18.943 14.816 1.00 1.78 C ATOM 490 O GLU A 31 14.213 -18.421 15.930 1.00 1.99 O ATOM 491 CB GLU A 31 13.405 -21.140 13.958 1.00 2.07 C ATOM 492 CG GLU A 31 12.247 -22.094 13.730 1.00 2.55 C ATOM 493 CD GLU A 31 11.488 -22.396 15.004 1.00 2.93 C ATOM 494 OE1 GLU A 31 12.032 -23.125 15.859 1.00 3.42 O ATOM 495 OE2 GLU A 31 10.351 -21.903 15.148 1.00 3.27 O ATOM 0 H GLU A 31 12.431 -19.583 12.315 1.00 1.67 H new ATOM 0 HA GLU A 31 12.245 -19.751 15.143 1.00 1.83 H new ATOM 0 HB2 GLU A 31 14.011 -21.097 13.053 1.00 2.07 H new ATOM 0 HB3 GLU A 31 14.041 -21.538 14.749 1.00 2.07 H new ATOM 0 HG2 GLU A 31 11.564 -21.664 12.997 1.00 2.55 H new ATOM 0 HG3 GLU A 31 12.625 -23.025 13.306 1.00 2.55 H new ATOM 502 N GLU A 32 15.211 -18.877 13.964 1.00 1.61 N ATOM 503 CA GLU A 32 16.459 -18.192 14.293 1.00 1.65 C ATOM 504 C GLU A 32 16.279 -16.684 14.445 1.00 1.75 C ATOM 505 O GLU A 32 17.247 -15.963 14.686 1.00 2.00 O ATOM 506 CB GLU A 32 17.508 -18.488 13.224 1.00 1.54 C ATOM 507 CG GLU A 32 17.007 -18.282 11.805 1.00 1.79 C ATOM 508 CD GLU A 32 17.785 -19.100 10.797 1.00 2.33 C ATOM 509 OE1 GLU A 32 18.944 -18.739 10.507 1.00 2.57 O ATOM 510 OE2 GLU A 32 17.236 -20.106 10.302 1.00 3.01 O ATOM 0 H GLU A 32 15.196 -19.293 13.033 1.00 1.61 H new ATOM 0 HA GLU A 32 16.792 -18.572 15.259 1.00 1.65 H new ATOM 0 HB2 GLU A 32 18.375 -17.848 13.391 1.00 1.54 H new ATOM 0 HB3 GLU A 32 17.846 -19.518 13.335 1.00 1.54 H new ATOM 0 HG2 GLU A 32 15.952 -18.551 11.752 1.00 1.79 H new ATOM 0 HG3 GLU A 32 17.080 -17.226 11.546 1.00 1.79 H new ATOM 517 N ASN A 33 15.050 -16.208 14.305 1.00 1.77 N ATOM 518 CA ASN A 33 14.770 -14.784 14.440 1.00 2.01 C ATOM 519 C ASN A 33 13.276 -14.543 14.587 1.00 1.89 C ATOM 520 O ASN A 33 12.532 -14.588 13.608 1.00 2.13 O ATOM 521 CB ASN A 33 15.308 -14.019 13.233 1.00 2.35 C ATOM 522 CG ASN A 33 15.379 -12.528 13.482 1.00 3.05 C ATOM 523 OD1 ASN A 33 15.621 -12.086 14.604 1.00 3.61 O ATOM 524 ND2 ASN A 33 15.165 -11.743 12.435 1.00 3.58 N ATOM 0 H ASN A 33 14.233 -16.783 14.099 1.00 1.77 H new ATOM 0 HA ASN A 33 15.270 -14.421 15.338 1.00 2.01 H new ATOM 0 HB2 ASN A 33 16.302 -14.391 12.984 1.00 2.35 H new ATOM 0 HB3 ASN A 33 14.670 -14.211 12.370 1.00 2.35 H new ATOM 0 HD21 ASN A 33 15.198 -10.729 12.543 1.00 3.58 H new ATOM 0 HD22 ASN A 33 14.968 -12.153 11.522 1.00 3.58 H new ATOM 531 N ARG A 34 12.839 -14.287 15.813 1.00 1.88 N ATOM 532 CA ARG A 34 11.427 -14.053 16.075 1.00 1.96 C ATOM 533 C ARG A 34 11.091 -12.571 16.091 1.00 1.98 C ATOM 534 O ARG A 34 11.377 -11.865 17.058 1.00 2.34 O ATOM 535 CB ARG A 34 11.015 -14.686 17.399 1.00 2.42 C ATOM 536 CG ARG A 34 10.841 -16.189 17.319 1.00 2.86 C ATOM 537 CD ARG A 34 10.322 -16.749 18.628 1.00 3.54 C ATOM 538 NE ARG A 34 11.167 -16.362 19.750 1.00 3.97 N ATOM 539 CZ ARG A 34 12.239 -17.044 20.133 1.00 4.63 C ATOM 540 NH1 ARG A 34 12.590 -18.149 19.490 1.00 4.92 N ATOM 541 NH2 ARG A 34 12.962 -16.620 21.158 1.00 5.33 N ATOM 0 H ARG A 34 13.439 -14.236 16.637 1.00 1.88 H new ATOM 0 HA ARG A 34 10.870 -14.517 15.262 1.00 1.96 H new ATOM 0 HB2 ARG A 34 11.767 -14.454 18.153 1.00 2.42 H new ATOM 0 HB3 ARG A 34 10.080 -14.237 17.733 1.00 2.42 H new ATOM 0 HG2 ARG A 34 10.148 -16.436 16.514 1.00 2.86 H new ATOM 0 HG3 ARG A 34 11.795 -16.656 17.073 1.00 2.86 H new ATOM 0 HD2 ARG A 34 9.305 -16.395 18.798 1.00 3.54 H new ATOM 0 HD3 ARG A 34 10.274 -17.836 18.566 1.00 3.54 H new ATOM 0 HE ARG A 34 10.921 -15.520 20.270 1.00 3.97 H new ATOM 0 HH11 ARG A 34 12.036 -18.477 18.699 1.00 4.92 H new ATOM 0 HH12 ARG A 34 13.414 -18.671 19.786 1.00 4.92 H new ATOM 0 HH21 ARG A 34 12.695 -15.769 21.653 1.00 5.33 H new ATOM 0 HH22 ARG A 34 13.786 -17.144 21.452 1.00 5.33 H new ATOM 555 N THR A 35 10.484 -12.110 15.007 1.00 1.80 N ATOM 556 CA THR A 35 10.076 -10.721 14.891 1.00 1.96 C ATOM 557 C THR A 35 8.591 -10.594 15.200 1.00 1.86 C ATOM 558 O THR A 35 7.760 -10.495 14.297 1.00 2.02 O ATOM 559 CB THR A 35 10.364 -10.164 13.488 1.00 2.32 C ATOM 560 OG1 THR A 35 9.824 -11.040 12.492 1.00 2.88 O ATOM 561 CG2 THR A 35 11.861 -10.000 13.272 1.00 2.78 C ATOM 0 H THR A 35 10.263 -12.683 14.192 1.00 1.80 H new ATOM 0 HA THR A 35 10.654 -10.139 15.609 1.00 1.96 H new ATOM 0 HB THR A 35 9.890 -9.186 13.403 1.00 2.32 H new ATOM 0 HG1 THR A 35 8.883 -11.224 12.694 1.00 2.88 H new ATOM 0 HG21 THR A 35 12.043 -9.605 12.273 1.00 2.78 H new ATOM 0 HG22 THR A 35 12.262 -9.310 14.014 1.00 2.78 H new ATOM 0 HG23 THR A 35 12.352 -10.968 13.374 1.00 2.78 H new ATOM 569 N GLU A 36 8.272 -10.626 16.489 1.00 1.87 N ATOM 570 CA GLU A 36 6.893 -10.535 16.950 1.00 1.94 C ATOM 571 C GLU A 36 6.173 -9.339 16.337 1.00 1.78 C ATOM 572 O GLU A 36 6.577 -8.193 16.531 1.00 1.92 O ATOM 573 CB GLU A 36 6.860 -10.432 18.474 1.00 2.27 C ATOM 574 CG GLU A 36 5.518 -10.802 19.076 1.00 2.71 C ATOM 575 CD GLU A 36 5.148 -12.246 18.812 1.00 3.32 C ATOM 576 OE1 GLU A 36 5.704 -13.135 19.490 1.00 3.69 O ATOM 577 OE2 GLU A 36 4.305 -12.489 17.926 1.00 3.86 O ATOM 0 H GLU A 36 8.958 -10.715 17.239 1.00 1.87 H new ATOM 0 HA GLU A 36 6.375 -11.439 16.630 1.00 1.94 H new ATOM 0 HB2 GLU A 36 7.628 -11.083 18.891 1.00 2.27 H new ATOM 0 HB3 GLU A 36 7.112 -9.413 18.767 1.00 2.27 H new ATOM 0 HG2 GLU A 36 5.544 -10.627 20.152 1.00 2.71 H new ATOM 0 HG3 GLU A 36 4.746 -10.151 18.666 1.00 2.71 H new ATOM 584 N ALA A 37 5.106 -9.618 15.594 1.00 1.73 N ATOM 585 CA ALA A 37 4.318 -8.569 14.960 1.00 1.70 C ATOM 586 C ALA A 37 3.282 -8.009 15.938 1.00 1.55 C ATOM 587 O ALA A 37 2.311 -8.689 16.269 1.00 1.78 O ATOM 588 CB ALA A 37 3.632 -9.109 13.715 1.00 2.06 C ATOM 0 H ALA A 37 4.768 -10.564 15.417 1.00 1.73 H new ATOM 0 HA ALA A 37 4.988 -7.760 14.669 1.00 1.70 H new ATOM 0 HB1 ALA A 37 3.046 -8.316 13.250 1.00 2.06 H new ATOM 0 HB2 ALA A 37 4.384 -9.466 13.011 1.00 2.06 H new ATOM 0 HB3 ALA A 37 2.974 -9.933 13.991 1.00 2.06 H new ATOM 594 N PRO A 38 3.472 -6.764 16.420 1.00 1.53 N ATOM 595 CA PRO A 38 2.544 -6.141 17.372 1.00 1.68 C ATOM 596 C PRO A 38 1.186 -5.819 16.758 1.00 1.55 C ATOM 597 O PRO A 38 1.058 -5.674 15.541 1.00 1.51 O ATOM 598 CB PRO A 38 3.261 -4.854 17.784 1.00 2.02 C ATOM 599 CG PRO A 38 4.173 -4.544 16.650 1.00 2.11 C ATOM 600 CD PRO A 38 4.598 -5.869 16.084 1.00 1.77 C ATOM 0 HA PRO A 38 2.320 -6.809 18.204 1.00 1.68 H new ATOM 0 HB2 PRO A 38 2.552 -4.044 17.954 1.00 2.02 H new ATOM 0 HB3 PRO A 38 3.817 -4.991 18.712 1.00 2.02 H new ATOM 0 HG2 PRO A 38 3.666 -3.942 15.896 1.00 2.11 H new ATOM 0 HG3 PRO A 38 5.035 -3.970 16.989 1.00 2.11 H new ATOM 0 HD2 PRO A 38 4.759 -5.813 15.007 1.00 1.77 H new ATOM 0 HD3 PRO A 38 5.532 -6.214 16.528 1.00 1.77 H new ATOM 608 N GLU A 39 0.177 -5.710 17.617 1.00 1.87 N ATOM 609 CA GLU A 39 -1.179 -5.401 17.181 1.00 1.91 C ATOM 610 C GLU A 39 -1.273 -3.965 16.685 1.00 1.53 C ATOM 611 O GLU A 39 -1.423 -3.033 17.475 1.00 1.78 O ATOM 612 CB GLU A 39 -2.167 -5.618 18.329 1.00 2.57 C ATOM 613 CG GLU A 39 -3.082 -6.812 18.127 1.00 3.24 C ATOM 614 CD GLU A 39 -2.320 -8.087 17.836 1.00 3.67 C ATOM 615 OE1 GLU A 39 -1.752 -8.668 18.783 1.00 3.88 O ATOM 616 OE2 GLU A 39 -2.292 -8.503 16.661 1.00 4.19 O ATOM 0 H GLU A 39 0.275 -5.832 18.625 1.00 1.87 H new ATOM 0 HA GLU A 39 -1.432 -6.071 16.359 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -1.610 -5.751 19.256 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -2.775 -4.721 18.448 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -3.691 -6.953 19.020 1.00 3.24 H new ATOM 0 HG3 GLU A 39 -3.766 -6.606 17.304 1.00 3.24 H new ATOM 623 N GLY A 40 -1.180 -3.794 15.374 1.00 1.33 N ATOM 624 CA GLY A 40 -1.254 -2.468 14.799 1.00 1.39 C ATOM 625 C GLY A 40 -2.679 -1.983 14.632 1.00 1.23 C ATOM 626 O GLY A 40 -3.303 -2.224 13.599 1.00 1.20 O ATOM 0 H GLY A 40 -1.055 -4.549 14.700 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -0.709 -1.770 15.434 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -0.759 -2.469 13.828 1.00 1.39 H new ATOM 630 N THR A 41 -3.199 -1.306 15.654 1.00 1.33 N ATOM 631 CA THR A 41 -4.556 -0.774 15.604 1.00 1.34 C ATOM 632 C THR A 41 -4.732 0.083 14.359 1.00 1.09 C ATOM 633 O THR A 41 -5.595 -0.181 13.521 1.00 1.05 O ATOM 634 CB THR A 41 -4.873 0.081 16.846 1.00 1.62 C ATOM 635 OG1 THR A 41 -4.588 -0.662 18.037 1.00 1.89 O ATOM 636 CG2 THR A 41 -6.332 0.511 16.851 1.00 1.79 C ATOM 0 H THR A 41 -2.702 -1.114 16.524 1.00 1.33 H new ATOM 0 HA THR A 41 -5.241 -1.621 15.579 1.00 1.34 H new ATOM 0 HB THR A 41 -4.248 0.973 16.814 1.00 1.62 H new ATOM 0 HG1 THR A 41 -4.790 -0.112 18.822 1.00 1.89 H new ATOM 0 HG21 THR A 41 -6.531 1.113 17.738 1.00 1.79 H new ATOM 0 HG22 THR A 41 -6.541 1.100 15.958 1.00 1.79 H new ATOM 0 HG23 THR A 41 -6.971 -0.372 16.861 1.00 1.79 H new ATOM 644 N GLU A 42 -3.901 1.112 14.249 1.00 1.02 N ATOM 645 CA GLU A 42 -3.939 2.011 13.108 1.00 0.87 C ATOM 646 C GLU A 42 -3.389 1.313 11.868 1.00 0.73 C ATOM 647 O GLU A 42 -3.752 1.649 10.741 1.00 0.63 O ATOM 648 CB GLU A 42 -3.128 3.272 13.409 1.00 1.05 C ATOM 649 CG GLU A 42 -3.148 4.296 12.289 1.00 1.53 C ATOM 650 CD GLU A 42 -2.333 5.528 12.620 1.00 2.12 C ATOM 651 OE1 GLU A 42 -1.091 5.460 12.520 1.00 2.82 O ATOM 652 OE2 GLU A 42 -2.936 6.557 12.987 1.00 2.42 O ATOM 0 H GLU A 42 -3.189 1.343 14.942 1.00 1.02 H new ATOM 0 HA GLU A 42 -4.974 2.295 12.917 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -3.515 3.733 14.317 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -2.095 2.989 13.611 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -2.760 3.841 11.377 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -4.178 4.589 12.086 1.00 1.53 H new ATOM 659 N SER A 43 -2.514 0.333 12.090 1.00 0.79 N ATOM 660 CA SER A 43 -1.911 -0.421 10.996 1.00 0.75 C ATOM 661 C SER A 43 -2.979 -1.145 10.187 1.00 0.67 C ATOM 662 O SER A 43 -2.842 -1.315 8.979 1.00 0.62 O ATOM 663 CB SER A 43 -0.898 -1.430 11.534 1.00 0.94 C ATOM 664 OG SER A 43 0.109 -0.787 12.296 1.00 1.14 O ATOM 0 H SER A 43 -2.208 0.044 13.019 1.00 0.79 H new ATOM 0 HA SER A 43 -1.396 0.285 10.345 1.00 0.75 H new ATOM 0 HB2 SER A 43 -1.409 -2.169 12.151 1.00 0.94 H new ATOM 0 HB3 SER A 43 -0.441 -1.969 10.704 1.00 0.94 H new ATOM 0 HG SER A 43 0.743 -1.455 12.630 1.00 1.14 H new ATOM 670 N GLU A 44 -4.040 -1.575 10.864 1.00 0.72 N ATOM 671 CA GLU A 44 -5.136 -2.275 10.202 1.00 0.73 C ATOM 672 C GLU A 44 -5.828 -1.360 9.199 1.00 0.61 C ATOM 673 O GLU A 44 -6.316 -1.811 8.163 1.00 0.66 O ATOM 674 CB GLU A 44 -6.157 -2.771 11.229 1.00 0.85 C ATOM 675 CG GLU A 44 -5.656 -3.906 12.107 1.00 1.32 C ATOM 676 CD GLU A 44 -5.485 -5.203 11.345 1.00 1.96 C ATOM 677 OE1 GLU A 44 -4.386 -5.430 10.802 1.00 2.98 O ATOM 678 OE2 GLU A 44 -6.451 -5.993 11.292 1.00 1.90 O ATOM 0 H GLU A 44 -4.164 -1.451 11.869 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.717 -3.131 9.674 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.450 -1.936 11.866 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -7.053 -3.101 10.704 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.702 -3.622 12.551 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -6.356 -4.061 12.928 1.00 1.32 H new ATOM 685 N ALA A 45 -5.863 -0.071 9.518 1.00 0.53 N ATOM 686 CA ALA A 45 -6.502 0.916 8.658 1.00 0.45 C ATOM 687 C ALA A 45 -5.678 1.182 7.402 1.00 0.39 C ATOM 688 O ALA A 45 -6.160 1.000 6.284 1.00 0.39 O ATOM 689 CB ALA A 45 -6.730 2.205 9.428 1.00 0.48 C ATOM 0 H ALA A 45 -5.455 0.315 10.369 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.464 0.515 8.340 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.208 2.938 8.778 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.372 2.007 10.286 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -5.773 2.596 9.774 1.00 0.48 H new ATOM 695 N VAL A 46 -4.437 1.619 7.593 1.00 0.36 N ATOM 696 CA VAL A 46 -3.545 1.913 6.475 1.00 0.32 C ATOM 697 C VAL A 46 -3.311 0.674 5.614 1.00 0.34 C ATOM 698 O VAL A 46 -3.228 0.770 4.391 1.00 0.35 O ATOM 699 CB VAL A 46 -2.197 2.476 6.969 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.718 1.718 8.193 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.151 2.436 5.864 1.00 0.34 C ATOM 0 H VAL A 46 -4.025 1.778 8.513 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.033 2.672 5.863 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.348 3.518 7.249 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.766 2.130 8.526 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.454 1.814 8.991 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.590 0.665 7.942 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.210 2.839 6.239 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.002 1.406 5.541 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.491 3.035 5.019 1.00 0.34 H new ATOM 711 N LYS A 47 -3.197 -0.485 6.255 1.00 0.41 N ATOM 712 CA LYS A 47 -2.995 -1.737 5.532 1.00 0.50 C ATOM 713 C LYS A 47 -4.155 -1.965 4.571 1.00 0.51 C ATOM 714 O LYS A 47 -3.988 -2.537 3.493 1.00 0.59 O ATOM 715 CB LYS A 47 -2.883 -2.907 6.515 1.00 0.63 C ATOM 716 CG LYS A 47 -2.809 -4.272 5.849 1.00 0.84 C ATOM 717 CD LYS A 47 -3.090 -5.386 6.845 1.00 1.45 C ATOM 718 CE LYS A 47 -3.269 -6.724 6.148 1.00 1.93 C ATOM 719 NZ LYS A 47 -3.697 -7.792 7.094 1.00 2.14 N ATOM 0 H LYS A 47 -3.241 -0.584 7.269 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.067 -1.675 4.964 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -1.995 -2.766 7.131 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -3.742 -2.888 7.186 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.529 -4.321 5.032 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -1.821 -4.413 5.411 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -2.269 -5.453 7.558 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -3.988 -5.148 7.415 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -4.010 -6.624 5.355 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -2.332 -7.014 5.673 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -3.808 -8.688 6.578 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -2.978 -7.906 7.837 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -4.604 -7.528 7.528 1.00 2.14 H new ATOM 733 N GLN A 48 -5.332 -1.501 4.980 1.00 0.47 N ATOM 734 CA GLN A 48 -6.539 -1.626 4.175 1.00 0.52 C ATOM 735 C GLN A 48 -6.568 -0.553 3.093 1.00 0.48 C ATOM 736 O GLN A 48 -7.043 -0.785 1.981 1.00 0.54 O ATOM 737 CB GLN A 48 -7.774 -1.499 5.073 1.00 0.55 C ATOM 738 CG GLN A 48 -9.095 -1.552 4.324 1.00 0.85 C ATOM 739 CD GLN A 48 -9.431 -2.945 3.833 1.00 1.50 C ATOM 740 OE1 GLN A 48 -9.049 -3.941 4.446 1.00 2.23 O ATOM 741 NE2 GLN A 48 -10.154 -3.021 2.723 1.00 2.02 N ATOM 0 H GLN A 48 -5.474 -1.031 5.874 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.543 -2.604 3.694 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.756 -2.300 5.813 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.717 -0.558 5.620 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.893 -1.199 4.977 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.054 -0.871 3.474 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -10.449 -2.168 2.247 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -10.415 -3.932 2.346 1.00 2.02 H new ATOM 750 N ALA A 49 -6.049 0.624 3.431 1.00 0.42 N ATOM 751 CA ALA A 49 -6.010 1.744 2.501 1.00 0.40 C ATOM 752 C ALA A 49 -5.023 1.493 1.366 1.00 0.39 C ATOM 753 O ALA A 49 -5.269 1.878 0.224 1.00 0.42 O ATOM 754 CB ALA A 49 -5.650 3.024 3.240 1.00 0.36 C ATOM 0 H ALA A 49 -5.648 0.825 4.347 1.00 0.42 H new ATOM 0 HA ALA A 49 -7.002 1.851 2.061 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.623 3.856 2.536 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.397 3.223 4.008 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.671 2.912 3.706 1.00 0.36 H new ATOM 760 N LEU A 50 -3.907 0.841 1.684 1.00 0.38 N ATOM 761 CA LEU A 50 -2.884 0.549 0.686 1.00 0.39 C ATOM 762 C LEU A 50 -3.370 -0.509 -0.295 1.00 0.46 C ATOM 763 O LEU A 50 -2.885 -0.591 -1.423 1.00 0.49 O ATOM 764 CB LEU A 50 -1.589 0.081 1.356 1.00 0.39 C ATOM 765 CG LEU A 50 -0.359 0.954 1.089 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.159 1.163 -0.406 1.00 0.31 C ATOM 767 CD2 LEU A 50 -0.484 2.290 1.807 1.00 0.29 C ATOM 0 H LEU A 50 -3.689 0.506 2.623 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.683 1.469 0.137 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.753 0.034 2.433 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.373 -0.934 1.022 1.00 0.39 H new ATOM 0 HG LEU A 50 0.517 0.436 1.479 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.720 1.786 -0.572 1.00 0.31 H new ATOM 0 HD12 LEU A 50 -0.017 0.198 -0.893 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.037 1.655 -0.825 1.00 0.31 H new ATOM 0 HD21 LEU A 50 0.399 2.896 1.605 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -1.372 2.813 1.451 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -0.569 2.120 2.880 1.00 0.29 H new ATOM 779 N ARG A 51 -4.322 -1.322 0.145 1.00 0.52 N ATOM 780 CA ARG A 51 -4.877 -2.367 -0.702 1.00 0.61 C ATOM 781 C ARG A 51 -5.798 -1.762 -1.754 1.00 0.62 C ATOM 782 O ARG A 51 -5.663 -2.039 -2.946 1.00 0.69 O ATOM 783 CB ARG A 51 -5.644 -3.388 0.139 1.00 0.67 C ATOM 784 CG ARG A 51 -6.347 -4.447 -0.694 1.00 0.98 C ATOM 785 CD ARG A 51 -7.153 -5.395 0.173 1.00 1.49 C ATOM 786 NE ARG A 51 -6.297 -6.237 0.999 1.00 2.00 N ATOM 787 CZ ARG A 51 -6.663 -7.428 1.453 1.00 2.89 C ATOM 788 NH1 ARG A 51 -7.867 -7.905 1.169 1.00 3.39 N ATOM 789 NH2 ARG A 51 -5.828 -8.142 2.192 1.00 3.74 N ATOM 0 H ARG A 51 -4.724 -1.277 1.081 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.054 -2.875 -1.204 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.952 -3.876 0.825 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.382 -2.866 0.748 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -7.006 -3.965 -1.416 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -5.609 -5.012 -1.263 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -7.823 -4.821 0.813 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -7.778 -6.024 -0.461 1.00 1.49 H new ATOM 0 HE ARG A 51 -5.368 -5.892 1.241 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -8.512 -7.356 0.601 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -8.148 -8.821 1.518 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -4.902 -7.776 2.413 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -6.111 -9.058 2.541 1.00 3.74 H new ATOM 803 N GLU A 52 -6.736 -0.935 -1.301 1.00 0.59 N ATOM 804 CA GLU A 52 -7.680 -0.280 -2.199 1.00 0.62 C ATOM 805 C GLU A 52 -6.961 0.714 -3.102 1.00 0.59 C ATOM 806 O GLU A 52 -7.402 0.988 -4.218 1.00 0.65 O ATOM 807 CB GLU A 52 -8.760 0.446 -1.395 1.00 0.66 C ATOM 808 CG GLU A 52 -9.570 -0.466 -0.489 1.00 0.92 C ATOM 809 CD GLU A 52 -10.411 -1.463 -1.261 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.477 -1.066 -1.777 1.00 1.45 O ATOM 811 OE2 GLU A 52 -10.005 -2.640 -1.348 1.00 1.88 O ATOM 0 H GLU A 52 -6.862 -0.703 -0.316 1.00 0.59 H new ATOM 0 HA GLU A 52 -8.147 -1.046 -2.819 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.289 1.220 -0.788 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.436 0.950 -2.086 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -8.894 -1.005 0.175 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -10.220 0.140 0.142 1.00 0.92 H new ATOM 818 N ALA A 53 -5.849 1.250 -2.609 1.00 0.52 N ATOM 819 CA ALA A 53 -5.067 2.218 -3.366 1.00 0.49 C ATOM 820 C ALA A 53 -4.188 1.528 -4.402 1.00 0.52 C ATOM 821 O ALA A 53 -4.053 2.005 -5.527 1.00 0.53 O ATOM 822 CB ALA A 53 -4.223 3.062 -2.424 1.00 0.43 C ATOM 0 H ALA A 53 -5.470 1.030 -1.688 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.758 2.871 -3.899 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.643 3.782 -3.001 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.874 3.594 -1.730 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.546 2.416 -1.864 1.00 0.43 H new ATOM 828 N GLY A 54 -3.588 0.406 -4.015 1.00 0.57 N ATOM 829 CA GLY A 54 -2.735 -0.331 -4.930 1.00 0.64 C ATOM 830 C GLY A 54 -3.512 -0.915 -6.091 1.00 0.74 C ATOM 831 O GLY A 54 -2.947 -1.197 -7.149 1.00 0.82 O ATOM 0 H GLY A 54 -3.677 -0.005 -3.086 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -1.957 0.330 -5.312 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -2.234 -1.134 -4.390 1.00 0.64 H new ATOM 835 N ASP A 55 -4.813 -1.094 -5.892 1.00 0.79 N ATOM 836 CA ASP A 55 -5.679 -1.647 -6.926 1.00 0.92 C ATOM 837 C ASP A 55 -6.132 -0.559 -7.893 1.00 0.88 C ATOM 838 O ASP A 55 -6.352 -0.819 -9.076 1.00 0.97 O ATOM 839 CB ASP A 55 -6.897 -2.321 -6.291 1.00 1.04 C ATOM 840 CG ASP A 55 -7.840 -2.903 -7.326 1.00 1.12 C ATOM 841 OD1 ASP A 55 -7.623 -4.060 -7.743 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.796 -2.202 -7.719 1.00 1.29 O ATOM 0 H ASP A 55 -5.292 -0.863 -5.021 1.00 0.79 H new ATOM 0 HA ASP A 55 -5.110 -2.391 -7.484 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -6.563 -3.114 -5.622 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -7.434 -1.595 -5.681 1.00 1.04 H new ATOM 847 N GLU A 56 -6.266 0.661 -7.383 1.00 0.79 N ATOM 848 CA GLU A 56 -6.698 1.787 -8.200 1.00 0.83 C ATOM 849 C GLU A 56 -5.523 2.398 -8.957 1.00 0.78 C ATOM 850 O GLU A 56 -5.674 2.855 -10.090 1.00 0.85 O ATOM 851 CB GLU A 56 -7.370 2.848 -7.328 1.00 0.83 C ATOM 852 CG GLU A 56 -7.878 4.044 -8.114 1.00 0.94 C ATOM 853 CD GLU A 56 -8.655 5.018 -7.254 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.794 4.688 -6.863 1.00 1.38 O ATOM 855 OE2 GLU A 56 -8.124 6.111 -6.972 1.00 2.06 O ATOM 0 H GLU A 56 -6.081 0.894 -6.407 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.419 1.418 -8.930 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -8.204 2.393 -6.794 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.660 3.192 -6.576 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.033 4.561 -8.569 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -8.514 3.696 -8.928 1.00 0.94 H new ATOM 862 N PHE A 57 -4.354 2.404 -8.325 1.00 0.72 N ATOM 863 CA PHE A 57 -3.155 2.956 -8.944 1.00 0.76 C ATOM 864 C PHE A 57 -2.680 2.058 -10.080 1.00 0.82 C ATOM 865 O PHE A 57 -2.057 2.523 -11.034 1.00 0.90 O ATOM 866 CB PHE A 57 -2.045 3.121 -7.901 1.00 0.77 C ATOM 867 CG PHE A 57 -0.782 3.723 -8.454 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.644 5.097 -8.565 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.267 2.913 -8.862 1.00 1.05 C ATOM 870 CE1 PHE A 57 0.516 5.653 -9.072 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.428 3.463 -9.370 1.00 1.25 C ATOM 872 CZ PHE A 57 1.552 4.834 -9.476 1.00 1.34 C ATOM 0 H PHE A 57 -4.212 2.033 -7.386 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.399 3.936 -9.354 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.412 3.749 -7.089 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -1.815 2.146 -7.471 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -1.452 5.741 -8.252 1.00 1.07 H new ATOM 0 HD2 PHE A 57 0.175 1.840 -8.782 1.00 1.05 H new ATOM 0 HE1 PHE A 57 0.612 6.726 -9.152 1.00 1.26 H new ATOM 0 HE2 PHE A 57 2.238 2.821 -9.684 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.458 5.266 -9.874 1.00 1.34 H new ATOM 882 N GLU A 58 -2.983 0.768 -9.972 1.00 0.83 N ATOM 883 CA GLU A 58 -2.589 -0.199 -10.990 1.00 0.95 C ATOM 884 C GLU A 58 -3.615 -0.255 -12.117 1.00 0.99 C ATOM 885 O GLU A 58 -3.323 -0.733 -13.212 1.00 1.08 O ATOM 886 CB GLU A 58 -2.418 -1.585 -10.365 1.00 1.05 C ATOM 887 CG GLU A 58 -1.980 -2.650 -11.357 1.00 1.35 C ATOM 888 CD GLU A 58 -1.829 -4.017 -10.721 1.00 1.27 C ATOM 889 OE1 GLU A 58 -0.790 -4.258 -10.071 1.00 1.45 O ATOM 890 OE2 GLU A 58 -2.748 -4.847 -10.875 1.00 1.61 O ATOM 0 H GLU A 58 -3.500 0.368 -9.189 1.00 0.83 H new ATOM 0 HA GLU A 58 -1.636 0.121 -11.411 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -1.683 -1.524 -9.562 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -3.361 -1.889 -9.911 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -2.709 -2.709 -12.166 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -1.031 -2.355 -11.804 1.00 1.35 H new ATOM 897 N LEU A 59 -4.817 0.239 -11.844 1.00 0.98 N ATOM 898 CA LEU A 59 -5.883 0.241 -12.840 1.00 1.10 C ATOM 899 C LEU A 59 -5.877 1.538 -13.642 1.00 1.10 C ATOM 900 O LEU A 59 -6.409 1.595 -14.751 1.00 1.24 O ATOM 901 CB LEU A 59 -7.243 0.050 -12.163 1.00 1.19 C ATOM 902 CG LEU A 59 -8.442 -0.023 -13.113 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.307 -1.203 -14.064 1.00 1.59 C ATOM 904 CD2 LEU A 59 -9.739 -0.121 -12.325 1.00 1.56 C ATOM 0 H LEU A 59 -5.078 0.642 -10.944 1.00 0.98 H new ATOM 0 HA LEU A 59 -5.707 -0.588 -13.525 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -7.211 -0.866 -11.573 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.402 0.873 -11.466 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.464 0.892 -13.706 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.170 -1.235 -14.729 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.398 -1.092 -14.654 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -8.257 -2.129 -13.491 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.581 -0.172 -13.015 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -9.722 -1.018 -11.706 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -9.845 0.757 -11.688 1.00 1.56 H new ATOM 916 N ARG A 60 -5.268 2.576 -13.077 1.00 1.00 N ATOM 917 CA ARG A 60 -5.198 3.873 -13.743 1.00 1.06 C ATOM 918 C ARG A 60 -3.799 4.143 -14.285 1.00 1.00 C ATOM 919 O ARG A 60 -3.643 4.701 -15.371 1.00 1.07 O ATOM 920 CB ARG A 60 -5.607 4.987 -12.779 1.00 1.10 C ATOM 921 CG ARG A 60 -7.037 4.860 -12.280 1.00 1.19 C ATOM 922 CD ARG A 60 -7.640 6.221 -11.981 1.00 1.31 C ATOM 923 NE ARG A 60 -7.502 7.135 -13.111 1.00 1.81 N ATOM 924 CZ ARG A 60 -8.313 7.136 -14.164 1.00 2.26 C ATOM 925 NH1 ARG A 60 -9.313 6.268 -14.240 1.00 2.15 N ATOM 926 NH2 ARG A 60 -8.121 8.005 -15.147 1.00 3.21 N ATOM 0 H ARG A 60 -4.817 2.545 -12.163 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.891 3.853 -14.584 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -4.930 4.984 -11.924 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -5.488 5.949 -13.277 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -7.642 4.349 -13.029 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -7.057 4.245 -11.380 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -8.695 6.105 -11.734 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -7.153 6.650 -11.105 1.00 1.31 H new ATOM 0 HE ARG A 60 -6.739 7.812 -13.091 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -9.463 5.595 -13.488 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -9.932 6.273 -15.050 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -7.351 8.672 -15.095 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -8.743 8.006 -15.955 1.00 3.21 H new ATOM 940 N TYR A 61 -2.786 3.746 -13.523 1.00 0.91 N ATOM 941 CA TYR A 61 -1.401 3.950 -13.930 1.00 0.90 C ATOM 942 C TYR A 61 -0.678 2.616 -14.085 1.00 0.84 C ATOM 943 O TYR A 61 0.420 2.423 -13.561 1.00 0.83 O ATOM 944 CB TYR A 61 -0.677 4.836 -12.915 1.00 0.96 C ATOM 945 CG TYR A 61 -1.290 6.211 -12.776 1.00 1.05 C ATOM 946 CD1 TYR A 61 -1.207 7.139 -13.807 1.00 1.27 C ATOM 947 CD2 TYR A 61 -1.954 6.580 -11.614 1.00 1.04 C ATOM 948 CE1 TYR A 61 -1.769 8.396 -13.682 1.00 1.38 C ATOM 949 CE2 TYR A 61 -2.519 7.835 -11.482 1.00 1.14 C ATOM 950 CZ TYR A 61 -2.424 8.738 -12.518 1.00 1.27 C ATOM 951 OH TYR A 61 -2.985 9.988 -12.391 1.00 1.41 O ATOM 0 H TYR A 61 -2.898 3.282 -12.622 1.00 0.91 H new ATOM 0 HA TYR A 61 -1.398 4.451 -14.898 1.00 0.90 H new ATOM 0 HB2 TYR A 61 -0.684 4.343 -11.943 1.00 0.96 H new ATOM 0 HB3 TYR A 61 0.366 4.939 -13.213 1.00 0.96 H new ATOM 0 HD1 TYR A 61 -0.695 6.874 -14.720 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -2.031 5.875 -10.799 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -1.695 9.106 -14.492 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -3.032 8.106 -10.571 1.00 1.14 H new ATOM 0 HH TYR A 61 -3.409 10.068 -11.511 1.00 1.41 H new ATOM 961 N ARG A 62 -1.306 1.700 -14.815 1.00 0.86 N ATOM 962 CA ARG A 62 -0.734 0.381 -15.056 1.00 0.85 C ATOM 963 C ARG A 62 0.576 0.495 -15.825 1.00 0.87 C ATOM 964 O ARG A 62 1.571 -0.142 -15.482 1.00 0.85 O ATOM 965 CB ARG A 62 -1.718 -0.479 -15.850 1.00 0.95 C ATOM 966 CG ARG A 62 -1.199 -1.871 -16.171 1.00 1.04 C ATOM 967 CD ARG A 62 -1.869 -2.926 -15.309 1.00 1.23 C ATOM 968 NE ARG A 62 -3.324 -2.857 -15.399 1.00 1.73 N ATOM 969 CZ ARG A 62 -4.098 -3.900 -15.684 1.00 2.16 C ATOM 970 NH1 ARG A 62 -3.558 -5.087 -15.920 1.00 2.24 N ATOM 971 NH2 ARG A 62 -5.414 -3.755 -15.734 1.00 3.02 N ATOM 0 H ARG A 62 -2.216 1.849 -15.252 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.536 -0.087 -14.092 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.645 -0.569 -15.284 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -1.962 0.031 -16.782 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -1.376 -2.093 -17.223 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -0.121 -1.903 -16.016 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -1.532 -3.915 -15.619 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -1.563 -2.795 -14.271 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.773 -1.956 -15.234 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -2.545 -5.203 -15.883 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -4.155 -5.885 -16.138 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -5.834 -2.843 -15.554 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -6.007 -4.555 -15.953 1.00 3.02 H new ATOM 985 N ARG A 63 0.559 1.314 -16.869 1.00 0.94 N ATOM 986 CA ARG A 63 1.732 1.518 -17.706 1.00 1.01 C ATOM 987 C ARG A 63 2.870 2.150 -16.916 1.00 0.95 C ATOM 988 O ARG A 63 4.017 1.711 -17.003 1.00 0.99 O ATOM 989 CB ARG A 63 1.375 2.405 -18.892 1.00 1.16 C ATOM 990 CG ARG A 63 2.464 2.479 -19.944 1.00 1.70 C ATOM 991 CD ARG A 63 1.980 3.218 -21.175 1.00 2.14 C ATOM 992 NE ARG A 63 0.651 2.773 -21.574 1.00 2.71 N ATOM 993 CZ ARG A 63 0.388 2.191 -22.736 1.00 3.58 C ATOM 994 NH1 ARG A 63 1.358 1.989 -23.616 1.00 3.92 N ATOM 995 NH2 ARG A 63 -0.848 1.807 -23.018 1.00 4.52 N ATOM 0 H ARG A 63 -0.260 1.850 -17.157 1.00 0.94 H new ATOM 0 HA ARG A 63 2.065 0.544 -18.064 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.461 2.031 -19.353 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.161 3.411 -18.531 1.00 1.16 H new ATOM 0 HG2 ARG A 63 3.338 2.984 -19.533 1.00 1.70 H new ATOM 0 HG3 ARG A 63 2.777 1.472 -20.220 1.00 1.70 H new ATOM 0 HD2 ARG A 63 1.962 4.289 -20.974 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.680 3.059 -21.995 1.00 2.14 H new ATOM 0 HE ARG A 63 -0.121 2.917 -20.923 1.00 2.71 H new ATOM 0 HH11 ARG A 63 2.311 2.282 -23.401 1.00 3.92 H new ATOM 0 HH12 ARG A 63 1.152 1.541 -24.509 1.00 3.92 H new ATOM 0 HH21 ARG A 63 -1.596 1.959 -22.342 1.00 4.52 H new ATOM 0 HH22 ARG A 63 -1.052 1.359 -23.912 1.00 4.52 H new ATOM 1009 N ALA A 64 2.546 3.185 -16.150 1.00 0.90 N ATOM 1010 CA ALA A 64 3.541 3.879 -15.345 1.00 0.89 C ATOM 1011 C ALA A 64 4.176 2.933 -14.335 1.00 0.75 C ATOM 1012 O ALA A 64 5.331 3.106 -13.947 1.00 0.73 O ATOM 1013 CB ALA A 64 2.910 5.067 -14.637 1.00 0.94 C ATOM 0 H ALA A 64 1.601 3.561 -16.070 1.00 0.90 H new ATOM 0 HA ALA A 64 4.325 4.243 -16.008 1.00 0.89 H new ATOM 0 HB1 ALA A 64 3.665 5.577 -14.039 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.505 5.758 -15.376 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.107 4.719 -13.988 1.00 0.94 H new ATOM 1019 N PHE A 65 3.410 1.932 -13.916 1.00 0.69 N ATOM 1020 CA PHE A 65 3.890 0.951 -12.952 1.00 0.61 C ATOM 1021 C PHE A 65 4.869 -0.022 -13.606 1.00 0.59 C ATOM 1022 O PHE A 65 5.939 -0.294 -13.066 1.00 0.59 O ATOM 1023 CB PHE A 65 2.710 0.185 -12.348 1.00 0.62 C ATOM 1024 CG PHE A 65 3.116 -0.870 -11.360 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.522 -0.523 -10.081 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.092 -2.210 -11.711 1.00 0.64 C ATOM 1027 CE1 PHE A 65 3.897 -1.494 -9.172 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.466 -3.185 -10.806 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.869 -2.826 -9.535 1.00 0.66 C ATOM 0 H PHE A 65 2.452 1.779 -14.230 1.00 0.69 H new ATOM 0 HA PHE A 65 4.415 1.481 -12.157 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.043 0.893 -11.856 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.142 -0.283 -13.152 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.546 0.517 -9.792 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.777 -2.496 -12.704 1.00 0.64 H new ATOM 0 HE1 PHE A 65 4.212 -1.211 -8.178 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.443 -4.226 -11.092 1.00 0.68 H new ATOM 0 HZ PHE A 65 4.162 -3.586 -8.826 1.00 0.66 H new ATOM 1039 N SER A 66 4.496 -0.538 -14.773 1.00 0.64 N ATOM 1040 CA SER A 66 5.340 -1.483 -15.498 1.00 0.68 C ATOM 1041 C SER A 66 6.636 -0.823 -15.958 1.00 0.66 C ATOM 1042 O SER A 66 7.666 -1.484 -16.096 1.00 0.68 O ATOM 1043 CB SER A 66 4.587 -2.045 -16.706 1.00 0.83 C ATOM 1044 OG SER A 66 3.378 -2.667 -16.310 1.00 1.20 O ATOM 0 H SER A 66 3.615 -0.318 -15.237 1.00 0.64 H new ATOM 0 HA SER A 66 5.592 -2.298 -14.819 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.372 -1.241 -17.410 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.217 -2.766 -17.227 1.00 0.83 H new ATOM 0 HG SER A 66 2.724 -1.981 -16.059 1.00 1.20 H new ATOM 1050 N ASP A 67 6.578 0.484 -16.192 1.00 0.68 N ATOM 1051 CA ASP A 67 7.744 1.234 -16.646 1.00 0.73 C ATOM 1052 C ASP A 67 8.651 1.615 -15.478 1.00 0.65 C ATOM 1053 O ASP A 67 9.875 1.523 -15.577 1.00 0.66 O ATOM 1054 CB ASP A 67 7.299 2.492 -17.392 1.00 0.89 C ATOM 1055 CG ASP A 67 8.456 3.218 -18.047 1.00 1.36 C ATOM 1056 OD1 ASP A 67 8.850 2.821 -19.164 1.00 1.41 O ATOM 1057 OD2 ASP A 67 8.969 4.183 -17.444 1.00 2.06 O ATOM 0 H ASP A 67 5.735 1.046 -16.075 1.00 0.68 H new ATOM 0 HA ASP A 67 8.313 0.594 -17.320 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.568 2.220 -18.153 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.799 3.165 -16.696 1.00 0.89 H new ATOM 1062 N LEU A 68 8.045 2.042 -14.375 1.00 0.63 N ATOM 1063 CA LEU A 68 8.803 2.442 -13.193 1.00 0.66 C ATOM 1064 C LEU A 68 9.470 1.240 -12.531 1.00 0.57 C ATOM 1065 O LEU A 68 10.560 1.358 -11.970 1.00 0.63 O ATOM 1066 CB LEU A 68 7.893 3.161 -12.195 1.00 0.75 C ATOM 1067 CG LEU A 68 7.774 4.672 -12.411 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.519 5.212 -11.744 1.00 1.64 C ATOM 1069 CD2 LEU A 68 9.007 5.379 -11.870 1.00 1.07 C ATOM 0 H LEU A 68 7.033 2.120 -14.274 1.00 0.63 H new ATOM 0 HA LEU A 68 9.587 3.128 -13.513 1.00 0.66 H new ATOM 0 HB2 LEU A 68 6.897 2.720 -12.249 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.267 2.980 -11.187 1.00 0.75 H new ATOM 0 HG LEU A 68 7.702 4.863 -13.482 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.453 6.287 -11.909 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.642 4.725 -12.170 1.00 1.64 H new ATOM 0 HD13 LEU A 68 6.561 5.011 -10.673 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.910 6.453 -12.030 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.103 5.178 -10.803 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.893 5.014 -12.389 1.00 1.07 H new ATOM 1081 N THR A 69 8.814 0.086 -12.597 1.00 0.49 N ATOM 1082 CA THR A 69 9.360 -1.131 -12.009 1.00 0.49 C ATOM 1083 C THR A 69 10.627 -1.558 -12.737 1.00 0.46 C ATOM 1084 O THR A 69 11.480 -2.244 -12.173 1.00 0.51 O ATOM 1085 CB THR A 69 8.344 -2.287 -12.040 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.736 -2.373 -13.334 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.272 -2.096 -10.978 1.00 0.63 C ATOM 0 H THR A 69 7.908 -0.032 -13.050 1.00 0.49 H new ATOM 0 HA THR A 69 9.593 -0.904 -10.969 1.00 0.49 H new ATOM 0 HB THR A 69 8.877 -3.214 -11.830 1.00 0.51 H new ATOM 0 HG1 THR A 69 7.013 -1.714 -13.400 1.00 0.71 H new ATOM 0 HG21 THR A 69 6.566 -2.926 -11.020 1.00 0.63 H new ATOM 0 HG22 THR A 69 7.737 -2.065 -9.993 1.00 0.63 H new ATOM 0 HG23 THR A 69 6.743 -1.160 -11.159 1.00 0.63 H new ATOM 1095 N SER A 70 10.742 -1.147 -13.997 1.00 0.46 N ATOM 1096 CA SER A 70 11.909 -1.473 -14.805 1.00 0.49 C ATOM 1097 C SER A 70 13.121 -0.695 -14.313 1.00 0.48 C ATOM 1098 O SER A 70 14.252 -1.180 -14.366 1.00 0.53 O ATOM 1099 CB SER A 70 11.645 -1.153 -16.276 1.00 0.57 C ATOM 1100 OG SER A 70 10.556 -1.909 -16.776 1.00 1.31 O ATOM 0 H SER A 70 10.039 -0.587 -14.479 1.00 0.46 H new ATOM 0 HA SER A 70 12.110 -2.540 -14.710 1.00 0.49 H new ATOM 0 HB2 SER A 70 11.435 -0.089 -16.388 1.00 0.57 H new ATOM 0 HB3 SER A 70 12.539 -1.365 -16.863 1.00 0.57 H new ATOM 0 HG SER A 70 9.719 -1.568 -16.397 1.00 1.31 H new ATOM 1106 N GLN A 71 12.871 0.519 -13.836 1.00 0.49 N ATOM 1107 CA GLN A 71 13.930 1.375 -13.320 1.00 0.53 C ATOM 1108 C GLN A 71 14.327 0.930 -11.917 1.00 0.46 C ATOM 1109 O GLN A 71 15.501 0.968 -11.549 1.00 0.53 O ATOM 1110 CB GLN A 71 13.468 2.833 -13.297 1.00 0.63 C ATOM 1111 CG GLN A 71 14.549 3.807 -12.859 1.00 0.69 C ATOM 1112 CD GLN A 71 14.051 5.239 -12.782 