USER MOD reduce.3.24.130724 H: found=0, std=0, add=1403, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1403 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 74 ASN : amide:sc= 0.443! C(o=2.2!,f=-6.1!) USER MOD Set 1.2: B 85 LYS NZ :NH3+ 161:sc= 1.73 (180deg=0.849) USER MOD Set 2.1: B 60 MET CE :methyl -173:sc= 0 (180deg=-0.0641) USER MOD Set 2.2: B 67 GLN : amide:sc= -0.395 K(o=-0.4,f=-4.5!) USER MOD Set 3.1: A 85 LYS NZ :NH3+ 155:sc= 2.15 (180deg=-0.26) USER MOD Set 3.2: B 74 ASN : amide:sc= 1.99 K(o=4.1,f=-12!) USER MOD Set 4.1: A 61 LYS NZ :NH3+ -170:sc= 1.02 (180deg=-0.0147) USER MOD Set 4.2: A 67 GLN : amide:sc= 1.08 K(o=2.1,f=-10!) USER MOD Set 5.1: A 55 SER OG : rot 180:sc= -0.0718 USER MOD Set 5.2: A 59 LYS NZ :NH3+ 170:sc= 2.23 (180deg=2.11) USER MOD Set 6.1: A 44 GLN : amide:sc= 0.913 K(o=1.7,f=-0.036) USER MOD Set 6.2: A 45 GLN : amide:sc= 0.824 K(o=1.7,f=-1.1) USER MOD Single : A 7 THR OG1 : rot -175:sc= 0.863 USER MOD Single : A 12 SER OG : rot -26:sc= 1.2 USER MOD Single : A 15 THR OG1 : rot 96:sc= 1.27 USER MOD Single : A 18 THR OG1 : rot 180:sc= 0 USER MOD Single : A 19 THR OG1 : rot -179:sc= 1.23 USER MOD Single : A 22 THR OG1 : rot 14:sc= 1.02 USER MOD Single : A 26 GLN : amide:sc= -0.779 X(o=-0.78,f=-0.75) USER MOD Single : A 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 179:sc= 1.32 USER MOD Single : A 34 SER OG : rot -63:sc= 0.936 USER MOD Single : A 36 ASN : amide:sc= 2.22 K(o=2.2,f=-0.22) USER MOD Single : A 39 LYS NZ :NH3+ -170:sc= 2.36 (180deg=1.87) USER MOD Single : A 43 THR OG1 : rot 90:sc= 1.13 USER MOD Single : A 48 HIS : no HD1:sc= -0.332 X(o=-0.33,f=-0.32) USER MOD Single : A 51 LYS NZ :NH3+ 175:sc= 0.787 (180deg=0.338) USER MOD Single : A 60 MET CE :methyl -179:sc= -0.0147 (180deg=-0.017) USER MOD Single : A 62 SER OG : rot 180:sc= 0.945 USER MOD Single : A 66 ASN : amide:sc= 1.12 K(o=1.1,f=-2.1!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ -137:sc= 2.35 (180deg=-1.67!) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 LYS NZ :NH3+ 175:sc= 1.17 (180deg=1.04) USER MOD Single : B 7 THR OG1 : rot -171:sc= 1.17 USER MOD Single : B 12 SER OG : rot -24:sc= 1.12 USER MOD Single : B 15 THR OG1 : rot -56:sc= 1.29 USER MOD Single : B 18 THR OG1 : rot 180:sc= 0 USER MOD Single : B 19 THR OG1 : rot 79:sc= 1.01 USER MOD Single : B 22 THR OG1 : rot 95:sc= 0.202 USER MOD Single : B 26 GLN : amide:sc= 2.21 K(o=2.2,f=-11!) USER MOD Single : B 30 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 32 SER OG : rot 163:sc= 0.941 USER MOD Single : B 34 SER OG : rot -63:sc= 1.02 USER MOD Single : B 36 ASN : amide:sc= 1.08 K(o=1.1,f=-0.45) USER MOD Single : B 39 LYS NZ :NH3+ -158:sc= 1.16 (180deg=0.972) USER MOD Single : B 43 THR OG1 : rot 87:sc= 1.22 USER MOD Single : B 44 GLN : amide:sc= -0.559 K(o=-0.56,f=0) USER MOD Single : B 45 GLN : amide:sc= -0.0406 K(o=-0.041,f=-0.76) USER MOD Single : B 48 HIS : no HE2:sc= 0.718 K(o=0.72,f=-3.6!) USER MOD Single : B 51 LYS NZ :NH3+ -160:sc= 0.381 (180deg=-1.42!) USER MOD Single : B 55 SER OG : rot -41:sc= 1.29 USER MOD Single : B 59 LYS NZ :NH3+ 180:sc= 1.23 (180deg=1.23) USER MOD Single : B 61 LYS NZ :NH3+ -136:sc= 1.06 (180deg=0.811) USER MOD Single : B 62 SER OG : rot 180:sc= 0 USER MOD Single : B 66 ASN : amide:sc= 0.779 K(o=0.78,f=-3!) USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 76 TYR OH : rot 150:sc= -0.0661 USER MOD Single : B 89 LYS NZ :NH3+ -130:sc= 1.17 (180deg=0.195) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 4 7.001 -16.872 -15.651 1.00 1.73 N ATOM 41 CA GLU A 4 7.378 -17.281 -14.320 1.00 1.94 C ATOM 42 C GLU A 4 6.277 -16.891 -13.319 1.00 1.92 C ATOM 43 O GLU A 4 5.823 -15.745 -13.348 1.00 1.94 O ATOM 44 CB GLU A 4 8.717 -16.588 -14.015 1.00 2.40 C ATOM 45 CG GLU A 4 9.528 -17.390 -13.007 1.00 4.16 C ATOM 46 CD GLU A 4 10.051 -18.693 -13.602 1.00 5.12 C ATOM 47 OE1 GLU A 4 10.800 -18.597 -14.598 1.00 5.24 O ATOM 48 OE2 GLU A 4 9.666 -19.757 -13.073 1.00 6.22 O ATOM 0 HA GLU A 4 7.495 -18.362 -14.239 1.00 1.94 H new ATOM 0 HB2 GLU A 4 9.288 -16.471 -14.936 1.00 2.40 H new ATOM 0 HB3 GLU A 4 8.532 -15.587 -13.625 1.00 2.40 H new ATOM 0 HG2 GLU A 4 10.367 -16.789 -12.656 1.00 4.16 H new ATOM 0 HG3 GLU A 4 8.909 -17.611 -12.137 1.00 4.16 H new ATOM 55 N PRO A 5 5.823 -17.801 -12.442 1.00 2.11 N ATOM 56 CA PRO A 5 4.797 -17.496 -11.458 1.00 2.26 C ATOM 57 C PRO A 5 5.366 -16.590 -10.359 1.00 2.10 C ATOM 58 O PRO A 5 5.983 -17.069 -9.409 1.00 2.64 O ATOM 59 CB PRO A 5 4.330 -18.854 -10.925 1.00 2.69 C ATOM 60 CG PRO A 5 5.563 -19.743 -11.088 1.00 2.75 C ATOM 61 CD PRO A 5 6.217 -19.199 -12.359 1.00 2.44 C ATOM 0 HA PRO A 5 3.956 -16.945 -11.880 1.00 2.26 H new ATOM 0 HB2 PRO A 5 4.016 -18.790 -9.883 1.00 2.69 H new ATOM 0 HB3 PRO A 5 3.481 -19.237 -11.491 1.00 2.69 H new ATOM 0 HG2 PRO A 5 6.229 -19.670 -10.229 1.00 2.75 H new ATOM 0 HG3 PRO A 5 5.292 -20.794 -11.192 1.00 2.75 H new ATOM 0 HD2 PRO A 5 7.302 -19.297 -12.313 1.00 2.44 H new ATOM 0 HD3 PRO A 5 5.884 -19.752 -13.237 1.00 2.44 H new ATOM 69 N LEU A 6 5.147 -15.280 -10.489 1.00 1.54 N ATOM 70 CA LEU A 6 5.501 -14.297 -9.469 1.00 1.57 C ATOM 71 C LEU A 6 4.813 -14.617 -8.132 1.00 1.62 C ATOM 72 O LEU A 6 3.784 -15.293 -8.093 1.00 1.71 O ATOM 73 CB LEU A 6 5.111 -12.890 -9.946 1.00 1.65 C ATOM 74 CG LEU A 6 5.812 -12.429 -11.237 1.00 1.41 C ATOM 75 CD1 LEU A 6 5.260 -11.054 -11.635 1.00 1.42 C ATOM 76 CD2 LEU A 6 7.332 -12.319 -11.058 1.00 1.60 C ATOM 0 H LEU A 6 4.714 -14.869 -11.316 1.00 1.54 H new ATOM 0 HA LEU A 6 6.579 -14.337 -9.310 1.00 1.57 H new ATOM 0 HB2 LEU A 6 4.033 -12.861 -10.104 1.00 1.65 H new ATOM 0 HB3 LEU A 6 5.336 -12.177 -9.153 1.00 1.65 H new ATOM 0 HG LEU A 6 5.617 -13.172 -12.010 1.00 1.41 H new ATOM 0 HD11 LEU A 6 5.749 -10.716 -12.549 1.00 1.42 H new ATOM 0 HD12 LEU A 6 4.186 -11.128 -11.804 1.00 1.42 H new ATOM 0 HD13 LEU A 6 5.452 -10.339 -10.835 1.00 1.42 H new ATOM 0 HD21 LEU A 6 7.786 -11.991 -11.993 1.00 1.60 H new ATOM 0 HD22 LEU A 6 7.555 -11.596 -10.273 1.00 1.60 H new ATOM 0 HD23 LEU A 6 7.737 -13.292 -10.780 1.00 1.60 H new ATOM 88 N THR A 7 5.375 -14.116 -7.029 1.00 1.61 N ATOM 89 CA THR A 7 4.783 -14.279 -5.703 1.00 1.68 C ATOM 90 C THR A 7 3.586 -13.335 -5.578 1.00 1.51 C ATOM 91 O THR A 7 3.497 -12.353 -6.316 1.00 1.44 O ATOM 92 CB THR A 7 5.837 -14.042 -4.605 1.00 1.71 C ATOM 93 OG1 THR A 7 5.271 -14.076 -3.308 1.00 2.49 O ATOM 94 CG2 THR A 7 6.544 -12.702 -4.784 1.00 1.11 C ATOM 0 H THR A 7 6.248 -13.589 -7.032 1.00 1.61 H new ATOM 0 HA THR A 7 4.428 -15.301 -5.572 1.00 1.68 H new ATOM 0 HB THR A 7 6.557 -14.854 -4.705 1.00 1.71 H new ATOM 0 HG1 THR A 7 5.954 -13.837 -2.647 1.00 2.49 H new ATOM 0 HG21 THR A 7 7.280 -12.570 -3.991 1.00 1.11 H new ATOM 0 HG22 THR A 7 7.045 -12.682 -5.752 1.00 1.11 H new ATOM 0 HG23 THR A 7 5.812 -11.895 -4.737 1.00 1.11 H new ATOM 102 N GLU A 8 2.680 -13.618 -4.635 1.00 1.64 N ATOM 103 CA GLU A 8 1.457 -12.849 -4.438 1.00 1.60 C ATOM 104 C GLU A 8 1.766 -11.356 -4.330 1.00 1.27 C ATOM 105 O GLU A 8 1.099 -10.537 -4.953 1.00 1.27 O ATOM 106 CB GLU A 8 0.702 -13.351 -3.199 1.00 1.93 C ATOM 107 CG GLU A 8 -0.657 -12.643 -3.060 1.00 2.63 C ATOM 108 CD GLU A 8 -1.429 -13.078 -1.820 1.00 3.24 C ATOM 109 OE1 GLU A 8 -1.163 -14.202 -1.345 1.00 3.12 O ATOM 110 OE2 GLU A 8 -2.281 -12.270 -1.386 1.00 4.28 O ATOM 0 H GLU A 8 2.781 -14.396 -3.983 1.00 1.64 H new ATOM 0 HA GLU A 8 0.814 -12.992 -5.307 1.00 1.60 H new ATOM 0 HB2 GLU A 8 0.550 -14.428 -3.272 1.00 1.93 H new ATOM 0 HB3 GLU A 8 1.302 -13.174 -2.306 1.00 1.93 H new ATOM 0 HG2 GLU A 8 -0.497 -11.565 -3.023 1.00 2.63 H new ATOM 0 HG3 GLU A 8 -1.259 -12.846 -3.946 1.00 2.63 H new ATOM 117 N LEU A 9 2.777 -10.990 -3.542 1.00 1.04 N ATOM 118 CA LEU A 9 3.107 -9.587 -3.350 1.00 0.82 C ATOM 119 C LEU A 9 3.582 -8.948 -4.663 1.00 0.72 C ATOM 120 O LEU A 9 2.959 -7.986 -5.103 1.00 0.69 O ATOM 121 CB LEU A 9 4.043 -9.409 -2.144 1.00 0.72 C ATOM 122 CG LEU A 9 3.188 -9.305 -0.863 1.00 0.96 C ATOM 123 CD1 LEU A 9 3.902 -9.858 0.372 1.00 1.33 C ATOM 124 CD2 LEU A 9 2.793 -7.847 -0.592 1.00 1.59 C ATOM 0 H LEU A 9 3.374 -11.642 -3.033 1.00 1.04 H new ATOM 0 HA LEU A 9 2.210 -9.026 -3.087 1.00 0.82 H new ATOM 0 HB2 LEU A 9 4.730 -10.252 -2.072 1.00 0.72 H new ATOM 0 HB3 LEU A 9 4.650 -8.512 -2.266 1.00 0.72 H new ATOM 0 HG LEU A 9 2.300 -9.911 -1.042 1.00 0.96 H new ATOM 0 HD11 LEU A 9 3.253 -9.759 1.242 1.00 1.33 H new ATOM 0 HD12 LEU A 9 4.139 -10.910 0.215 1.00 1.33 H new ATOM 0 HD13 LEU A 9 4.823 -9.300 0.540 1.00 1.33 H new ATOM 0 HD21 LEU A 9 2.191 -7.796 0.315 1.00 1.59 H new ATOM 0 HD22 LEU A 9 3.692 -7.244 -0.465 1.00 1.59 H new ATOM 0 HD23 LEU A 9 2.215 -7.464 -1.433 1.00 1.59 H new ATOM 136 N GLU A 10 4.616 -9.497 -5.311 1.00 0.70 N ATOM 137 CA GLU A 10 5.141 -9.042 -6.605 1.00 0.62 C ATOM 138 C GLU A 10 4.007 -8.875 -7.620 1.00 0.61 C ATOM 139 O GLU A 10 3.822 -7.808 -8.208 1.00 0.59 O ATOM 140 CB GLU A 10 6.194 -10.029 -7.147 1.00 0.73 C ATOM 141 CG GLU A 10 7.495 -9.981 -6.332 1.00 1.29 C ATOM 142 CD GLU A 10 8.572 -10.975 -6.782 1.00 1.42 C ATOM 143 OE1 GLU A 10 8.203 -11.888 -7.554 1.00 2.19 O ATOM 144 OE2 GLU A 10 9.732 -10.833 -6.318 1.00 2.08 O ATOM 0 H GLU A 10 5.128 -10.296 -4.937 1.00 0.70 H new ATOM 0 HA GLU A 10 5.619 -8.074 -6.451 1.00 0.62 H new ATOM 0 HB2 GLU A 10 5.789 -11.041 -7.125 1.00 0.73 H new ATOM 0 HB3 GLU A 10 6.409 -9.794 -8.189 1.00 0.73 H new ATOM 0 HG2 GLU A 10 7.905 -8.973 -6.388 1.00 1.29 H new ATOM 0 HG3 GLU A 10 7.259 -10.172 -5.285 1.00 1.29 H new ATOM 151 N GLU A 11 3.238 -9.949 -7.788 1.00 0.65 N ATOM 152 CA GLU A 11 2.051 -9.983 -8.616 1.00 0.66 C ATOM 153 C GLU A 11 1.141 -8.803 -8.259 1.00 0.64 C ATOM 154 O GLU A 11 0.888 -7.931 -9.087 1.00 0.63 O ATOM 155 CB GLU A 11 1.405 -11.361 -8.412 1.00 0.74 C ATOM 156 CG GLU A 11 0.047 -11.554 -9.081 1.00 2.20 C ATOM 157 CD GLU A 11 0.050 -11.135 -10.543 1.00 2.55 C ATOM 158 OE1 GLU A 11 0.402 -11.992 -11.379 1.00 2.28 O ATOM 159 OE2 GLU A 11 -0.288 -9.956 -10.784 1.00 3.90 O ATOM 0 H GLU A 11 3.436 -10.841 -7.335 1.00 0.65 H new ATOM 0 HA GLU A 11 2.271 -9.866 -9.677 1.00 0.66 H new ATOM 0 HB2 GLU A 11 2.088 -12.123 -8.789 1.00 0.74 H new ATOM 0 HB3 GLU A 11 1.292 -11.535 -7.342 1.00 0.74 H new ATOM 0 HG2 GLU A 11 -0.244 -12.602 -9.008 1.00 2.20 H new ATOM 0 HG3 GLU A 11 -0.704 -10.976 -8.543 1.00 2.20 H new ATOM 166 N SER A 12 0.692 -8.726 -7.003 1.00 0.71 N ATOM 167 CA SER A 12 -0.270 -7.719 -6.577 1.00 0.76 C ATOM 168 C SER A 12 0.240 -6.303 -6.869 1.00 0.70 C ATOM 169 O SER A 12 -0.515 -5.468 -7.372 1.00 0.74 O ATOM 170 CB SER A 12 -0.668 -7.908 -5.107 1.00 0.90 C ATOM 171 OG SER A 12 0.399 -7.599 -4.237 1.00 1.56 O ATOM 0 H SER A 12 0.987 -9.359 -6.260 1.00 0.71 H new ATOM 0 HA SER A 12 -1.178 -7.854 -7.165 1.00 0.76 H new ATOM 0 HB2 SER A 12 -1.523 -7.272 -4.876 1.00 0.90 H new ATOM 0 HB3 SER A 12 -0.984 -8.938 -4.944 1.00 0.90 H new ATOM 0 HG SER A 12 1.250 -7.729 -4.705 1.00 1.56 H new ATOM 177 N ILE A 13 1.519 -6.026 -6.582 1.00 0.63 N ATOM 178 CA ILE A 13 2.059 -4.699 -6.812 1.00 0.60 C ATOM 179 C ILE A 13 2.106 -4.395 -8.304 1.00 0.58 C ATOM 180 O ILE A 13 1.684 -3.310 -8.700 1.00 0.62 O ATOM 181 CB ILE A 13 3.333 -4.366 -6.010 1.00 0.61 C ATOM 182 CG1 ILE A 13 4.500 -5.356 -6.122 1.00 0.57 C ATOM 183 CG2 ILE A 13 2.936 -4.242 -4.530 1.00 0.69 C ATOM 184 CD1 ILE A 13 5.465 -5.020 -7.249 1.00 0.60 C ATOM 0 H ILE A 13 2.182 -6.698 -6.196 1.00 0.63 H new ATOM 0 HA ILE A 13 1.362 -3.982 -6.380 1.00 0.60 H new ATOM 0 HB ILE A 13 3.716 -3.444 -6.447 1.00 0.61 H new ATOM 0 HG12 ILE A 13 5.045 -5.373 -5.178 1.00 0.57 H new ATOM 0 HG13 ILE A 13 4.103 -6.359 -6.279 1.00 0.57 H new ATOM 0 HG21 ILE A 13 3.818 -4.006 -3.935 1.00 0.69 H new ATOM 0 HG22 ILE A 13 2.199 -3.447 -4.416 1.00 0.69 H new ATOM 0 HG23 ILE A 13 2.509 -5.185 -4.188 1.00 0.69 H new ATOM 0 HD11 ILE A 13 6.267 -5.758 -7.274 1.00 0.60 H new ATOM 0 HD12 ILE A 13 4.932 -5.031 -8.200 1.00 0.60 H new ATOM 0 HD13 ILE A 13 5.889 -4.030 -7.082 1.00 0.60 H new ATOM 196 N GLU A 14 2.530 -5.341 -9.149 1.00 0.56 N ATOM 197 CA GLU A 14 2.483 -5.093 -10.582 1.00 0.56 C ATOM 198 C GLU A 14 1.031 -4.851 -11.024 1.00 0.58 C ATOM 199 O GLU A 14 0.742 -3.841 -11.659 1.00 0.63 O ATOM 200 CB GLU A 14 3.185 -6.198 -11.381 