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.802 6.182 -13.027 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.781 5.410 -12.431 1.00 0.82 N ATOM 0 H GLN A 71 11.940 0.933 -13.796 1.00 0.49 H new ATOM 0 HA GLN A 71 14.797 1.292 -13.975 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.122 3.111 -14.292 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.614 2.924 -12.625 1.00 0.63 H new ATOM 0 HG2 GLN A 71 14.930 3.506 -11.883 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.384 3.754 -13.557 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.192 4.600 -12.236 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.395 6.351 -12.356 1.00 0.82 H new ATOM 1123 N LEU A 72 13.332 0.507 -11.141 1.00 0.39 N ATOM 1124 CA LEU A 72 13.563 0.044 -9.778 1.00 0.33 C ATOM 1125 C LEU A 72 13.915 -1.440 -9.781 1.00 0.34 C ATOM 1126 O LEU A 72 13.932 -2.095 -8.739 1.00 0.37 O ATOM 1127 CB LEU A 72 12.321 0.302 -8.919 1.00 0.37 C ATOM 1128 CG LEU A 72 12.521 0.158 -7.408 1.00 0.46 C ATOM 1129 CD1 LEU A 72 13.651 1.054 -6.923 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.233 0.489 -6.673 1.00 0.92 C ATOM 0 H LEU A 72 12.356 0.476 -11.435 1.00 0.39 H new ATOM 0 HA LEU A 72 14.400 0.596 -9.351 1.00 0.33 H new ATOM 0 HB2 LEU A 72 11.961 1.310 -9.125 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.536 -0.387 -9.231 1.00 0.37 H new ATOM 0 HG LEU A 72 12.792 -0.876 -7.196 1.00 0.46 H new ATOM 0 HD11 LEU A 72 13.774 0.934 -5.847 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.577 0.777 -7.427 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.413 2.094 -7.147 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.389 0.383 -5.599 1.00 0.92 H new ATOM 0 HD22 LEU A 72 10.939 1.514 -6.897 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.445 -0.192 -6.994 1.00 0.92 H new ATOM 1142 N HIS A 73 14.198 -1.953 -10.974 1.00 0.41 N ATOM 1143 CA HIS A 73 14.561 -3.353 -11.162 1.00 0.46 C ATOM 1144 C HIS A 73 15.651 -3.773 -10.177 1.00 0.41 C ATOM 1145 O HIS A 73 16.787 -3.303 -10.257 1.00 0.45 O ATOM 1146 CB HIS A 73 15.036 -3.559 -12.601 1.00 0.60 C ATOM 1147 CG HIS A 73 15.429 -4.964 -12.923 1.00 1.34 C ATOM 1148 ND1 HIS A 73 14.516 -5.950 -13.229 1.00 2.07 N ATOM 1149 CD2 HIS A 73 16.647 -5.544 -13.000 1.00 2.33 C ATOM 1150 CE1 HIS A 73 15.158 -7.076 -13.481 1.00 2.86 C ATOM 1151 NE2 HIS A 73 16.451 -6.855 -13.349 1.00 3.01 N ATOM 0 H HIS A 73 14.182 -1.410 -11.837 1.00 0.41 H new ATOM 0 HA HIS A 73 13.686 -3.974 -10.973 1.00 0.46 H new ATOM 0 HB2 HIS A 73 14.242 -3.251 -13.281 1.00 0.60 H new ATOM 0 HB3 HIS A 73 15.887 -2.904 -12.788 1.00 0.60 H new ATOM 0 HD2 HIS A 73 17.598 -5.064 -12.820 1.00 2.33 H new ATOM 0 HE1 HIS A 73 14.702 -8.017 -13.749 1.00 2.86 H new ATOM 0 HE2 HIS A 73 17.187 -7.548 -13.485 1.00 3.01 H new ATOM 1160 N ILE A 74 15.297 -4.661 -9.251 1.00 0.37 N ATOM 1161 CA ILE A 74 16.242 -5.135 -8.246 1.00 0.36 C ATOM 1162 C ILE A 74 17.244 -6.120 -8.844 1.00 0.45 C ATOM 1163 O ILE A 74 16.867 -7.108 -9.475 1.00 0.61 O ATOM 1164 CB ILE A 74 15.514 -5.794 -7.052 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.523 -6.232 -5.984 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.675 -6.977 -7.518 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.881 -6.633 -4.673 1.00 0.34 C ATOM 0 H ILE A 74 14.364 -5.066 -9.177 1.00 0.37 H new ATOM 0 HA ILE A 74 16.784 -4.261 -7.885 1.00 0.36 H new ATOM 0 HB ILE A 74 14.844 -5.057 -6.610 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.103 -7.072 -6.367 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.224 -5.417 -5.802 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.172 -7.426 -6.662 1.00 0.35 H new ATOM 0 HG22 ILE A 74 13.931 -6.635 -8.238 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.321 -7.718 -7.989 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.655 -6.931 -3.965 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.324 -5.789 -4.267 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.202 -7.469 -4.841 1.00 0.34 H new ATOM 1179 N THR A 75 18.525 -5.829 -8.647 1.00 0.61 N ATOM 1180 CA THR A 75 19.595 -6.679 -9.154 1.00 0.73 C ATOM 1181 C THR A 75 20.471 -7.185 -8.010 1.00 0.58 C ATOM 1182 O THR A 75 20.523 -6.567 -6.947 1.00 0.57 O ATOM 1183 CB THR A 75 20.476 -5.930 -10.172 1.00 1.02 C ATOM 1184 OG1 THR A 75 20.860 -4.653 -9.648 1.00 1.38 O ATOM 1185 CG2 THR A 75 19.740 -5.748 -11.489 1.00 1.56 C ATOM 0 H THR A 75 18.848 -5.007 -8.137 1.00 0.61 H new ATOM 0 HA THR A 75 19.123 -7.525 -9.654 1.00 0.73 H new ATOM 0 HB THR A 75 21.371 -6.526 -10.353 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.628 -4.607 -8.697 1.00 1.38 H new ATOM 0 HG21 THR A 75 20.380 -5.217 -12.193 1.00 1.56 H new ATOM 0 HG22 THR A 75 19.481 -6.724 -11.899 1.00 1.56 H new ATOM 0 HG23 THR A 75 18.830 -5.172 -11.321 1.00 1.56 H new ATOM 1193 N PRO A 76 21.171 -8.320 -8.207 1.00 0.66 N ATOM 1194 CA PRO A 76 22.040 -8.892 -7.174 1.00 0.73 C ATOM 1195 C PRO A 76 23.118 -7.912 -6.728 1.00 0.72 C ATOM 1196 O PRO A 76 24.097 -7.682 -7.438 1.00 0.81 O ATOM 1197 CB PRO A 76 22.670 -10.111 -7.856 1.00 0.93 C ATOM 1198 CG PRO A 76 21.753 -10.439 -8.984 1.00 1.06 C ATOM 1199 CD PRO A 76 21.176 -9.130 -9.439 1.00 0.90 C ATOM 0 HA PRO A 76 21.485 -9.143 -6.270 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.674 -9.887 -8.216 1.00 0.93 H new ATOM 0 HB3 PRO A 76 22.759 -10.948 -7.164 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.291 -10.931 -9.794 1.00 1.06 H new ATOM 0 HG3 PRO A 76 20.967 -11.122 -8.662 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.783 -8.672 -10.220 1.00 0.90 H new ATOM 0 HD3 PRO A 76 20.172 -9.252 -9.845 1.00 0.90 H new ATOM 1207 N GLY A 77 22.923 -7.332 -5.549 1.00 0.86 N ATOM 1208 CA GLY A 77 23.882 -6.380 -5.024 1.00 1.10 C ATOM 1209 C GLY A 77 23.332 -4.968 -4.990 1.00 1.00 C ATOM 1210 O GLY A 77 24.087 -4.004 -4.864 1.00 1.32 O ATOM 0 H GLY A 77 22.117 -7.505 -4.948 1.00 0.86 H new ATOM 0 HA2 GLY A 77 24.173 -6.679 -4.017 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.784 -6.401 -5.636 1.00 1.10 H new ATOM 1214 N THR A 78 22.012 -4.847 -5.107 1.00 0.85 N ATOM 1215 CA THR A 78 21.355 -3.545 -5.088 1.00 0.82 C ATOM 1216 C THR A 78 21.221 -3.023 -3.661 1.00 0.85 C ATOM 1217 O THR A 78 20.325 -3.429 -2.923 1.00 1.52 O ATOM 1218 CB THR A 78 19.959 -3.616 -5.742 1.00 0.90 C ATOM 1219 OG1 THR A 78 20.090 -3.923 -7.135 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.202 -2.304 -5.580 1.00 1.15 C ATOM 0 H THR A 78 21.376 -5.637 -5.216 1.00 0.85 H new ATOM 0 HA THR A 78 21.978 -2.859 -5.662 1.00 0.82 H new ATOM 0 HB THR A 78 19.393 -4.401 -5.241 1.00 0.90 H new ATOM 0 HG1 THR A 78 19.563 -3.286 -7.661 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.223 -2.388 -6.052 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.076 -2.085 -4.520 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.764 -1.499 -6.052 1.00 1.15 H new ATOM 1228 N ALA A 79 22.124 -2.127 -3.279 1.00 0.68 N ATOM 1229 CA ALA A 79 22.114 -1.549 -1.940 1.00 0.73 C ATOM 1230 C ALA A 79 20.950 -0.580 -1.763 1.00 0.62 C ATOM 1231 O ALA A 79 20.260 -0.239 -2.725 1.00 0.56 O ATOM 1232 CB ALA A 79 23.434 -0.845 -1.665 1.00 0.85 C ATOM 0 H ALA A 79 22.874 -1.784 -3.879 1.00 0.68 H new ATOM 0 HA ALA A 79 21.985 -2.360 -1.223 1.00 0.73 H new ATOM 0 HB1 ALA A 79 23.416 -0.417 -0.663 1.00 0.85 H new ATOM 0 HB2 ALA A 79 24.251 -1.562 -1.739 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.582 -0.050 -2.396 1.00 0.85 H new ATOM 1238 N TYR A 80 20.739 -0.139 -0.526 1.00 0.63 N ATOM 1239 CA TYR A 80 19.661 0.794 -0.217 1.00 0.58 C ATOM 1240 C TYR A 80 19.864 2.121 -0.943 1.00 0.50 C ATOM 1241 O TYR A 80 18.903 2.836 -1.229 1.00 0.46 O ATOM 1242 CB TYR A 80 19.580 1.033 1.294 1.00 0.67 C ATOM 1243 CG TYR A 80 18.612 2.127 1.688 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.239 1.933 1.602 1.00 0.89 C ATOM 1245 CD2 TYR A 80 19.073 3.357 2.141 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.353 2.933 1.957 1.00 1.24 C ATOM 1247 CE2 TYR A 80 18.194 4.361 2.498 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.836 4.144 2.404 1.00 1.58 C ATOM 1249 OH TYR A 80 15.957 5.143 2.757 1.00 2.03 O ATOM 0 H TYR A 80 21.301 -0.414 0.279 1.00 0.63 H new ATOM 0 HA TYR A 80 18.725 0.353 -0.559 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.284 0.105 1.784 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.572 1.288 1.666 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.858 0.985 1.252 1.00 0.89 H new ATOM 0 HD2 TYR A 80 20.136 3.531 2.215 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.288 2.766 1.884 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.569 5.311 2.849 1.00 1.55 H new ATOM 0 HH TYR A 80 16.269 5.997 2.393 1.00 2.03 H new ATOM 1259 N GLN A 81 21.118 2.443 -1.243 1.00 0.56 N ATOM 1260 CA GLN A 81 21.438 3.689 -1.928 1.00 0.59 C ATOM 1261 C GLN A 81 20.856 3.706 -3.338 1.00 0.54 C ATOM 1262 O GLN A 81 20.204 4.672 -3.734 1.00 0.63 O ATOM 1263 CB GLN A 81 22.951 3.906 -1.978 1.00 0.72 C ATOM 1264 CG GLN A 81 23.350 5.178 -2.711 1.00 0.84 C ATOM 1265 CD GLN A 81 24.687 5.727 -2.257 1.00 1.40 C ATOM 1266 OE1 GLN A 81 24.907 6.938 -2.267 1.00 2.01 O ATOM 1267 NE2 GLN A 81 25.591 4.840 -1.859 1.00 2.18 N ATOM 0 H GLN A 81 21.926 1.861 -1.023 1.00 0.56 H new ATOM 0 HA GLN A 81 20.987 4.504 -1.362 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.340 3.943 -0.960 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.418 3.051 -2.467 1.00 0.72 H new ATOM 0 HG2 GLN A 81 23.391 4.977 -3.781 1.00 0.84 H new ATOM 0 HG3 GLN A 81 22.581 5.936 -2.558 1.00 0.84 H new ATOM 0 HE21 GLN A 81 25.367 3.845 -1.867 1.00 2.18 H new ATOM 0 HE22 GLN A 81 26.510 5.154 -1.546 1.00 2.18 H new ATOM 1276 N SER A 82 21.096 2.640 -4.096 1.00 0.48 N ATOM 1277 CA SER A 82 20.579 2.551 -5.456 1.00 0.47 C ATOM 1278 C SER A 82 19.058 2.453 -5.441 1.00 0.40 C ATOM 1279 O SER A 82 18.388 2.860 -6.391 1.00 0.42 O ATOM 1280 CB SER A 82 21.185 1.352 -6.188 1.00 0.55 C ATOM 1281 OG SER A 82 21.143 0.186 -5.386 1.00 1.17 O ATOM 0 H SER A 82 21.641 1.832 -3.794 1.00 0.48 H new ATOM 0 HA SER A 82 20.864 3.457 -5.991 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.642 1.177 -7.117 1.00 0.55 H new ATOM 0 HB3 SER A 82 22.217 1.573 -6.459 1.00 0.55 H new ATOM 0 HG SER A 82 20.632 0.369 -4.570 1.00 1.17 H new ATOM 1287 N PHE A 83 18.519 1.913 -4.352 1.00 0.36 N ATOM 1288 CA PHE A 83 17.077 1.774 -4.198 1.00 0.33 C ATOM 1289 C PHE A 83 16.452 3.118 -3.840 1.00 0.31 C ATOM 1290 O PHE A 83 15.305 3.396 -4.190 1.00 0.32 O ATOM 1291 CB PHE A 83 16.758 0.738 -3.115 1.00 0.35 C ATOM 1292 CG PHE A 83 15.289 0.586 -2.831 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.492 -0.200 -3.645 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.708 1.229 -1.749 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.142 -0.344 -3.387 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.358 1.089 -1.486 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.575 0.302 -2.306 1.00 0.38 C ATOM 0 H PHE A 83 19.062 1.564 -3.562 1.00 0.36 H new ATOM 0 HA PHE A 83 16.656 1.434 -5.144 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.161 -0.228 -3.420 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.269 1.020 -2.194 1.00 0.35 H new ATOM 0 HD1 PHE A 83 14.930 -0.707 -4.492 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.317 1.846 -1.105 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.531 -0.961 -4.030 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.917 1.595 -0.640 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.520 0.191 -2.103 1.00 0.38 H new ATOM 1307 N GLU A 84 17.223 3.951 -3.146 1.00 0.34 N ATOM 1308 CA GLU A 84 16.752 5.267 -2.733 1.00 0.39 C ATOM 1309 C GLU A 84 16.777 6.252 -3.896 1.00 0.37 C ATOM 1310 O GLU A 84 15.855 7.046 -4.060 1.00 0.40 O ATOM 1311 CB GLU A 84 17.605 5.803 -1.583 1.00 0.51 C ATOM 1312 CG GLU A 84 17.158 7.167 -1.083 1.00 0.64 C ATOM 1313 CD GLU A 84 18.003 7.675 0.067 1.00 0.90 C ATOM 1314 OE1 GLU A 84 17.730 7.286 1.221 1.00 0.95 O ATOM 1315 OE2 GLU A 84 18.937 8.464 -0.187 1.00 1.58 O ATOM 0 H GLU A 84 18.178 3.736 -2.858 1.00 0.34 H new ATOM 0 HA GLU A 84 15.721 5.159 -2.395 1.00 0.39 H new ATOM 0 HB2 GLU A 84 17.574 5.093 -0.756 1.00 0.51 H new ATOM 0 HB3 GLU A 84 18.643 5.866 -1.910 1.00 0.51 H new ATOM 0 HG2 GLU A 84 17.202 7.882 -1.904 1.00 0.64 H new ATOM 0 HG3 GLU A 84 16.117 7.110 -0.766 1.00 0.64 H new ATOM 1322 N GLN A 85 17.833 6.193 -4.701 1.00 0.37 N ATOM 1323 CA GLN A 85 17.976 7.089 -5.846 1.00 0.42 C ATOM 1324 C GLN A 85 16.753 7.022 -6.755 1.00 0.38 C ATOM 1325 O GLN A 85 16.460 7.968 -7.487 1.00 0.46 O ATOM 1326 CB GLN A 85 19.236 6.741 -6.638 1.00 0.50 C ATOM 1327 CG GLN A 85 20.523 7.072 -5.901 1.00 0.61 C ATOM 1328 CD GLN A 85 21.759 6.642 -6.664 1.00 1.44 C ATOM 1329 OE1 GLN A 85 22.297 7.398 -7.473 1.00 1.90 O ATOM 1330 NE2 GLN A 85 22.217 5.424 -6.407 1.00 2.16 N ATOM 0 H GLN A 85 18.603 5.535 -4.583 1.00 0.37 H new ATOM 0 HA GLN A 85 18.063 8.107 -5.466 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.225 5.677 -6.875 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.220 7.279 -7.586 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.568 8.146 -5.720 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.515 6.585 -4.926 1.00 0.61 H new ATOM 0 HE21 GLN A 85 21.738 4.832 -5.728 1.00 2.16 H new ATOM 0 HE22 GLN A 85 23.048 5.079 -6.888 1.00 2.16 H new ATOM 1339 N VAL A 86 16.041 5.902 -6.700 1.00 0.31 N ATOM 1340 CA VAL A 86 14.850 5.714 -7.517 1.00 0.31 C ATOM 1341 C VAL A 86 13.596 6.176 -6.781 1.00 0.29 C ATOM 1342 O VAL A 86 12.811 6.963 -7.310 1.00 0.32 O ATOM 1343 CB VAL A 86 14.677 4.239 -7.925 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.478 4.075 -8.847 1.00 0.38 C ATOM 1345 CG2 VAL A 86 15.942 3.715 -8.586 1.00 0.36 C ATOM 0 H VAL A 86 16.269 5.111 -6.098 1.00 0.31 H new ATOM 0 HA VAL A 86 14.984 6.319 -8.413 1.00 0.31 H new ATOM 0 HB VAL A 86 14.496 3.652 -7.024 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.373 3.026 -9.124 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.576 4.407 -8.333 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.625 4.674 -9.745 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.800 2.671 -8.867 1.00 0.36 H new ATOM 0 HG22 VAL A 86 16.158 4.305 -9.477 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.776 3.793 -7.888 1.00 0.36 H new ATOM 1355 N VAL A 87 13.412 5.684 -5.558 1.00 0.28 N ATOM 1356 CA VAL A 87 12.243 6.043 -4.761 1.00 0.32 C ATOM 1357 C VAL A 87 12.328 7.478 -4.248 1.00 0.35 C ATOM 1358 O VAL A 87 11.387 7.980 -3.634 1.00 0.37 O ATOM 1359 CB VAL A 87 12.052 5.087 -3.567 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.013 3.642 -4.039 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.148 5.289 -2.532 1.00 0.41 C ATOM 0 H VAL A 87 14.055 5.038 -5.099 1.00 0.28 H new ATOM 0 HA VAL A 87 11.382 5.956 -5.424 1.00 0.32 H new ATOM 0 HB VAL A 87 11.097 5.317 -3.095 1.00 0.38 H new ATOM 0 HG11 VAL A 87 11.878 2.983 -3.182 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.184 3.508 -4.734 1.00 0.38 H new ATOM 0 HG13 VAL A 87 12.950 3.398 -4.540 1.00 0.38 H new ATOM 0 HG21 VAL A 87 12.992 4.604 -1.699 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.119 5.093 -2.987 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.119 6.316 -2.167 1.00 0.41 H new ATOM 1371 N ASN A 88 13.457 8.134 -4.501 1.00 0.38 N ATOM 1372 CA ASN A 88 13.644 9.515 -4.070 1.00 0.47 C ATOM 1373 C ASN A 88 12.902 10.451 -5.009 1.00 0.44 C ATOM 1374 O ASN A 88 12.419 11.507 -4.602 1.00 0.45 O ATOM 1375 CB ASN A 88 15.129 9.879 -4.035 1.00 0.61 C ATOM 1376 CG ASN A 88 15.373 11.273 -3.487 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.614 11.767 -2.653 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.437 11.914 -3.955 1.00 0.97 N ATOM 0 H ASN A 88 14.252 7.734 -4.999 1.00 0.38 H new ATOM 0 HA ASN A 88 13.243 9.620 -3.062 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.663 9.153 -3.423 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.540 9.811 -5.042 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.653 12.854 -3.624 1.00 0.97 H new ATOM 0 HD22 ASN A 88 17.039 11.466 -4.646 1.00 0.97 H new ATOM 1385 N GLU A 89 12.816 10.047 -6.272 1.00 0.42 N ATOM 1386 CA GLU A 89 12.123 10.835 -7.279 1.00 0.45 C ATOM 1387 C GLU A 89 10.640 10.920 -6.948 1.00 0.38 C ATOM 1388 O GLU A 89 9.948 11.841 -7.382 1.00 0.43 O ATOM 1389 CB GLU A 89 12.332 10.227 -8.665 1.00 0.54 C ATOM 1390 CG GLU A 89 13.770 10.322 -9.147 1.00 0.65 C ATOM 1391 CD GLU A 89 13.942 9.847 -10.575 1.00 1.23 C ATOM 1392 OE1 GLU A 89 13.771 10.669 -11.499 1.00 1.28 O ATOM 1393 OE2 GLU A 89 14.249 8.652 -10.769 1.00 2.04 O ATOM 0 H GLU A 89 13.219 9.177 -6.621 1.00 0.42 H new ATOM 0 HA GLU A 89 12.535 11.844 -7.282 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.030 9.180 -8.645 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.682 10.733 -9.379 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.107 11.356 -9.069 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.408 9.729 -8.492 1.00 0.65 H new ATOM 1400 N LEU A 90 10.158 9.950 -6.175 1.00 0.31 N ATOM 1401 CA LEU A 90 8.763 9.930 -5.763 1.00 0.27 C ATOM 1402 C LEU A 90 8.497 11.087 -4.811 1.00 0.25 C ATOM 1403 O LEU A 90 7.393 11.630 -4.764 1.00 0.26 O ATOM 1404 CB LEU A 90 8.421 8.606 -5.077 1.00 0.26 C ATOM 1405 CG LEU A 90 8.666 7.349 -5.913 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.500 6.104 -5.056 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.720 7.304 -7.105 1.00 0.37 C ATOM 0 H LEU A 90 10.714 9.170 -5.824 1.00 0.31 H new ATOM 0 HA LEU A 90 8.135 10.032 -6.648 1.00 0.27 H new ATOM 0 HB2 LEU A 90 9.005 8.531 -4.160 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.371 8.628 -4.786 1.00 0.26 H new ATOM 0 HG LEU A 90 9.689 7.379 -6.289 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.677 5.217 -5.664 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.216 6.130 -4.235 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.487 6.071 -4.654 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.911 6.402 -7.687 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.689 7.297 -6.751 1.00 0.37 H new ATOM 0 HD23 LEU A 90 7.882 8.181 -7.732 1.00 0.37 H new ATOM 1419 N PHE A 91 9.527 11.457 -4.054 1.00 0.27 N ATOM 1420 CA PHE A 91 9.423 12.553 -3.102 1.00 0.29 C ATOM 1421 C PHE A 91 9.766 13.874 -3.779 1.00 0.33 C ATOM 1422 O PHE A 91 9.298 14.936 -3.369 1.00 0.33 O ATOM 1423 CB PHE A 91 10.356 12.316 -1.911 1.00 0.35 C ATOM 1424 CG PHE A 91 10.024 13.156 -0.709 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.521 14.445 -0.586 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.215 12.656 0.299 1.00 0.37 C ATOM 1427 CE1 PHE A 91 10.217 15.217 0.519 1.00 0.53 C ATOM 1428 CE2 PHE A 91 8.907 13.424 1.406 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.408 14.706 1.516 1.00 0.50 C ATOM 0 H PHE A 91 10.444 11.011 -4.084 1.00 0.27 H new ATOM 0 HA PHE A 91 8.396 12.599 -2.739 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.314 11.263 -1.631 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.381 12.524 -2.217 1.00 0.35 H new ATOM 0 HD1 PHE A 91 11.153 14.850 -1.363 1.00 0.46 H new ATOM 0 HD2 PHE A 91 8.820 11.654 0.219 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.611 16.219 0.603 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.275 13.022 2.184 1.00 0.43 H new ATOM 0 HZ PHE A 91 9.168 15.308 2.380 1.00 0.50 H new ATOM 1439 N ARG A 92 10.582 13.792 -4.823 1.00 0.39 N ATOM 1440 CA ARG A 92 11.001 14.971 -5.569 1.00 0.49 C ATOM 1441 C ARG A 92 9.941 15.374 -6.593 1.00 0.51 C ATOM 1442 O ARG A 92 9.985 16.472 -7.147 1.00 0.62 O ATOM 1443 CB ARG A 92 12.329 14.694 -6.279 1.00 0.56 C ATOM 1444 CG ARG A 92 12.971 15.931 -6.884 1.00 1.24 C ATOM 1445 CD ARG A 92 13.495 16.866 -5.808 1.00 1.54 C ATOM 1446 NE ARG A 92 14.553 16.245 -5.018 1.00 2.30 N ATOM 1447 CZ ARG A 92 14.892 16.640 -3.796 1.00 2.99 C ATOM 1448 NH1 ARG A 92 14.257 17.651 -3.220 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.869 16.023 -3.146 1.00 3.95 N ATOM 0 H ARG A 92 10.968 12.915 -5.173 1.00 0.39 H new ATOM 0 HA ARG A 92 11.130 15.793 -4.865 1.00 0.49 H new ATOM 0 HB2 ARG A 92 13.024 14.246 -5.568 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.162 13.960 -7.067 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.789 15.634 -7.540 1.00 1.24 H new ATOM 0 HG3 ARG A 92 12.242 16.456 -7.501 1.00 1.24 H new ATOM 0 HD2 ARG A 92 13.874 17.777 -6.271 1.00 1.54 H new ATOM 0 HD3 ARG A 92 12.676 17.160 -5.151 1.00 1.54 H new ATOM 0 HE ARG A 92 15.062 15.462 -5.428 1.00 2.30 H new ATOM 0 HH11 ARG A 92 13.504 18.129 -3.715 1.00 3.13 H new ATOM 0 HH12 ARG A 92 14.521 17.951 -2.281 1.00 3.13 H new ATOM 0 HH21 ARG A 92 16.361 15.244 -3.584 1.00 3.95 H new ATOM 0 HH22 ARG A 92 16.129 16.327 -2.208 1.00 3.95 H new ATOM 1463 N ASP A 93 8.987 14.480 -6.832 1.00 0.46 N ATOM 1464 CA ASP A 93 7.924 14.734 -7.799 1.00 0.53 C ATOM 1465 C ASP A 93 6.719 15.409 -7.142 1.00 0.50 C ATOM 1466 O ASP A 93 5.685 15.608 -7.779 1.00 0.60 O ATOM 1467 CB ASP A 93 7.499 13.420 -8.457 1.00 0.62 C ATOM 1468 CG ASP A 93 6.613 13.633 -9.668 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.156 13.910 -10.758 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.378 13.524 -9.527 1.00 1.11 O ATOM 0 H ASP A 93 8.928 13.573 -6.369 1.00 0.46 H new ATOM 0 HA ASP A 93 8.311 15.413 -8.559 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.388 12.864 -8.755 1.00 0.62 H new ATOM 0 HB3 ASP A 93 6.969 12.808 -7.727 1.00 0.62 H new ATOM 1475 N GLY A 94 6.859 15.763 -5.867 1.00 0.45 N ATOM 1476 CA GLY A 94 5.771 16.411 -5.153 1.00 0.47 C ATOM 1477 C GLY A 94 5.189 15.531 -4.067 1.00 0.39 C ATOM 1478 O GLY A 94 4.338 15.972 -3.296 1.00 0.42 O ATOM 0 H GLY A 94 7.704 15.613 -5.316 1.00 0.45 H new ATOM 0 HA2 GLY A 94 6.132 17.339 -4.710 1.00 0.47 H new ATOM 0 HA3 GLY A 94 4.985 16.680 -5.859 1.00 0.47 H new ATOM 1482 N VAL A 95 5.661 14.284 -4.018 1.00 0.32 N ATOM 1483 CA VAL A 95 5.220 13.294 -3.030 1.00 0.26 C ATOM 1484 C VAL A 95 3.746 13.444 -2.647 1.00 0.25 C ATOM 1485 O VAL A 95 3.401 14.163 -1.711 1.00 0.29 O ATOM 1486 CB VAL A 95 6.094 13.331 -1.752 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.147 14.729 -1.149 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.596 12.317 -0.730 1.00 0.33 C ATOM 0 H VAL A 95 6.364 13.929 -4.666 1.00 0.32 H new ATOM 0 HA VAL A 95 5.339 12.327 -3.518 1.00 0.26 H new ATOM 0 HB VAL A 95 7.110 13.060 -2.039 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.769 14.716 -0.254 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.571 15.423 -1.875 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.139 15.050 -0.886 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.224 12.359 0.160 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.566 12.549 -0.459 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.641 11.316 -1.159 1.00 0.33 H new ATOM 1498 N ASN A 96 2.877 12.767 -3.387 1.00 0.24 N ATOM 1499 CA ASN A 96 1.449 12.797 -3.101 1.00 0.29 C ATOM 1500 C ASN A 96 1.028 11.477 -2.474 1.00 0.23 C ATOM 1501 O ASN A 96 1.830 10.547 -2.384 1.00 0.21 O ATOM 1502 CB ASN A 96 0.640 13.046 -4.376 1.00 0.41 C ATOM 1503 CG ASN A 96 0.828 14.447 -4.920 1.00 1.33 C ATOM 1504 OD1 ASN A 96 1.702 14.690 -5.749 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.004 15.377 -4.453 1.00 2.00 N ATOM 0 H ASN A 96 3.136 12.191 -4.188 1.00 0.24 H new ATOM 0 HA ASN A 96 1.252 13.614 -2.407 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.935 12.322 -5.136 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.417 12.879 -4.170 1.00 0.41 H new ATOM 0 HD21 ASN A 96 0.082 16.339 -4.782 1.00 2.00 H new ATOM 0 HD22 ASN A 96 -0.707 15.129 -3.765 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.222 11.394 -2.036 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.722 10.168 -1.434 1.00 0.24 C ATOM 1514 C TRP A 97 -0.593 9.015 -2.422 1.00 0.25 C ATOM 1515 O TRP A 97 -0.497 7.853 -2.029 1.00 0.25 O ATOM 1516 CB TRP A 97 -2.174 10.335 -0.993 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.335 11.275 0.162 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -3.043 12.441 0.175 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.770 11.133 1.472 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.963 13.028 1.415 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -2.185 12.245 2.228 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.956 10.172 2.080 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.815 12.422 3.559 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.588 10.350 3.401 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -1.018 11.466 4.128 1.00 0.30 C ATOM 0 H TRP A 97 -0.901 12.154 -2.086 1.00 0.25 H new ATOM 0 HA TRP A 97 -0.125 9.944 -0.550 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.763 10.699 -1.835 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.578 9.360 -0.719 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.587 12.844 -0.666 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.410 13.904 1.686 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.621 9.306 1.528 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -2.145 13.283 4.122 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.042 9.615 3.880 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.715 11.575 5.159 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.585 9.353 -3.710 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.448 8.345 -4.741 1.00 0.29 C ATOM 1538 C GLY A 98 0.954 7.776 -4.774 1.00 0.26 C ATOM 1539 O GLY A 98 1.148 6.595 -5.063 1.00 0.27 O ATOM 0 H GLY A 98 -0.671 10.309 -4.055 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.164 7.542 -4.565 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.689 8.780 -5.711 1.00 0.29 H new ATOM 1543 N ARG A 99 1.934 8.626 -4.476 1.00 0.26 N ATOM 1544 CA ARG A 99 3.329 8.209 -4.449 1.00 0.25 C ATOM 1545 C ARG A 99 3.529 7.158 -3.369 1.00 0.21 C ATOM 1546 O ARG A 99 4.335 6.240 -3.520 1.00 0.20 O ATOM 1547 CB ARG A 99 4.241 9.411 -4.197 1.00 0.30 C ATOM 1548 CG ARG A 99 4.242 10.423 -5.333 1.00 0.70 C ATOM 1549 CD ARG A 99 4.810 9.827 -6.610 1.00 1.40 C ATOM 1550 NE ARG A 99 4.543 10.666 -7.774 1.00 1.74 N ATOM 1551 CZ ARG A 99 4.493 10.202 -9.018 1.00 2.46 C ATOM 1552 NH1 ARG A 99 4.695 8.914 -9.256 1.00 3.06 N ATOM 1553 NH2 ARG A 99 4.241 11.025 -10.025 1.00 2.98 N ATOM 0 H ARG A 99 1.785 9.609 -4.250 1.00 0.26 H new ATOM 0 HA ARG A 99 3.589 7.779 -5.416 1.00 0.25 H new ATOM 0 HB2 ARG A 99 3.928 9.908 -3.279 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.259 9.057 -4.036 1.00 0.30 H new ATOM 0 HG2 ARG A 99 3.225 10.770 -5.513 1.00 0.70 H new ATOM 0 HG3 ARG A 99 4.829 11.295 -5.045 1.00 0.70 H new ATOM 0 HD2 ARG A 99 5.886 9.693 -6.500 1.00 1.40 H new ATOM 0 HD3 ARG A 99 4.380 8.838 -6.770 1.00 1.40 H new ATOM 0 HE ARG A 99 4.386 11.663 -7.624 1.00 1.74 H new ATOM 0 HH11 ARG A 99 4.889 8.277 -8.483 1.00 3.06 H new ATOM 0 HH12 ARG A 99 4.656 8.560 -10.212 1.00 3.06 H new ATOM 0 HH21 ARG A 99 4.085 12.017 -9.846 1.00 2.98 H new ATOM 0 HH22 ARG A 99 4.203 10.667 -10.979 1.00 2.98 H new ATOM 1567 N ILE A 100 2.788 7.307 -2.273 1.00 0.22 N ATOM 1568 CA ILE A 100 2.855 6.358 -1.173 1.00 0.21 C ATOM 1569 C ILE A 100 2.420 4.990 -1.671 1.00 0.20 C ATOM 1570 O ILE A 100 3.021 3.969 -1.342 1.00 0.19 O ATOM 1571 CB ILE A 100 1.937 6.775 -0.004 1.00 0.24 C ATOM 1572 CG1 ILE A 100 2.044 8.282 0.270 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.274 5.974 1.247 1.00 0.24 C ATOM 1574 CD1 ILE A 100 3.411 8.731 0.740 1.00 0.30 C ATOM 0 H ILE A 100 2.135 8.077 -2.127 1.00 0.22 H new ATOM 0 HA ILE A 100 3.883 6.333 -0.811 1.00 0.21 H new ATOM 0 HB ILE A 100 0.907 6.559 -0.286 1.00 0.24 H new ATOM 0 HG12 ILE A 100 1.789 8.825 -0.640 1.00 0.26 H new ATOM 0 HG13 ILE A 100 1.305 8.557 1.023 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.618 6.280 2.062 1.00 0.24 H new ATOM 0 HG22 ILE A 100 2.134 4.912 1.047 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.311 6.157 1.528 1.00 0.24 H new ATOM 0 HD11 ILE A 100 3.402 9.808 0.911 1.00 0.30 H new ATOM 0 HD12 ILE A 100 3.663 8.219 1.668 1.00 0.30 H new ATOM 0 HD13 ILE A 100 4.154 8.491 -0.020 1.00 0.30 H new ATOM 1586 N VAL A 101 1.363 4.991 -2.477 1.00 0.21 N ATOM 1587 CA VAL A 101 0.828 3.767 -3.051 1.00 0.21 C ATOM 1588 C VAL A 101 1.854 3.116 -3.965 1.00 0.20 C ATOM 1589 O VAL A 101 2.187 1.944 -3.803 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.452 4.042 -3.861 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.115 2.737 -4.274 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.412 4.912 -3.067 1.00 0.26 C ATOM 0 H VAL A 101 0.858 5.835 -2.748 1.00 0.21 H new ATOM 0 HA VAL A 101 0.589 3.098 -2.224 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.177 4.583 -4.766 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -2.018 2.952 -4.845 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.426 2.158 -4.889 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.377 2.164 -3.384 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.310 5.095 -3.657 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.683 4.404 -2.141 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.933 5.862 -2.832 1.00 0.26 H new ATOM 1602 N ALA A 102 2.346 3.889 -4.931 1.00 0.19 N ATOM 1603 CA ALA A 102 3.338 3.398 -5.877 1.00 0.19 C ATOM 1604 C ALA A 102 4.525 2.783 -5.151 1.00 0.17 C ATOM 1605 O ALA A 102 5.027 1.736 -5.548 1.00 0.19 O ATOM 1606 CB ALA A 102 3.805 4.522 -6.790 1.00 0.21 C ATOM 0 H ALA A 102 2.071 4.860 -5.077 1.00 0.19 H new ATOM 0 HA ALA A 102 2.870 2.623 -6.485 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.546 4.137 -7.491 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.954 4.919 -7.343 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.250 5.316 -6.191 1.00 0.21 H new ATOM 1612 N PHE A 103 4.965 3.439 -4.080 1.00 0.16 N ATOM 1613 CA PHE A 103 6.099 2.958 -3.298 1.00 0.17 C ATOM 1614 C PHE A 103 5.854 1.537 -2.797 1.00 0.17 C ATOM 1615 O PHE A 103 6.721 0.671 -2.912 1.00 0.21 O ATOM 1616 CB PHE A 103 6.363 3.892 -2.116 1.00 0.17 C ATOM 1617 CG PHE A 103 7.578 3.517 -1.317 1.00 0.19 C ATOM 1618 CD1 PHE A 103 8.846 3.649 -1.860 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.453 3.032 -0.025 1.00 0.17 C ATOM 1620 CE1 PHE A 103 9.966 3.304 -1.130 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.571 2.686 0.710 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.829 2.822 0.156 1.00 0.26 C ATOM 0 H PHE A 103 4.553 4.306 -3.734 1.00 0.16 H new ATOM 0 HA PHE A 103 6.976 2.947 -3.946 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.482 4.910 -2.487 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.492 3.891 -1.461 1.00 0.17 H new ATOM 0 HD1 PHE A 103 8.959 4.026 -2.866 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.471 2.923 0.412 1.00 0.17 H new ATOM 0 HE1 PHE A 103 10.949 3.411 -1.565 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.461 2.310 1.716 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.704 2.552 0.728 1.00 0.26 H new ATOM 1632 N PHE A 104 4.668 1.306 -2.243 1.00 0.16 N ATOM 1633 CA PHE A 104 4.308 -0.010 -1.727 1.00 0.18 C ATOM 1634 C PHE A 104 4.049 -0.988 -2.868 1.00 0.19 C ATOM 1635 O PHE A 104 4.302 -2.187 -2.742 1.00 0.23 O ATOM 1636 CB PHE A 104 3.069 0.086 -0.835 1.00 0.19 C ATOM 1637 CG PHE A 104 3.356 0.588 0.553 1.00 0.21 C ATOM 1638 CD1 PHE A 104 3.842 1.869 0.757 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.136 -0.224 1.654 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.104 2.331 2.033 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.395 0.233 2.931 1.00 0.33 C ATOM 1642 CZ PHE A 104 3.879 1.512 3.122 1.00 0.30 C ATOM 0 H PHE A 104 3.940 2.013 -2.140 1.00 0.16 H new ATOM 0 HA PHE A 104 5.145 -0.380 -1.135 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.343 0.748 -1.308 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.605 -0.898 -0.766 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.018 2.514 -0.091 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.758 -1.226 1.512 1.00 0.29 H new ATOM 0 HE1 PHE A 104 4.484 3.331 2.178 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.219 -0.410 3.781 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.081 1.871 4.120 1.00 0.30 H new ATOM 1652 N SER A 105 3.546 -0.466 -3.982 1.00 0.18 N ATOM 1653 CA SER A 105 3.249 -1.288 -5.148 1.00 0.21 C ATOM 1654 C SER A 105 4.531 -1.829 -5.770 1.00 0.21 C ATOM 1655 O SER A 105 4.580 -2.979 -6.209 1.00 0.23 O ATOM 1656 CB SER A 105 2.462 -0.482 -6.183 1.00 0.25 C ATOM 1657 OG SER A 105 1.214 -0.063 -5.660 1.00 1.04 O ATOM 0 H SER A 105 3.335 0.525 -4.101 1.00 0.18 H new ATOM 0 HA SER A 105 2.641 -2.132 -4.822 1.00 0.21 H new ATOM 0 HB2 SER A 105 3.042 0.388 -6.489 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.301 -1.088 -7.075 1.00 0.25 H new ATOM 0 HG SER A 105 1.360 0.627 -4.979 1.00 1.04 H new ATOM 1663 N PHE A 106 5.569 -0.996 -5.806 1.00 0.20 N ATOM 1664 CA PHE A 106 6.848 -1.404 -6.372 1.00 0.21 C ATOM 1665 C PHE A 106 7.420 -2.574 -5.584 1.00 0.22 C ATOM 1666 O PHE A 106 7.836 -3.577 -6.160 1.00 0.24 O ATOM 1667 CB PHE A 106 7.848 -0.242 -6.369 1.00 0.23 C ATOM 1668 CG PHE A 106 7.424 0.944 -7.195 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.790 0.773 -8.417 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.665 2.234 -6.746 1.00 0.27 C ATOM 1671 CE1 PHE A 106 6.403 1.864 -9.172 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.281 3.328 -7.498 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.649 3.142 -8.712 1.00 0.33 C ATOM 0 H PHE A 106 5.548 -0.040 -5.451 1.00 0.20 H new ATOM 0 HA PHE A 106 6.677 -1.710 -7.404 1.00 0.21 H new ATOM 0 HB2 PHE A 106 8.005 0.084 -5.341 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.808 -0.603 -6.739 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.597 -0.225 -8.783 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.159 2.385 -5.797 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.909 1.717 -10.121 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.475 4.327 -7.137 1.00 0.30 H new ATOM 0 HZ PHE A 106 6.348 3.996 -9.301 1.00 0.33 H new ATOM 1683 N GLY A 107 7.432 -2.433 -4.261 1.00 0.23 N ATOM 1684 CA GLY A 107 7.949 -3.485 -3.406 1.00 0.27 C ATOM 1685 C GLY A 107 7.223 -4.798 -3.609 1.00 0.32 C ATOM 1686 O GLY A 107 7.832 -5.865 -3.554 1.00 0.37 O ATOM 0 H GLY A 107 7.092 -1.608 -3.767 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.011 -3.625 -3.607 1.00 0.27 H new ATOM 0 HA3 GLY A 107 7.859 -3.180 -2.363 1.00 0.27 H new ATOM 1690 N GLY A 108 5.915 -4.720 -3.837 1.00 0.33 N ATOM 1691 CA GLY A 108 5.127 -5.920 -4.052 1.00 0.41 C ATOM 1692 C GLY A 108 5.557 -6.665 -5.298 1.00 0.42 C ATOM 1693 O GLY A 108 5.316 -7.864 -5.429 1.00 0.63 O ATOM 0 H GLY A 108 5.387 -3.848 -3.877 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.222 -6.576 -3.187 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.074 -5.652 -4.135 1.00 0.41 H new ATOM 1697 N ALA A 109 6.193 -5.946 -6.216 1.00 0.27 N ATOM 1698 CA ALA A 109 6.673 -6.535 -7.457 1.00 0.26 C ATOM 1699 C ALA A 109 8.135 -6.943 -7.324 1.00 0.23 C ATOM 1700 O ALA A 109 8.575 -7.924 -7.923 1.00 0.24 O ATOM 1701 CB ALA A 109 6.495 -5.557 -8.608 1.00 0.29 C ATOM 0 H ALA A 109 6.388 -4.949 -6.122 1.00 0.27 H new ATOM 0 HA ALA A 109 6.086 -7.429 -7.667 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.858 -6.010 -9.530 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.439 -5.311 -8.716 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.060 -4.648 -8.404 1.00 0.29 H new ATOM 1707 N LEU A 110 8.879 -6.181 -6.528 1.00 0.22 N ATOM 1708 CA LEU A 110 10.293 -6.452 -6.304 1.00 0.23 C ATOM 1709 C LEU A 110 10.478 -7.738 -5.510 1.00 0.21 C ATOM 1710 O LEU A 110 11.356 -8.543 -5.813 1.00 0.21 O ATOM 1711 CB LEU A 110 10.945 -5.285 -5.561 1.00 0.25 C ATOM 1712 CG LEU A 110 11.022 -3.977 -6.347 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.520 -2.855 -5.454 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.926 -4.134 -7.560 1.00 0.36 C ATOM 0 H LEU A 110 8.523 -5.368 -6.026 1.00 0.22 H new ATOM 0 HA LEU A 110 10.774 -6.571 -7.275 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.390 -5.105 -4.640 1.00 0.25 H new ATOM 0 HB3 LEU A 110 11.955 -5.577 -5.272 1.00 0.25 H new ATOM 0 HG LEU A 110 10.021 -3.724 -6.697 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.570 -1.929 -6.027 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.836 -2.726 -4.615 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.512 -3.103 -5.078 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.968 -3.192 -8.107 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.929 -4.409 -7.233 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.530 -4.914 -8.210 1.00 0.36 H new ATOM 1726 N CYS A 111 9.643 -7.923 -4.493 1.00 0.21 N ATOM 1727 CA CYS A 111 9.713 -9.112 -3.655 1.00 0.21 C ATOM 1728 C CYS A 111 9.460 -10.367 -4.483 1.00 0.21 C ATOM 1729 O CYS A 111 9.946 -11.448 -4.155 1.00 0.25 