1.00 0.59 C ATOM 201 CG GLU A 14 3.639 -5.609 -12.726 1.00 0.62 C ATOM 202 CD GLU A 14 4.305 -6.643 -13.624 1.00 1.89 C ATOM 203 OE1 GLU A 14 5.241 -7.304 -13.127 1.00 3.41 O ATOM 204 OE2 GLU A 14 3.886 -6.726 -14.798 1.00 2.54 O ATOM 0 H GLU A 14 2.896 -6.252 -8.873 1.00 0.56 H new ATOM 0 HA GLU A 14 3.046 -4.185 -10.800 1.00 0.56 H new ATOM 0 HB2 GLU A 14 4.041 -6.582 -10.826 1.00 0.59 H new ATOM 0 HB3 GLU A 14 2.508 -7.037 -11.543 1.00 0.59 H new ATOM 0 HG2 GLU A 14 2.777 -5.186 -13.242 1.00 0.62 H new ATOM 0 HG3 GLU A 14 4.335 -4.790 -12.543 1.00 0.62 H new ATOM 211 N THR A 15 0.114 -5.739 -10.631 1.00 0.56 N ATOM 212 CA THR A 15 -1.326 -5.643 -10.856 1.00 0.56 C ATOM 213 C THR A 15 -1.885 -4.245 -10.531 1.00 0.57 C ATOM 214 O THR A 15 -2.570 -3.639 -11.355 1.00 0.64 O ATOM 215 CB THR A 15 -2.029 -6.785 -10.095 1.00 0.71 C ATOM 216 OG1 THR A 15 -1.986 -7.963 -10.875 1.00 1.70 O ATOM 217 CG2 THR A 15 -3.500 -6.500 -9.781 1.00 1.17 C ATOM 0 H THR A 15 0.371 -6.585 -10.122 1.00 0.56 H new ATOM 0 HA THR A 15 -1.533 -5.768 -11.919 1.00 0.56 H new ATOM 0 HB THR A 15 -1.496 -6.890 -9.150 1.00 0.71 H new ATOM 0 HG1 THR A 15 -1.223 -8.512 -10.597 1.00 1.70 H new ATOM 0 HG21 THR A 15 -3.928 -7.347 -9.245 1.00 1.17 H new ATOM 0 HG22 THR A 15 -3.573 -5.605 -9.163 1.00 1.17 H new ATOM 0 HG23 THR A 15 -4.047 -6.345 -10.711 1.00 1.17 H new ATOM 225 N VAL A 16 -1.606 -3.692 -9.350 1.00 0.54 N ATOM 226 CA VAL A 16 -2.107 -2.351 -9.042 1.00 0.59 C ATOM 227 C VAL A 16 -1.350 -1.305 -9.860 1.00 0.64 C ATOM 228 O VAL A 16 -1.967 -0.361 -10.353 1.00 0.74 O ATOM 229 CB VAL A 16 -2.153 -2.008 -7.540 1.00 0.58 C ATOM 230 CG1 VAL A 16 -3.040 -2.987 -6.764 1.00 0.60 C ATOM 231 CG2 VAL A 16 -0.775 -1.932 -6.892 1.00 0.61 C ATOM 0 H VAL A 16 -1.055 -4.133 -8.613 1.00 0.54 H new ATOM 0 HA VAL A 16 -3.156 -2.339 -9.339 1.00 0.59 H new ATOM 0 HB VAL A 16 -2.589 -1.010 -7.487 1.00 0.58 H new ATOM 0 HG11 VAL A 16 -3.048 -2.713 -5.709 1.00 0.60 H new ATOM 0 HG12 VAL A 16 -4.056 -2.947 -7.157 1.00 0.60 H new ATOM 0 HG13 VAL A 16 -2.648 -3.998 -6.873 1.00 0.60 H new ATOM 0 HG21 VAL A 16 -0.883 -1.687 -5.835 1.00 0.61 H new ATOM 0 HG22 VAL A 16 -0.272 -2.894 -6.992 1.00 0.61 H new ATOM 0 HG23 VAL A 16 -0.183 -1.161 -7.385 1.00 0.61 H new ATOM 241 N VAL A 17 -0.028 -1.459 -10.018 1.00 0.61 N ATOM 242 CA VAL A 17 0.790 -0.545 -10.807 1.00 0.66 C ATOM 243 C VAL A 17 0.235 -0.416 -12.228 1.00 0.68 C ATOM 244 O VAL A 17 0.163 0.698 -12.741 1.00 0.70 O ATOM 245 CB VAL A 17 2.279 -0.946 -10.771 1.00 0.67 C ATOM 246 CG1 VAL A 17 3.109 -0.243 -11.853 1.00 0.73 C ATOM 247 CG2 VAL A 17 2.885 -0.573 -9.409 1.00 0.72 C ATOM 0 H VAL A 17 0.500 -2.225 -9.599 1.00 0.61 H new ATOM 0 HA VAL A 17 0.738 0.447 -10.357 1.00 0.66 H new ATOM 0 HB VAL A 17 2.313 -2.021 -10.947 1.00 0.67 H new ATOM 0 HG11 VAL A 17 4.148 -0.563 -11.780 1.00 0.73 H new ATOM 0 HG12 VAL A 17 2.718 -0.502 -12.837 1.00 0.73 H new ATOM 0 HG13 VAL A 17 3.051 0.836 -11.712 1.00 0.73 H new ATOM 0 HG21 VAL A 17 3.937 -0.858 -9.388 1.00 0.72 H new ATOM 0 HG22 VAL A 17 2.798 0.502 -9.254 1.00 0.72 H new ATOM 0 HG23 VAL A 17 2.351 -1.098 -8.617 1.00 0.72 H new ATOM 257 N THR A 18 -0.172 -1.511 -12.871 1.00 0.70 N ATOM 258 CA THR A 18 -0.746 -1.431 -14.207 1.00 0.75 C ATOM 259 C THR A 18 -2.036 -0.598 -14.195 1.00 0.73 C ATOM 260 O THR A 18 -2.128 0.365 -14.957 1.00 0.68 O ATOM 261 CB THR A 18 -0.848 -2.810 -14.886 1.00 0.79 C ATOM 262 OG1 THR A 18 -1.412 -2.688 -16.177 1.00 0.92 O ATOM 263 CG2 THR A 18 -1.622 -3.864 -14.098 1.00 0.70 C ATOM 0 H THR A 18 -0.114 -2.455 -12.489 1.00 0.70 H new ATOM 0 HA THR A 18 -0.061 -0.885 -14.855 1.00 0.75 H new ATOM 0 HB THR A 18 0.181 -3.167 -14.940 1.00 0.79 H new ATOM 0 HG1 THR A 18 -1.468 -3.573 -16.594 1.00 0.92 H new ATOM 0 HG21 THR A 18 -1.638 -4.799 -14.659 1.00 0.70 H new ATOM 0 HG22 THR A 18 -1.138 -4.027 -13.135 1.00 0.70 H new ATOM 0 HG23 THR A 18 -2.644 -3.520 -13.937 1.00 0.70 H new ATOM 271 N THR A 19 -3.010 -0.901 -13.329 1.00 0.80 N ATOM 272 CA THR A 19 -4.256 -0.145 -13.274 1.00 0.87 C ATOM 273 C THR A 19 -3.973 1.342 -13.004 1.00 0.86 C ATOM 274 O THR A 19 -4.425 2.223 -13.742 1.00 0.85 O ATOM 275 CB THR A 19 -5.182 -0.798 -12.237 1.00 0.98 C ATOM 276 OG1 THR A 19 -5.216 -2.183 -12.515 1.00 0.96 O ATOM 277 CG2 THR A 19 -6.601 -0.230 -12.317 1.00 1.12 C ATOM 0 H THR A 19 -2.954 -1.667 -12.658 1.00 0.80 H new ATOM 0 HA THR A 19 -4.771 -0.173 -14.235 1.00 0.87 H new ATOM 0 HB THR A 19 -4.804 -0.598 -11.234 1.00 0.98 H new ATOM 0 HG1 THR A 19 -5.806 -2.631 -11.874 1.00 0.96 H new ATOM 0 HG21 THR A 19 -7.229 -0.714 -11.570 1.00 1.12 H new ATOM 0 HG22 THR A 19 -6.574 0.843 -12.129 1.00 1.12 H new ATOM 0 HG23 THR A 19 -7.011 -0.414 -13.310 1.00 1.12 H new ATOM 285 N PHE A 20 -3.173 1.609 -11.967 1.00 0.90 N ATOM 286 CA PHE A 20 -2.634 2.926 -11.644 1.00 0.87 C ATOM 287 C PHE A 20 -2.099 3.609 -12.902 1.00 0.79 C ATOM 288 O PHE A 20 -2.521 4.714 -13.228 1.00 0.76 O ATOM 289 CB PHE A 20 -1.538 2.774 -10.575 1.00 0.95 C ATOM 290 CG PHE A 20 -0.472 3.852 -10.546 1.00 1.16 C ATOM 291 CD1 PHE A 20 -0.783 5.147 -10.102 1.00 2.39 C ATOM 292 CD2 PHE A 20 0.831 3.565 -11.000 1.00 2.32 C ATOM 293 CE1 PHE A 20 0.224 6.123 -10.027 1.00 2.93 C ATOM 294 CE2 PHE A 20 1.828 4.552 -10.961 1.00 2.99 C ATOM 295 CZ PHE A 20 1.530 5.822 -10.447 1.00 2.80 C ATOM 0 H PHE A 20 -2.875 0.888 -11.310 1.00 0.90 H new ATOM 0 HA PHE A 20 -3.426 3.559 -11.244 1.00 0.87 H new ATOM 0 HB2 PHE A 20 -2.017 2.741 -9.597 1.00 0.95 H new ATOM 0 HB3 PHE A 20 -1.047 1.812 -10.723 1.00 0.95 H new ATOM 0 HD1 PHE A 20 -1.796 5.392 -9.818 1.00 2.39 H new ATOM 0 HD2 PHE A 20 1.063 2.581 -11.380 1.00 2.32 H new ATOM 0 HE1 PHE A 20 -0.006 7.107 -9.646 1.00 2.93 H new ATOM 0 HE2 PHE A 20 2.821 4.334 -11.326 1.00 2.99 H new ATOM 0 HZ PHE A 20 2.306 6.570 -10.374 1.00 2.80 H new ATOM 305 N PHE A 21 -1.183 2.951 -13.612 1.00 0.80 N ATOM 306 CA PHE A 21 -0.540 3.485 -14.801 1.00 0.84 C ATOM 307 C PHE A 21 -1.582 3.840 -15.862 1.00 0.88 C ATOM 308 O PHE A 21 -1.596 4.965 -16.360 1.00 0.95 O ATOM 309 CB PHE A 21 0.490 2.478 -15.318 1.00 0.94 C ATOM 310 CG PHE A 21 1.224 2.909 -16.571 1.00 1.58 C ATOM 311 CD1 PHE A 21 2.217 3.902 -16.497 1.00 2.01 C ATOM 312 CD2 PHE A 21 0.964 2.271 -17.798 1.00 3.16 C ATOM 313 CE1 PHE A 21 2.990 4.211 -17.628 1.00 2.68 C ATOM 314 CE2 PHE A 21 1.736 2.582 -18.930 1.00 3.95 C ATOM 315 CZ PHE A 21 2.763 3.536 -18.839 1.00 3.35 C ATOM 0 H PHE A 21 -0.864 2.013 -13.368 1.00 0.80 H new ATOM 0 HA PHE A 21 -0.015 4.408 -14.552 1.00 0.84 H new ATOM 0 HB2 PHE A 21 1.221 2.291 -14.532 1.00 0.94 H new ATOM 0 HB3 PHE A 21 -0.014 1.532 -15.516 1.00 0.94 H new ATOM 0 HD1 PHE A 21 2.385 4.428 -15.569 1.00 2.01 H new ATOM 0 HD2 PHE A 21 0.171 1.542 -17.870 1.00 3.16 H new ATOM 0 HE1 PHE A 21 3.759 4.967 -17.567 1.00 2.68 H new ATOM 0 HE2 PHE A 21 1.540 2.088 -19.870 1.00 3.95 H new ATOM 0 HZ PHE A 21 3.378 3.751 -19.700 1.00 3.35 H new ATOM 325 N THR A 22 -2.473 2.900 -16.197 1.00 0.91 N ATOM 326 CA THR A 22 -3.495 3.141 -17.205 1.00 1.00 C ATOM 327 C THR A 22 -4.351 4.359 -16.849 1.00 0.99 C ATOM 328 O THR A 22 -4.675 5.150 -17.735 1.00 1.14 O ATOM 329 CB THR A 22 -4.331 1.878 -17.457 1.00 1.12 C ATOM 330 OG1 THR A 22 -4.717 1.242 -16.259 1.00 2.31 O ATOM 331 CG2 THR A 22 -3.527 0.858 -18.268 1.00 1.98 C ATOM 0 H THR A 22 -2.502 1.969 -15.782 1.00 0.91 H new ATOM 0 HA THR A 22 -2.999 3.379 -18.146 1.00 1.00 H new ATOM 0 HB THR A 22 -5.219 2.207 -17.997 1.00 1.12 H new ATOM 0 HG1 THR A 22 -4.568 1.849 -15.504 1.00 2.31 H new ATOM 0 HG21 THR A 22 -4.134 -0.031 -18.438 1.00 1.98 H new ATOM 0 HG22 THR A 22 -3.247 1.295 -19.227 1.00 1.98 H new ATOM 0 HG23 THR A 22 -2.627 0.583 -17.718 1.00 1.98 H new ATOM 339 N PHE A 23 -4.681 4.551 -15.566 1.00 0.90 N ATOM 340 CA PHE A 23 -5.324 5.787 -15.139 1.00 0.88 C ATOM 341 C PHE A 23 -4.389 6.980 -15.319 1.00 0.82 C ATOM 342 O PHE A 23 -4.739 7.976 -15.936 1.00 0.92 O ATOM 343 CB PHE A 23 -5.790 5.699 -13.681 1.00 0.88 C ATOM 344 CG PHE A 23 -7.131 5.021 -13.510 1.00 0.96 C ATOM 345 CD1 PHE A 23 -8.293 5.675 -13.961 1.00 2.13 C ATOM 346 CD2 PHE A 23 -7.234 3.787 -12.842 1.00 2.03 C ATOM 347 CE1 PHE A 23 -9.553 5.094 -13.755 1.00 2.42 C ATOM 348 CE2 PHE A 23 -8.498 3.217 -12.614 1.00 2.52 C ATOM 349 CZ PHE A 23 -9.655 3.882 -13.053 1.00 2.13 C ATOM 0 H PHE A 23 -4.514 3.875 -14.821 1.00 0.90 H new ATOM 0 HA PHE A 23 -6.201 5.932 -15.770 1.00 0.88 H new ATOM 0 HB2 PHE A 23 -5.042 5.157 -13.102 1.00 0.88 H new ATOM 0 HB3 PHE A 23 -5.846 6.705 -13.266 1.00 0.88 H new ATOM 0 HD1 PHE A 23 -8.214 6.626 -14.467 1.00 2.13 H new ATOM 0 HD2 PHE A 23 -6.343 3.279 -12.505 1.00 2.03 H new ATOM 0 HE1 PHE A 23 -10.441 5.577 -14.135 1.00 2.42 H new ATOM 0 HE2 PHE A 23 -8.580 2.269 -12.102 1.00 2.52 H new ATOM 0 HZ PHE A 23 -10.628 3.459 -12.850 1.00 2.13 H new ATOM 359 N ALA A 24 -3.183 6.887 -14.773 1.00 0.76 N ATOM 360 CA ALA A 24 -2.232 7.976 -14.659 1.00 0.77 C ATOM 361 C ALA A 24 -1.767 8.475 -16.022 1.00 0.73 C ATOM 362 O ALA A 24 -1.255 9.594 -16.110 1.00 0.76 O ATOM 363 CB ALA A 24 -1.039 7.533 -13.813 1.00 0.86 C ATOM 0 H ALA A 24 -2.830 6.013 -14.383 1.00 0.76 H new ATOM 0 HA ALA A 24 -2.735 8.810 -14.169 1.00 0.77 H new ATOM 0 HB1 ALA A 24 -0.327 8.354 -13.730 1.00 0.86 H new ATOM 0 HB2 ALA A 24 -1.383 7.249 -12.819 1.00 0.86 H new ATOM 0 HB3 ALA A 24 -0.554 6.679 -14.286 1.00 0.86 H new ATOM 369 N ARG A 25 -1.924 7.661 -17.068 1.00 0.77 N ATOM 370 CA ARG A 25 -1.658 8.043 -18.444 1.00 0.86 C ATOM 371 C ARG A 25 -2.618 9.146 -18.878 1.00 0.83 C ATOM 372 O ARG A 25 -2.206 9.990 -19.672 1.00 0.97 O ATOM 373 CB ARG A 25 -1.599 6.793 -19.356 1.00 1.02 C ATOM 374 CG ARG A 25 -2.532 6.681 -20.581 1.00 1.54 C ATOM 375 CD ARG A 25 -2.003 7.297 -21.893 1.00 2.36 C ATOM 376 NE ARG A 25 -2.266 8.742 -21.967 1.00 3.78 N ATOM 377 CZ ARG A 25 -3.036 9.405 -22.844 1.00 4.62 C ATOM 378 NH1 ARG A 25 -3.327 8.864 -24.033 1.00 4.50 N ATOM 379 NH2 ARG A 25 -3.513 10.612 -22.524 1.00 6.02 N ATOM 0 H ARG A 25 -2.247 6.698 -16.973 1.00 0.77 H new ATOM 0 HA ARG A 25 -0.667 8.487 -18.538 1.00 0.86 H new ATOM 0 HB2 ARG A 25 -0.575 6.707 -19.720 1.00 1.02 H new ATOM 0 HB3 ARG A 25 -1.787 5.924 -18.726 1.00 1.02 H new ATOM 0 HG2 ARG A 25 -2.742 5.626 -20.757 1.00 1.54 H new ATOM 0 HG3 ARG A 25 -3.480 7.159 -20.335 1.00 1.54 H new ATOM 0 HD2 ARG A 25 -0.930 7.119 -21.971 1.00 2.36 H new ATOM 0 HD3 ARG A 25 -2.471 6.799 -22.742 1.00 2.36 H new ATOM 0 HE ARG A 25 -1.804 9.314 -21.261 1.00 3.78 H new ATOM 0 HH11 ARG A 25 -2.963 7.943 -24.277 1.00 4.50 H new ATOM 0 HH12 ARG A 25 -3.913 9.373 -24.695 1.00 4.50 H new ATOM 0 HH21 ARG A 25 -3.291 11.024 -21.618 1.00 6.02 H new ATOM 0 HH22 ARG A 25 -4.099 11.121 -23.186 1.00 6.02 H new ATOM 393 N GLN A 26 -3.862 9.152 -18.378 1.00 0.77 N ATOM 394 CA GLN A 26 -4.919 10.068 -18.825 1.00 0.83 C ATOM 395 C GLN A 26 -4.389 11.481 -19.105 1.00 0.94 C ATOM 396 O GLN A 26 -4.211 11.868 -20.262 1.00 1.23 O ATOM 397 CB GLN A 26 -6.002 10.172 -17.740 1.00 0.82 C ATOM 398 CG GLN A 26 -7.309 9.415 -17.882 1.00 0.83 C ATOM 399 CD GLN A 26 -7.181 7.902 -17.728 1.00 1.10 C ATOM 400 OE1 GLN A 26 -7.899 7.295 -16.942 1.00 2.20 O ATOM 401 NE2 GLN A 26 -6.269 7.280 -18.470 1.00 2.52 N ATOM 0 H GLN A 26 -4.165 8.513 -17.643 1.00 0.77 H new ATOM 0 HA GLN A 26 -5.322 9.660 -19.752 1.00 0.83 H new ATOM 0 HB2 GLN A 26 -5.548 9.856 -16.801 1.00 0.82 H new ATOM 0 HB3 GLN A 26 -6.251 11.228 -17.635 1.00 0.82 H new ATOM 0 HG2 GLN A 26 -8.012 9.786 -17.136 1.00 0.83 H new ATOM 0 HG3 GLN A 26 -7.737 9.634 -18.860 1.00 0.83 H new ATOM 0 HE21 GLN A 26 -5.686 7.813 -19.115 1.00 2.52 H new ATOM 0 HE22 GLN A 26 -6.152 6.270 -18.394 1.00 2.52 H new ATOM 410 N GLU A 27 -4.158 12.225 -18.026 1.00 0.84 N ATOM 411 CA GLU A 27 -3.760 13.617 -17.991 1.00 0.98 C ATOM 412 C GLU A 27 -2.250 13.636 -17.725 1.00 0.96 C ATOM 413 O GLU A 27 -1.663 12.587 -17.433 1.00 1.46 O ATOM 414 CB GLU A 27 -4.561 14.339 -16.885 1.00 1.08 C ATOM 415 CG GLU A 27 -6.089 14.127 -16.975 1.00 1.14 C ATOM 416 CD GLU A 27 -6.849 14.674 -15.764 1.00 1.61 C ATOM 417 OE1 GLU A 27 -6.211 15.256 -14.858 1.00 2.49 O ATOM 418 OE2 GLU A 27 -8.080 14.467 -15.737 1.00 2.31 O ATOM 0 H GLU A 27 -4.253 11.836 -17.088 1.00 0.84 H new ATOM 0 HA GLU A 27 -3.967 14.137 -18.926 1.00 0.98 H new ATOM 0 HB2 GLU A 27 -4.213 13.991 -15.913 1.00 1.08 H new ATOM 0 HB3 GLU A 27 -4.349 15.407 -16.936 1.00 1.08 H new ATOM 0 HG2 GLU A 27 -6.463 14.609 -17.878 1.00 1.14 H new ATOM 0 HG3 GLU A 27 -6.296 13.061 -17.074 1.00 1.14 H new ATOM 425 N GLY A 28 -1.620 14.814 -17.782 1.00 1.36 N ATOM 426 CA GLY A 28 -0.172 15.022 -17.684 1.00 1.49 C ATOM 427 C GLY A 28 0.570 14.040 -16.762 1.00 1.33 C ATOM 428 O GLY A 28 0.041 13.641 -15.715 1.00 1.41 O ATOM 0 H GLY A 28 -2.130 15.689 -17.903 1.00 1.36 H new ATOM 0 HA2 GLY A 28 0.257 14.952 -18.683 1.00 1.49 H new ATOM 0 HA3 GLY A 28 0.010 16.036 -17.329 1.00 1.49 H new ATOM 432 N ARG A 29 1.776 13.620 -17.177 1.00 1.29 N ATOM 433 CA ARG A 29 2.624 12.657 -16.471 1.00 1.24 C ATOM 434 C ARG A 29 1.948 11.285 -16.351 1.00 1.00 C ATOM 435 O ARG A 29 0.991 11.126 -15.583 1.00 0.97 O ATOM 436 CB ARG A 29 3.137 13.181 -15.117 1.00 1.61 C ATOM 437 CG ARG A 29 4.525 13.835 -15.187 1.00 2.22 C ATOM 438 CD ARG A 29 4.467 15.260 -15.752 1.00 1.87 C ATOM 439 NE ARG A 29 5.805 15.870 -15.852 1.00 2.67 N ATOM 440 CZ ARG A 29 6.482 16.445 -14.841 1.00 3.71 C ATOM 441 NH1 ARG A 29 6.009 16.390 -13.596 1.00 4.52 N ATOM 442 NH2 ARG A 29 7.636 17.077 -15.084 1.00 4.65 N ATOM 0 H ARG A 29 2.198 13.955 -18.043 1.00 1.29 H new ATOM 0 HA ARG A 29 3.513 12.523 -17.087 1.00 1.24 H new ATOM 0 HB2 ARG A 29 2.424 13.907 -14.726 1.00 1.61 H new ATOM 0 HB3 ARG A 29 3.171 12.354 -14.408 1.00 1.61 H new ATOM 0 HG2 ARG A 29 4.964 13.859 -14.190 1.00 2.22 H new ATOM 0 HG3 ARG A 29 5.181 13.226 -15.809 1.00 2.22 H new ATOM 0 HD2 ARG A 29 4.003 15.240 -16.738 1.00 1.87 H new ATOM 0 HD3 ARG A 29 3.834 15.877 -15.114 1.00 1.87 H new ATOM 0 HE ARG A 29 6.257 15.855 -16.766 1.00 2.67 H new ATOM 0 HH11 ARG A 29 5.129 15.910 -13.405 1.00 4.52 H new ATOM 0 HH12 ARG A 29 6.527 16.828 -12.834 1.00 4.52 H new ATOM 0 HH21 ARG A 29 8.002 17.123 -16.035 1.00 4.65 H new ATOM 0 HH22 ARG A 29 8.150 17.513 -14.318 1.00 4.65 H new ATOM 456 N LYS A 30 2.398 10.306 -17.148 1.00 1.06 N ATOM 457 CA LYS A 30 1.909 8.928 -17.100 1.00 1.10 C ATOM 458 C LYS A 30 2.403 8.150 -15.868 1.00 1.26 C ATOM 459 O LYS A 30 2.884 7.027 -15.992 1.00 1.56 O ATOM 460 CB LYS A 30 2.145 8.205 -18.440 1.00 1.29 C ATOM 461 CG LYS A 30 3.618 8.029 -18.839 1.00 1.42 C ATOM 462 CD LYS A 30 3.699 7.245 -20.158 1.00 1.92 C ATOM 463 CE LYS A 30 5.161 6.969 -20.535 1.00 2.46 C ATOM 464 NZ LYS A 30 5.284 6.242 -21.817 1.00 3.60 N ATOM 0 H LYS A 30 3.121 10.454 -17.852 1.00 1.06 H new ATOM 0 HA LYS A 30 0.828 8.972 -16.964 1.00 1.10 H new ATOM 0 HB2 LYS A 30 1.679 7.221 -18.390 1.00 1.29 H new ATOM 0 HB3 LYS A 30 1.636 8.760 -19.228 1.00 1.29 H new ATOM 0 HG2 LYS A 30 4.094 9.003 -18.952 1.00 1.42 H new ATOM 0 HG3 LYS A 30 4.158 7.499 -18.054 1.00 1.42 H new ATOM 0 HD2 LYS A 30 3.159 6.303 -20.061 1.00 1.92 H new ATOM 0 HD3 LYS A 30 3.213 7.810 -20.953 1.00 1.92 H new ATOM 0 HE2 LYS A 30 5.701 7.914 -20.603 1.00 2.46 H new ATOM 0 HE3 LYS A 30 5.634 6.388 -19.744 1.00 2.46 H new ATOM 0 HZ1 LYS A 30 6.289 6.079 -22.029 1.00 3.60 H new ATOM 0 HZ2 LYS A 30 4.792 5.328 -21.746 1.00 3.60 H new ATOM 0 HZ3 LYS A 30 4.857 6.807 -22.579 1.00 3.60 H new ATOM 478 N ASP A 31 2.231 8.746 -14.685 1.00 1.37 N ATOM 479 CA ASP A 31 2.449 8.170 -13.361 1.00 1.91 C ATOM 480 C ASP A 31 1.945 9.147 -12.293 1.00 1.58 C ATOM 481 O ASP A 31 1.360 8.725 -11.302 1.00 1.96 O ATOM 482 CB ASP A 31 3.888 7.699 -13.105 1.00 2.74 C ATOM 483 CG ASP A 31 4.912 8.803 -12.921 1.00 2.45 C ATOM 484 OD1 ASP A 31 4.626 9.954 -13.315 1.00 2.94 O ATOM 485 OD2 ASP A 31 5.980 8.432 -12.373 1.00 3.47 O ATOM 0 H ASP A 31 1.913 9.713 -14.626 1.00 1.37 H new ATOM 0 HA ASP A 31 1.867 7.250 -13.306 1.00 1.91 H new ATOM 0 HB2 ASP A 31 3.893 7.070 -12.215 1.00 2.74 H new ATOM 0 HB3 ASP A 31 4.201 7.072 -13.940 1.00 2.74 H new ATOM 490 N SER A 32 2.040 10.455 -12.542 1.00 1.14 N ATOM 491 CA SER A 32 1.397 11.412 -11.652 1.00 0.99 C ATOM 492 C SER A 32 -0.094 11.447 -11.965 1.00 0.79 C ATOM 493 O SER A 32 -0.482 11.607 -13.129 1.00 0.77 O ATOM 494 CB SER A 32 1.958 12.832 -11.812 1.00 1.11 C ATOM 495 OG SER A 32 3.370 12.867 -11.786 1.00 2.30 O ATOM 0 H SER A 32 2.542 10.863 -13.330 1.00 1.14 H new ATOM 0 HA SER A 32 1.588 11.089 -10.629 1.00 0.99 H new ATOM 0 HB2 SER A 32 1.606 13.253 -12.753 1.00 1.11 H new ATOM 0 HB3 SER A 32 1.568 13.464 -11.014 1.00 1.11 H new ATOM 0 HG SER A 32 3.677 13.789 -11.916 1.00 2.30 H new ATOM 501 N LEU A 33 -0.927 11.324 -10.929 1.00 0.75 N ATOM 502 CA LEU A 33 -2.328 11.708 -11.034 1.00 0.68 C ATOM 503 C LEU A 33 -2.383 13.220 -10.790 1.00 0.77 C ATOM 504 O LEU A 33 -1.518 13.763 -10.105 1.00 1.14 O ATOM 505 CB LEU A 33 -3.220 10.959 -10.023 1.00 0.90 C ATOM 506 CG LEU A 33 -3.509 9.475 -10.286 1.00 1.11 C ATOM 507 CD1 LEU A 33 -4.380 9.248 -11.525 1.00 2.07 C ATOM 508 CD2 LEU A 33 -2.223 8.654 -10.350 1.00 1.62 C ATOM 0 H LEU A 33 -0.654 10.963 -10.015 1.00 0.75 H new ATOM 0 HA LEU A 33 -2.714 11.444 -12.019 1.00 0.68 H new ATOM 0 HB2 LEU A 33 -2.754 11.041 -9.041 1.00 0.90 H new ATOM 0 HB3 LEU A 33 -4.175 11.482 -9.967 1.00 0.90 H new ATOM 0 HG LEU A 33 -4.089 9.122 -9.433 1.00 1.11 H new ATOM 0 HD11 LEU A 33 -4.550 8.180 -11.659 1.00 2.07 H new ATOM 0 HD12 LEU A 33 -5.337 9.754 -11.395 1.00 2.07 H new ATOM 0 HD13 LEU A 33 -3.874 9.648 -12.404 1.00 2.07 H new ATOM 0 HD21 LEU A 33 -2.468 7.609 -10.538 1.00 1.62 H new ATOM 0 HD22 LEU A 33 -1.592 9.029 -11.155 1.00 1.62 H new ATOM 0 HD23 LEU A 33 -1.690 8.738 -9.403 1.00 1.62 H new ATOM 520 N SER A 34 -3.394 13.897 -11.323 1.00 0.89 N ATOM 521 CA SER A 34 -3.801 15.226 -10.887 1.00 1.15 C ATOM 522 C SER A 34 -5.268 15.135 -10.469 1.00 1.05 C ATOM 523 O SER A 34 -5.878 14.083 -10.644 1.00 0.99 O ATOM 524 CB SER A 34 -3.538 16.243 -12.001 1.00 1.72 C ATOM 525 OG SER A 34 -2.138 16.398 -12.154 1.00 2.98 O ATOM 0 H SER A 34 -3.964 13.530 -12.085 1.00 0.89 H new ATOM 0 HA SER A 34 -3.223 15.575 -10.031 1.00 1.15 H new ATOM 0 HB2 SER A 34 -3.985 15.904 -12.935 1.00 1.72 H new ATOM 0 HB3 SER A 34 -3.999 17.200 -11.756 1.00 1.72 H new ATOM 0 HG SER A 34 -1.757 16.762 -11.328 1.00 2.98 H new ATOM 531 N VAL A 35 -5.816 16.191 -9.855 1.00 1.24 N ATOM 532 CA VAL A 35 -7.091 16.119 -9.147 1.00 1.21 C ATOM 533 C VAL A 35 -8.189 15.436 -9.969 1.00 1.21 C ATOM 534 O VAL A 35 -8.811 14.491 -9.486 1.00 1.10 O ATOM 535 CB VAL A 35 -7.501 17.504 -8.609 1.00 1.43 C ATOM 536 CG1 VAL A 35 -7.815 18.530 -9.706 1.00 2.09 C ATOM 537 CG2 VAL A 35 -8.698 17.396 -7.654 1.00 2.06 C ATOM 0 H VAL A 35 -5.386 17.116 -9.837 1.00 1.24 H new ATOM 0 HA VAL A 35 -6.950 15.472 -8.281 1.00 1.21 H new ATOM 0 HB VAL A 35 -6.626 17.870 -8.071 1.00 1.43 H new ATOM 0 HG11 VAL A 35 -8.095 19.478 -9.248 1.00 2.09 H new ATOM 0 HG12 VAL A 35 -6.934 18.675 -10.331 1.00 2.09 H new ATOM 0 HG13 VAL A 35 -8.639 18.166 -10.319 1.00 2.09 H new ATOM 0 HG21 VAL A 35 -8.964 18.389 -7.291 1.00 2.06 H new ATOM 0 HG22 VAL A 35 -9.547 16.963 -8.183 1.00 2.06 H new ATOM 0 HG23 VAL A 35 -8.433 16.760 -6.810 1.00 2.06 H new ATOM 547 N ASN A 36 -8.411 15.888 -11.208 1.00 1.39 N ATOM 548 CA ASN A 36 -9.455 15.307 -12.038 1.00 1.48 C ATOM 549 C ASN A 36 -9.143 13.838 -12.308 1.00 1.39 C ATOM 550 O ASN A 36 -9.921 12.987 -11.890 1.00 1.40 O ATOM 551 CB ASN A 36 -9.696 16.100 -13.322 1.00 1.70 C ATOM 552 CG ASN A 36 -10.894 15.476 -14.036 1.00 1.87 C ATOM 553 OD1 ASN A 36 -12.032 15.800 -13.706 1.00 2.53 O ATOM 554 ND2 ASN A 36 -10.652 14.550 -14.955 1.00 1.91 N ATOM 0 H ASN A 36 -7.886 16.644 -11.648 1.00 1.39 H new ATOM 0 HA ASN A 36 -10.395 15.362 -11.489 1.00 1.48 H new ATOM 0 HB2 ASN A 36 -9.890 17.148 -13.093 1.00 1.70 H new ATOM 0 HB3 ASN A 36 -8.813 16.072 -13.960 1.00 1.70 H new ATOM 0 HD21 ASN A 36 -11.428 14.076 -15.418 1.00 1.91 H new ATOM 0 HD22 ASN A 36 -9.690 14.312 -15.198 1.00 1.91 H new ATOM 561 N GLU A 37 -7.976 13.550 -12.898 1.00 1.34 N ATOM 562 CA GLU A 37 -7.460 12.200 -13.127 1.00 1.31 C ATOM 563 C GLU A 37 -7.771 11.275 -11.947 1.00 1.18 C ATOM 564 O GLU A 37 -8.295 10.172 -12.096 1.00 1.30 O ATOM 565 CB GLU A 37 -5.929 12.284 -13.310 1.00 1.26 C ATOM 566 CG GLU A 37 -5.454 11.429 -14.481 1.00 0.76 C ATOM 567 CD GLU A 37 -3.975 11.609 -14.772 1.00 0.71 C ATOM 568 OE1 GLU A 37 -3.226 12.358 -14.110 1.00 1.65 O ATOM 569 OE2 GLU A 37 -3.452 11.021 -15.734 1.00 1.66 O ATOM 0 H GLU A 37 -7.346 14.276 -13.239 1.00 1.34 H new ATOM 0 HA GLU A 37 -7.939 11.790 -14.016 1.00 1.31 H new ATOM 0 HB2 GLU A 37 -5.638 13.321 -13.475 1.00 1.26 H new ATOM 0 HB3 GLU A 37 -5.434 11.956 -12.396 1.00 1.26 H new ATOM 0 HG2 GLU A 37 -5.653 10.379 -14.264 1.00 0.76 H new ATOM 0 HG3 GLU A 37 -6.030 11.685 -15.370 1.00 0.76 H new ATOM 576 N PHE A 38 -7.420 11.749 -10.754 1.00 1.00 N ATOM 577 CA PHE A 38 -7.638 11.036 -9.516 1.00 0.92 C ATOM 578 C PHE A 38 -9.133 10.818 -9.304 1.00 0.98 C ATOM 579 O PHE A 38 -9.567 9.707 -9.001 1.00 0.99 O ATOM 580 CB PHE A 38 -7.023 11.826 -8.357 1.00 0.85 C ATOM 581 CG PHE A 38 -6.459 10.955 -7.259 1.00 1.12 C ATOM 582 CD1 PHE A 38 -7.284 10.061 -6.555 1.00 1.72 C ATOM 583 CD2 PHE A 38 -5.083 10.998 -6.979 1.00 2.53 C ATOM 584 CE1 PHE A 38 -6.747 9.265 -5.532 1.00 2.19 C ATOM 585 CE2 PHE A 38 -4.543 10.207 -5.957 1.00 3.15 C ATOM 586 CZ PHE A 38 -5.376 9.339 -5.234 1.00 2.58 C ATOM 0 H PHE A 38 -6.969 12.655 -10.628 1.00 1.00 H new ATOM 0 HA PHE A 38 -7.156 10.059 -9.560 1.00 0.92 H new ATOM 0 HB2 PHE A 38 -6.230 12.465 -8.745 1.00 0.85 H new ATOM 0 HB3 PHE A 38 -7.783 12.483 -7.933 1.00 0.85 H new ATOM 0 HD1 PHE A 38 -8.333 9.987 -6.802 1.00 1.72 H new ATOM 0 HD2 PHE A 38 -4.438 11.645 -7.555 1.00 2.53 H new ATOM 0 HE1 PHE A 38 -7.386 8.597 -4.975 1.00 2.19 H new ATOM 0 HE2 PHE A 38 -3.490 10.265 -5.726 1.00 3.15 H new ATOM 0 HZ PHE A 38 -4.962 8.726 -4.447 1.00 2.58 H new ATOM 596 N LYS A 39 -9.934 11.875 -9.448 1.00 1.05 N ATOM 597 CA LYS A 39 -11.357 11.785 -9.196 1.00 1.16 C ATOM 598 C LYS A 39 -11.996 10.752 -10.123 1.00 1.26 C ATOM 599 O LYS A 39 -12.802 9.954 -9.650 1.00 1.28 O ATOM 600 CB LYS A 39 -12.038 13.160 -9.159 1.00 1.31 C ATOM 601 CG LYS A 39 -13.215 13.177 -8.158 1.00 1.72 C ATOM 602 CD LYS A 39 -13.494 14.622 -7.695 1.00 2.23 C ATOM 603 CE LYS A 39 -14.545 14.680 -6.572 1.00 2.36 C ATOM 604 NZ LYS A 39 -14.500 15.948 -5.804 1.00 4.01 N ATOM 0 H LYS A 39 -9.614 12.799 -9.738 1.00 1.05 H new ATOM 0 HA LYS A 39 -11.518 11.409 -8.186 1.00 1.16 H new ATOM 0 HB2 LYS A 39 -11.310 13.921 -8.880 1.00 1.31 H new ATOM 0 HB3 LYS A 39 -12.401 13.415 -10.155 1.00 1.31 H new ATOM 0 HG2 LYS A 39 -14.106 12.758 -8.625 1.00 1.72 H new ATOM 0 HG3 LYS A 39 -12.981 12.550 -7.298 1.00 1.72 H new ATOM 0 HD2 LYS A 39 -12.566 15.075 -7.346 1.00 2.23 H new ATOM 0 HD3 LYS A 39 -13.838 15.213 -8.543 1.00 2.23 H new ATOM 0 HE2 LYS A 39 -15.538 14.558 -7.004 1.00 2.36 H new ATOM 0 HE3 LYS A 39 -14.389 13.843 -5.891 1.00 2.36 H new ATOM 0 HZ1 LYS A 39 -15.106 15.866 -4.963 1.00 4.01 H new ATOM 0 HZ2 LYS A 39 -13.522 16.140 -5.509 1.00 4.01 H new ATOM 0 HZ3 LYS A 39 -14.841 16.728 -6.401 1.00 4.01 H new ATOM 618 N GLU A 40 -11.574 10.692 -11.391 1.00 1.32 N ATOM 619 CA GLU A 40 -11.999 9.625 -12.294 1.00 1.37 C ATOM 620 C GLU A 40 -11.723 8.251 -11.678 1.00 1.33 C ATOM 621 O GLU A 40 -12.569 7.364 -11.745 1.00 1.35 O ATOM 622 CB GLU A 40 -11.303 9.683 -13.664 1.00 1.38 C ATOM 623 CG GLU A 40 -11.261 11.066 -14.337 1.00 1.60 C ATOM 624 CD GLU A 40 -12.596 11.575 -14.866 1.00 2.63 C ATOM 625 OE1 GLU A 40 -13.603 10.850 -14.713 1.00 3.68 O ATOM 626 OE2 GLU A 40 -12.569 12.696 -15.424 1.00 3.18 O ATOM 0 H GLU A 40 -10.939 11.371 -11.812 1.00 1.32 H new ATOM 0 HA GLU A 40 -13.068 9.775 -12.444 1.00 1.37 H new ATOM 0 HB2 GLU A 40 -10.280 9.326 -13.546 1.00 1.38 H new ATOM 0 HB3 GLU A 40 -11.807 8.988 -14.336 1.00 1.38 H new ATOM 0 HG2 GLU A 40 -10.874 11.789 -13.619 1.00 1.60 H new ATOM 0 HG3 GLU A 40 -10.552 11.028 -15.164 1.00 1.60 H new ATOM 633 N LEU A 41 -10.542 8.058 -11.080 1.00 1.31 N ATOM 634 CA LEU A 41 -10.111 6.757 -10.589 1.00 1.33 C ATOM 635 C LEU A 41 -11.063 6.316 -9.492 1.00 1.24 C ATOM 636 O LEU A 41 -11.586 5.202 -9.514 1.00 1.24 O ATOM 637 CB LEU A 41 -8.641 6.825 -10.132 1.00 1.44 C ATOM 638 CG LEU A 41 -8.046 5.499 -9.618 1.00 1.49 C ATOM 639 CD1 LEU A 41 -6.521 