O ATOM 1730 CB CYS A 111 8.697 -9.019 -2.516 1.00 0.22 C ATOM 1731 SG CYS A 111 6.987 -8.818 -3.065 1.00 1.34 S ATOM 0 H CYS A 111 8.910 -7.264 -4.230 1.00 0.21 H new ATOM 0 HA CYS A 111 10.714 -9.174 -3.229 1.00 0.21 H new ATOM 0 HB2 CYS A 111 8.768 -9.920 -1.906 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.962 -8.178 -1.875 1.00 0.22 H new ATOM 0 HG CYS A 111 6.181 -9.231 -2.133 1.00 1.34 H new ATOM 1737 N VAL A 112 8.698 -10.211 -5.561 1.00 0.19 N ATOM 1738 CA VAL A 112 8.384 -11.328 -6.444 1.00 0.20 C ATOM 1739 C VAL A 112 9.553 -11.629 -7.375 1.00 0.22 C ATOM 1740 O VAL A 112 10.104 -12.729 -7.356 1.00 0.25 O ATOM 1741 CB VAL A 112 7.132 -11.042 -7.296 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.822 -12.223 -8.204 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.943 -10.719 -6.406 1.00 0.25 C ATOM 0 H VAL A 112 8.287 -9.322 -5.844 1.00 0.19 H new ATOM 0 HA VAL A 112 8.190 -12.190 -5.806 1.00 0.20 H new ATOM 0 HB VAL A 112 7.333 -10.174 -7.924 1.00 0.23 H new ATOM 0 HG11 VAL A 112 5.935 -12.002 -8.798 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.667 -12.403 -8.868 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.641 -13.111 -7.598 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.068 -10.520 -7.025 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.738 -11.566 -5.751 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.168 -9.839 -5.803 1.00 0.25 H new ATOM 1753 N GLU A 113 9.918 -10.645 -8.194 1.00 0.22 N ATOM 1754 CA GLU A 113 11.018 -10.802 -9.140 1.00 0.25 C ATOM 1755 C GLU A 113 12.301 -11.213 -8.427 1.00 0.25 C ATOM 1756 O GLU A 113 13.154 -11.883 -9.008 1.00 0.30 O ATOM 1757 CB GLU A 113 11.243 -9.505 -9.920 1.00 0.29 C ATOM 1758 CG GLU A 113 11.577 -8.312 -9.041 1.00 0.30 C ATOM 1759 CD GLU A 113 11.769 -7.037 -9.839 1.00 0.39 C ATOM 1760 OE1 GLU A 113 10.773 -6.317 -10.058 1.00 0.51 O ATOM 1761 OE2 GLU A 113 12.917 -6.759 -10.246 1.00 0.50 O ATOM 0 H GLU A 113 9.467 -9.730 -8.221 1.00 0.22 H new ATOM 0 HA GLU A 113 10.747 -11.593 -9.839 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.053 -9.657 -10.634 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.347 -9.279 -10.498 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.778 -8.165 -8.315 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.485 -8.524 -8.477 1.00 0.30 H new ATOM 1768 N SER A 114 12.434 -10.811 -7.166 1.00 0.23 N ATOM 1769 CA SER A 114 13.617 -11.151 -6.384 1.00 0.28 C ATOM 1770 C SER A 114 13.665 -12.652 -6.127 1.00 0.27 C ATOM 1771 O SER A 114 14.702 -13.288 -6.312 1.00 0.31 O ATOM 1772 CB SER A 114 13.631 -10.385 -5.060 1.00 0.33 C ATOM 1773 OG SER A 114 12.471 -10.660 -4.296 1.00 0.99 O ATOM 0 H SER A 114 11.741 -10.253 -6.667 1.00 0.23 H new ATOM 0 HA SER A 114 14.500 -10.863 -6.955 1.00 0.28 H new ATOM 0 HB2 SER A 114 14.519 -10.657 -4.489 1.00 0.33 H new ATOM 0 HB3 SER A 114 13.695 -9.315 -5.257 1.00 0.33 H new ATOM 0 HG SER A 114 12.543 -10.222 -3.422 1.00 0.99 H new ATOM 1779 N VAL A 115 12.537 -13.213 -5.701 1.00 0.28 N ATOM 1780 CA VAL A 115 12.451 -14.644 -5.439 1.00 0.33 C ATOM 1781 C VAL A 115 12.548 -15.423 -6.746 1.00 0.37 C ATOM 1782 O VAL A 115 13.069 -16.537 -6.785 1.00 0.42 O ATOM 1783 CB VAL A 115 11.134 -15.013 -4.722 1.00 0.40 C ATOM 1784 CG1 VAL A 115 11.013 -16.521 -4.553 1.00 0.45 C ATOM 1785 CG2 VAL A 115 11.046 -14.316 -3.373 1.00 0.41 C ATOM 0 H VAL A 115 11.673 -12.699 -5.531 1.00 0.28 H new ATOM 0 HA VAL A 115 13.283 -14.908 -4.786 1.00 0.33 H new ATOM 0 HB VAL A 115 10.304 -14.673 -5.341 1.00 0.40 H new ATOM 0 HG11 VAL A 115 10.077 -16.756 -4.046 1.00 0.45 H new ATOM 0 HG12 VAL A 115 11.025 -16.999 -5.533 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.850 -16.889 -3.960 1.00 0.45 H new ATOM 0 HG21 VAL A 115 10.111 -14.588 -2.883 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.886 -14.623 -2.749 1.00 0.41 H new ATOM 0 HG23 VAL A 115 11.078 -13.236 -3.519 1.00 0.41 H new ATOM 1795 N ASP A 116 12.043 -14.818 -7.817 1.00 0.38 N ATOM 1796 CA ASP A 116 12.070 -15.438 -9.135 1.00 0.46 C ATOM 1797 C ASP A 116 13.505 -15.583 -9.629 1.00 0.47 C ATOM 1798 O ASP A 116 13.815 -16.477 -10.416 1.00 0.56 O ATOM 1799 CB ASP A 116 11.252 -14.606 -10.125 1.00 0.49 C ATOM 1800 CG ASP A 116 11.199 -15.230 -11.504 1.00 1.08 C ATOM 1801 OD1 ASP A 116 10.420 -16.187 -11.694 1.00 1.23 O ATOM 1802 OD2 ASP A 116 11.937 -14.761 -12.396 1.00 1.89 O ATOM 0 H ASP A 116 11.609 -13.895 -7.796 1.00 0.38 H new ATOM 0 HA ASP A 116 11.629 -16.432 -9.060 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.238 -14.488 -9.744 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.683 -13.607 -10.198 1.00 0.49 H new ATOM 1807 N LYS A 117 14.377 -14.696 -9.156 1.00 0.43 N ATOM 1808 CA LYS A 117 15.783 -14.722 -9.542 1.00 0.49 C ATOM 1809 C LYS A 117 16.617 -15.454 -8.492 1.00 0.47 C ATOM 1810 O LYS A 117 17.840 -15.317 -8.448 1.00 0.52 O ATOM 1811 CB LYS A 117 16.304 -13.297 -9.741 1.00 0.53 C ATOM 1812 CG LYS A 117 15.579 -12.542 -10.844 1.00 0.61 C ATOM 1813 CD LYS A 117 16.092 -11.118 -10.981 1.00 1.20 C ATOM 1814 CE LYS A 117 15.237 -10.309 -11.942 1.00 1.32 C ATOM 1815 NZ LYS A 117 15.141 -10.954 -13.280 1.00 1.90 N ATOM 0 H LYS A 117 14.133 -13.950 -8.504 1.00 0.43 H new ATOM 0 HA LYS A 117 15.872 -15.261 -10.485 1.00 0.49 H new ATOM 0 HB2 LYS A 117 16.203 -12.746 -8.806 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.368 -13.336 -9.975 1.00 0.53 H new ATOM 0 HG2 LYS A 117 15.708 -13.068 -11.790 1.00 0.61 H new ATOM 0 HG3 LYS A 117 14.510 -12.525 -10.631 1.00 0.61 H new ATOM 0 HD2 LYS A 117 16.098 -10.636 -10.003 1.00 1.20 H new ATOM 0 HD3 LYS A 117 17.123 -11.134 -11.334 1.00 1.20 H new ATOM 0 HE2 LYS A 117 14.237 -10.189 -11.525 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.659 -9.310 -12.050 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 14.681 -10.302 -13.947 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 16.095 -11.185 -13.623 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 14.580 -11.826 -13.205 1.00 1.90 H new ATOM 1829 N GLU A 118 15.933 -16.229 -7.649 1.00 0.45 N ATOM 1830 CA GLU A 118 16.581 -17.011 -6.595 1.00 0.49 C ATOM 1831 C GLU A 118 17.254 -16.121 -5.554 1.00 0.45 C ATOM 1832 O GLU A 118 18.106 -16.580 -4.793 1.00 0.55 O ATOM 1833 CB GLU A 118 17.602 -17.980 -7.193 1.00 0.59 C ATOM 1834 CG GLU A 118 16.987 -19.010 -8.124 1.00 1.07 C ATOM 1835 CD GLU A 118 18.004 -20.009 -8.634 1.00 1.72 C ATOM 1836 OE1 GLU A 118 18.278 -20.995 -7.919 1.00 1.89 O ATOM 1837 OE2 GLU A 118 18.527 -19.806 -9.749 1.00 2.54 O ATOM 0 H GLU A 118 14.919 -16.332 -7.677 1.00 0.45 H new ATOM 0 HA GLU A 118 15.799 -17.579 -6.091 1.00 0.49 H new ATOM 0 HB2 GLU A 118 18.354 -17.411 -7.740 1.00 0.59 H new ATOM 0 HB3 GLU A 118 18.119 -18.496 -6.384 1.00 0.59 H new ATOM 0 HG2 GLU A 118 16.192 -19.541 -7.600 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.526 -18.501 -8.970 1.00 1.07 H new ATOM 1844 N MET A 119 16.868 -14.851 -5.520 1.00 0.35 N ATOM 1845 CA MET A 119 17.428 -13.912 -4.555 1.00 0.33 C ATOM 1846 C MET A 119 16.527 -13.820 -3.324 1.00 0.31 C ATOM 1847 O MET A 119 15.987 -12.758 -3.012 1.00 0.27 O ATOM 1848 CB MET A 119 17.603 -12.530 -5.193 1.00 0.34 C ATOM 1849 CG MET A 119 18.408 -12.553 -6.483 1.00 0.41 C ATOM 1850 SD MET A 119 18.738 -10.901 -7.129 1.00 0.47 S ATOM 1851 CE MET A 119 17.076 -10.320 -7.457 1.00 0.44 C ATOM 0 H MET A 119 16.172 -14.448 -6.147 1.00 0.35 H new ATOM 0 HA MET A 119 18.408 -14.275 -4.244 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.620 -12.105 -5.396 1.00 0.34 H new ATOM 0 HB3 MET A 119 18.095 -11.869 -4.479 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.354 -13.065 -6.307 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.868 -13.131 -7.233 1.00 0.41 H new ATOM 0 HE1 MET A 119 17.094 -9.620 -8.292 1.00 0.44 H new ATOM 0 HE2 MET A 119 16.437 -11.167 -7.707 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.684 -9.819 -6.572 1.00 0.44 H new ATOM 1861 N GLN A 120 16.370 -14.947 -2.632 1.00 0.36 N ATOM 1862 CA GLN A 120 15.524 -15.015 -1.442 1.00 0.39 C ATOM 1863 C GLN A 120 16.120 -14.231 -0.277 1.00 0.41 C ATOM 1864 O GLN A 120 15.472 -14.054 0.755 1.00 0.47 O ATOM 1865 CB GLN A 120 15.308 -16.471 -1.028 1.00 0.49 C ATOM 1866 CG GLN A 120 14.660 -17.318 -2.110 1.00 0.53 C ATOM 1867 CD GLN A 120 14.456 -18.757 -1.678 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.254 -19.041 -0.497 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.510 -19.675 -2.636 1.00 0.70 N ATOM 0 H GLN A 120 16.820 -15.829 -2.876 1.00 0.36 H new ATOM 0 HA GLN A 120 14.566 -14.562 -1.697 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.269 -16.911 -0.760 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.685 -16.498 -0.134 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.697 -16.883 -2.379 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.282 -17.296 -3.005 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.680 -19.395 -3.602 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.382 -20.660 -2.406 1.00 0.70 H new ATOM 1878 N VAL A 121 17.356 -13.774 -0.435 1.00 0.39 N ATOM 1879 CA VAL A 121 18.015 -13.005 0.612 1.00 0.44 C ATOM 1880 C VAL A 121 17.812 -11.510 0.391 1.00 0.38 C ATOM 1881 O VAL A 121 18.135 -10.692 1.253 1.00 0.47 O ATOM 1882 CB VAL A 121 19.521 -13.321 0.691 1.00 0.52 C ATOM 1883 CG1 VAL A 121 19.740 -14.742 1.186 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.184 -13.116 -0.661 1.00 0.92 C ATOM 0 H VAL A 121 17.919 -13.921 -1.273 1.00 0.39 H new ATOM 0 HA VAL A 121 17.558 -13.293 1.559 1.00 0.44 H new ATOM 0 HB VAL A 121 19.980 -12.634 1.402 1.00 0.52 H new ATOM 0 HG11 VAL A 121 20.809 -14.949 1.236 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.302 -14.853 2.178 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.266 -15.444 0.499 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.247 -13.344 -0.583 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.724 -13.776 -1.396 1.00 0.92 H new ATOM 0 HG23 VAL A 121 20.058 -12.080 -0.975 1.00 0.92 H new ATOM 1894 N LEU A 122 17.263 -11.165 -0.772 1.00 0.30 N ATOM 1895 CA LEU A 122 16.997 -9.773 -1.114 1.00 0.27 C ATOM 1896 C LEU A 122 15.550 -9.412 -0.799 1.00 0.23 C ATOM 1897 O LEU A 122 15.257 -8.287 -0.397 1.00 0.23 O ATOM 1898 CB LEU A 122 17.287 -9.516 -2.596 1.00 0.28 C ATOM 1899 CG LEU A 122 18.731 -9.123 -2.920 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.673 -10.290 -2.680 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.844 -8.635 -4.356 1.00 0.41 C ATOM 0 H LEU A 122 16.994 -11.834 -1.494 1.00 0.30 H new ATOM 0 HA LEU A 122 17.656 -9.145 -0.514 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.037 -10.415 -3.160 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.625 -8.725 -2.947 1.00 0.28 H new ATOM 0 HG LEU A 122 19.019 -8.308 -2.255 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.693 -9.989 -2.917 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.617 -10.593 -1.635 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.385 -11.127 -3.316 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.878 -8.361 -4.567 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.534 -9.429 -5.036 1.00 0.41 H new ATOM 0 HD23 LEU A 122 18.202 -7.765 -4.496 1.00 0.41 H new ATOM 1913 N VAL A 123 14.651 -10.375 -0.986 1.00 0.23 N ATOM 1914 CA VAL A 123 13.234 -10.164 -0.719 1.00 0.25 C ATOM 1915 C VAL A 123 13.018 -9.666 0.708 1.00 0.27 C ATOM 1916 O VAL A 123 12.122 -8.862 0.966 1.00 0.31 O ATOM 1917 CB VAL A 123 12.422 -11.457 -0.944 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.935 -12.577 -0.053 1.00 0.31 C ATOM 1919 CG2 VAL A 123 10.940 -11.211 -0.706 1.00 0.31 C ATOM 0 H VAL A 123 14.881 -11.310 -1.322 1.00 0.23 H new ATOM 0 HA VAL A 123 12.882 -9.406 -1.419 1.00 0.25 H new ATOM 0 HB VAL A 123 12.551 -11.764 -1.982 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.348 -13.479 -0.228 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.982 -12.775 -0.283 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.843 -12.282 0.992 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.387 -12.136 -0.870 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.787 -10.874 0.319 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.583 -10.447 -1.396 1.00 0.31 H new ATOM 1929 N SER A 124 13.849 -10.145 1.629 1.00 0.29 N ATOM 1930 CA SER A 124 13.757 -9.741 3.026 1.00 0.35 C ATOM 1931 C SER A 124 14.315 -8.335 3.208 1.00 0.34 C ATOM 1932 O SER A 124 13.864 -7.581 4.070 1.00 0.44 O ATOM 1933 CB SER A 124 14.519 -10.722 3.918 1.00 0.43 C ATOM 1934 OG SER A 124 13.983 -12.029 3.814 1.00 1.32 O ATOM 0 H SER A 124 14.594 -10.814 1.432 1.00 0.29 H new ATOM 0 HA SER A 124 12.706 -9.746 3.316 1.00 0.35 H new ATOM 0 HB2 SER A 124 15.571 -10.734 3.635 1.00 0.43 H new ATOM 0 HB3 SER A 124 14.472 -10.388 4.954 1.00 0.43 H new ATOM 0 HG SER A 124 14.580 -12.664 4.262 1.00 1.32 H new ATOM 1940 N ARG A 125 15.302 -7.991 2.385 1.00 0.28 N ATOM 1941 CA ARG A 125 15.927 -6.677 2.446 1.00 0.31 C ATOM 1942 C ARG A 125 15.014 -5.615 1.852 1.00 0.24 C ATOM 1943 O ARG A 125 15.081 -4.448 2.233 1.00 0.24 O ATOM 1944 CB ARG A 125 17.263 -6.691 1.708 1.00 0.41 C ATOM 1945 CG ARG A 125 18.282 -7.626 2.330 1.00 0.91 C ATOM 1946 CD ARG A 125 19.598 -7.594 1.576 1.00 0.74 C ATOM 1947 NE ARG A 125 20.573 -8.514 2.149 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.766 -8.751 1.615 1.00 1.24 C ATOM 1949 NH1 ARG A 125 22.125 -8.146 0.491 1.00 1.28 N ATOM 1950 NH2 ARG A 125 22.601 -9.594 2.204 1.00 1.84 N ATOM 0 H ARG A 125 15.685 -8.607 1.668 1.00 0.28 H new ATOM 0 HA ARG A 125 16.103 -6.433 3.494 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.095 -6.985 0.672 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.671 -5.680 1.690 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.450 -7.344 3.369 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.889 -8.643 2.335 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.425 -7.852 0.531 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.001 -6.581 1.591 1.00 0.74 H new ATOM 0 HE ARG A 125 20.325 -9.004 3.009 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.484 -7.497 0.034 1.00 1.28 H new ATOM 0 HH12 ARG A 125 23.042 -8.330 0.083 1.00 1.28 H new ATOM 0 HH21 ARG A 125 22.328 -10.062 3.068 1.00 1.84 H new ATOM 0 HH22 ARG A 125 23.517 -9.775 1.793 1.00 1.84 H new ATOM 1964 N ILE A 126 14.170 -6.022 0.910 1.00 0.21 N ATOM 1965 CA ILE A 126 13.235 -5.101 0.280 1.00 0.19 C ATOM 1966 C ILE A 126 12.308 -4.504 1.329 1.00 0.19 C ATOM 1967 O ILE A 126 12.016 -3.308 1.309 1.00 0.19 O ATOM 1968 CB ILE A 126 12.396 -5.803 -0.808 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.298 -6.265 -1.954 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.305 -4.874 -1.327 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.602 -7.175 -2.943 1.00 0.23 C ATOM 0 H ILE A 126 14.115 -6.981 0.568 1.00 0.21 H new ATOM 0 HA ILE A 126 13.816 -4.310 -0.194 1.00 0.19 H new ATOM 0 HB ILE A 126 11.917 -6.677 -0.367 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.677 -5.390 -2.482 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.161 -6.786 -1.539 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.724 -5.387 -2.093 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.649 -4.589 -0.505 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.761 -3.981 -1.754 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.302 -7.463 -3.728 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.247 -8.068 -2.428 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.755 -6.651 -3.386 1.00 0.23 H new ATOM 1983 N ALA A 127 11.855 -5.350 2.248 1.00 0.22 N ATOM 1984 CA ALA A 127 10.969 -4.915 3.318 1.00 0.25 C ATOM 1985 C ALA A 127 11.698 -3.973 4.269 1.00 0.24 C ATOM 1986 O ALA A 127 11.086 -3.102 4.887 1.00 0.26 O ATOM 1987 CB ALA A 127 10.425 -6.117 4.074 1.00 0.30 C ATOM 0 H ALA A 127 12.088 -6.343 2.272 1.00 0.22 H new ATOM 0 HA ALA A 127 10.133 -4.374 2.875 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.764 -5.777 4.871 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.868 -6.756 3.389 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.252 -6.681 4.505 1.00 0.30 H new ATOM 1993 N ALA A 128 13.011 -4.157 4.379 1.00 0.22 N ATOM 1994 CA ALA A 128 13.829 -3.325 5.252 1.00 0.23 C ATOM 1995 C ALA A 128 14.082 -1.958 4.626 1.00 0.19 C ATOM 1996 O ALA A 128 14.022 -0.935 5.307 1.00 0.19 O ATOM 1997 CB ALA A 128 15.148 -4.019 5.561 1.00 0.27 C ATOM 0 H ALA A 128 13.530 -4.875 3.874 1.00 0.22 H new ATOM 0 HA ALA A 128 13.285 -3.174 6.184 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.748 -3.385 6.214 1.00 0.27 H new ATOM 0 HB2 ALA A 128 14.952 -4.969 6.058 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.690 -4.200 4.633 1.00 0.27 H new ATOM 2003 N TRP A 129 14.361 -1.948 3.325 1.00 0.17 N ATOM 2004 CA TRP A 129 14.621 -0.706 2.608 1.00 0.17 C ATOM 2005 C TRP A 129 13.376 0.168 2.584 1.00 0.15 C ATOM 2006 O TRP A 129 13.452 1.381 2.778 1.00 0.18 O ATOM 2007 CB TRP A 129 15.078 -0.995 1.175 1.00 0.20 C ATOM 2008 CG TRP A 129 16.342 -1.798 1.096 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.389 -1.770 1.972 1.00 0.27 C ATOM 2010 CD2 TRP A 129 16.694 -2.744 0.080 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.368 -2.644 1.566 1.00 0.33 N ATOM 2012 CE2 TRP A 129 17.965 -3.253 0.406 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.057 -3.211 -1.074 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 18.609 -4.206 -0.378 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 16.698 -4.157 -1.851 1.00 0.47 C ATOM 2016 CH2 TRP A 129 17.963 -4.646 -1.500 1.00 0.50 C ATOM 0 H TRP A 129 14.412 -2.787 2.747 1.00 0.17 H new ATOM 0 HA TRP A 129 15.416 -0.175 3.131 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.285 -1.529 0.651 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.225 -0.050 0.652 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.440 -1.151 2.855 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.251 -2.812 2.049 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.082 -2.839 -1.353 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 19.584 -4.584 -0.110 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 16.216 -4.526 -2.744 1.00 0.47 H new ATOM 0 HH2 TRP A 129 18.438 -5.385 -2.128 1.00 0.50 H new ATOM 2027 N MET A 130 12.230 -0.459 2.343 1.00 0.16 N ATOM 2028 CA MET A 130 10.965 0.259 2.295 1.00 0.21 C ATOM 2029 C MET A 130 10.619 0.841 3.659 1.00 0.19 C ATOM 2030 O MET A 130 10.249 2.010 3.767 