5.549 -9.780 1.00 3.21 C ATOM 640 CD2 LEU A 41 -8.340 5.242 -8.131 1.00 2.09 C ATOM 0 H LEU A 41 -9.863 8.803 -10.926 1.00 1.31 H new ATOM 0 HA LEU A 41 -10.147 6.007 -11.379 1.00 1.33 H new ATOM 0 HB2 LEU A 41 -8.035 7.176 -10.967 1.00 1.44 H new ATOM 0 HB3 LEU A 41 -8.558 7.571 -9.342 1.00 1.44 H new ATOM 0 HG LEU A 41 -8.505 4.700 -10.200 1.00 1.49 H new ATOM 0 HD11 LEU A 41 -6.086 4.617 -9.420 1.00 3.21 H new ATOM 0 HD12 LEU A 41 -6.271 5.683 -10.832 1.00 3.21 H new ATOM 0 HD13 LEU A 41 -6.121 6.383 -9.203 1.00 3.21 H new ATOM 0 HD21 LEU A 41 -7.895 4.294 -7.831 1.00 2.09 H new ATOM 0 HD22 LEU A 41 -7.916 6.048 -7.532 1.00 2.09 H new ATOM 0 HD23 LEU A 41 -9.418 5.202 -7.975 1.00 2.09 H new ATOM 652 N VAL A 42 -11.308 7.211 -8.536 1.00 1.19 N ATOM 653 CA VAL A 42 -12.122 6.863 -7.389 1.00 1.16 C ATOM 654 C VAL A 42 -13.566 6.669 -7.849 1.00 1.17 C ATOM 655 O VAL A 42 -14.161 5.618 -7.614 1.00 1.24 O ATOM 656 CB VAL A 42 -11.942 7.874 -6.244 1.00 1.14 C ATOM 657 CG1 VAL A 42 -10.591 7.662 -5.547 1.00 1.15 C ATOM 658 CG2 VAL A 42 -12.053 9.349 -6.605 1.00 1.23 C ATOM 0 H VAL A 42 -10.957 8.169 -8.538 1.00 1.19 H new ATOM 0 HA VAL A 42 -11.795 5.916 -6.961 1.00 1.16 H new ATOM 0 HB VAL A 42 -12.791 7.661 -5.595 1.00 1.14 H new ATOM 0 HG11 VAL A 42 -10.481 8.386 -4.740 1.00 1.15 H new ATOM 0 HG12 VAL A 42 -10.547 6.653 -5.138 1.00 1.15 H new ATOM 0 HG13 VAL A 42 -9.785 7.797 -6.268 1.00 1.15 H new ATOM 0 HG21 VAL A 42 -11.907 9.955 -5.711 1.00 1.23 H new ATOM 0 HG22 VAL A 42 -11.291 9.601 -7.343 1.00 1.23 H new ATOM 0 HG23 VAL A 42 -13.041 9.549 -7.021 1.00 1.23 H new ATOM 668 N THR A 43 -14.098 7.663 -8.559 1.00 1.26 N ATOM 669 CA THR A 43 -15.456 7.671 -9.074 1.00 1.40 C ATOM 670 C THR A 43 -15.749 6.405 -9.881 1.00 1.43 C ATOM 671 O THR A 43 -16.757 5.742 -9.653 1.00 1.50 O ATOM 672 CB THR A 43 -15.626 8.940 -9.918 1.00 1.50 C ATOM 673 OG1 THR A 43 -15.435 10.070 -9.092 1.00 1.52 O ATOM 674 CG2 THR A 43 -17.011 9.047 -10.562 1.00 1.69 C ATOM 0 H THR A 43 -13.576 8.507 -8.796 1.00 1.26 H new ATOM 0 HA THR A 43 -16.174 7.677 -8.254 1.00 1.40 H new ATOM 0 HB THR A 43 -14.888 8.893 -10.719 1.00 1.50 H new ATOM 0 HG1 THR A 43 -14.487 10.318 -9.091 1.00 1.52 H new ATOM 0 HG21 THR A 43 -17.071 9.965 -11.146 1.00 1.69 H new ATOM 0 HG22 THR A 43 -17.176 8.190 -11.215 1.00 1.69 H new ATOM 0 HG23 THR A 43 -17.774 9.062 -9.784 1.00 1.69 H new ATOM 682 N GLN A 44 -14.885 6.083 -10.846 1.00 1.47 N ATOM 683 CA GLN A 44 -15.103 4.972 -11.747 1.00 1.56 C ATOM 684 C GLN A 44 -14.900 3.646 -11.012 1.00 1.50 C ATOM 685 O GLN A 44 -15.730 2.747 -11.123 1.00 1.50 O ATOM 686 CB GLN A 44 -14.143 5.114 -12.936 1.00 1.68 C ATOM 687 CG GLN A 44 -14.476 4.151 -14.079 1.00 1.98 C ATOM 688 CD GLN A 44 -13.386 4.251 -15.135 1.00 2.22 C ATOM 689 OE1 GLN A 44 -13.514 4.975 -16.114 1.00 3.59 O ATOM 690 NE2 GLN A 44 -12.278 3.556 -14.911 1.00 1.73 N ATOM 0 H GLN A 44 -14.017 6.591 -11.017 1.00 1.47 H new ATOM 0 HA GLN A 44 -16.128 4.979 -12.117 1.00 1.56 H new ATOM 0 HB2 GLN A 44 -14.179 6.138 -13.307 1.00 1.68 H new ATOM 0 HB3 GLN A 44 -13.123 4.932 -12.598 1.00 1.68 H new ATOM 0 HG2 GLN A 44 -14.546 3.130 -13.704 1.00 1.98 H new ATOM 0 HG3 GLN A 44 -15.445 4.399 -14.512 1.00 1.98 H new ATOM 0 HE21 GLN A 44 -12.206 2.963 -14.084 1.00 1.73 H new ATOM 0 HE22 GLN A 44 -11.498 3.615 -15.565 1.00 1.73 H new ATOM 699 N GLN A 45 -13.768 3.498 -10.315 1.00 1.51 N ATOM 700 CA GLN A 45 -13.282 2.184 -9.922 1.00 1.60 C ATOM 701 C GLN A 45 -13.717 1.780 -8.509 1.00 1.38 C ATOM 702 O GLN A 45 -13.788 0.583 -8.232 1.00 2.13 O ATOM 703 CB GLN A 45 -11.755 2.124 -10.107 1.00 2.14 C ATOM 704 CG GLN A 45 -11.290 0.814 -10.761 1.00 2.02 C ATOM 705 CD GLN A 45 -11.642 0.710 -12.247 1.00 2.72 C ATOM 706 OE1 GLN A 45 -12.252 1.605 -12.829 1.00 4.12 O ATOM 707 NE2 GLN A 45 -11.233 -0.380 -12.890 1.00 2.80 N ATOM 0 H GLN A 45 -13.177 4.274 -10.015 1.00 1.51 H new ATOM 0 HA GLN A 45 -13.743 1.444 -10.577 1.00 1.60 H new ATOM 0 HB2 GLN A 45 -11.434 2.966 -10.720 1.00 2.14 H new ATOM 0 HB3 GLN A 45 -11.271 2.233 -9.137 1.00 2.14 H new ATOM 0 HG2 GLN A 45 -10.210 0.724 -10.645 1.00 2.02 H new ATOM 0 HG3 GLN A 45 -11.739 -0.026 -10.231 1.00 2.02 H new ATOM 0 HE21 GLN A 45 -10.728 -1.110 -12.387 1.00 2.80 H new ATOM 0 HE22 GLN A 45 -11.424 -0.486 -13.886 1.00 2.80 H new ATOM 716 N LEU A 46 -13.975 2.738 -7.605 1.00 1.52 N ATOM 717 CA LEU A 46 -14.312 2.464 -6.206 1.00 1.37 C ATOM 718 C LEU A 46 -15.801 2.755 -5.954 1.00 1.64 C ATOM 719 O LEU A 46 -16.141 3.888 -5.624 1.00 2.07 O ATOM 720 CB LEU A 46 -13.429 3.306 -5.267 1.00 1.09 C ATOM 721 CG LEU A 46 -12.026 2.725 -5.016 1.00 1.10 C ATOM 722 CD1 LEU A 46 -11.182 2.584 -6.286 1.00 2.26 C ATOM 723 CD2 LEU A 46 -11.291 3.639 -4.029 1.00 1.57 C ATOM 0 H LEU A 46 -13.954 3.733 -7.830 1.00 1.52 H new ATOM 0 HA LEU A 46 -14.124 1.410 -5.999 1.00 1.37 H new ATOM 0 HB2 LEU A 46 -13.324 4.306 -5.688 1.00 1.09 H new ATOM 0 HB3 LEU A 46 -13.939 3.415 -4.310 1.00 1.09 H new ATOM 0 HG LEU A 46 -12.162 1.719 -4.618 1.00 1.10 H new ATOM 0 HD11 LEU A 46 -10.207 2.168 -6.031 1.00 2.26 H new ATOM 0 HD12 LEU A 46 -11.687 1.920 -6.987 1.00 2.26 H new ATOM 0 HD13 LEU A 46 -11.050 3.563 -6.746 1.00 2.26 H new ATOM 0 HD21 LEU A 46 -10.294 3.242 -3.839 1.00 1.57 H new ATOM 0 HD22 LEU A 46 -11.209 4.640 -4.452 1.00 1.57 H new ATOM 0 HD23 LEU A 46 -11.847 3.685 -3.093 1.00 1.57 H new ATOM 735 N PRO A 47 -16.701 1.761 -6.057 1.00 1.50 N ATOM 736 CA PRO A 47 -18.127 1.983 -5.873 1.00 1.73 C ATOM 737 C PRO A 47 -18.469 2.238 -4.402 1.00 1.93 C ATOM 738 O PRO A 47 -19.263 3.126 -4.104 1.00 2.36 O ATOM 739 CB PRO A 47 -18.812 0.724 -6.414 1.00 1.66 C ATOM 740 CG PRO A 47 -17.768 -0.374 -6.208 1.00 1.47 C ATOM 741 CD PRO A 47 -16.443 0.367 -6.387 1.00 1.28 C ATOM 0 HA PRO A 47 -18.468 2.873 -6.402 1.00 1.73 H new ATOM 0 HB2 PRO A 47 -19.734 0.506 -5.874 1.00 1.66 H new ATOM 0 HB3 PRO A 47 -19.077 0.833 -7.466 1.00 1.66 H new ATOM 0 HG2 PRO A 47 -17.847 -0.825 -5.219 1.00 1.47 H new ATOM 0 HG3 PRO A 47 -17.881 -1.179 -6.935 1.00 1.47 H new ATOM 0 HD2 PRO A 47 -15.674 -0.050 -5.736 1.00 1.28 H new ATOM 0 HD3 PRO A 47 -16.080 0.271 -7.410 1.00 1.28 H new ATOM 749 N HIS A 48 -17.903 1.447 -3.482 1.00 1.81 N ATOM 750 CA HIS A 48 -18.235 1.522 -2.063 1.00 2.02 C ATOM 751 C HIS A 48 -17.037 1.105 -1.204 1.00 1.55 C ATOM 752 O HIS A 48 -17.180 0.374 -0.222 1.00 1.76 O ATOM 753 CB HIS A 48 -19.496 0.683 -1.794 1.00 2.69 C ATOM 754 CG HIS A 48 -20.024 0.756 -0.381 1.00 2.86 C ATOM 755 ND1 HIS A 48 -20.467 -0.313 0.364 1.00 2.93 N ATOM 756 CD2 HIS A 48 -20.097 1.871 0.414 1.00 3.80 C ATOM 757 CE1 HIS A 48 -20.799 0.151 1.581 1.00 3.40 C ATOM 758 NE2 HIS A 48 -20.586 1.474 1.663 1.00 3.84 N ATOM 0 H HIS A 48 -17.203 0.739 -3.705 1.00 1.81 H new ATOM 0 HA HIS A 48 -18.460 2.551 -1.783 1.00 2.02 H new ATOM 0 HB2 HIS A 48 -20.282 1.007 -2.476 1.00 2.69 H new ATOM 0 HB3 HIS A 48 -19.278 -0.358 -2.031 1.00 2.69 H new ATOM 0 HD2 HIS A 48 -19.825 2.876 0.127 1.00 3.80 H new ATOM 0 HE1 HIS A 48 -21.185 -0.458 2.385 1.00 3.40 H new ATOM 0 HE2 HIS A 48 -20.748 2.071 2.474 1.00 3.84 H new ATOM 766 N LEU A 49 -15.848 1.600 -1.557 1.00 1.70 N ATOM 767 CA LEU A 49 -14.667 1.532 -0.720 1.00 1.45 C ATOM 768 C LEU A 49 -14.582 2.855 0.042 1.00 1.33 C ATOM 769 O LEU A 49 -15.044 2.947 1.180 1.00 1.41 O ATOM 770 CB LEU A 49 -13.446 1.227 -1.597 1.00 1.51 C ATOM 771 CG LEU A 49 -12.118 1.193 -0.826 1.00 1.74 C ATOM 772 CD1 LEU A 49 -12.201 0.327 0.429 1.00 1.95 C ATOM 773 CD2 LEU A 49 -11.040 0.601 -1.731 1.00 1.49 C ATOM 0 H LEU A 49 -15.685 2.066 -2.450 1.00 1.70 H new ATOM 0 HA LEU A 49 -14.708 0.727 0.014 1.00 1.45 H new ATOM 0 HB2 LEU A 49 -13.595 0.265 -2.088 1.00 1.51 H new ATOM 0 HB3 LEU A 49 -13.379 1.979 -2.383 1.00 1.51 H new ATOM 0 HG LEU A 49 -11.885 2.215 -0.527 1.00 1.74 H new ATOM 0 HD11 LEU A 49 -11.238 0.334 0.940 1.00 1.95 H new ATOM 0 HD12 LEU A 49 -12.968 0.723 1.094 1.00 1.95 H new ATOM 0 HD13 LEU A 49 -12.456 -0.695 0.149 1.00 1.95 H new ATOM 0 HD21 LEU A 49 -10.091 0.571 -1.195 1.00 1.49 H new ATOM 0 HD22 LEU A 49 -11.324 -0.410 -2.022 1.00 1.49 H new ATOM 0 HD23 LEU A 49 -10.934 1.219 -2.623 1.00 1.49 H new ATOM 785 N LEU A 50 -14.062 3.900 -0.606 1.00 1.33 N ATOM 786 CA LEU A 50 -14.062 5.246 -0.055 1.00 1.33 C ATOM 787 C LEU A 50 -15.464 5.838 -0.171 1.00 1.44 C ATOM 788 O LEU A 50 -15.770 6.572 -1.110 1.00 2.30 O ATOM 789 CB LEU A 50 -13.013 6.118 -0.760 1.00 1.39 C ATOM 790 CG LEU A 50 -11.579 5.761 -0.339 1.00 1.40 C ATOM 791 CD1 LEU A 50 -10.587 6.407 -1.312 1.00 1.58 C ATOM 792 CD2 LEU A 50 -11.257 6.255 1.080 1.00 1.38 C ATOM 0 H LEU A 50 -13.630 3.831 -1.528 1.00 1.33 H new ATOM 0 HA LEU A 50 -13.790 5.211 1.000 1.00 1.33 H new ATOM 0 HB2 LEU A 50 -13.112 6.001 -1.839 1.00 1.39 H new ATOM 0 HB3 LEU A 50 -13.205 7.167 -0.534 1.00 1.39 H new ATOM 0 HG LEU A 50 -11.494 4.674 -0.355 1.00 1.40 H new ATOM 0 HD11 LEU A 50 -9.569 6.155 -1.015 1.00 1.58 H new ATOM 0 HD12 LEU A 50 -10.773 6.037 -2.320 1.00 1.58 H new ATOM 0 HD13 LEU A 50 -10.712 7.490 -1.294 1.00 1.58 H new ATOM 0 HD21 LEU A 50 -10.234 5.981 1.337 1.00 1.38 H new ATOM 0 HD22 LEU A 50 -11.364 7.339 1.121 1.00 1.38 H new ATOM 0 HD23 LEU A 50 -11.945 5.796 1.790 1.00 1.38 H new ATOM 804 N LYS A 51 -16.309 5.519 0.811 1.00 1.41 N ATOM 805 CA LYS A 51 -17.546 6.247 1.065 1.00 1.85 C ATOM 806 C LYS A 51 -17.310 7.763 0.988 1.00 1.76 C ATOM 807 O LYS A 51 -16.254 8.253 1.386 1.00 2.52 O ATOM 808 CB LYS A 51 -18.160 5.809 2.408 1.00 2.46 C ATOM 809 CG LYS A 51 -17.210 5.889 3.620 1.00 3.19 C ATOM 810 CD LYS A 51 -17.307 7.188 4.439 1.00 4.41 C ATOM 811 CE LYS A 51 -18.542 7.234 5.359 1.00 5.27 C ATOM 812 NZ LYS A 51 -19.543 8.234 4.936 1.00 5.73 N ATOM 0 H LYS A 51 -16.150 4.743 1.454 1.00 1.41 H new ATOM 0 HA LYS A 51 -18.270 6.003 0.288 1.00 1.85 H new ATOM 0 HB2 LYS A 51 -19.034 6.429 2.610 1.00 2.46 H new ATOM 0 HB3 LYS A 51 -18.513 4.782 2.310 1.00 2.46 H new ATOM 0 HG2 LYS A 51 -17.415 5.046 4.279 1.00 3.19 H new ATOM 0 HG3 LYS A 51 -16.185 5.776 3.267 1.00 3.19 H new ATOM 0 HD2 LYS A 51 -16.407 7.297 5.044 1.00 4.41 H new ATOM 0 HD3 LYS A 51 -17.338 8.038 3.758 1.00 4.41 H new ATOM 0 HE2 LYS A 51 -19.008 6.249 5.381 1.00 5.27 H new ATOM 0 HE3 LYS A 51 -18.221 7.458 6.377 1.00 5.27 H new ATOM 0 HZ1 LYS A 51 -20.385 8.160 5.541 1.00 5.73 H new ATOM 0 HZ2 LYS A 51 -19.138 9.188 5.022 1.00 5.73 H new ATOM 0 HZ3 LYS A 51 -19.811 8.059 3.947 1.00 5.73 H new ATOM 826 N ASP A 52 -18.300 8.486 0.459 1.00 1.72 N ATOM 827 CA ASP A 52 -18.322 9.939 0.334 1.00 1.81 C ATOM 828 C ASP A 52 -17.265 10.406 -0.669 1.00 1.63 C ATOM 829 O ASP A 52 -16.639 11.448 -0.485 1.00 1.89 O ATOM 830 CB ASP A 52 -18.184 10.659 1.691 1.00 2.28 C ATOM 831 CG ASP A 52 -19.053 10.116 2.813 1.00 3.16 C ATOM 832 OD1 ASP A 52 -19.887 9.209 2.586 1.00 3.92 O ATOM 833 OD2 ASP A 52 -18.809 10.505 3.976 1.00 4.19 O ATOM 0 H ASP A 52 -19.146 8.051 0.090 1.00 1.72 H new ATOM 0 HA ASP A 52 -19.304 10.216 -0.049 1.00 1.81 H new ATOM 0 HB2 ASP A 52 -17.142 10.607 2.005 1.00 2.28 H new ATOM 0 HB3 ASP A 52 -18.422 11.713 1.549 1.00 2.28 H new ATOM 838 N VAL A 53 -17.101 9.653 -1.762 1.00 1.43 N ATOM 839 CA VAL A 53 -16.132 9.883 -2.818 1.00 1.46 C ATOM 840 C VAL A 53 -16.128 11.321 -3.360 1.00 1.60 C ATOM 841 O VAL A 53 -15.108 11.790 -3.860 1.00 2.13 O ATOM 842 CB VAL A 53 -16.355 8.812 -3.906 1.00 1.48 C ATOM 843 CG1 VAL A 53 -17.017 9.327 -5.188 1.00 2.35 C ATOM 844 CG2 VAL A 53 -15.019 8.149 -4.206 1.00 3.15 C ATOM 0 H VAL A 53 -17.674 8.827 -1.935 1.00 1.43 H new ATOM 0 HA VAL A 53 -15.127 9.780 -2.408 1.00 1.46 H new ATOM 0 HB VAL A 53 -17.070 8.092 -3.508 1.00 1.48 H new ATOM 0 HG11 VAL A 53 -17.133 8.504 -5.894 1.00 2.35 H new ATOM 0 HG12 VAL A 53 -17.997 9.742 -4.950 1.00 2.35 H new ATOM 0 HG13 VAL A 53 -16.393 10.102 -5.634 1.00 2.35 H new ATOM 0 HG21 VAL A 53 -15.155 7.387 -4.974 1.00 3.15 H new ATOM 0 HG22 VAL A 53 -14.312 8.899 -4.560 1.00 3.15 H new ATOM 0 HG23 VAL A 53 -14.631 7.685 -3.299 1.00 3.15 H new ATOM 854 N GLY A 54 -17.254 12.033 -3.247 1.00 1.45 N ATOM 855 CA GLY A 54 -17.324 13.461 -3.533 1.00 1.76 C ATOM 856 C GLY A 54 -16.176 14.218 -2.857 1.00 1.69 C ATOM 857 O GLY A 54 -15.515 15.041 -3.495 1.00 1.91 O ATOM 0 H GLY A 54 -18.143 11.629 -2.953 