1.00 0.21 O ATOM 2031 CB MET A 130 9.844 -0.664 1.821 1.00 0.29 C ATOM 2032 CG MET A 130 9.987 -1.099 0.373 1.00 0.33 C ATOM 2033 SD MET A 130 8.623 -2.142 -0.174 1.00 0.71 S ATOM 2034 CE MET A 130 7.227 -1.066 0.141 1.00 0.29 C ATOM 0 H MET A 130 12.153 -1.463 2.178 1.00 0.16 H new ATOM 0 HA MET A 130 11.070 1.080 1.586 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.820 -1.549 2.457 1.00 0.29 H new ATOM 0 HB3 MET A 130 8.888 -0.155 1.946 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.043 -0.216 -0.264 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.925 -1.640 0.251 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.307 -1.565 -0.164 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.179 -0.835 1.205 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.344 -0.143 -0.426 1.00 0.29 H new ATOM 2044 N ALA A 131 10.738 0.020 4.697 1.00 0.18 N ATOM 2045 CA ALA A 131 10.442 0.460 6.054 1.00 0.20 C ATOM 2046 C ALA A 131 11.329 1.634 6.450 1.00 0.21 C ATOM 2047 O ALA A 131 10.902 2.530 7.177 1.00 0.23 O ATOM 2048 CB ALA A 131 10.616 -0.689 7.035 1.00 0.23 C ATOM 0 H ALA A 131 11.037 -0.952 4.624 1.00 0.18 H new ATOM 0 HA ALA A 131 9.404 0.791 6.085 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.391 -0.343 8.044 1.00 0.23 H new ATOM 0 HB2 ALA A 131 9.938 -1.500 6.770 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.644 -1.049 6.996 1.00 0.23 H new ATOM 2054 N THR A 132 12.567 1.624 5.963 1.00 0.22 N ATOM 2055 CA THR A 132 13.517 2.689 6.264 1.00 0.25 C ATOM 2056 C THR A 132 13.093 3.997 5.603 1.00 0.24 C ATOM 2057 O THR A 132 12.913 5.013 6.275 1.00 0.25 O ATOM 2058 CB THR A 132 14.941 2.321 5.798 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.340 1.075 6.381 1.00 0.33 O ATOM 2060 CG2 THR A 132 15.937 3.404 6.187 1.00 0.37 C ATOM 0 H THR A 132 12.935 0.890 5.358 1.00 0.22 H new ATOM 0 HA THR A 132 13.524 2.817 7.346 1.00 0.25 H new ATOM 0 HB THR A 132 14.930 2.231 4.712 1.00 0.31 H new ATOM 0 HG1 THR A 132 14.859 0.341 5.945 1.00 0.33 H new ATOM 0 HG21 THR A 132 16.933 3.121 5.847 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.649 4.347 5.722 1.00 0.37 H new ATOM 0 HG23 THR A 132 15.943 3.521 7.271 1.00 0.37 H new ATOM 2068 N TYR A 133 12.940 3.965 4.282 1.00 0.23 N ATOM 2069 CA TYR A 133 12.536 5.147 3.527 1.00 0.24 C ATOM 2070 C TYR A 133 11.157 5.634 3.967 1.00 0.21 C ATOM 2071 O TYR A 133 10.802 6.793 3.759 1.00 0.23 O ATOM 2072 CB TYR A 133 12.531 4.835 2.026 1.00 0.27 C ATOM 2073 CG TYR A 133 12.095 5.996 1.157 1.00 0.33 C ATOM 2074 CD1 TYR A 133 13.007 6.954 0.733 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.770 6.133 0.760 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.612 8.015 -0.060 1.00 0.50 C ATOM 2077 CE2 TYR A 133 10.367 7.190 -0.033 1.00 0.45 C ATOM 2078 CZ TYR A 133 11.291 8.128 -0.439 1.00 0.51 C ATOM 2079 OH TYR A 133 10.894 9.181 -1.229 1.00 0.61 O ATOM 0 H TYR A 133 13.090 3.133 3.712 1.00 0.23 H new ATOM 0 HA TYR A 133 13.256 5.941 3.726 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.532 4.526 1.726 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.868 3.989 1.843 1.00 0.27 H new ATOM 0 HD1 TYR A 133 14.042 6.868 1.028 1.00 0.42 H new ATOM 0 HD2 TYR A 133 10.043 5.400 1.077 1.00 0.36 H new ATOM 0 HE1 TYR A 133 13.334 8.751 -0.381 1.00 0.50 H new ATOM 0 HE2 TYR A 133 9.333 7.281 -0.333 1.00 0.45 H new ATOM 0 HH TYR A 133 11.000 8.940 -2.173 1.00 0.61 H new ATOM 2089 N LEU A 134 10.385 4.746 4.582 1.00 0.20 N ATOM 2090 CA LEU A 134 9.044 5.089 5.044 1.00 0.20 C ATOM 2091 C LEU A 134 9.061 5.591 6.486 1.00 0.21 C ATOM 2092 O LEU A 134 8.129 6.264 6.927 1.00 0.24 O ATOM 2093 CB LEU A 134 8.123 3.867 4.929 1.00 0.20 C ATOM 2094 CG LEU A 134 6.770 3.991 5.639 1.00 0.22 C ATOM 2095 CD1 LEU A 134 5.897 5.029 4.953 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.065 2.644 5.683 1.00 0.26 C ATOM 0 H LEU A 134 10.664 3.783 4.773 1.00 0.20 H new ATOM 0 HA LEU A 134 8.667 5.893 4.412 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.942 3.668 3.873 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.647 3.000 5.332 1.00 0.20 H new ATOM 0 HG LEU A 134 6.950 4.319 6.663 1.00 0.22 H new ATOM 0 HD11 LEU A 134 4.941 5.101 5.472 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.397 5.997 4.976 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.726 4.734 3.918 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.106 2.751 6.191 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.899 2.287 4.667 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.683 1.927 6.223 1.00 0.26 H new ATOM 2108 N ASN A 135 10.132 5.285 7.212 1.00 0.24 N ATOM 2109 CA ASN A 135 10.231 5.676 8.613 1.00 0.29 C ATOM 2110 C ASN A 135 10.912 7.033 8.821 1.00 0.30 C ATOM 2111 O ASN A 135 10.549 7.762 9.743 1.00 0.33 O ATOM 2112 CB ASN A 135 10.972 4.599 9.405 1.00 0.37 C ATOM 2113 CG ASN A 135 10.955 4.868 10.895 1.00 0.92 C ATOM 2114 OD1 ASN A 135 10.006 4.509 11.592 1.00 1.17 O ATOM 2115 ND2 ASN A 135 12.010 5.501 11.394 1.00 1.46 N ATOM 0 H ASN A 135 10.938 4.771 6.856 1.00 0.24 H new ATOM 0 HA ASN A 135 9.209 5.780 8.977 1.00 0.29 H new ATOM 0 HB2 ASN A 135 10.517 3.628 9.208 1.00 0.37 H new ATOM 0 HB3 ASN A 135 12.004 4.543 9.060 1.00 0.37 H new ATOM 0 HD21 ASN A 135 12.056 5.708 12.392 1.00 1.46 H new ATOM 0 HD22 ASN A 135 12.775 5.781 10.780 1.00 1.46 H new ATOM 2122 N ASP A 136 11.890 7.384 7.984 1.00 0.32 N ATOM 2123 CA ASP A 136 12.587 8.662 8.163 1.00 0.37 C ATOM 2124 C ASP A 136 12.562 9.544 6.916 1.00 0.34 C ATOM 2125 O ASP A 136 13.004 10.692 6.964 1.00 0.36 O ATOM 2126 CB ASP A 136 14.037 8.430 8.599 1.00 0.46 C ATOM 2127 CG ASP A 136 14.869 7.738 7.539 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.166 8.374 6.506 1.00 2.07 O ATOM 2129 OD2 ASP A 136 15.229 6.562 7.745 1.00 1.27 O ATOM 0 H ASP A 136 12.212 6.821 7.197 1.00 0.32 H new ATOM 0 HA ASP A 136 12.044 9.194 8.944 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.495 9.388 8.844 1.00 0.46 H new ATOM 0 HB3 ASP A 136 14.046 7.830 9.509 1.00 0.46 H new ATOM 2134 N HIS A 137 12.051 9.028 5.806 1.00 0.33 N ATOM 2135 CA HIS A 137 11.997 9.812 4.575 1.00 0.35 C ATOM 2136 C HIS A 137 10.560 10.122 4.172 1.00 0.29 C ATOM 2137 O HIS A 137 10.269 11.208 3.669 1.00 0.32 O ATOM 2138 CB HIS A 137 12.707 9.077 3.439 1.00 0.45 C ATOM 2139 CG HIS A 137 14.038 9.666 3.080 1.00 0.63 C ATOM 2140 ND1 HIS A 137 15.168 8.903 2.870 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.418 10.953 2.885 1.00 1.53 C ATOM 2142 CE1 HIS A 137 16.182 9.693 2.564 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.753 10.940 2.566 1.00 1.34 N ATOM 0 H HIS A 137 11.672 8.084 5.730 1.00 0.33 H new ATOM 0 HA HIS A 137 12.508 10.756 4.766 1.00 0.35 H new ATOM 0 HB2 HIS A 137 12.846 8.034 3.724 1.00 0.45 H new ATOM 0 HB3 HIS A 137 12.067 9.084 2.557 1.00 0.45 H new ATOM 0 HD2 HIS A 137 13.787 11.826 2.966 1.00 1.53 H new ATOM 0 HE1 HIS A 137 17.191 9.372 2.349 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.322 11.762 2.363 1.00 1.34 H new ATOM 2152 N LEU A 138 9.666 9.169 4.400 1.00 0.26 N ATOM 2153 CA LEU A 138 8.263 9.341 4.044 1.00 0.25 C ATOM 2154 C LEU A 138 7.424 9.716 5.263 1.00 0.24 C ATOM 2155 O LEU A 138 6.434 10.438 5.147 1.00 0.25 O ATOM 2156 CB LEU A 138 7.726 8.057 3.410 1.00 0.23 C ATOM 2157 CG LEU A 138 6.499 8.232 2.514 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.814 9.149 1.342 1.00 0.26 C ATOM 2159 CD2 LEU A 138 6.013 6.880 2.015 1.00 0.22 C ATOM 0 H LEU A 138 9.886 8.270 4.829 1.00 0.26 H new ATOM 0 HA LEU A 138 8.192 10.157 3.324 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.523 7.602 2.822 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.477 7.355 4.206 1.00 0.23 H new ATOM 0 HG LEU A 138 5.706 8.692 3.103 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.927 9.259 0.718 1.00 0.26 H new ATOM 0 HD12 LEU A 138 7.118 10.126 1.716 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.623 8.719 0.751 1.00 0.26 H new ATOM 0 HD21 LEU A 138 5.139 7.020 1.379 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.805 6.397 1.443 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.746 6.253 2.866 1.00 0.22 H new ATOM 2171 N GLU A 139 7.830 9.223 6.430 1.00 0.26 N ATOM 2172 CA GLU A 139 7.119 9.500 7.678 1.00 0.29 C ATOM 2173 C GLU A 139 6.919 11.006 7.906 1.00 0.30 C ATOM 2174 O GLU A 139 5.806 11.438 8.207 1.00 0.30 O ATOM 2175 CB GLU A 139 7.870 8.878 8.863 1.00 0.36 C ATOM 2176 CG GLU A 139 7.240 9.174 10.215 1.00 0.52 C ATOM 2177 CD GLU A 139 5.878 8.532 10.379 1.00 1.00 C ATOM 2178 OE1 GLU A 139 4.882 9.130 9.921 1.00 1.74 O ATOM 2179 OE2 GLU A 139 5.806 7.432 10.965 1.00 1.46 O ATOM 0 H GLU A 139 8.651 8.627 6.539 1.00 0.26 H new ATOM 0 HA GLU A 139 6.130 9.049 7.599 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.918 7.798 8.724 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.896 9.245 8.863 1.00 0.36 H new ATOM 0 HG2 GLU A 139 7.902 8.819 11.005 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.146 10.253 10.339 1.00 0.52 H new ATOM 2186 N PRO A 140 7.983 11.833 7.770 1.00 0.33 N ATOM 2187 CA PRO A 140 7.880 13.285 7.980 1.00 0.36 C ATOM 2188 C PRO A 140 6.737 13.926 7.198 1.00 0.31 C ATOM 2189 O PRO A 140 5.983 14.731 7.742 1.00 0.36 O ATOM 2190 CB PRO A 140 9.226 13.815 7.485 1.00 0.42 C ATOM 2191 CG PRO A 140 10.167 12.676 7.662 1.00 0.42 C ATOM 2192 CD PRO A 140 9.362 11.432 7.412 1.00 0.35 C ATOM 0 HA PRO A 140 7.666 13.520 9.023 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.170 14.125 6.441 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.545 14.685 8.059 1.00 0.42 H new ATOM 0 HG2 PRO A 140 11.002 12.747 6.965 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.590 12.672 8.666 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.430 11.113 6.372 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.709 10.600 8.024 1.00 0.35 H new ATOM 2200 N TRP A 141 6.608 13.569 5.923 1.00 0.28 N ATOM 2201 CA TRP A 141 5.556 14.130 5.079 1.00 0.25 C ATOM 2202 C TRP A 141 4.180 13.611 5.484 1.00 0.22 C ATOM 2203 O TRP A 141 3.248 14.389 5.684 1.00 0.22 O ATOM 2204 CB TRP A 141 5.816 13.804 3.606 1.00 0.29 C ATOM 2205 CG TRP A 141 4.863 14.493 2.678 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.009 15.734 2.127 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.613 13.985 2.199 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.925 16.029 1.336 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.055 14.970 1.364 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.913 12.791 2.395 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.827 14.798 0.728 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.696 12.622 1.762 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.164 13.620 0.937 1.00 0.36 C ATOM 0 H TRP A 141 7.215 12.897 5.453 1.00 0.28 H new ATOM 0 HA TRP A 141 5.570 15.211 5.216 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.836 14.092 3.350 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.742 12.726 3.459 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.853 16.388 2.289 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.790 16.894 0.813 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.316 12.015 3.029 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.414 15.567 0.093 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.146 11.704 1.906 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.211 13.457 0.456 1.00 0.36 H new ATOM 2224 N ILE A 142 4.062 12.292 5.598 1.00 0.20 N ATOM 2225 CA ILE A 142 2.800 11.656 5.967 1.00 0.19 C ATOM 2226 C ILE A 142 2.183 12.296 7.208 1.00 0.20 C ATOM 2227 O ILE A 142 1.105 12.887 7.141 1.00 0.20 O ATOM 2228 CB ILE A 142 2.996 10.147 6.222 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.481 9.453 4.947 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.701 9.515 6.715 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.901 8.014 5.160 1.00 0.23 C ATOM 0 H ILE A 142 4.829 11.639 5.439 1.00 0.20 H new ATOM 0 HA ILE A 142 2.120 11.799 5.127 1.00 0.19 H new ATOM 0 HB ILE A 142 3.753 10.021 6.996 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.686 9.484 4.202 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.323 10.011 4.538 1.00 0.21 H new ATOM 0 HG21 ILE A 142 1.859 8.451 6.889 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.394 9.993 7.645 1.00 0.25 H new ATOM 0 HG23 ILE A 142 0.922 9.648 5.964 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.232 7.588 4.213 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.718 7.976 5.881 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.055 7.441 5.540 1.00 0.23 H new ATOM 2243 N GLN A 143 2.869 12.168 8.338 1.00 0.25 N ATOM 2244 CA GLN A 143 2.382 12.715 9.600 1.00 0.30 C ATOM 2245 C GLN A 143 2.118 14.216 9.510 1.00 0.29 C ATOM 2246 O GLN A 143 1.297 14.750 10.257 1.00 0.31 O ATOM 2247 CB GLN A 143 3.379 12.425 10.720 1.00 0.40 C ATOM 2248 CG GLN A 143 2.756 11.710 11.906 1.00 0.51 C ATOM 2249 CD GLN A 143 2.809 12.532 13.176 1.00 0.95 C ATOM 2250 OE1 GLN A 143 3.732 12.396 13.976 1.00 1.51 O ATOM 2251 NE2 GLN A 143 1.819 13.397 13.363 1.00 1.60 N ATOM 0 H GLN A 143 3.767 11.689 8.406 1.00 0.25 H new ATOM 0 HA GLN A 143 1.433 12.227 9.822 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.193 11.817 10.325 1.00 0.40 H new ATOM 0 HB3 GLN A 143 3.817 13.364 11.059 1.00 0.40 H new ATOM 0 HG2 GLN A 143 1.718 11.470 11.676 1.00 0.51 H new ATOM 0 HG3 GLN A 143 3.273 10.764 12.068 1.00 0.51 H new ATOM 0 HE21 GLN A 143 1.073 13.476 12.672 1.00 1.60 H new ATOM 0 HE22 GLN A 143 1.804 13.983 14.198 1.00 1.60 H new ATOM 2260 N GLU A 144 2.810 14.896 8.601 1.00 0.29 N ATOM 2261 CA GLU A 144 2.629 16.335 8.441 1.00 0.33 C ATOM 2262 C GLU A 144 1.231 16.647 7.922 1.00 0.29 C ATOM 2263 O GLU A 144 0.637 17.663 8.284 1.00 0.35 O ATOM 2264 CB GLU A 144 3.676 16.914 7.491 1.00 0.41 C ATOM 2265 CG GLU A 144 4.014 18.366 7.786 1.00 0.64 C ATOM 2266 CD GLU A 144 4.884 18.992 6.716 1.00 1.09 C ATOM 2267 OE1 GLU A 144 4.325 19.553 5.751 1.00 1.75 O ATOM 2268 OE2 GLU A 144 6.124 18.922 6.844 1.00 1.25 O ATOM 0 H GLU A 144 3.494 14.479 7.970 1.00 0.29 H new ATOM 0 HA GLU A 144 2.753 16.797 9.420 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.585 16.316 7.554 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.312 16.833 6.467 1.00 0.41 H new ATOM 0 HG2 GLU A 144 3.091 18.938 7.879 1.00 0.64 H new ATOM 0 HG3 GLU A 144 4.525 18.428 8.747 1.00 0.64 H new ATOM 2275 N ASN A 145 0.710 15.769 7.071 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.622 15.952 6.507 1.00 0.28 C ATOM 2277 C ASN A 145 -1.680 15.301 7.393 1.00 0.30 C ATOM 2278 O ASN A 145 -2.831 15.145 6.988 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.688 15.374 5.091 1.00 0.32 C ATOM 2280 CG ASN A 145 0.160 16.159 4.110 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.313 17.106 3.480 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.421 15.768 3.974 1.00 0.33 N ATOM 0 H ASN A 145 1.189 14.925 6.757 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.826 17.022 6.458 1.00 0.28 H new ATOM 0 HB2 ASN A 145 -0.354 14.337 5.108 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.723 15.369 4.751 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.040 16.257 3.328 1.00 0.33 H new ATOM 0 HD22 ASN A 145 1.771 14.978 4.516 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.281 14.928 8.607 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.207 14.305 9.536 1.00 0.30 C ATOM 2291 C GLY A 146 -1.855 12.861 9.837 1.00 0.30 C ATOM 2292 O GLY A 146 -2.327 12.294 10.823 1.00 0.41 O ATOM 0 H GLY A 146 -0.333 15.047 8.963 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.218 14.873 10.466 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.215 14.350 9.123 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.025 12.265 8.987 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.626 10.883 9.183 1.00 0.22 C ATOM 2298 C GLY A 147 -1.440 9.924 8.339 1.00 0.19 C ATOM 2299 O GLY A 147 -2.198 10.348 7.466 1.00 0.20 O ATOM 0 H GLY A 147 -0.621 12.715 8.165 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.430 10.774 8.937 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.737 10.621 10.235 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.282 8.628 8.597 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.016 7.608 7.857 1.00 0.21 C ATOM 2305 C TRP A 148 -3.518 7.852 7.946 1.00 0.23 C ATOM 2306 O TRP A 148 -4.265 7.499 7.037 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.685 6.213 8.393 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.307 5.745 8.039 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.699 5.424 8.905 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.217 5.541 6.722 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.815 5.031 8.207 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.544 5.095 6.865 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.309 5.692 5.435 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.351 4.798 5.771 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.494 5.396 4.350 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.811 4.954 4.524 1.00 0.24 C ATOM 0 H TRP A 148 -0.653 8.261 9.312 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.713 7.667 6.812 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.791 6.215 9.478 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.413 5.501 8.003 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.628 5.472 9.982 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.701 4.739 8.620 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.324 6.033 5.292 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.367 4.457 5.902 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.099 5.507 3.351 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.413 4.732 3.655 1.00 0.24 H new ATOM 2327 N ASP A 149 -3.948 8.461 9.047 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.361 8.758 9.266 1.00 0.31 C ATOM 2329 C ASP A 149 -5.972 9.463 8.058 1.00 0.30 C ATOM 2330 O ASP A 149 -7.126 9.221 7.703 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.525 9.636 10.507 1.00 0.40 C ATOM 2332 CG ASP A 149 -6.415 9.001 11.554 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -7.651 9.060 11.396 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -5.875 8.445 12.532 1.00 1.94 O ATOM 0 H ASP A 149 -3.335 8.760 9.805 1.00 0.26 H new ATOM 0 HA ASP A 149 -5.883 7.813 9.413 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -4.544 9.834 10.940 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -5.944 10.599 10.214 1.00 0.40 H new ATOM 2339 N THR A 150 -5.188 10.335 7.436 1.00 0.27 N ATOM 2340 CA THR A 150 -5.643 11.084 6.271 1.00 0.29 C ATOM 2341 C THR A 150 -5.740 10.187 5.040 1.00 0.28 C ATOM 2342 O THR A 150 -6.773 10.147 4.372 1.00 0.33 O ATOM 2343 CB THR A 150 -4.695 12.258 5.964 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.544 13.080 7.128 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.224 13.098 4.812 1.00 0.37 C ATOM 0 H THR A 150 -4.230 10.541 7.720 1.00 0.27 H new ATOM 0 HA THR A 150 -6.633 11.473 6.508 1.00 0.29 H new ATOM 0 HB THR A 150 -3.727 11.848 5.677 1.00 0.33 H new ATOM 0 HG1 THR A 150 -3.906 13.800 6.940 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.536 13.920 4.615 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.312 12.478 3.920 1.00 0.37 H new ATOM 0 HG23 THR A 150 -6.203 13.499 5.074 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.656 9.476 4.745 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.615 8.581 3.592 1.00 0.25 C ATOM 2355 C PHE A 151 -5.762 7.578 3.639 1.00 0.26 C ATOM 2356 O PHE A 151 -6.489 7.406 2.660 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.279 7.838 3.546 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.137 6.929 2.359 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -2.853 7.444 1.106 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -3.285 5.558 2.498 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -2.719 6.611 0.012 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -3.154 4.720 1.408 1.00 0.28 C ATOM 2363 CZ PHE A 151 -2.870 5.247 0.163 1.00 0.34 C ATOM 0 H PHE A 151 -3.793 9.502 5.289 1.00 0.24 H new ATOM 0 HA PHE A 151 -4.721 9.186 2.691 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.468 8.566 3.534 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.168 7.251 4.458 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -2.735 8.510 0.982 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -3.505 5.140 3.469 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -2.496 7.026 -0.960 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -3.274 3.653 1.529 1.00 0.28 H new ATOM 0 HZ PHE A 151 -2.766 4.593 -0.690 1.00 0.34 H new ATOM 2373 N VAL A 152 -5.913 6.918 4.781 1.00 0.25 N ATOM 2374 CA VAL A 152 -6.971 5.933 4.961 1.00 0.29 C ATOM 2375 C VAL A 152 -8.343 6.572 4.797 1.00 0.35 C ATOM 2376 O VAL A 152 -9.319 5.894 4.476 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.892 5.263 6.345 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.951 4.179 6.477 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.505 4.692 6.583 1.00 0.28 C ATOM 0 H VAL A 152 -5.315 7.048 5.597 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.829 5.173 4.193 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.084 6.021 7.105 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.879 3.718 7.462 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.940 4.620 6.355 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.794 3.422 5.709 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.469 4.223 7.566 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.281 3.949 5.818 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.768 5.494 6.536 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.419 7.879 5.015 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.684 8.582 4.883 1.00 0.46 C ATOM 2391 C GLU A 153 -10.024 8.800 3.414 1.00 0.51 C ATOM 2392 O GLU A 153 -11.180 9.030 3.059 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.655 9.920 5.620 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.016 10.598 5.667 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.040 11.807 6.578 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.757 12.920 6.091 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -11.347 11.640 7.777 1.00 1.42 O ATOM 0 H GLU A 153 -7.628 8.466 5.281 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.457 7.961 5.337 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.298 9.761 6.638 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -8.941 10.583 5.132 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.300 10.903 4.660 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -11.763 9.880 6.005 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.005 8.721 2.564 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.184 8.909 1.129 1.00 0.59 C ATOM 2406 C LEU A 154 -9.479 7.586 0.434 1.00 0.68 C ATOM 2407 O LEU A 154 -10.590 7.359 -0.046 1.00 0.74 O ATOM 2408 CB LEU A 154 -7.932 9.539 0.519 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.635 10.969 0.967 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.217 11.357 0.586 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.634 11.937 0.353 1.00 0.67 C ATOM 0 H LEU A 154 -8.044 8.527 2.846 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.035 9.575 0.983 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.074 8.913 0.765 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.033 9.530 -0.566 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.729 11.019 2.052 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -6.019 12.378 0.911 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.512 10.680 1.068 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.100 11.292 -0.496 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.408 12.951 0.683 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.569 11.886 -0.734 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.642 11.669 0.670 1.00 0.67 H new ATOM 2423 N TYR A 155 -8.474 6.718 0.380 1.00 0.75 N ATOM 2424 CA TYR A 155 -8.616 5.420 -0.266 1.00 0.90 C ATOM 2425 C TYR A 155 -9.361 4.436 0.612 1.00 0.97 C ATOM 2426 O TYR A 155 -10.233 3.714 0.129 1.00 1.15 O ATOM 2427 CB TYR A 155 -7.250 4.852 -0.628 1.00 0.98 C ATOM 2428 CG TYR A 155 -6.683 5.450 -1.887 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -7.153 5.054 -3.130 1.00 1.05 C ATOM 2430 CD2 TYR A 155 -5.687 6.414 -1.834 1.00 0.98 C ATOM 2431 CE1 TYR A 155 -6.643 5.600 -4.288 1.00 1.10 C ATOM 2432 CE2 TYR A 155 -5.171 6.965 -2.989 1.00 1.03 C ATOM 2433 CZ TYR A 155 -5.653 6.556 -4.213 1.00 1.08 C ATOM 2434 OH TYR A 155 -5.143 7.104 -5.366 1.00 1.17 O ATOM 0 H TYR A 155 -7.551 6.891 0.777 1.00 0.75 H new ATOM 0 HA TYR A 155 -9.198 5.572 -1.175 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -6.559 5.029 0.196 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -7.332 3.772 -0.749 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -7.930 4.307 -3.192 1.00 1.05 H new ATOM 0 HD2 TYR A 155 -5.310 6.738 -0.875 1.00 0.98 H new ATOM 0 HE1 TYR A 155 -7.017 5.280 -5.249 1.00 1.10 H new ATOM 0 HE2 TYR A 155 -4.394 7.713 -2.934 1.00 1.03 H new ATOM 0 HH TYR A 155 -4.454 7.763 -5.138 1.00 1.17 H new ATOM 2444 N GLY A 156 -9.001 4.395 1.894 1.00 0.89 N ATOM 2445 CA GLY A 156 -9.663 3.491 2.811 1.00 1.02 C ATOM 2446 C GLY A 156 -11.152 3.491 2.588 1.00 1.11 C ATOM 2447 O GLY A 156 -11.852 4.404 3.028 1.00 1.68 O ATOM 0 H GLY A 156 -8.267 4.969 2.309 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -9.272 2.482 2.679 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -9.445 3.785 3.838 1.00 1.02 H new ATOM 2451 N ASN A 157 -11.639 2.478 1.880 1.00 1.62 N ATOM 2452 CA ASN A 157 -13.051 2.396 1.582 1.00 2.05 C ATOM 2453 C ASN A 157 -13.870 2.451 2.846 1.00 2.33 C ATOM 2454 O ASN A 157 -15.077 2.606 2.784 1.00 2.52 O ATOM 2455 CB ASN A 157 -13.407 1.145 0.796 1.00 3.21 C ATOM 2456 CG ASN A 157 -14.882 1.128 0.454 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -15.696 0.581 1.198 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -15.239 1.755 -0.660 1.00 4.60 N ATOM 0 H ASN A 157 -11.077 1.712 1.508 1.00 1.62 H new ATOM 0 HA ASN A 157 -13.286 3.259 0.959 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -12.816 1.104 -0.119 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -13.154 0.259 1.379 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -16.222 1.797 -0.929 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -14.530 2.195 -1.247 1.00 4.60 H new ATOM 2465 N ASN A 158 -13.227 2.281 3.992 1.00 2.99 N ATOM 2466 CA ASN A 158 -13.946 2.382 5.238 1.00 4.03 C ATOM 2467 C ASN A 158 -14.384 3.816 5.393 1.00 4.18 C ATOM 2468 O ASN A 158 -15.510 4.097 5.778 1.00 4.81 O ATOM 2469 CB ASN A 158 -13.109 1.964 6.428 1.00 5.08 C ATOM 2470 CG ASN A 158 -13.913 2.073 7.701 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -14.607 1.136 8.088 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -13.842 3.229 8.347 1.00 6.76 N ATOM 0 H ASN A 158 -12.231 2.077 4.078 1.00 2.99 H new ATOM 0 HA ASN A 158 -14.799 1.704 5.210 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -12.763 0.939 6.295 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -12.222 2.593 6.496 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -14.378 3.368 9.204 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -13.252 3.979 7.987 1.00 6.76 H new ATOM 2479 N ALA A 159 -13.466 4.728 5.105 1.00 3.95 N ATOM 2480 CA ALA A 159 -13.791 6.134 5.133 1.00 4.72 C ATOM 2481 C ALA A 159 -14.823 6.357 4.058 1.00 4.66 C ATOM 2482 O ALA A 159 -15.693 7.219 4.162 1.00 5.63 O ATOM 2483 CB ALA A 159 -12.563 6.982 4.885 1.00 4.78 C ATOM 0 H ALA A 159 -12.501 4.516 4.852 1.00 3.95 H new ATOM 0 HA ALA A 159 -14.175 6.424 6.111 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -12.838 8.037 4.912 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -11.820 6.781 5.657 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -12.145 6.740 3.908 1.00 4.78 H new ATOM 2489 N ALA A 160 -14.695 5.552 3.008 1.00 3.75 N ATOM 2490 CA ALA A 160 -15.629 5.579 1.910 1.00 4.08 C ATOM 2491 C ALA A 160 -16.857 4.791 2.315 1.00 4.33 C ATOM 2492 O ALA A 160 -17.871 4.815 1.633 1.00 5.11 O ATOM 2493 CB ALA A 160 -15.011 5.011 0.647 1.00 3.59 C ATOM 0 H ALA A 160 -13.943 4.870 2.903 1.00 3.75 H new ATOM 0 HA ALA A 160 -15.905 6.610 1.689 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -15.740 5.045 -0.162 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -14.137 5.601 0.373 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -14.711 3.978 0.822 1.00 3.59 H new ATOM 2499 N ALA A 161 -16.716 4.063 3.428 1.00 3.93 N ATOM 2500 CA ALA A 161 -17.795 3.277 4.002 1.00 4.43 C ATOM 2501 C ALA A 161 -18.544 4.187 4.933 1.00 5.54 C ATOM 2502 O ALA A 161 -19.687 3.936 5.305 1.00 6.11 O ATOM 2503 CB ALA A 161 -17.283 2.051 4.739 1.00 4.39 C ATOM 0 H ALA A 161 -15.843 4.007 3.953 1.00 3.93 H new ATOM 0 HA ALA A 161 -18.442 2.898 3.211 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -18.126 1.496 5.150 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -16.732 1.414 4.047 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -16.624 2.362 5.549 1.00 4.39 H new ATOM 2509 N GLU A 162 -17.829 5.231 5.341 1.00 5.98 N ATOM 2510 CA GLU A 162 -18.383 6.278 6.159 1.00 7.23 C ATOM 2511 C GLU A 162 -18.977 7.241 5.175 1.00 7.80 C ATOM 2512 O GLU A 162 -19.928 7.966 5.457 1.00 8.75 O ATOM 2513 CB GLU A 162 -17.310 6.943 7.016 1.00 7.72 C ATOM 2514 CG GLU A 162 -16.509 5.955 7.847 1.00 7.99 C ATOM 2515 CD GLU A 162 -17.320 4.737 8.251 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -17.986 4.792 9.302 1.00 9.03 O ATOM 2517 OE2 GLU A 162 -17.292 3.732 7.512 1.00 9.09 O ATOM 0 H GLU A 162 -16.845 5.365 5.107 1.00 5.98 H new ATOM 0 HA GLU A 162 -19.122 5.903 6.867 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -16.631 7.498 6.369 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -17.782 7.667 7.680 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -15.636 5.633 7.280 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -16.141 6.455 8.743 1.00 7.99 H new ATOM 2524 N SER A 163 -18.362 7.229 3.995 1.00 7.39 N ATOM 2525 CA SER A 163 -18.845 7.993 2.880 1.00 8.21 C ATOM 2526 C SER A 163 -19.929 7.135 2.279 1.00 8.28 C ATOM 2527 O SER A 163 -20.788 7.606 1.540 1.00 9.15 O ATOM 2528 CB SER A 163 -17.744 8.276 1.859 1.00 8.03 C ATOM 2529 OG SER A 163 -17.731 7.294 0.840 1.00 7.86 O ATOM 0 H SER A 163 -17.520 6.688 3.799 1.00 7.39 H new ATOM 0 HA SER A 163 -19.207 8.973 3.190 1.00 8.21 H new ATOM 0 HB2 SER A 163 -17.897 9.261 1.418 1.00 8.03 H new ATOM 0 HB3 SER A 163 -16.776 8.298 2.360 1.00 8.03 H new ATOM 0 HG SER A 163 -17.132 7.579 0.118 1.00 7.86 H new ATOM 2535 N ARG A 164 -19.843 5.833 2.598 1.00 7.47 N ATOM 2536 CA ARG A 164 -20.852 4.889 2.185 1.00 7.60 C ATOM 2537 C ARG A 164 -21.919 4.967 3.238 1.00 8.33 C ATOM 2538 O ARG A 164 -23.089 4.706 2.990 1.00 8.87 O ATOM 2539 CB ARG A 164 -20.338 3.466 2.011 1.00 6.69 C ATOM 2540 CG ARG A 164 -21.283 2.573 1.225 1.00 6.19 C ATOM 2541 CD ARG A 164 -22.322 1.938 2.131 1.00 5.74 C ATOM 2542 NE ARG A 164 -21.737 1.534 3.403 1.00 5.66 N ATOM 2543 CZ ARG A 164 -22.156 1.979 4.577 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -23.197 2.782 4.643 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -21.543 1.610 5.688 1.00 6.02 N ATOM 0 H ARG A 164 -19.080 5.427 3.140 1.00 7.47 H new ATOM 0 HA ARG A 164 -21.223 5.148 1.193 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -19.373 3.496 1.505 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -20.169 3.026 2.994 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -21.781 3.158 0.451 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -20.714 1.794 0.719 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -23.133 2.644 2.309 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -22.758 1.070 1.636 1.00 5.74 H new ATOM 0 HE ARG A 164 -20.962 0.872 3.388 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -23.681 3.061 3.789 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -23.520 3.125 5.548 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -20.743 0.979 5.644 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -21.870 1.956 6.590 1.00 6.02 H new ATOM 2559 N LYS A 165 -21.484 5.328 4.441 1.00 8.52 N ATOM 2560 CA LYS A 165 -22.414 5.595 5.499 1.00 9.41 C ATOM 2561 C LYS A 165 -23.068 6.843 5.000 1.00 10.47 C ATOM 2562 O LYS A 165 -24.229 7.130 5.257 1.00 11.24 O ATOM 2563 CB LYS A 165 -21.720 5.822 6.840 1.00 9.61 C ATOM 2564 CG LYS A 165 -22.633 6.398 7.909 1.00 9.69 C ATOM 2565 CD LYS A 165 -23.363 5.313 8.679 1.00 10.12 C ATOM 2566 CE LYS A 165 -24.567 4.796 7.914 1.00 10.34 C ATOM 2567 NZ LYS A 165 -24.300 3.470 7.298 1.00 10.42 N ATOM 0 H LYS A 165 -20.502 5.438 4.693 1.00 8.52 H new ATOM 0 HA LYS A 165 -23.101 4.772 5.699 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -21.313 4.875 7.194 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -20.876 6.496 6.693 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -22.045 7.001 8.601 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -23.360 7.064 7.444 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -22.680 4.489 8.883 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -23.686 5.705 9.643 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -25.420 4.719 8.588 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -24.838 5.510 7.137 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -25.020 3.272 6.575 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -23.358 3.476 6.857 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -24.334 2.733 8.031 1.00 10.42 H new ATOM 2581 N GLY A 166 -22.245 7.580 4.251 1.00 10.61 N ATOM 2582 CA GLY A 166 -22.703 8.745 3.566 1.00 11.72 C ATOM 2583 C GLY A 166 -23.597 8.253 2.479 1.00 12.02 C ATOM 2584 O GLY A 166 -24.592 8.856 2.153 1.00 13.02 O ATOM 0 H GLY A 166 -21.256 7.372 4.116 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -23.240 9.410 4.242 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -21.867 9.312 3.158 1.00 11.72 H new ATOM 2588 N GLN A 167 -23.236 7.099 1.932 1.00 11.25 N ATOM 2589 CA GLN A 167 -24.058 6.459 0.939 1.00 11.64 C ATOM 2590 C GLN A 167 -25.214 5.804 1.669 1.00 12.01 C ATOM 2591 O GLN A 167 -25.945 4.984 1.126 1.00 12.84 O ATOM 2592 CB GLN A 167 -23.285 5.429 0.109 1.00 10.86 C ATOM 2593 CG GLN A 167 -22.180 6.037 -0.736 1.00 11.50 C ATOM 2594 CD GLN A 167 -22.602 7.317 -1.412 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -22.494 8.399 -0.836 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -23.086 7.202 -2.640 1.00 12.41 N ATOM 0 H GLN A 167 -22.380 6.596 2.165 1.00 11.25 H new ATOM 0 HA GLN A 167 -24.412 7.205 0.227 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -22.852 4.686 0.779 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -23.982 4.903 -0.543 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -21.312 6.233 -0.106 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -21.869 5.317 -1.493 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -23.156 6.283 -3.076 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -23.388 8.033 -3.149 1.00 12.41 H new ATOM 2605 N GLU A 168 -25.297 6.137 2.952 1.00 11.51 N ATOM 2606 CA GLU A 168 -26.358 5.686 3.818 1.00 11.94 C ATOM 2607 C GLU A 168 -26.881 6.886 4.589 1.00 13.03 C ATOM 2608 O GLU A 168 -27.503 6.767 5.641 1.00 13.73 O ATOM 2609 CB GLU A 168 -25.906 4.570 4.750 1.00 11.38 C ATOM 2610 CG GLU A 168 -25.992 3.198 4.105 1.00 10.85 C ATOM 2611 CD GLU A 168 -27.247 3.020 3.275 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -28.352 3.192 3.826 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -27.121 2.726 2.069 1.00 10.74 O ATOM 0 H GLU A 168 -24.616 6.736 3.418 1.00 11.51 H new ATOM 0 HA GLU A 168 -27.158 5.256 3.215 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -24.878 4.757 5.062 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -26.520 4.583 5.650 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -25.118 3.043 3.472 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -25.963 2.434 4.881 1.00 10.85 H new ATOM 2620 N ARG A 169 -26.624 8.045 4.000 1.00 13.26 N ATOM 2621 CA ARG A 169 -27.053 9.337 4.517 1.00 14.38 C ATOM 2622 C ARG A 169 -27.276 10.253 3.328 1.00 15.16 C ATOM 2623 O ARG A 169 -27.864 11.327 3.428 1.00 16.19 O ATOM 2624 CB ARG A 169 -25.997 9.934 5.433 1.00 14.52 C ATOM 2625 CG ARG A 169 -25.747 9.130 6.692 1.00 14.72 C ATOM 2626 CD ARG A 169 -24.442 9.545 7.348 1.00 14.96 C ATOM 2627 NE ARG A 169 -23.512 10.141 6.390 1.00 14.97 N ATOM 2628 CZ ARG A 169 -22.202 9.936 6.402 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -21.654 9.161 7.321 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -21.434 10.513 5.492 1.00 15.37 N ATOM 0 H ARG A 169 -26.099 8.115 3.128 1.00 13.26 H new ATOM 0 HA ARG A 169 -27.967 9.219 5.099 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -25.062 