1.00 1.45 H new ATOM 0 HA2 GLY A 54 -17.284 13.621 -4.610 1.00 1.76 H new ATOM 0 HA3 GLY A 54 -18.278 13.858 -3.187 1.00 1.76 H new ATOM 861 N SER A 55 -15.904 13.890 -1.590 1.00 1.53 N ATOM 862 CA SER A 55 -14.814 14.422 -0.779 1.00 1.57 C ATOM 863 C SER A 55 -13.464 13.820 -1.205 1.00 1.44 C ATOM 864 O SER A 55 -12.659 13.425 -0.362 1.00 1.54 O ATOM 865 CB SER A 55 -15.132 14.122 0.700 1.00 1.73 C ATOM 866 OG SER A 55 -14.138 14.600 1.589 1.00 2.85 O ATOM 0 H SER A 55 -16.469 13.211 -1.080 1.00 1.53 H new ATOM 0 HA SER A 55 -14.728 15.499 -0.922 1.00 1.57 H new ATOM 0 HB2 SER A 55 -16.090 14.573 0.958 1.00 1.73 H new ATOM 0 HB3 SER A 55 -15.241 13.045 0.831 1.00 1.73 H new ATOM 0 HG SER A 55 -14.392 14.384 2.510 1.00 2.85 H new ATOM 872 N LEU A 56 -13.179 13.754 -2.507 1.00 1.40 N ATOM 873 CA LEU A 56 -11.896 13.313 -3.003 1.00 1.37 C ATOM 874 C LEU A 56 -10.844 14.331 -2.583 1.00 1.35 C ATOM 875 O LEU A 56 -9.817 13.968 -2.029 1.00 1.31 O ATOM 876 CB LEU A 56 -11.998 13.149 -4.525 1.00 1.48 C ATOM 877 CG LEU A 56 -10.729 12.668 -5.239 1.00 1.53 C ATOM 878 CD1 LEU A 56 -9.861 13.843 -5.687 1.00 1.49 C ATOM 879 CD2 LEU A 56 -9.955 11.655 -4.399 1.00 1.57 C ATOM 0 H LEU A 56 -13.841 14.008 -3.240 1.00 1.40 H new ATOM 0 HA LEU A 56 -11.602 12.349 -2.588 1.00 1.37 H new ATOM 0 HB2 LEU A 56 -12.801 12.444 -4.741 1.00 1.48 H new ATOM 0 HB3 LEU A 56 -12.291 14.107 -4.954 1.00 1.48 H new ATOM 0 HG LEU A 56 -11.039 12.144 -6.143 1.00 1.53 H new ATOM 0 HD11 LEU A 56 -8.970 13.466 -6.189 1.00 1.49 H new ATOM 0 HD12 LEU A 56 -10.427 14.472 -6.374 1.00 1.49 H new ATOM 0 HD13 LEU A 56 -9.566 14.430 -4.817 1.00 1.49 H new ATOM 0 HD21 LEU A 56 -9.063 11.339 -4.940 1.00 1.57 H new ATOM 0 HD22 LEU A 56 -9.663 12.113 -3.454 1.00 1.57 H new ATOM 0 HD23 LEU A 56 -10.586 10.788 -4.202 1.00 1.57 H new ATOM 891 N ASP A 57 -11.104 15.611 -2.839 1.00 1.48 N ATOM 892 CA ASP A 57 -10.147 16.707 -2.762 1.00 1.63 C ATOM 893 C ASP A 57 -9.417 16.736 -1.412 1.00 1.65 C ATOM 894 O ASP A 57 -8.215 16.984 -1.335 1.00 1.69 O ATOM 895 CB ASP A 57 -10.874 18.026 -3.075 1.00 1.89 C ATOM 896 CG ASP A 57 -11.727 17.944 -4.349 1.00 2.91 C ATOM 897 OD1 ASP A 57 -12.611 17.051 -4.410 1.00 3.49 O ATOM 898 OD2 ASP A 57 -11.471 18.747 -5.268 1.00 4.11 O ATOM 0 H ASP A 57 -12.033 15.925 -3.119 1.00 1.48 H new ATOM 0 HA ASP A 57 -9.365 16.559 -3.507 1.00 1.63 H new ATOM 0 HB2 ASP A 57 -11.511 18.294 -2.232 1.00 1.89 H new ATOM 0 HB3 ASP A 57 -10.139 18.824 -3.185 1.00 1.89 H new ATOM 903 N GLU A 58 -10.141 16.433 -0.335 1.00 1.67 N ATOM 904 CA GLU A 58 -9.558 16.231 0.983 1.00 1.73 C ATOM 905 C GLU A 58 -8.464 15.151 0.940 1.00 1.61 C ATOM 906 O GLU A 58 -7.328 15.385 1.358 1.00 1.66 O ATOM 907 CB GLU A 58 -10.693 15.876 1.950 1.00 1.82 C ATOM 908 CG GLU A 58 -10.184 15.575 3.361 1.00 2.35 C ATOM 909 CD GLU A 58 -11.343 15.233 4.281 1.00 2.44 C ATOM 910 OE1 GLU A 58 -11.848 14.098 4.133 1.00 2.53 O ATOM 911 OE2 GLU A 58 -11.730 16.116 5.072 1.00 3.26 O ATOM 0 H GLU A 58 -11.155 16.321 -0.357 1.00 1.67 H new ATOM 0 HA GLU A 58 -9.067 17.140 1.329 1.00 1.73 H new ATOM 0 HB2 GLU A 58 -11.403 16.702 1.991 1.00 1.82 H new ATOM 0 HB3 GLU A 58 -11.234 15.010 1.569 1.00 1.82 H new ATOM 0 HG2 GLU A 58 -9.479 14.745 3.330 1.00 2.35 H new ATOM 0 HG3 GLU A 58 -9.644 16.438 3.751 1.00 2.35 H new ATOM 918 N LYS A 59 -8.793 13.962 0.420 1.00 1.50 N ATOM 919 CA LYS A 59 -7.811 12.904 0.250 1.00 1.47 C ATOM 920 C LYS A 59 -6.694 13.405 -0.666 1.00 1.38 C ATOM 921 O LYS A 59 -5.528 13.227 -0.329 1.00 1.42 O ATOM 922 CB LYS A 59 -8.408 11.594 -0.293 1.00 1.48 C ATOM 923 CG LYS A 59 -9.209 10.743 0.710 1.00 1.49 C ATOM 924 CD LYS A 59 -10.692 11.126 0.831 1.00 1.55 C ATOM 925 CE LYS A 59 -10.969 11.983 2.079 1.00 1.93 C ATOM 926 NZ LYS A 59 -12.351 12.507 2.138 1.00 2.75 N ATOM 0 H LYS A 59 -9.734 13.716 0.112 1.00 1.50 H new ATOM 0 HA LYS A 59 -7.417 12.663 1.237 1.00 1.47 H new ATOM 0 HB2 LYS A 59 -9.059 11.837 -1.133 1.00 1.48 H new ATOM 0 HB3 LYS A 59 -7.595 10.984 -0.686 1.00 1.48 H new ATOM 0 HG2 LYS A 59 -9.140 9.696 0.415 1.00 1.49 H new ATOM 0 HG3 LYS A 59 -8.744 10.828 1.692 1.00 1.49 H new ATOM 0 HD2 LYS A 59 -10.998 11.674 -0.060 1.00 1.55 H new ATOM 0 HD3 LYS A 59 -11.298 10.221 0.872 1.00 1.55 H new ATOM 0 HE2 LYS A 59 -10.777 11.386 2.970 1.00 1.93 H new ATOM 0 HE3 LYS A 59 -10.270 12.819 2.099 1.00 1.93 H new ATOM 0 HZ1 LYS A 59 -12.523 12.928 3.073 1.00 2.75 H new ATOM 0 HZ2 LYS A 59 -12.479 13.231 1.403 1.00 2.75 H new ATOM 0 HZ3 LYS A 59 -13.024 11.730 1.979 1.00 2.75 H new ATOM 940 N MET A 60 -7.045 14.049 -1.791 1.00 1.30 N ATOM 941 CA MET A 60 -6.085 14.590 -2.755 1.00 1.25 C ATOM 942 C MET A 60 -4.978 15.323 -2.002 1.00 1.42 C ATOM 943 O MET A 60 -3.798 15.019 -2.152 1.00 1.44 O ATOM 944 CB MET A 60 -6.756 15.470 -3.819 1.00 1.28 C ATOM 945 CG MET A 60 -5.782 15.883 -4.933 1.00 1.30 C ATOM 946 SD MET A 60 -4.702 17.305 -4.596 1.00 1.88 S ATOM 947 CE MET A 60 -5.889 18.664 -4.698 1.00 1.57 C ATOM 0 H MET A 60 -8.017 14.208 -2.056 1.00 1.30 H new ATOM 0 HA MET A 60 -5.641 13.763 -3.309 1.00 1.25 H new ATOM 0 HB2 MET A 60 -7.597 14.931 -4.256 1.00 1.28 H new ATOM 0 HB3 MET A 60 -7.162 16.363 -3.345 1.00 1.28 H new ATOM 0 HG2 MET A 60 -5.151 15.026 -5.167 1.00 1.30 H new ATOM 0 HG3 MET A 60 -6.364 16.104 -5.828 1.00 1.30 H new ATOM 0 HE1 MET A 60 -5.374 19.610 -4.531 1.00 1.57 H new ATOM 0 HE2 MET A 60 -6.350 18.671 -5.686 1.00 1.57 H new ATOM 0 HE3 MET A 60 -6.660 18.532 -3.939 1.00 1.57 H new ATOM 957 N LYS A 61 -5.381 16.247 -1.133 1.00 1.56 N ATOM 958 CA LYS A 61 -4.463 17.038 -0.334 1.00 1.70 C ATOM 959 C LYS A 61 -3.749 16.175 0.721 1.00 1.66 C ATOM 960 O LYS A 61 -2.553 16.342 0.941 1.00 1.80 O ATOM 961 CB LYS A 61 -5.236 18.227 0.251 1.00 1.84 C ATOM 962 CG LYS A 61 -5.794 19.096 -0.894 1.00 1.95 C ATOM 963 CD LYS A 61 -6.868 20.085 -0.432 1.00 1.92 C ATOM 964 CE LYS A 61 -6.382 21.046 0.656 1.00 2.95 C ATOM 965 NZ LYS A 61 -5.204 21.836 0.231 1.00 4.66 N ATOM 0 H LYS A 61 -6.363 16.466 -0.966 1.00 1.56 H new ATOM 0 HA LYS A 61 -3.658 17.434 -0.953 1.00 1.70 H new ATOM 0 HB2 LYS A 61 -6.051 17.869 0.880 1.00 1.84 H new ATOM 0 HB3 LYS A 61 -4.581 18.822 0.887 1.00 1.84 H new ATOM 0 HG2 LYS A 61 -4.975 19.648 -1.355 1.00 1.95 H new ATOM 0 HG3 LYS A 61 -6.213 18.447 -1.663 1.00 1.95 H new ATOM 0 HD2 LYS A 61 -7.212 20.663 -1.290 1.00 1.92 H new ATOM 0 HD3 LYS A 61 -7.727 19.528 -0.057 1.00 1.92 H new ATOM 0 HE2 LYS A 61 -7.192 21.724 0.925 1.00 2.95 H new ATOM 0 HE3 LYS A 61 -6.130 20.478 1.552 1.00 2.95 H new ATOM 0 HZ1 LYS A 61 -4.812 22.342 1.050 1.00 4.66 H new ATOM 0 HZ2 LYS A 61 -4.481 21.199 -0.160 1.00 4.66 H new ATOM 0 HZ3 LYS A 61 -5.490 22.523 -0.496 1.00 4.66 H new ATOM 979 N SER A 62 -4.456 15.234 1.360 1.00 1.55 N ATOM 980 CA SER A 62 -3.856 14.296 2.314 1.00 1.52 C ATOM 981 C SER A 62 -2.736 13.448 1.694 1.00 1.47 C ATOM 982 O SER A 62 -1.838 12.992 2.409 1.00 1.53 O ATOM 983 CB SER A 62 -4.928 13.371 2.906 1.00 1.49 C ATOM 984 OG SER A 62 -4.383 12.590 3.959 1.00 2.59 O ATOM 0 H SER A 62 -5.459 15.103 1.229 1.00 1.55 H new ATOM 0 HA SER A 62 -3.410 14.903 3.102 1.00 1.52 H new ATOM 0 HB2 SER A 62 -5.763 13.964 3.279 1.00 1.49 H new ATOM 0 HB3 SER A 62 -5.324 12.718 2.128 1.00 1.49 H new ATOM 0 HG SER A 62 -5.079 12.006 4.327 1.00 2.59 H new ATOM 990 N LEU A 63 -2.807 13.159 0.393 1.00 1.48 N ATOM 991 CA LEU A 63 -1.734 12.438 -0.281 1.00 1.52 C ATOM 992 C LEU A 63 -0.692 13.439 -0.797 1.00 1.46 C ATOM 993 O LEU A 63 0.505 13.225 -0.615 1.00 1.53 O ATOM 994 CB LEU A 63 -2.237 11.520 -1.401 1.00 1.65 C ATOM 995 CG LEU A 63 -3.659 10.934 -1.272 1.00 1.25 C ATOM 996 CD1 LEU A 63 -4.477 11.461 -2.443 1.00 1.96 C ATOM 997 CD2 LEU A 63 -3.715 9.416 -1.373 1.00 1.21 C ATOM 0 H LEU A 63 -3.591 13.412 -0.208 1.00 1.48 H new ATOM 0 HA LEU A 63 -1.269 11.776 0.449 1.00 1.52 H new ATOM 0 HB2 LEU A 63 -2.189 12.077 -2.337 1.00 1.65 H new ATOM 0 HB3 LEU A 63 -1.539 10.687 -1.489 1.00 1.65 H new ATOM 0 HG LEU A 63 -4.030 11.224 -0.289 1.00 1.25 H new ATOM 0 HD11 LEU A 63 -5.491 11.067 -2.385 1.00 1.96 H new ATOM 0 HD12 LEU A 63 -4.508 12.550 -2.404 1.00 1.96 H new ATOM 0 HD13 LEU A 63 -4.018 11.144 -3.379 1.00 1.96 H new ATOM 0 HD21 LEU A 63 -4.748 9.083 -1.273 1.00 1.21 H new ATOM 0 HD22 LEU A 63 -3.324 9.101 -2.341 1.00 1.21 H new ATOM 0 HD23 LEU A 63 -3.113 8.976 -0.578 1.00 1.21 H new ATOM 1009 N ASP A 64 -1.141 14.536 -1.426 1.00 1.35 N ATOM 1010 CA ASP A 64 -0.289 15.575 -2.000 1.00 1.29 C ATOM 1011 C ASP A 64 0.307 16.463 -0.905 1.00 1.41 C ATOM 1012 O ASP A 64 0.095 17.673 -0.875 1.00 1.64 O ATOM 1013 CB ASP A 64 -1.071 16.385 -3.052 1.00 1.18 C ATOM 1014 CG ASP A 64 -0.204 17.368 -3.830 1.00 1.22 C ATOM 1015 OD1 ASP A 64 1.035 17.175 -3.841 1.00 1.45 O ATOM 1016 OD2 ASP A 64 -0.760 18.313 -4.433 1.00 1.59 O ATOM 0 H ASP A 64 -2.136 14.725 -1.550 1.00 1.35 H new ATOM 0 HA ASP A 64 0.551 15.102 -2.510 1.00 1.29 H new ATOM 0 HB2 ASP A 64 -1.543 15.696 -3.752 1.00 1.18 H new ATOM 0 HB3 ASP A 64 -1.872 16.933 -2.555 1.00 1.18 H new ATOM 1021 N VAL A 65 1.093 15.858 -0.010 1.00 1.35 N ATOM 1022 CA VAL A 65 1.651 16.520 1.161 1.00 1.46 C ATOM 1023 C VAL A 65 2.517 17.728 0.788 1.00 1.67 C ATOM 1024 O VAL A 65 2.547 18.712 1.523 1.00 1.79 O ATOM 1025 CB VAL A 65 2.412 15.508 2.041 1.00 1.46 C ATOM 1026 CG1 VAL A 65 1.447 14.481 2.647 1.00 1.68 C ATOM 1027 CG2 VAL A 65 3.534 14.778 1.289 1.00 1.63 C ATOM 0 H VAL A 65 1.361 14.877 -0.085 1.00 1.35 H new ATOM 0 HA VAL A 65 0.821 16.916 1.747 1.00 1.46 H new ATOM 0 HB VAL A 65 2.879 16.091 2.835 1.00 1.46 H new ATOM 0 HG11 VAL A 65 2.005 13.777 3.264 1.00 1.68 H new ATOM 0 HG12 VAL A 65 0.708 14.995 3.261 1.00 1.68 H new ATOM 0 HG13 VAL A 65 0.941 13.940 1.847 1.00 1.68 H new ATOM 0 HG21 VAL A 65 4.030 14.081 1.964 1.00 1.63 H new ATOM 0 HG22 VAL A 65 3.111 14.230 0.447 1.00 1.63 H new ATOM 0 HG23 VAL A 65 4.258 15.505 0.921 1.00 1.63 H new ATOM 1037 N ASN A 66 3.227 17.666 -0.346 1.00 1.79 N ATOM 1038 CA ASN A 66 4.039 18.782 -0.829 1.00 2.04 C ATOM 1039 C ASN A 66 3.209 19.817 -1.598 1.00 2.18 C ATOM 1040 O ASN A 66 3.728 20.876 -1.934 1.00 2.49 O ATOM 1041 CB ASN A 66 5.223 18.280 -1.666 1.00 2.18 C ATOM 1042 CG ASN A 66 4.814 17.802 -3.057 1.00 1.75 C ATOM 1043 OD1 ASN A 66 3.878 17.018 -3.209 1.00 1.58 O ATOM 1044 ND2 ASN A 66 5.509 18.246 -4.099 1.00 2.45 N ATOM 0 H ASN A 66 3.253 16.844 -0.949 1.00 1.79 H new ATOM 0 HA ASN A 66 4.437 19.291 0.049 1.00 2.04 H new ATOM 0 HB2 ASN A 66 5.956 19.081 -1.765 1.00 2.18 H new ATOM 0 HB3 ASN A 66 5.713 17.463 -1.137 1.00 2.18 H new ATOM 0 HD21 ASN A 66 5.269 17.937 -5.041 1.00 2.45 H new ATOM 0 HD22 ASN A 66 6.282 18.896 -3.957 1.00 2.45 H new ATOM 1051 N GLN A 67 1.940 19.510 -1.880 1.00 2.02 N ATOM 1052 CA GLN A 67 0.973 20.348 -2.561 1.00 2.12 C ATOM 1053 C GLN A 67 1.489 20.921 -3.882 1.00 2.16 C ATOM 1054 O GLN A 67 1.636 22.133 -4.030 1.00 2.53 O ATOM 1055 CB GLN A 67 0.306 21.363 -1.628 1.00 2.21 C ATOM 1056 CG GLN A 67 -1.058 21.800 -2.199 1.00 2.55 C ATOM 1057 CD GLN A 67 -2.195 20.804 -1.936 1.00 2.89 C ATOM 1058 OE1 GLN A 67 -2.998 21.025 -1.027 1.00 2.79 O ATOM 1059 NE2 GLN A 67 -2.337 19.734 -2.720 1.00 4.41 N ATOM 0 H GLN A 67 1.543 18.608 -1.618 1.00 2.02 H new ATOM 0 HA GLN A 67 0.159 19.691 -2.869 1.00 2.12 H new ATOM 0 HB2 GLN A 67 0.170 20.924 -0.640 1.00 2.21 H new ATOM 0 HB3 GLN A 67 0.952 22.233 -1.505 1.00 2.21 H new ATOM 0 HG2 GLN A 67 -1.328 22.765 -1.769 1.00 2.55 H new ATOM 0 HG3 GLN A 67 -0.959 21.947 -3.275 1.00 2.55 H new ATOM 0 HE21 GLN A 67 -1.668 19.559 -3.470 1.00 4.41 H new ATOM 0 HE22 GLN A 67 -3.115 19.091 -2.570 1.00 4.41 H new ATOM 1068 N ASP A 68 1.715 20.035 -4.854 1.00 1.86 N ATOM 1069 CA ASP A 68 2.135 20.379 -6.214 1.00 1.88 C ATOM 1070 C ASP A 68 1.044 20.050 -7.249 1.00 1.89 C ATOM 1071 O ASP A 68 1.229 20.345 -8.427 1.00 2.45 O ATOM 1072 CB ASP A 68 3.467 19.673 -6.552 1.00 1.87 C ATOM 1073 CG ASP A 68 3.338 18.168 -6.489 1.00 1.69 C ATOM 1074 OD1 ASP A 68 2.205 17.684 -6.338 1.00 1.52 O ATOM 1075 OD2 ASP A 68 4.334 17.412 -6.391 1.00 1.84 O ATOM 0 H ASP A 68 1.608 19.030 -4.713 1.00 1.86 H new ATOM 0 HA ASP A 68 2.294 21.456 -6.259 1.00 1.88 H new ATOM 0 HB2 ASP A 68 3.792 19.968 -7.550 1.00 1.87 H new ATOM 0 HB3 ASP A 68 4.239 20.001 -5.856 1.00 1.87 H new ATOM 1080 N SER A 69 -0.073 19.422 -6.850 1.00 1.52 N ATOM 1081 CA SER A 69 -1.101 18.908 -7.759 1.00 1.54 C ATOM 1082 C SER A 69 -0.588 17.807 -8.704 1.00 1.50 C ATOM 1083 O SER A 69 -1.273 17.448 -9.665 1.00 1.54 O ATOM 1084 CB SER A 69 -1.788 20.049 -8.519 1.00 1.70 C ATOM 1085 OG SER A 69 -2.248 21.022 -7.600 1.00 1.98 O ATOM 0 H SER A 69 -0.288 19.256 -5.867 1.00 1.52 H new ATOM 0 HA SER A 69 -1.851 18.423 -7.134 1.00 1.54 H new ATOM 0 HB2 SER A 69 -1.091 20.501 -9.224 1.00 1.70 H new ATOM 0 HB3 SER A 69 -2.623 19.660 -9.101 1.00 1.70 H new ATOM 0 HG SER A 69 -2.685 21.751 -8.087 1.00 1.98 H new ATOM 1091 N GLU A 70 0.579 17.235 -8.395 1.00 1.47 N ATOM 1092 CA GLU A 70 1.087 15.999 -8.955 1.00 1.42 C ATOM 1093 C GLU A 70 1.093 14.971 -7.835 1.00 1.24 C ATOM 1094 O GLU A 70 1.921 15.027 -6.920 1.00 1.30 O ATOM 1095 CB GLU A 70 2.528 16.133 -9.439 1.00 1.61 C ATOM 1096 CG GLU A 70 2.701 16.779 -10.809 1.00 1.88 C ATOM 1097 CD GLU A 70 4.018 16.307 -11.390 1.00 2.68 C ATOM 1098 OE1 GLU A 70 5.076 16.745 -10.878 1.00 3.47 O ATOM 1099 OE2 GLU A 70 3.971 15.434 -12.287 1.00 3.37 O ATOM 0 H GLU A 70 1.218 17.647 -7.715 1.00 1.47 H new ATOM 0 HA GLU A 70 0.459 15.721 -9.802 1.00 1.42 H new ATOM 0 HB2 GLU A 70 3.086 16.718 -8.708 1.00 1.61 H new ATOM 0 HB3 GLU A 70 2.978 15.141 -9.465 1.00 1.61 H new ATOM 0 HG2 GLU A 70 1.875 16.505 -11.466 1.00 1.88 H new ATOM 0 HG3 GLU A 70 2.691 17.865 -10.721 1.00 1.88 H new ATOM 1106 N LEU A 71 0.201 14.005 -7.934 1.00 1.06 N ATOM 1107 CA LEU A 71 0.168 12.837 -7.089 1.00 0.90 C ATOM 1108 C LEU A 71 1.066 11.812 -7.776 1.00 0.89 C ATOM 1109 O LEU A 71 0.566 10.900 -8.435 1.00 0.87 O ATOM 1110 CB LEU A 71 -1.287 12.376 -6.988 1.00 0.78 C ATOM 1111 CG LEU A 71 -2.192 13.244 -6.104 1.00 1.02 C ATOM 1112 CD1 LEU A 71 -1.908 12.968 -4.632 1.00 1.05 C ATOM 1113 CD2 LEU A 71 -2.143 14.749 -6.396 1.00 1.36 C ATOM 0 H LEU A 71 -0.544 14.016 -8.630 1.00 1.06 H new ATOM 0 HA LEU A 71 0.524 13.008 -6.073 1.00 0.90 H new ATOM 0 HB2 LEU A 71 -1.711 12.344 -7.992 1.00 0.78 H new ATOM 0 HB3 LEU A 71 -1.302 11.356 -6.603 1.00 0.78 H new ATOM 0 HG LEU A 71 -3.211 12.949 -6.355 1.00 1.02 H new ATOM 0 HD11 LEU A 71 -2.556 13.589 -4.014 1.00 1.05 H new ATOM 0 HD12 LEU A 71 -2.099 11.917 -4.415 1.00 1.05 H new ATOM 0 HD13 LEU A 71 -0.866 13.200 -4.413 1.00 1.05 H new ATOM 0 HD21 LEU A 71 -2.817 15.273 -5.718 1.00 1.36 H new ATOM 0 HD22 LEU A 71 -1.126 15.115 -6.252 1.00 1.36 H new ATOM 0 HD23 LEU A 71 -2.451 14.930 -7.426 1.00 1.36 H new ATOM 1125 N LYS A 72 2.389 12.012 -7.687 1.00 1.09 N ATOM 1126 CA LYS A 72 3.359 11.080 -8.252 1.00 1.21 C ATOM 1127 C LYS A 72 3.393 9.775 -7.451 1.00 0.98 C ATOM 1128 O LYS A 72 2.949 9.723 -6.307 1.00 0.95 O ATOM 1129 CB LYS A 72 4.734 11.723 -8.531 1.00 1.87 C ATOM 1130 CG LYS A 72 5.455 12.439 -7.374 1.00 0.93 C ATOM 1131 CD LYS A 72 5.256 13.968 -7.309 1.00 1.72 C ATOM 1132 CE LYS A 72 5.795 14.745 -8.523 1.00 2.59 C ATOM 1133 NZ LYS A 72 5.719 16.218 -8.353 1.00 3.32 N ATOM 0 H LYS A 72 2.808 12.819 -7.224 1.00 1.09 H new ATOM 0 HA LYS A 72 3.019 10.802 -9.250 1.00 1.21 H new ATOM 0 HB2 LYS A 72 5.397 10.942 -8.903 1.00 1.87 H new ATOM 0 HB3 LYS A 72 4.606 12.443 -9.339 1.00 1.87 H new ATOM 0 HG2 LYS A 72 5.114 12.006 -6.434 1.00 0.93 H new ATOM 0 HG3 LYS A 72 6.522 12.232 -7.452 1.00 0.93 H new ATOM 0 HD2 LYS A 72 4.191 14.177 -7.206 1.00 1.72 H new ATOM 0 HD3 LYS A 72 5.743 14.345 -6.410 1.00 1.72 H new ATOM 0 HE2 LYS A 72 6.832 14.459 -8.699 1.00 2.59 H new ATOM 0 HE3 LYS A 72 5.230 14.458 -9.410 1.00 2.59 H new ATOM 0 HZ1 LYS A 72 5.379 16.652 -9.235 1.00 3.32 H new ATOM 0 HZ2 LYS A 72 5.062 16.445 -7.579 1.00 3.32 H new ATOM 0 HZ3 LYS A 72 6.663 16.590 -8.126 1.00 3.32 H new ATOM 1147 N PHE A 73 3.905 8.716 -8.080 1.00 1.02 N ATOM 1148 CA PHE A 73 3.733 7.321 -7.686 1.00 0.95 C ATOM 1149 C PHE A 73 3.740 7.094 -6.167 1.00 0.88 C ATOM 1150 O PHE A 73 2.783 6.540 -5.638 1.00 0.84 O ATOM 1151 CB PHE A 73 4.773 6.449 -8.415 1.00 1.12 C ATOM 1152 CG PHE A 73 6.221 6.883 -8.229 1.00 1.72 C ATOM 1153 CD1 PHE A 73 6.711 8.011 -8.918 1.00 2.97 C ATOM 1154 CD2 PHE A 73 6.992 6.322 -7.194 1.00 3.17 C ATOM 1155 CE1 PHE A 73 7.798 8.731 -8.395 1.00 4.70 C ATOM 1156 CE2 PHE A 73 8.099 7.025 -6.690 1.00 4.78 C ATOM 1157 CZ PHE A 73 8.437 8.280 -7.228 1.00 5.41 C ATOM 0 H PHE A 73 4.478 8.815 -8.918 1.00 1.02 H new ATOM 0 HA PHE A 73 2.733 7.018 -7.994 1.00 0.95 H new ATOM 0 HB2 PHE A 73 4.670 5.421 -8.068 1.00 1.12 H new ATOM 0 HB3 PHE A 73 4.543 6.450 -9.480 1.00 1.12 H new ATOM 0 HD1 PHE A 73 6.252 8.321 -9.845 1.00 2.97 H new ATOM 0 HD2 PHE A 73 6.734 5.355 -6.789 1.00 3.17 H new ATOM 0 HE1 PHE A 73 8.141 9.628 -8.888 1.00 4.70 H new ATOM 0 HE2 PHE A 73 8.690 6.602 -5.891 1.00 4.78 H new ATOM 0 HZ PHE A 73 9.184 8.894 -6.746 1.00 5.41 H new ATOM 1167 N ASN A 74 4.790 7.516 -5.457 1.00 0.94 N ATOM 1168 CA ASN A 74 4.906 7.284 -4.017 1.00 0.98 C ATOM 1169 C ASN A 74 3.834 8.048 -3.231 1.00 1.01 C ATOM 1170 O ASN A 74 3.305 7.512 -2.260 1.00 1.09 O ATOM 1171 CB ASN A 74 6.337 7.588 -3.549 1.00 1.07 C ATOM 1172 CG ASN A 74 6.698 7.338 -2.076 1.00 1.47 C ATOM 1173 OD1 ASN A 74 7.877 7.198 -1.771 1.00 2.31 O ATOM 1174 ND2 ASN A 74 5.776 7.221 -1.128 1.00 1.91 N ATOM 0 H ASN A 74 5.577 8.024 -5.861 1.00 0.94 H new ATOM 0 HA ASN A 74 4.717 6.230 -3.811 1.00 0.98 H new ATOM 0 HB2 ASN A 74 7.018 6.997 -4.162 1.00 1.07 H new ATOM 0 HB3 ASN A 74 6.541 8.637 -3.766 1.00 1.07 H new ATOM 0 HD21 ASN A 74 6.055 7.018 -0.168 1.00 1.91 H new ATOM 0 HD22 ASN A 74 4.789 7.334 -1.360 1.00 1.91 H new ATOM 1181 N GLU A 75 3.506 9.288 -3.583 1.00 0.98 N ATOM 1182 CA GLU A 75 2.498 10.003 -2.812 1.00 1.09 C ATOM 1183 C GLU A 75 1.106 9.485 -3.178 1.00 0.92 C ATOM 1184 O GLU A 75 0.330 9.184 -2.277 1.00 0.98 O ATOM 1185 CB GLU A 75 2.657 11.522 -2.907 1.00 1.37 C ATOM 1186 CG GLU A 75 2.996 11.998 -4.313 1.00 1.50 C ATOM 1187 CD GLU A 75 2.924 13.496 -4.382 1.00 1.14 C ATOM 1188 OE1 GLU A 75 1.834 14.066 -4.198 1.00 1.66 O ATOM 1189 OE2 GLU A 75 3.906 14.192 -4.712 1.00 2.12 O ATOM 0 H GLU A 75 3.907 9.802 -4.367 1.00 0.98 H new ATOM 0 HA GLU A 75 2.644 9.795 -1.752 1.00 1.09 H new ATOM 0 HB2 GLU A 75 1.733 12.000 -2.581 1.00 1.37 H new ATOM 0 HB3 GLU A 75 3.441 11.843 -2.222 1.00 1.37 H new ATOM 0 HG2 GLU A 75 3.995 11.661 -4.588 1.00 1.50 H new ATOM 0 HG3 GLU A 75 2.303 11.559 -5.031 1.00 1.50 H new ATOM 1196 N TYR A 76 0.816 9.286 -4.472 1.00 0.83 N ATOM 1197 CA TYR A 76 -0.375 8.556 -4.913 1.00 0.81 C ATOM 1198 C TYR A 76 -0.548 7.288 -4.079 1.00 0.75 C ATOM 1199 O TYR A 76 -1.625 7.034 -3.536 1.00 0.76 O ATOM 1200 CB TYR A 76 -0.269 8.210 -6.408 1.00 0.86 C ATOM 1201 CG TYR A 76 -1.199 7.093 -6.847 1.00 1.15 C ATOM 1202 CD1 TYR A 76 -2.562 7.361 -7.071 1.00 1.42 C ATOM 1203 CD2 TYR A 76 -0.748 5.758 -6.835 1.00 2.87 C ATOM 1204 CE1 TYR A 76 -3.475 6.304 -7.220 1.00 1.71 C ATOM 1205 CE2 TYR A 76 -1.662 4.702 -6.976 1.00 3.35 C ATOM 1206 CZ TYR A 76 -3.030 4.974 -7.151 1.00 2.30 C ATOM 1207 OH TYR A 76 -3.923 3.954 -7.290 1.00 3.00 O ATOM 0 H TYR A 76 1.399 9.626 -5.237 1.00 0.83 H new ATOM 0 HA TYR A 76 -1.250 9.190 -4.771 1.00 0.81 H new ATOM 0 HB2 TYR A 76 -0.487 9.103 -6.994 1.00 0.86 H new ATOM 0 HB3 TYR A 76 0.758 7.924 -6.633 1.00 0.86 H new ATOM 0 HD1 TYR A 76 -2.907 8.383 -7.129 1.00 1.42 H new ATOM 0 HD2 TYR A 76 0.305 5.547 -6.717 1.00 2.87 H new ATOM 0 HE1 TYR A 76 -4.521 6.515 -7.388 1.00 1.71 H new ATOM 0 HE2 TYR A 76 -1.314 3.680 -6.950 1.00 3.35 H new ATOM 0 HH TYR A 76 -3.454 3.097 -7.218 1.00 3.00 H new ATOM 1217 N TRP A 77 0.535 6.515 -3.972 1.00 0.75 N ATOM 1218 CA TRP A 77 0.585 5.274 -3.227 1.00 0.72 C ATOM 1219 C TRP A 77 -0.047 5.402 -1.832 1.00 0.76 C ATOM 1220 O TRP A 77 -0.667 4.428 -1.410 1.00 0.79 O ATOM 1221 CB TRP A 77 2.013 4.689 -3.245 1.00 0.78 C ATOM 1222 CG TRP A 77 2.436 3.938 -2.030 1.00 0.82 C ATOM 1223 CD1 TRP A 77 3.132 4.459 -0.997 1.00 2.03 C ATOM 1224 CD2 TRP A 77 2.143 2.560 -1.662 1.00 1.56 C ATOM 1225 NE1 TRP A 77 3.266 3.521 -0.006 1.00 2.11 N ATOM 1226 CE2 TRP A 77 2.648 2.343 -0.350 1.00 1.42 C ATOM 1227 CE3 TRP A 77 1.501 1.473 -2.288 1.00 3.24 C ATOM 1228 CZ2 TRP A 77 2.480 1.133 0.327 1.00 2.12 C ATOM 1229 CZ3 TRP A 77 1.355 0.241 -1.622 1.00 4.03 C ATOM 1230 CH2 TRP A 77 1.790 0.093 -0.304 1.00 3.43 C ATOM 0 H TRP A 77 1.422 6.750 -4.417 1.00 0.75 H new ATOM 0 HA TRP A 77 -0.044 4.538 -3.728 1.00 0.72 H new ATOM 0 HB2 TRP A 77 2.099 4.025 -4.105 1.00 0.78 H new ATOM 0 HB3 TRP A 77 2.716 5.507 -3.403 1.00 0.78 H new ATOM 0 HD1 TRP A 77 3.525 5.464 -0.957 1.00 2.03 H new ATOM 0 HE1 TRP A 77 3.760 3.677 0.872 1.00 2.11 H new ATOM 0 HE3 TRP A 77 1.116 1.586 -3.291 1.00 3.24 H new ATOM 0 HZ2 TRP A 77 2.877 1.002 1.323 1.00 2.12 H new ATOM 0 HZ3 TRP A 77 0.903 -0.595 -2.135 1.00 4.03 H new ATOM 0 HH2 TRP A 77 1.594 -0.826 0.229 1.00 3.43 H new ATOM 1241 N ARG A 78 0.016 6.568 -1.150 1.00 0.76 N ATOM 1242 CA ARG A 78 -0.697 6.819 0.120 1.00 0.80 C ATOM 1243 C ARG A 78 -2.084 6.177 0.075 1.00 0.76 C ATOM 1244 O ARG A 78 -2.472 5.464 1.002 1.00 0.81 O ATOM 1245 CB ARG A 78 -0.932 8.314 0.395 1.00 0.80 C ATOM 1246 CG ARG A 78 0.253 9.183 0.854 1.00 1.59 C ATOM 1247 CD ARG A 78 0.187 9.710 2.307 1.00 1.61 C ATOM 1248 NE ARG A 78 -1.129 10.268 2.724 1.00 2.26 N ATOM 1249 CZ ARG A 78 -2.037 9.605 3.468 1.00 3.21 C ATOM 1250 NH1 ARG A 78 -1.837 8.327 3.792 1.00 3.80 N ATOM 1251 NH2 ARG A 78 -3.169 10.162 3.909 1.00 4.68 N ATOM 0 H ARG A 78 0.567 7.365 -1.469 1.00 0.76 H new ATOM 0 HA ARG A 78 -0.062 6.399 0.900 1.00 0.80 H new ATOM 0 HB2 ARG A 78 -1.332 8.758 -0.517 1.00 0.80 H new ATOM 0 HB3 ARG A 78 -1.710 8.391 1.154 1.00 0.80 H new ATOM 0 HG2 ARG A 78 1.169 8.602 0.741 1.00 1.59 H new ATOM 0 HG3 ARG A 78 0.332 10.038 0.182 1.00 1.59 H new ATOM 0 HD2 ARG A 78 0.448 8.896 2.983 1.00 1.61 H new ATOM 0 HD3 ARG A 78 0.946 10.483 2.430 1.00 1.61 H new ATOM 0 HE ARG A 78 -1.359 11.216 2.427 1.00 2.26 H new ATOM 0 HH11 ARG A 78 -0.994 7.847 3.477 1.00 3.80 H new ATOM 0 HH12 ARG A 78 -2.527 7.830 4.355 1.00 3.80 H new ATOM 0 HH21 ARG A 78 -3.380 11.135 3.685 1.00 4.68 H new ATOM 0 HH22 ARG A 78 -3.822 9.614 4.469 1.00 4.68 H new ATOM 1265 N LEU A 79 -2.817 6.435 -1.016 1.00 0.72 N ATOM 1266 CA LEU A 79 -4.178 5.974 -1.201 1.00 0.72 C ATOM 1267 C LEU A 79 -4.280 4.496 -0.878 1.00 0.76 C ATOM 1268 O LEU A 79 -5.189 4.100 -0.164 1.00 0.80 O ATOM 1269 CB LEU A 79 -4.635 6.212 -2.647 1.00 0.71 C ATOM 1270 CG LEU A 79 -6.158 6.049 -2.805 1.00 0.73 C ATOM 1271 CD1 LEU A 79 -6.907 7.278 -2.269 1.00 0.82 C ATOM 1272 CD2 LEU A 79 -6.499 5.797 -4.279 1.00 0.75 C ATOM 0 H LEU A 79 -2.464 6.981 -1.802 1.00 0.72 H new ATOM 0 HA LEU A 79 -4.823 6.537 -0.526 1.00 0.72 H new ATOM 0 HB2 LEU A 79 -4.343 7.215 -2.959 1.00 0.71 H new ATOM 0 HB3 LEU A 79 -4.125 5.512 -3.308 1.00 0.71 H new ATOM 0 HG LEU A 79 -6.481 5.191 -2.216 1.00 0.73 H new ATOM 0 HD11 LEU A 79 -7.980 7.133 -2.394 1.00 0.82 H new ATOM 0 HD12 LEU A 79 -6.680 7.410 -1.211 1.00 0.82 H new ATOM 0 HD13 LEU A 79 -6.594 8.164 -2.821 1.00 0.82 H new ATOM 0 HD21 LEU A 79 -7.577 5.682 -4.388 1.00 0.75 H new ATOM 0 HD22 LEU A 79 -6.161 6.641 -4.880 1.00 0.75 H new ATOM 0 HD23 LEU A 79 -6.001 4.888 -4.617 1.00 0.75 H new ATOM 1284 N ILE A 80 -3.346 3.687 -1.381 1.00 0.80 N ATOM 1285 CA ILE A 80 -3.427 2.233 -1.307 1.00 0.82 C ATOM 1286 C ILE A 80 -3.402 1.803 0.164 1.00 0.86 C ATOM 1287 O ILE A 80 -4.044 0.831 0.561 1.00 0.85 O ATOM 1288 CB ILE A 80 -2.320 1.615 -2.191 1.00 0.97 C ATOM 1289 CG1 ILE A 80 -2.654 1.914 -3.668 1.00 1.01 C ATOM 1290 CG2 ILE A 80 -2.216 0.100 -1.981 1.00 1.18 C ATOM 1291 CD1 ILE A 80 -1.495 1.645 -4.633 1.00 1.74 C ATOM 0 H ILE A 80 -2.508 4.027 -1.853 1.00 0.80 H new ATOM 0 HA ILE A 80 -4.367 1.855 -1.709 1.00 0.82 H new ATOM 0 HB ILE A 80 -1.361 2.053 -1.916 1.00 0.97 H new ATOM 0 HG12 ILE A 80 -3.510 1.309 -3.966 1.00 1.01 H new ATOM 0 HG13 ILE A 80 -2.954 2.958 -3.758 1.00 1.01 H new ATOM 0 HG21 ILE A 80 -1.428 -0.302 -2.618 1.00 1.18 H new ATOM 0 HG22 ILE A 80 -1.980 -0.107 -0.937 1.00 1.18 H new ATOM 0 HG23 ILE A 80 -3.166 -0.369 -2.239 1.00 1.18 H new ATOM 0 HD11 ILE A 80 -1.807 1.879 -5.651 1.00 1.74 H new ATOM 0 HD12 ILE A 80 -0.644 2.269 -4.362 1.00 1.74 H new ATOM 0 HD13 ILE A 80 -1.208 0.595 -4.574 1.00 1.74 H new ATOM 1303 N GLY A 81 -2.700 2.573 0.994 1.00 0.99 N ATOM 1304 CA GLY A 81 -2.605 2.335 2.419 1.00 1.11 C ATOM 1305 C GLY A 81 -3.928 2.576 3.056 1.00 1.05 C ATOM 1306 O GLY A 81 -4.402 1.805 3.887 1.00 1.23 O ATOM 0 H GLY A 81 -2.176 3.391 0.683 1.00 0.99 H new ATOM 0 HA2 GLY A 81 -2.282 1.311 2.606 1.00 1.11 H new ATOM 0 HA3 GLY A 81 -1.854 2.992 2.858 1.00 1.11 H new ATOM 1310 N GLU A 82 -4.507 3.687 2.650 1.00 0.91 N ATOM 1311 CA GLU A 82 -5.711 4.153 3.245 1.00 0.97 C ATOM 1312 C GLU A 82 -6.789 3.170 2.823 1.00 1.03 C ATOM 1313 O GLU A 82 -7.376 2.597 3.716 1.00 1.13 O ATOM 1314 CB GLU A 82 -5.871 5.634 2.934 1.00 0.96 C ATOM 1315 CG GLU A 82 -4.560 6.346 3.367 1.00 0.96 C ATOM 1316 CD GLU A 82 -4.549 6.781 4.828 1.00 1.42 C ATOM 1317 OE1 GLU A 82 -4.819 5.928 5.713 1.00 2.33 O ATOM 1318 OE2 GLU A 82 -4.123 7.942 5.033 1.00 2.39 O ATOM 0 H GLU A 82 -4.147 4.279 1.901 1.00 0.91 H new ATOM 0 HA GLU A 82 -5.750 4.155 4.334 1.00 0.97 H new ATOM 0 HB2 GLU A 82 -6.056 5.785 1.870 1.00 0.96 H new ATOM 0 HB3 GLU A 82 -6.726 6.048 3.468 1.00 0.96 H new ATOM 0 HG2 GLU A 82 -3.719 5.676 3.191 1.00 0.96 H new ATOM 0 HG3 GLU A 82 -4.408 7.222 2.736 1.00 0.96 H new ATOM 1325 N LEU A 83 -6.927 2.811 1.543 1.00 0.99 N ATOM 1326 CA LEU A 83 -7.743 1.678 1.101 1.00 0.97 C ATOM 1327 C LEU A 83 -7.577 0.464 2.029 1.00 0.98 C ATOM 1328 O LEU A 83 -8.553 -0.018 2.608 1.00 1.07 O ATOM 1329 CB LEU A 83 -7.376 1.228 -0.321 1.00 1.09 C ATOM 1330 CG LEU A 83 -7.459 2.228 -1.483 1.00 1.21 C ATOM 1331 CD1 LEU A 83 -7.563 1.435 -2.791 1.00 1.47 C ATOM 1332 CD2 LEU A 83 -8.571 3.268 -1.344 1.00 2.45 C ATOM 0 H LEU A 83 -6.470 3.305 0.777 1.00 0.99 H new ATOM 0 HA LEU A 83 -8.774 2.031 1.124 1.00 0.97 H new ATOM 0 HB2 LEU A 83 -6.354 0.851 -0.289 1.00 1.09 H new ATOM 0 HB3 LEU A 83 -8.019 0.384 -0.571 1.00 1.09 H new ATOM 0 HG LEU A 83 -6.549 2.828 -1.476 1.00 1.21 H new ATOM 0 HD11 LEU A 83 -7.623 2.126 -3.632 1.00 1.47 H new ATOM 0 HD12 LEU A 83 -6.683 0.802 -2.904 1.00 1.47 H new ATOM 0 HD13 LEU A 83 -8.457 0.812 -2.769 1.00 1.47 H new ATOM 0 HD21 LEU A 83 -8.557 3.933 -2.207 1.00 2.45 H new ATOM 0 HD22 LEU A 83 -9.536 2.764 -1.290 1.00 2.45 H new ATOM 0 HD23 LEU A 83 -8.414 3.850 -0.436 1.00 2.45 H new ATOM 1344 N ALA A 84 -6.339 -0.032 2.164 1.00 0.95 N ATOM 1345 CA ALA A 84 -6.019 -1.185 3.002 1.00 1.03 C ATOM 1346 C ALA A 84 -6.465 -0.973 4.452 1.00 1.12 C ATOM 1347 O ALA A 84 -6.813 -1.924 5.149 1.00 1.29 O ATOM 1348 CB ALA A 84 -4.522 -1.494 2.904 1.00 1.03 C ATOM 0 H ALA A 84 -5.528 0.363 1.688 1.00 0.95 H new ATOM 0 HA ALA A 84 -6.574 -2.048 2.635 1.00 1.03 H new ATOM 0 HB1 ALA A 84 -4.286 -2.355 3.530 1.00 1.03 H new ATOM 0 HB2 ALA A 84 -4.263 -1.717 1.869 1.00 1.03 H new ATOM 0 HB3 ALA A 84 -3.949 -0.631 3.243 1.00 1.03 H new ATOM 1354 N LYS A 85 -6.463 0.276 4.917 1.00 1.09 N ATOM 1355 CA LYS A 85 -7.034 0.648 6.195 1.00 1.19 C ATOM 1356 C LYS A 85 -8.560 0.557 6.145 1.00 1.15 C ATOM 1357 O LYS A 85 -9.155 -0.123 6.967 1.00 1.20 O ATOM 1358 CB LYS A 85 -6.603 2.074 6.573 1.00 1.42 C ATOM 1359 CG LYS A 85 -6.111 2.147 8.016 1.00 0.90 C ATOM 1360 CD LYS A 85 -4.619 1.901 8.171 1.00 1.80 C ATOM 1361 CE LYS A 85 -3.659 2.653 7.240 1.00 1.28 C ATOM 1362 NZ LYS A 85 -3.726 4.133 7.244 1.00 1.34 N ATOM 0 H LYS A 85 -6.059 1.060 4.406 1.00 1.09 H new ATOM 0 HA LYS A 85 -6.668 -0.045 6.953 1.00 1.19 H new ATOM 0 HB2 LYS A 85 -5.812 2.406 5.901 1.00 1.42 H new ATOM 0 HB3 LYS A 85 -7.442 2.756 6.439 1.00 1.42 H new ATOM 0 HG2 LYS A 85 -6.351 3.129 8.422 1.00 0.90 H new ATOM 0 HG3 LYS A 85 -6.654 1.414 8.612 1.00 0.90 H new ATOM 0 HD2 LYS A 85 -4.346 2.145 9.198 1.00 1.80 H new ATOM 0 HD3 LYS A 85 -4.442 0.833 8.039 1.00 1.80 H new ATOM 0 HE2 LYS A 85 -2.641 2.361 7.498 1.00 1.28 H new ATOM 0 HE3 LYS A 85 -3.840 2.310 6.221 1.00 1.28 H new ATOM 0 HZ1 LYS A 85 -2.811 4.523 6.939 1.00 1.34 H new ATOM 0 HZ2 LYS A 85 -4.472 4.448 6.592 1.00 1.34 H new ATOM 0 HZ3 LYS A 85 -3.942 4.468 8.205 1.00 1.34 H new ATOM 1376 N GLU A 86 -9.189 1.280 5.216 1.00 1.13 N ATOM 1377 CA GLU A 86 -10.617 1.469 5.025 1.00 1.17 C ATOM 1378 C GLU A 86 -11.298 0.111 5.016 1.00 1.15 C ATOM 1379 O GLU A 86 -12.258 -0.098 5.749 1.00 1.16 O ATOM 1380 CB GLU A 86 -10.858 2.293 3.746 1.00 1.13 C ATOM 1381 CG GLU A 86 -10.245 3.712 3.822 1.00 1.17 C ATOM 1382 CD GLU A 86 -11.040 4.709 4.653 1.00 1.64 C ATOM 1383 OE1 GLU A 86 -12.247 4.476 4.859 1.00 2.17 O ATOM 1384 OE2 GLU A 86 -10.386 5.657 5.151 1.00 2.22 O ATOM 0 H GLU A 86 -8.655 1.794 4.515 1.00 1.13 H new ATOM 0 HA GLU A 86 -11.057 2.038 5.844 1.00 1.17 H new ATOM 0 HB2 GLU A 86 -10.433 1.764 2.893 1.00 1.13 H new ATOM 0 HB3 GLU A 86 -11.930 2.375 3.569 1.00 1.13 H new ATOM 0 HG2 GLU A 86 -9.240 3.636 4.236 1.00 1.17 H new ATOM 0 HG3 GLU A 86 -10.144 4.103 2.810 1.00 1.17 H new ATOM 1391 N ILE A 87 -10.771 -0.847 4.252 1.00 1.18 N ATOM 1392 CA ILE A 87 -11.348 -2.175 4.203 1.00 1.29 C ATOM 1393 C ILE A 87 -11.342 -2.908 5.560 1.00 1.19 C ATOM 1394 O ILE A 87 -12.105 -3.861 5.742 1.00 1.28 O ATOM 1395 CB ILE A 87 -10.659 -2.964 3.080 1.00 1.54 C ATOM 1396 CG1 ILE A 87 -11.696 -3.906 2.459 1.00 1.96 C ATOM 1397 CG2 ILE A 87 -9.412 -3.689 3.603 1.00 1.57 C ATOM 1398 CD1 ILE A 87 -11.144 -4.516 1.185 1.00 1.75 C ATOM 0 H ILE A 87 -9.948 -0.721 3.663 1.00 1.18 H new ATOM 0 HA ILE A 87 -12.410 -2.085 3.975 1.00 1.29 H new ATOM 0 HB ILE A 87 -10.294 -2.294 2.301 1.00 1.54 H new ATOM 0 HG12 ILE A 87 -11.954 -4.693 3.167 1.00 1.96 H new ATOM 0 HG13 ILE A 87 -12.613 -3.359 2.242 1.00 1.96 H new ATOM 0 HG21 ILE A 87 -8.943 -4.240 2.788 1.00 1.57 H new ATOM 0 HG22 ILE A 87 -8.707 -2.959 4.001 1.00 1.57 H new ATOM 0 HG23 ILE A 87 -9.699 -4.384 4.392 1.00 1.57 H new ATOM 0 HD11 ILE A 87 -11.887 -5.184 0.750 1.00 1.75 H new ATOM 0 HD12 ILE A 87 -10.908 -3.724 0.475 1.00 1.75 H new ATOM 0 HD13 ILE A 87 -10.239 -5.079 1.414 1.00 1.75 H new ATOM 1410 N ARG A 88 -10.474 -2.502 6.498 1.00 1.18 N ATOM 1411 CA ARG A 88 -10.354 -3.068 7.837 1.00 1.23 C ATOM 1412 C ARG A 88 -11.157 -2.204 8.823 1.00 1.24 C ATOM 1413 O ARG A 88 -12.116 -2.689 9.416 1.00 1.70 O ATOM 1414 CB ARG A 88 -8.862 -3.206 8.201 1.00 1.61 C ATOM 1415 CG ARG A 88 -8.592 -4.164 9.376 1.00 1.58 C ATOM 1416 CD ARG A 88 -7.071 -4.335 9.558 1.00 2.21 C ATOM 1417 NE ARG A 88 -6.695 -5.287 10.626 1.00 3.05 N ATOM 1418 CZ ARG A 88 -6.547 -6.617 10.473 1.00 4.20 C ATOM 1419 NH1 ARG A 88 -6.996 -7.202 9.359 1.00 4.98 N ATOM 1420 NH2 ARG A 88 -5.948 -7.361 11.415 1.00 5.31 N ATOM 0 H ARG A 88 -9.815 -1.742 6.332 1.00 1.18 H new ATOM 0 HA ARG A 88 -10.777 -4.071 7.884 1.00 1.23 H new ATOM 0 HB2 ARG A 88 -8.316 -3.557 7.326 1.00 1.61 H new ATOM 0 HB3 ARG A 88 -8.466 -2.221 8.450 1.00 1.61 H new ATOM 0 HG2 ARG A 88 -9.037 -3.770 10.290 1.00 1.58 H new ATOM 0 HG3 ARG A 88 -9.058 -5.131 9.186 1.00 1.58 H new ATOM 0 HD2 ARG A 88 -6.639 -4.673 8.616 1.00 2.21 H new ATOM 0 HD3 ARG A 88 -6.631 -3.363 9.781 1.00 2.21 H new ATOM 0 HE ARG A 88 -6.534 -4.904 11.557 1.00 3.05 H new ATOM 0 HH11 ARG A 88 -7.446 -6.642 8.635 1.00 4.98 H new ATOM 0 HH12 ARG A 88 -6.889 -8.209 9.233 1.00 4.98 H new ATOM 0 HH21 ARG A 88 -5.596 -6.921 12.265 1.00 5.31 H new ATOM 0 HH22 ARG A 88 -5.845 -8.367 11.281 1.00 5.31 H new ATOM 1434 N LYS A 89 -10.818 -0.915 8.966 1.00 1.06 N ATOM 1435 CA LYS A 89 -11.482 0.018 9.873 1.00 1.29 C ATOM 1436 C LYS A 89 -12.911 0.410 9.429 1.00 1.69 C ATOM 1437 O LYS A 89 -13.489 1.316 10.022 1.00 2.30 O ATOM 1438 CB LYS A 89 -10.562 1.251 10.023 1.00 1.30 C ATOM 1439 CG LYS A 89 -10.730 2.221 8.854 1.00 1.78 C ATOM 1440 CD LYS A 89 -9.623 3.277 8.811 1.00 1.62 C ATOM 1441 CE LYS A 89 -9.878 4.098 7.536 1.00 3.27 C ATOM 1442 NZ LYS A 89 -9.086 5.331 7.377 1.00 3.92 N ATOM 0 H LYS A 89 -10.056 -0.487 8.440 1.00 1.06 H new ATOM 0 HA LYS A 89 -11.631 -0.471 10.835 1.00 1.29 H new ATOM 0 HB2 LYS A 89 -10.789 1.764 10.958 1.00 1.30 H new ATOM 0 HB3 LYS A 89 -9.523 0.926 10.081 1.00 1.30 H new ATOM 0 HG2 LYS A 89 -10.732 1.662 7.918 1.00 1.78 H new ATOM 0 HG3 LYS A 89 -11.698 2.716 8.932 1.00 1.78 H new ATOM 0 HD2 LYS A 89 -9.653 3.911 9.697 1.00 1.62 H new ATOM 0 HD3 LYS A 89 -8.638 2.811 8.786 1.00 1.62 H new ATOM 0 HE2 LYS A 89 -9.688 3.458 6.675 1.00 3.27 H new ATOM 0 HE3 LYS A 89 -10.934 4.365 7.508 1.00 3.27 H new ATOM 0 HZ1 LYS A 89 -9.282 5.752 6.446 1.00 3.92 H new ATOM 0 HZ2 LYS A 89 -9.343 6.007 8.124 1.00 3.92 H new ATOM 0 HZ3 LYS A 89 -8.073 5.105 7.448 1.00 3.92 H new ATOM 1710 N LEU B 6 -15.590 -7.738 -3.804 1.00 1.78 N ATOM 1711 CA LEU B 6 -15.606 -6.284 -3.921 1.00 1.60 C ATOM 1712 C LEU B 6 -14.944 -5.878 -5.252 1.00 1.57 C ATOM 1713 O LEU B 6 -14.746 -6.732 -6.115 1.00 2.02 O ATOM 1714 CB LEU B 6 -14.918 -5.700 -2.673 1.00 1.74 C ATOM 1715 CG LEU B 6 -15.690 -5.976 -1.363 1.00 2.46 C ATOM 1716 CD1 LEU B 6 -14.799 -5.780 -0.132 1.00 3.09 C ATOM 1717 CD2 LEU B 6 -16.929 -5.082 -1.238 1.00 3.74 C ATOM 0 HA LEU B 6 -16.618 -5.880 -3.952 1.00 1.60 H new ATOM 0 HB2 LEU B 6 -13.915 -6.119 -2.590 1.00 1.74 H new ATOM 0 HB3 LEU B 6 -14.805 -4.623 -2.800 1.00 1.74 H new ATOM 0 HG LEU B 6 -16.009 -7.017 -1.407 1.00 2.46 H new ATOM 0 HD11 LEU B 6 -15.376 -5.983 0.771 1.00 3.09 H new ATOM 0 HD12 LEU B 6 -13.952 -6.464 -0.183 1.00 3.09 H new ATOM 0 HD13 LEU B 6 -14.434 -4.753 -0.107 1.00 3.09 H new ATOM 0 HD21 LEU B 6 -17.446 -5.305 -0.305 1.00 3.74 H new ATOM 0 HD22 LEU B 6 -16.625 -4.035 -1.243 1.00 3.74 H new ATOM 0 HD23 LEU B 6 -17.599 -5.269 -2.077 1.00 3.74 H new ATOM 1729 N THR B 7 -14.635 -4.590 -5.461 1.00 1.55 N ATOM 1730 CA THR B 7 -14.050 -4.121 -6.719 1.00 1.73 C ATOM 1731 C THR B 7 -12.572 -4.512 -6.785 1.00 1.75 C ATOM 1732 O THR B 7 -12.035 -5.067 -5.834 1.00 2.34 O ATOM 1733 CB THR B 7 -14.254 -2.606 -6.909 1.00 1.81 C ATOM 1734 OG1 THR B 7 -13.781 -2.199 -8.181 1.00 2.19 O ATOM 1735 CG2 THR B 7 -13.525 -1.792 -5.839 1.00 1.70 C ATOM 0 H THR B 7 -14.782 -3.854 -4.770 1.00 1.55 H new ATOM 0 HA THR B 7 -14.568 -4.608 -7.545 1.00 1.73 H new ATOM 0 HB THR B 7 -15.325 -2.420 -6.824 1.00 1.81 H new ATOM 0 HG1 THR B 7 -13.789 -1.221 -8.235 1.00 2.19 H new ATOM 0 HG21 THR B 7 -13.696 -0.729 -6.011 1.00 1.70 H new ATOM 0 HG22 THR B 7 -13.903 -2.065 -4.854 1.00 1.70 H new ATOM 0 HG23 THR B 7 -12.456 -2.000 -5.889 1.00 1.70 H new ATOM 1743 N GLU B 8 -11.900 -4.180 -7.887 1.00 1.61 N ATOM 1744 CA GLU B 8 -10.541 -4.616 -8.155 1.00 1.51 C ATOM 1745 C GLU B 8 -9.591 -4.090 -7.086 1.00 1.37 C ATOM 1746 O GLU B 8 -8.964 -4.851 -6.353 1.00 1.33 O ATOM 1747 CB GLU B 8 -10.128 -4.136 -9.549 1.00 1.77 C ATOM 1748 CG GLU B 8 -8.706 -4.598 -9.870 1.00 1.97 C ATOM 1749 CD GLU B 8 -8.262 -4.039 -11.217 1.00 2.46 C ATOM 1750 OE1 GLU B 8 -9.009 -4.254 -12.195 1.00 2.67 O ATOM 1751 OE2 GLU B 8 -7.226 -3.337 -11.229 1.00 3.41 O ATOM 0 H GLU B 8 -12.293 -3.594 -8.623 1.00 1.61 H new ATOM 0 HA GLU B 8 -10.493 -5.705 -8.127 1.00 1.51 H new ATOM 0 HB2 GLU B 8 -10.821 -4.525 -10.295 1.00 1.77 H new ATOM 0 HB3 GLU B 8 -10.184 -3.049 -9.598 1.00 1.77 H new ATOM 0 HG2 GLU B 8 -8.023 -4.267 -9.088 1.00 1.97 H new ATOM 0 HG3 GLU B 8 -8.665 -5.687 -9.889 1.00 1.97 H new ATOM 1758 N LEU B 9 -9.459 -2.767 -6.991 1.00 1.38 N ATOM 1759 CA LEU B 9 -8.500 -2.203 -6.060 1.00 1.31 C ATOM 1760 C LEU B 9 -8.790 -2.711 -4.647 1.00 1.19 C ATOM 1761 O LEU B 9 -7.867 -3.171 -3.985 1.00 1.09 O ATOM 1762 CB LEU B 9 -8.419 -0.680 -6.201 1.00 1.37 C ATOM 1763 CG LEU B 9 -7.665 -0.322 -7.501 1.00 1.27 C ATOM 1764 CD1 LEU B 9 -8.577 0.257 -8.582 1.00 1.07 C ATOM 1765 CD2 LEU B 9 -6.527 0.662 -7.209 1.00 2.08 C ATOM 0 H LEU B 9 -9.991 -2.087 -7.534 1.00 1.38 H new ATOM 0 HA LEU B 9 -7.494 -2.548 -6.300 1.00 1.31 H new ATOM 0 HB2 LEU B 9 -9.421 -0.252 -6.220 1.00 1.37 H new ATOM 0 HB3 LEU B 9 -7.906 -0.251 -5.340 1.00 1.37 H new ATOM 0 HG LEU B 9 -7.259 -1.258 -7.886 1.00 1.27 H new ATOM 0 HD11 LEU B 9 -7.988 0.488 -9.470 1.00 1.07 H new ATOM 0 HD12 LEU B 9 -9.347 -0.471 -8.837 1.00 1.07 H new ATOM 0 HD13 LEU B 9 -9.047 1.168 -8.212 1.00 1.07 H new ATOM 0 HD21 LEU B 9 -6.007 0.903 -8.136 1.00 2.08 H new ATOM 0 HD22 LEU B 9 -6.937 1.574 -6.776 1.00 2.08 H new ATOM 0 HD23 LEU B 9 -5.826 0.210 -6.507 1.00 2.08 H new ATOM 1777 N GLU B 10 -10.065 -2.726 -4.248 1.00 1.19 N ATOM 1778 CA GLU B 10 -10.578 -3.283 -3.003 1.00 1.19 C