10.025 4.881 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -26.302 10.942 5.713 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -26.572 9.274 7.390 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -25.716 8.068 6.450 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -24.648 10.259 8.145 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -23.977 8.675 7.812 1.00 14.96 H new ATOM 0 HE ARG A 169 -23.894 10.752 5.668 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -22.239 8.716 8.028 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -20.646 9.008 7.324 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -21.850 11.115 4.782 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -20.426 10.355 5.501 1.00 15.37 H new ATOM 2644 N LEU A 170 -26.786 9.776 2.199 1.00 14.77 N ATOM 2645 CA LEU A 170 -26.885 10.449 0.922 1.00 15.59 C ATOM 2646 C LEU A 170 -27.380 9.418 -0.054 1.00 16.06 C ATOM 2647 O LEU A 170 -28.397 9.594 -0.721 1.00 17.05 O ATOM 2648 CB LEU A 170 -25.526 10.976 0.457 1.00 15.16 C ATOM 2649 CG LEU A 170 -24.623 11.530 1.558 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -23.164 11.333 1.187 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -24.916 12.997 1.797 1.00 15.45 C ATOM 0 H LEU A 170 -26.294 8.884 2.146 1.00 14.77 H new ATOM 0 HA LEU A 170 -27.553 11.307 0.997 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -24.997 10.169 -0.050 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -25.693 11.761 -0.281 1.00 15.16 H new ATOM 0 HG LEU A 170 -24.825 10.986 2.481 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -22.530 11.732 1.979 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -22.961 10.270 1.061 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -22.952 11.856 0.255 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -24.264 13.375 2.584 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -24.739 13.558 0.879 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -25.956 13.116 2.100 1.00 15.45 H new ATOM 2663 N GLU A 171 -26.646 8.314 -0.109 1.00 15.42 N ATOM 2664 CA GLU A 171 -27.021 7.212 -0.950 1.00 15.90 C ATOM 2665 C GLU A 171 -27.817 6.225 -0.121 1.00 16.52 C ATOM 2666 O GLU A 171 -28.040 5.097 -0.545 1.00 17.29 O ATOM 2667 CB GLU A 171 -25.816 6.527 -1.585 1.00 15.17 C ATOM 2668 CG GLU A 171 -26.092 5.871 -2.927 1.00 15.22 C ATOM 2669 CD GLU A 171 -26.857 4.570 -2.799 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -26.488 3.748 -1.933 1.00 15.07 O ATOM 2671 OE2 GLU A 171 -27.822 4.369 -3.562 1.00 14.68 O ATOM 0 H GLU A 171 -25.788 8.169 0.424 1.00 15.42 H new ATOM 0 HA GLU A 171 -27.625 7.595 -1.773 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -25.022 7.263 -1.712 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -25.441 5.770 -0.896 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -26.659 6.560 -3.553 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -25.146 5.682 -3.435 1.00 15.22 H new ATOM 2678 N HIS A 172 -28.188 6.619 1.107 1.00 16.27 N ATOM 2679 CA HIS A 172 -29.026 5.749 1.921 1.00 16.96 C ATOM 2680 C HIS A 172 -30.206 5.442 1.100 1.00 17.80 C ATOM 2681 O HIS A 172 -31.127 6.258 1.007 1.00 18.06 O ATOM 2682 CB HIS A 172 -29.519 6.374 3.224 1.00 16.71 C ATOM 2683 CG HIS A 172 -29.817 7.832 3.154 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -30.295 8.535 4.233 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -29.718 8.722 2.140 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -30.479 9.791 3.890 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -30.136 9.930 2.625 1.00 16.80 N ATOM 0 H HIS A 172 -27.928 7.505 1.540 1.00 16.27 H new ATOM 0 HA HIS A 172 -28.429 4.883 2.207 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -30.420 5.850 3.542 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -28.766 6.210 3.995 1.00 16.71 H new ATOM 0 HD1 HIS A 172 -30.479 8.144 5.157 1.00 16.51 H new ATOM 0 HD2 HIS A 172 -29.374 8.517 1.137 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -30.848 10.575 4.535 1.00 16.61 H new ATOM 2696 N HIS A 173 -30.190 4.284 0.464 1.00 18.31 N ATOM 2697 CA HIS A 173 -31.278 3.937 -0.406 1.00 19.22 C ATOM 2698 C HIS A 173 -31.334 5.013 -1.474 1.00 19.76 C ATOM 2699 O HIS A 173 -32.194 5.040 -2.339 1.00 19.79 O ATOM 2700 CB HIS A 173 -32.564 3.858 0.411 1.00 19.61 C ATOM 2701 CG HIS A 173 -32.317 3.751 1.875 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -31.612 2.715 2.437 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -32.616 4.595 2.880 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -31.485 2.928 3.731 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -32.086 4.064 4.025 1.00 20.87 N ATOM 0 H HIS A 173 -29.449 3.587 0.536 1.00 18.31 H new ATOM 0 HA HIS A 173 -31.146 2.964 -0.879 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -33.168 4.743 0.214 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -33.145 2.996 0.082 1.00 19.61 H new ATOM 0 HD2 HIS A 173 -33.170 5.518 2.798 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -30.976 2.282 4.431 1.00 20.74 H new ATOM 0 HE2 HIS A 173 -32.146 4.480 4.955 1.00 20.87 H new ATOM 2714 N HIS A 174 -30.314 5.849 -1.394 1.00 20.30 N ATOM 2715 CA HIS A 174 -30.102 6.996 -2.225 1.00 20.96 C ATOM 2716 C HIS A 174 -31.201 7.995 -2.058 1.00 21.59 C ATOM 2717 O HIS A 174 -32.361 7.639 -1.919 1.00 21.97 O ATOM 2718 CB HIS A 174 -29.853 6.638 -3.667 1.00 21.33 C ATOM 2719 CG HIS A 174 -28.788 7.508 -4.222 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -28.251 8.555 -3.503 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -28.124 7.476 -5.392 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -27.301 9.129 -4.206 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -27.202 8.495 -5.360 1.00 21.66 N ATOM 0 H HIS A 174 -29.574 5.728 -0.703 1.00 20.30 H new ATOM 0 HA HIS A 174 -29.181 7.470 -1.885 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -29.559 5.591 -3.746 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -30.770 6.756 -4.244 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -28.285 6.781 -6.203 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -26.704 9.973 -3.894 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -26.547 8.724 -6.107 1.00 21.66 H new ATOM 2732 N HIS A 175 -30.820 9.261 -2.068 1.00 21.78 N ATOM 2733 CA HIS A 175 -31.767 10.323 -1.843 1.00 22.46 C ATOM 2734 C HIS A 175 -32.695 9.890 -0.742 1.00 23.08 C ATOM 2735 O HIS A 175 -33.911 9.883 -0.893 1.00 23.17 O ATOM 2736 CB HIS A 175 -32.566 10.682 -3.086 1.00 22.43 C ATOM 2737 CG HIS A 175 -31.806 10.545 -4.348 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -30.444 10.375 -4.390 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -32.230 10.527 -5.626 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -30.061 10.259 -5.645 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -31.126 10.347 -6.415 1.00 22.28 N ATOM 0 H HIS A 175 -29.862 9.571 -2.230 1.00 21.78 H new ATOM 0 HA HIS A 175 -31.214 11.221 -1.568 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -33.449 10.045 -3.134 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -32.918 11.710 -2.995 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -33.250 10.634 -5.965 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -29.046 10.116 -5.985 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -31.128 10.290 -7.433 1.00 22.28 H new ATOM 2750 N HIS A 176 -32.092 9.474 0.359 1.00 23.60 N ATOM 2751 CA HIS A 176 -32.838 9.065 1.532 1.00 24.32 C ATOM 2752 C HIS A 176 -33.789 7.931 1.234 1.00 24.96 C ATOM 2753 O HIS A 176 -33.698 7.265 0.205 1.00 25.33 O ATOM 2754 CB HIS A 176 -33.587 10.275 2.084 1.00 24.63 C ATOM 2755 CG HIS A 176 -32.977 11.555 1.616 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -33.331 12.152 0.426 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -31.965 12.289 2.115 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -32.556 13.191 0.211 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -31.717 13.300 1.222 1.00 24.83 N ATOM 0 H HIS A 176 -31.079 9.411 0.463 1.00 23.60 H new ATOM 0 HA HIS A 176 -32.137 8.690 2.278 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -34.630 10.232 1.772 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -33.579 10.244 3.174 1.00 24.63 H new ATOM 0 HD2 HIS A 176 -31.445 12.114 3.045 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -32.599 13.844 -0.648 1.00 25.05 H new ATOM 0 HE2 HIS A 176 -31.000 14.019 1.324 1.00 24.83 H new ATOM 2768 N HIS A 177 -34.693 7.728 2.161 1.00 25.19 N ATOM 2769 CA HIS A 177 -35.679 6.681 2.065 1.00 25.89 C ATOM 2770 C HIS A 177 -36.808 7.104 1.159 1.00 26.38 C ATOM 2771 O HIS A 177 -37.471 6.259 0.563 1.00 26.64 O ATOM 2772 CB HIS A 177 -36.183 6.352 3.456 1.00 26.07 C ATOM 2773 CG HIS A 177 -35.061 6.204 4.424 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -34.046 7.134 4.539 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -34.760 5.216 5.291 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -33.170 6.720 5.429 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -33.578 5.559 5.901 1.00 27.04 N ATOM 0 H HIS A 177 -34.765 8.289 3.010 1.00 25.19 H new ATOM 0 HA HIS A 177 -35.230 5.788 1.631 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -36.856 7.139 3.796 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -36.762 5.429 3.425 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -35.339 4.323 5.472 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -32.271 7.242 5.722 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -33.094 5.004 6.606 1.00 27.04 H new ATOM 2786 N LEU A 178 -37.055 8.413 1.085 1.00 26.60 N ATOM 2787 CA LEU A 178 -38.076 8.917 0.183 1.00 27.15 C ATOM 2788 C LEU A 178 -37.816 8.253 -1.139 1.00 27.42 C ATOM 2789 O LEU A 178 -38.709 7.762 -1.818 1.00 27.57 O ATOM 2790 CB LEU A 178 -37.986 10.429 0.054 1.00 27.23 C ATOM 2791 CG LEU A 178 -36.575 10.970 -0.155 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -36.329 11.270 -1.625 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -36.366 12.211 0.693 1.00 27.61 C ATOM 0 H LEU A 178 -36.570 9.126 1.629 1.00 26.60 H new ATOM 0 HA LEU A 178 -39.078 8.697 0.552 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -38.609 10.746 -0.782 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -38.404 10.882 0.953 1.00 27.23 H new ATOM 0 HG LEU A 178 -35.857 10.211 0.156 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -35.317 11.655 -1.753 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -36.446 10.356 -2.207 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -37.047 12.014 -1.970 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -35.356 12.591 0.538 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -37.089 12.974 0.406 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -36.502 11.960 1.745 1.00 27.61 H new ATOM 2805 N GLU A 179 -36.547 8.243 -1.467 1.00 27.58 N ATOM 2806 CA GLU A 179 -36.063 7.577 -2.627 1.00 27.93 C ATOM 2807 C GLU A 179 -35.332 6.384 -2.109 1.00 28.01 C ATOM 2808 O GLU A 179 -34.134 6.273 -2.235 1.00 27.88 O ATOM 2809 CB GLU A 179 -35.140 8.466 -3.443 1.00 28.15 C ATOM 2810 CG GLU A 179 -34.676 7.834 -4.740 1.00 28.46 C ATOM 2811 CD GLU A 179 -33.348 7.133 -4.594 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -32.328 7.825 -4.561 1.00 29.20 O ATOM 2813 OE2 GLU A 179 -33.330 5.895 -4.503 1.00 29.07 O ATOM 0 H GLU A 179 -35.821 8.707 -0.921 1.00 27.58 H new ATOM 0 HA GLU A 179 -36.877 7.304 -3.299 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -35.655 9.400 -3.668 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -34.268 8.720 -2.840 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -35.425 7.120 -5.082 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -34.595 8.603 -5.508 1.00 28.46 H new ATOM 2820 N HIS A 180 -36.065 5.532 -1.432 1.00 28.32 N ATOM 2821 CA HIS A 180 -35.483 4.355 -0.852 1.00 28.53 C ATOM 2822 C HIS A 180 -34.665 3.596 -1.873 1.00 28.95 C ATOM 2823 O HIS A 180 -34.524 4.028 -3.012 1.00 29.23 O ATOM 2824 CB HIS A 180 -36.543 3.456 -0.259 1.00 28.74 C ATOM 2825 CG HIS A 180 -36.004 2.652 0.860 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -35.613 3.212 2.051 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -35.739 1.333 0.954 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -35.126 2.273 2.834 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -35.191 1.124 2.191 1.00 28.84 N ATOM 0 H HIS A 180 -37.067 5.636 -1.272 1.00 28.32 H new ATOM 0 HA HIS A 180 -34.821 4.679 -0.049 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -37.379 4.060 0.094 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -36.933 2.793 -1.031 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -35.924 0.584 0.198 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -34.740 2.419 3.832 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -34.882 0.223 2.557 1.00 28.84 H new ATOM 2838 N HIS A 181 -34.110 2.464 -1.467 1.00 29.09 N ATOM 2839 CA HIS A 181 -33.318 1.688 -2.375 1.00 29.57 C ATOM 2840 C HIS A 181 -34.184 1.220 -3.500 1.00 29.91 C ATOM 2841 O HIS A 181 -33.693 0.731 -4.515 1.00 30.13 O ATOM 2842 CB HIS A 181 -32.595 0.542 -1.693 1.00 29.72 C ATOM 2843 CG HIS A 181 -31.141 0.841 -1.568 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -30.492 0.932 -0.360 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -30.224 1.159 -2.512 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -29.237 1.298 -0.563 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -29.052 1.442 -1.860 1.00 30.14 N ATOM 0 H HIS A 181 -34.198 2.077 -0.527 1.00 29.09 H new ATOM 0 HA HIS A 181 -32.527 2.324 -2.774 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -33.023 0.371 -0.705 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -32.736 -0.375 -2.264 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -30.386 1.185 -3.579 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -28.492 1.452 0.203 1.00 29.92 H new ATOM 0 HE2 HIS A 181 -28.178 1.719 -2.306 1.00 30.14 H new ATOM 2856 N HIS A 182 -35.494 1.386 -3.320 1.00 30.03 N ATOM 2857 CA HIS A 182 -36.428 1.070 -4.372 1.00 30.43 C ATOM 2858 C HIS A 182 -35.962 1.846 -5.579 1.00 30.87 C ATOM 2859 O HIS A 182 -36.279 1.537 -6.721 1.00 31.02 O ATOM 2860 CB HIS A 182 -37.856 1.477 -3.979 1.00 30.52 C ATOM 2861 CG HIS A 182 -38.009 2.909 -3.538 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -38.800 3.278 -2.471 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -37.504 4.064 -4.038 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -38.776 4.590 -2.336 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -37.997 5.089 -3.273 1.00 30.28 N ATOM 0 H HIS A 182 -35.918 1.735 -2.460 1.00 30.03 H new ATOM 0 HA HIS A 182 -36.457 -0.001 -4.571 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -38.515 1.302 -4.829 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -38.195 0.826 -3.173 1.00 30.52 H new ATOM 0 HD1 HIS A 182 -39.324 2.635 -1.877 1.00 30.34 H new ATOM 0 HD2 HIS A 182 -36.837 4.159 -4.882 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -39.305 5.158 -1.585 1.00 30.28 H new ATOM 2874 N HIS A 183 -35.176 2.861 -5.253 1.00 31.15 N ATOM 2875 CA HIS A 183 -34.569 3.745 -6.199 1.00 31.67 C ATOM 2876 C HIS A 183 -35.531 4.198 -7.250 1.00 32.06 C ATOM 2877 O HIS A 183 -35.879 3.443 -8.155 1.00 32.12 O ATOM 2878 CB HIS A 183 -33.364 3.081 -6.850 1.00 31.92 C ATOM 2879 CG HIS A 183 -32.068 3.481 -6.230 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -30.995 3.924 -6.964 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -31.674 3.500 -4.939 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -29.993 4.196 -6.151 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -30.381 3.948 -4.917 1.00 31.97 N ATOM 0 H HIS A 183 -34.944 3.088 -4.286 1.00 31.15 H new ATOM 0 HA HIS A 183 -34.245 4.628 -5.648 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -33.473 1.999 -6.783 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -33.346 3.334 -7.910 1.00 31.92 H new ATOM 0 HD1 HIS A 183 -30.976 4.027 -7.979 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -32.268 3.215 -4.083 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -29.020 4.560 -6.447 1.00 31.97 H new ATOM 2892 N HIS A 184 -35.968 5.440 -7.133 1.00 32.40 N ATOM 2893 CA HIS A 184 -36.832 6.007 -8.140 1.00 32.88 C ATOM 2894 C HIS A 184 -36.136 5.802 -9.464 1.00 33.44 C ATOM 2895 O HIS A 184 -36.729 5.856 -10.534 1.00 33.70 O ATOM 2896 CB HIS A 184 -37.054 7.488 -7.871 1.00 33.08 C ATOM 2897 CG HIS A 184 -37.596 7.754 -6.508 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -37.524 8.982 -5.895 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -38.249 6.942 -5.646 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -38.114 8.917 -4.716 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -38.561 7.688 -4.542 1.00 32.91 N ATOM 0 H HIS A 184 -35.740 6.064 -6.359 1.00 32.40 H new ATOM 0 HA HIS A 184 -37.812 5.530 -8.138 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -36.110 8.020 -7.992 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -37.743 7.888 -8.615 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -38.481 5.899 -5.800 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -38.214 9.731 -4.013 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -39.058 7.349 -3.718 1.00 32.91 H new ATOM 2910 N HIS A 185 -34.844 5.559 -9.335 1.00 33.68 N ATOM 2911 CA HIS A 185 -33.963 5.292 -10.439 1.00 34.28 C ATOM 2912 C HIS A 185 -33.287 3.943 -10.212 1.00 34.40 C ATOM 2913 O HIS A 185 -33.927 2.908 -10.489 1.00 34.51 O ATOM 2914 CB HIS A 185 -32.922 6.398 -10.520 1.00 34.66 C ATOM 2915 CG HIS A 185 -32.550 6.911 -9.170 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -31.521 6.384 -8.426 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -33.101 7.885 -8.414 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -31.456 7.012 -7.269 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -32.404 7.927 -7.238 1.00 36.03 N ATOM 2920 OXT HIS A 185 -32.135 3.933 -9.730 1.00 34.44 O ATOM 0 H HIS A 185 -34.373 5.543 -8.430 1.00 33.68 H new ATOM 0 HA HIS A 185 -34.521 5.261 -11.375 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -32.031 6.022 -11.024 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -33.309 7.217 -11.126 1.00 34.66 H new ATOM 0 HD1 HIS A 185 -30.905 5.627 -8.722 1.00 35.58 H new ATOM 0 HD2 HIS A 185 -33.936 8.513 -8.687 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -30.746 6.811 -6.480 1.00 36.07 H new TER 2929 HIS A 185