ATOM 1779 C GLU B 10 -10.143 -4.752 -2.796 1.00 1.24 C ATOM 1780 O GLU B 10 -9.667 -5.109 -1.716 1.00 1.50 O ATOM 1781 CB GLU B 10 -12.102 -3.053 -2.968 1.00 1.31 C ATOM 1782 CG GLU B 10 -12.681 -3.047 -1.548 1.00 1.93 C ATOM 1783 CD GLU B 10 -14.067 -2.408 -1.428 1.00 2.57 C ATOM 1784 OE1 GLU B 10 -14.690 -2.154 -2.480 1.00 2.84 O ATOM 1785 OE2 GLU B 10 -14.480 -2.156 -0.269 1.00 3.82 O ATOM 0 H GLU B 10 -10.806 -2.325 -4.822 1.00 1.19 H new ATOM 0 HA GLU B 10 -10.142 -2.769 -2.146 1.00 1.19 H new ATOM 0 HB2 GLU B 10 -12.330 -2.103 -3.450 1.00 1.31 H new ATOM 0 HB3 GLU B 10 -12.594 -3.832 -3.550 1.00 1.31 H new ATOM 0 HG2 GLU B 10 -12.737 -4.074 -1.188 1.00 1.93 H new ATOM 0 HG3 GLU B 10 -11.992 -2.516 -0.891 1.00 1.93 H new ATOM 1792 N GLU B 11 -10.255 -5.600 -3.824 1.00 1.22 N ATOM 1793 CA GLU B 11 -9.802 -6.986 -3.760 1.00 1.19 C ATOM 1794 C GLU B 11 -8.297 -7.012 -3.484 1.00 1.13 C ATOM 1795 O GLU B 11 -7.830 -7.646 -2.536 1.00 1.25 O ATOM 1796 CB GLU B 11 -10.261 -7.790 -5.007 1.00 1.34 C ATOM 1797 CG GLU B 11 -9.284 -8.073 -6.160 1.00 2.04 C ATOM 1798 CD GLU B 11 -8.120 -8.986 -5.796 1.00 3.29 C ATOM 1799 OE1 GLU B 11 -8.378 -9.973 -5.076 1.00 3.47 O ATOM 1800 OE2 GLU B 11 -6.993 -8.669 -6.236 1.00 4.73 O ATOM 0 H GLU B 11 -10.663 -5.341 -4.722 1.00 1.22 H new ATOM 0 HA GLU B 11 -10.274 -7.505 -2.926 1.00 1.19 H new ATOM 0 HB2 GLU B 11 -10.626 -8.754 -4.651 1.00 1.34 H new ATOM 0 HB3 GLU B 11 -11.115 -7.263 -5.432 1.00 1.34 H new ATOM 0 HG2 GLU B 11 -9.837 -8.522 -6.985 1.00 2.04 H new ATOM 0 HG3 GLU B 11 -8.886 -7.125 -6.522 1.00 2.04 H new ATOM 1807 N SER B 12 -7.540 -6.262 -4.288 1.00 1.04 N ATOM 1808 CA SER B 12 -6.089 -6.325 -4.255 1.00 0.94 C ATOM 1809 C SER B 12 -5.555 -5.804 -2.920 1.00 0.93 C ATOM 1810 O SER B 12 -4.643 -6.386 -2.334 1.00 1.00 O ATOM 1811 CB SER B 12 -5.503 -5.600 -5.468 1.00 0.90 C ATOM 1812 OG SER B 12 -5.751 -4.210 -5.400 1.00 2.07 O ATOM 0 H SER B 12 -7.916 -5.603 -4.970 1.00 1.04 H new ATOM 0 HA SER B 12 -5.766 -7.364 -4.324 1.00 0.94 H new ATOM 0 HB2 SER B 12 -4.429 -5.779 -5.518 1.00 0.90 H new ATOM 0 HB3 SER B 12 -5.937 -6.005 -6.382 1.00 0.90 H new ATOM 0 HG SER B 12 -6.537 -4.045 -4.839 1.00 2.07 H new ATOM 1818 N ILE B 13 -6.138 -4.719 -2.403 1.00 0.94 N ATOM 1819 CA ILE B 13 -5.772 -4.233 -1.089 1.00 1.02 C ATOM 1820 C ILE B 13 -6.148 -5.279 -0.041 1.00 1.10 C ATOM 1821 O ILE B 13 -5.331 -5.541 0.839 1.00 1.12 O ATOM 1822 CB ILE B 13 -6.224 -2.778 -0.844 1.00 1.05 C ATOM 1823 CG1 ILE B 13 -7.706 -2.517 -1.088 1.00 1.03 C ATOM 1824 CG2 ILE B 13 -5.391 -1.888 -1.773 1.00 0.99 C ATOM 1825 CD1 ILE B 13 -8.509 -2.570 0.194 1.00 1.26 C ATOM 0 H ILE B 13 -6.857 -4.172 -2.876 1.00 0.94 H new ATOM 0 HA ILE B 13 -4.691 -4.127 -1.003 1.00 1.02 H new ATOM 0 HB ILE B 13 -6.069 -2.560 0.213 1.00 1.05 H new ATOM 0 HG12 ILE B 13 -7.830 -1.539 -1.554 1.00 1.03 H new ATOM 0 HG13 ILE B 13 -8.094 -3.256 -1.790 1.00 1.03 H new ATOM 0 HG21 ILE B 13 -5.678 -0.846 -1.633 1.00 0.99 H new ATOM 0 HG22 ILE B 13 -4.333 -2.007 -1.539 1.00 0.99 H new ATOM 0 HG23 ILE B 13 -5.568 -2.177 -2.809 1.00 0.99 H new ATOM 0 HD11 ILE B 13 -9.559 -2.379 -0.026 1.00 1.26 H new ATOM 0 HD12 ILE B 13 -8.407 -3.556 0.647 1.00 1.26 H new ATOM 0 HD13 ILE B 13 -8.140 -1.813 0.886 1.00 1.26 H new ATOM 1837 N GLU B 14 -7.297 -5.966 -0.152 1.00 1.15 N ATOM 1838 CA GLU B 14 -7.534 -7.041 0.801 1.00 1.19 C ATOM 1839 C GLU B 14 -6.485 -8.156 0.700 1.00 1.13 C ATOM 1840 O GLU B 14 -5.999 -8.602 1.734 1.00 1.09 O ATOM 1841 CB GLU B 14 -8.939 -7.645 0.792 1.00 1.37 C ATOM 1842 CG GLU B 14 -9.167 -8.259 2.196 1.00 1.50 C ATOM 1843 CD GLU B 14 -10.047 -7.427 3.107 1.00 3.47 C ATOM 1844 OE1 GLU B 14 -11.219 -7.175 2.750 1.00 4.88 O ATOM 1845 OE2 GLU B 14 -9.604 -7.086 4.229 1.00 4.24 O ATOM 0 H GLU B 14 -8.027 -5.807 -0.846 1.00 1.15 H new ATOM 0 HA GLU B 14 -7.439 -6.534 1.761 1.00 1.19 H new ATOM 0 HB2 GLU B 14 -9.687 -6.882 0.577 1.00 1.37 H new ATOM 0 HB3 GLU B 14 -9.028 -8.406 0.017 1.00 1.37 H new ATOM 0 HG2 GLU B 14 -9.615 -9.246 2.079 1.00 1.50 H new ATOM 0 HG3 GLU B 14 -8.200 -8.403 2.678 1.00 1.50 H new ATOM 1852 N THR B 15 -6.125 -8.639 -0.496 1.00 1.14 N ATOM 1853 CA THR B 15 -5.213 -9.788 -0.583 1.00 1.13 C ATOM 1854 C THR B 15 -3.887 -9.501 0.163 1.00 1.07 C ATOM 1855 O THR B 15 -3.336 -10.344 0.879 1.00 1.11 O ATOM 1856 CB THR B 15 -5.091 -10.337 -2.019 1.00 1.15 C ATOM 1857 OG1 THR B 15 -4.790 -11.717 -1.978 1.00 1.42 O ATOM 1858 CG2 THR B 15 -4.081 -9.633 -2.925 1.00 0.98 C ATOM 0 H THR B 15 -6.439 -8.266 -1.392 1.00 1.14 H new ATOM 0 HA THR B 15 -5.647 -10.631 -0.045 1.00 1.13 H new ATOM 0 HB THR B 15 -6.064 -10.141 -2.469 1.00 1.15 H new ATOM 0 HG1 THR B 15 -3.979 -11.859 -1.446 1.00 1.42 H new ATOM 0 HG21 THR B 15 -4.083 -10.105 -3.908 1.00 0.98 H new ATOM 0 HG22 THR B 15 -4.353 -8.582 -3.026 1.00 0.98 H new ATOM 0 HG23 THR B 15 -3.085 -9.709 -2.488 1.00 0.98 H new ATOM 1866 N VAL B 16 -3.432 -8.246 0.114 1.00 1.04 N ATOM 1867 CA VAL B 16 -2.301 -7.811 0.926 1.00 1.05 C ATOM 1868 C VAL B 16 -2.692 -7.576 2.395 1.00 1.12 C ATOM 1869 O VAL B 16 -1.878 -7.871 3.266 1.00 1.16 O ATOM 1870 CB VAL B 16 -1.500 -6.660 0.294 1.00 0.95 C ATOM 1871 CG1 VAL B 16 -1.004 -7.054 -1.105 1.00 0.93 C ATOM 1872 CG2 VAL B 16 -2.278 -5.350 0.207 1.00 0.95 C ATOM 0 H VAL B 16 -3.831 -7.518 -0.479 1.00 1.04 H new ATOM 0 HA VAL B 16 -1.598 -8.644 0.943 1.00 1.05 H new ATOM 0 HB VAL B 16 -0.655 -6.485 0.960 1.00 0.95 H new ATOM 0 HG11 VAL B 16 -0.439 -6.228 -1.537 1.00 0.93 H new ATOM 0 HG12 VAL B 16 -0.362 -7.932 -1.030 1.00 0.93 H new ATOM 0 HG13 VAL B 16 -1.858 -7.283 -1.743 1.00 0.93 H new ATOM 0 HG21 VAL B 16 -1.651 -4.584 -0.249 1.00 0.95 H new ATOM 0 HG22 VAL B 16 -3.171 -5.497 -0.401 1.00 0.95 H new ATOM 0 HG23 VAL B 16 -2.569 -5.032 1.208 1.00 0.95 H new ATOM 1882 N VAL B 17 -3.907 -7.102 2.714 1.00 1.12 N ATOM 1883 CA VAL B 17 -4.394 -7.071 4.100 1.00 1.11 C ATOM 1884 C VAL B 17 -4.292 -8.455 4.733 1.00 1.06 C ATOM 1885 O VAL B 17 -3.764 -8.577 5.832 1.00 1.09 O ATOM 1886 CB VAL B 17 -5.832 -6.517 4.244 1.00 1.13 C ATOM 1887 CG1 VAL B 17 -6.378 -6.708 5.669 1.00 1.10 C ATOM 1888 CG2 VAL B 17 -5.828 -5.003 3.994 1.00 1.27 C ATOM 0 H VAL B 17 -4.569 -6.735 2.030 1.00 1.12 H new ATOM 0 HA VAL B 17 -3.746 -6.374 4.631 1.00 1.11 H new ATOM 0 HB VAL B 17 -6.449 -7.057 3.526 1.00 1.13 H new ATOM 0 HG11 VAL B 17 -7.389 -6.306 5.728 1.00 1.10 H new ATOM 0 HG12 VAL B 17 -6.395 -7.770 5.913 1.00 1.10 H new ATOM 0 HG13 VAL B 17 -5.737 -6.183 6.378 1.00 1.10 H new ATOM 0 HG21 VAL B 17 -6.841 -4.615 4.096 1.00 1.27 H new ATOM 0 HG22 VAL B 17 -5.178 -4.516 4.721 1.00 1.27 H new ATOM 0 HG23 VAL B 17 -5.462 -4.801 2.987 1.00 1.27 H new ATOM 1898 N THR B 18 -4.812 -9.497 4.086 1.00 1.04 N ATOM 1899 CA THR B 18 -4.793 -10.841 4.649 1.00 1.07 C ATOM 1900 C THR B 18 -3.350 -11.344 4.780 1.00 1.05 C ATOM 1901 O THR B 18 -2.980 -11.864 5.835 1.00 1.07 O ATOM 1902 CB THR B 18 -5.749 -11.781 3.899 1.00 1.12 C ATOM 1903 OG1 THR B 18 -5.790 -13.042 4.532 1.00 1.15 O ATOM 1904 CG2 THR B 18 -5.385 -11.959 2.429 1.00 1.21 C ATOM 0 H THR B 18 -5.253 -9.433 3.168 1.00 1.04 H new ATOM 0 HA THR B 18 -5.186 -10.818 5.665 1.00 1.07 H new ATOM 0 HB THR B 18 -6.732 -11.311 3.931 1.00 1.12 H new ATOM 0 HG1 THR B 18 -6.403 -13.632 4.046 1.00 1.15 H new ATOM 0 HG21 THR B 18 -6.099 -12.634 1.957 1.00 1.21 H new ATOM 0 HG22 THR B 18 -5.414 -10.992 1.927 1.00 1.21 H new ATOM 0 HG23 THR B 18 -4.382 -12.379 2.351 1.00 1.21 H new ATOM 1912 N THR B 19 -2.501 -11.125 3.765 1.00 1.05 N ATOM 1913 CA THR B 19 -1.088 -11.465 3.867 1.00 1.08 C ATOM 1914 C THR B 19 -0.460 -10.770 5.083 1.00 1.09 C ATOM 1915 O THR B 19 0.117 -11.420 5.951 1.00 1.15 O ATOM 1916 CB THR B 19 -0.373 -11.129 2.552 1.00 1.10 C ATOM 1917 OG1 THR B 19 -1.004 -11.812 1.491 1.00 1.07 O ATOM 1918 CG2 THR B 19 1.084 -11.601 2.584 1.00 1.12 C ATOM 0 H THR B 19 -2.774 -10.716 2.871 1.00 1.05 H new ATOM 0 HA THR B 19 -0.976 -12.537 4.027 1.00 1.08 H new ATOM 0 HB THR B 19 -0.413 -10.048 2.417 1.00 1.10 H new ATOM 0 HG1 THR B 19 -1.826 -11.340 1.241 1.00 1.07 H new ATOM 0 HG21 THR B 19 1.568 -11.351 1.640 1.00 1.12 H new ATOM 0 HG22 THR B 19 1.608 -11.108 3.403 1.00 1.12 H new ATOM 0 HG23 THR B 19 1.114 -12.681 2.732 1.00 1.12 H new ATOM 1926 N PHE B 20 -0.613 -9.448 5.178 1.00 1.07 N ATOM 1927 CA PHE B 20 -0.215 -8.664 6.339 1.00 1.13 C ATOM 1928 C PHE B 20 -0.716 -9.337 7.621 1.00 1.10 C ATOM 1929 O PHE B 20 0.074 -9.649 8.503 1.00 1.11 O ATOM 1930 CB PHE B 20 -0.734 -7.224 6.179 1.00 1.22 C ATOM 1931 CG PHE B 20 -0.847 -6.410 7.453 1.00 1.92 C ATOM 1932 CD1 PHE B 20 0.247 -5.657 7.913 1.00 2.56 C ATOM 1933 CD2 PHE B 20 -2.068 -6.368 8.154 1.00 3.26 C ATOM 1934 CE1 PHE B 20 0.116 -4.853 9.058 1.00 3.49 C ATOM 1935 CE2 PHE B 20 -2.177 -5.617 9.337 1.00 4.21 C ATOM 1936 CZ PHE B 20 -1.082 -4.863 9.790 1.00 4.05 C ATOM 0 H PHE B 20 -1.025 -8.886 4.434 1.00 1.07 H new ATOM 0 HA PHE B 20 0.871 -8.615 6.414 1.00 1.13 H new ATOM 0 HB2 PHE B 20 -0.073 -6.696 5.492 1.00 1.22 H new ATOM 0 HB3 PHE B 20 -1.717 -7.264 5.709 1.00 1.22 H new ATOM 0 HD1 PHE B 20 1.189 -5.696 7.386 1.00 2.56 H new ATOM 0 HD2 PHE B 20 -2.922 -6.914 7.782 1.00 3.26 H new ATOM 0 HE1 PHE B 20 0.937 -4.227 9.375 1.00 3.49 H new ATOM 0 HE2 PHE B 20 -3.101 -5.620 9.897 1.00 4.21 H new ATOM 0 HZ PHE B 20 -1.162 -4.290 10.702 1.00 4.05 H new ATOM 1946 N PHE B 21 -2.021 -9.591 7.707 1.00 1.08 N ATOM 1947 CA PHE B 21 -2.713 -10.103 8.882 1.00 1.12 C ATOM 1948 C PHE B 21 -2.093 -11.427 9.346 1.00 1.15 C ATOM 1949 O PHE B 21 -1.728 -11.567 10.516 1.00 1.21 O ATOM 1950 CB PHE B 21 -4.207 -10.240 8.537 1.00 1.15 C ATOM 1951 CG PHE B 21 -5.229 -10.398 9.648 1.00 1.26 C ATOM 1952 CD1 PHE B 21 -4.870 -10.514 11.006 1.00 2.23 C ATOM 1953 CD2 PHE B 21 -6.587 -10.480 9.282 1.00 2.31 C ATOM 1954 CE1 PHE B 21 -5.863 -10.734 11.976 1.00 2.50 C ATOM 1955 CE2 PHE B 21 -7.584 -10.606 10.265 1.00 2.55 C ATOM 1956 CZ PHE B 21 -7.220 -10.739 11.614 1.00 2.01 C ATOM 0 H PHE B 21 -2.652 -9.437 6.920 1.00 1.08 H new ATOM 0 HA PHE B 21 -2.608 -9.413 9.719 1.00 1.12 H new ATOM 0 HB2 PHE B 21 -4.489 -9.360 7.960 1.00 1.15 H new ATOM 0 HB3 PHE B 21 -4.310 -11.101 7.876 1.00 1.15 H new ATOM 0 HD1 PHE B 21 -3.834 -10.434 11.301 1.00 2.23 H new ATOM 0 HD2 PHE B 21 -6.864 -10.446 8.239 1.00 2.31 H new ATOM 0 HE1 PHE B 21 -5.581 -10.900 13.005 1.00 2.50 H new ATOM 0 HE2 PHE B 21 -8.627 -10.600 9.983 1.00 2.55 H new ATOM 0 HZ PHE B 21 -7.982 -10.845 12.372 1.00 2.01 H new ATOM 1966 N THR B 22 -1.966 -12.403 8.439 1.00 1.17 N ATOM 1967 CA THR B 22 -1.481 -13.727 8.815 1.00 1.26 C ATOM 1968 C THR B 22 -0.033 -13.671 9.319 1.00 1.20 C ATOM 1969 O THR B 22 0.359 -14.514 10.119 1.00 1.17 O ATOM 1970 CB THR B 22 -1.746 -14.771 7.711 1.00 1.38 C ATOM 1971 OG1 THR B 22 -1.694 -16.090 8.236 1.00 2.56 O ATOM 1972 CG2 THR B 22 -0.777 -14.679 6.533 1.00 2.10 C ATOM 0 H THR B 22 -2.191 -12.298 7.450 1.00 1.17 H new ATOM 0 HA THR B 22 -2.062 -14.080 9.667 1.00 1.26 H new ATOM 0 HB THR B 22 -2.745 -14.544 7.338 1.00 1.38 H new ATOM 0 HG1 THR B 22 -2.599 -16.386 8.467 1.00 2.56 H new ATOM 0 HG21 THR B 22 -1.025 -15.444 5.797 1.00 2.10 H new ATOM 0 HG22 THR B 22 -0.856 -13.694 6.073 1.00 2.10 H new ATOM 0 HG23 THR B 22 0.242 -14.834 6.887 1.00 2.10 H new ATOM 1980 N PHE B 23 0.760 -12.674 8.913 1.00 1.30 N ATOM 1981 CA PHE B 23 2.052 -12.424 9.549 1.00 1.38 C ATOM 1982 C PHE B 23 1.878 -11.634 10.847 1.00 1.43 C ATOM 1983 O PHE B 23 2.467 -11.953 11.869 1.00 1.59 O ATOM 1984 CB PHE B 23 3.015 -11.728 8.576 1.00 1.37 C ATOM 1985 CG PHE B 23 3.618 -12.658 7.536 1.00 1.22 C ATOM 1986 CD1 PHE B 23 2.809 -13.224 6.533 1.00 2.43 C ATOM 1987 CD2 PHE B 23 4.974 -13.028 7.619 1.00 1.91 C ATOM 1988 CE1 PHE B 23 3.337 -14.159 5.630 1.00 2.92 C ATOM 1989 CE2 PHE B 23 5.505 -13.961 6.712 1.00 2.22 C ATOM 1990 CZ PHE B 23 4.683 -14.541 5.733 1.00 2.34 C ATOM 0 H PHE B 23 0.530 -12.033 8.153 1.00 1.30 H new ATOM 0 HA PHE B 23 2.497 -13.383 9.813 1.00 1.38 H new ATOM 0 HB2 PHE B 23 2.483 -10.925 8.066 1.00 1.37 H new ATOM 0 HB3 PHE B 23 3.821 -11.265 9.146 1.00 1.37 H new ATOM 0 HD1 PHE B 23 1.771 -12.936 6.458 1.00 2.43 H new ATOM 0 HD2 PHE B 23 5.606 -12.595 8.380 1.00 1.91 H new ATOM 0 HE1 PHE B 23 2.710 -14.583 4.859 1.00 2.92 H new ATOM 0 HE2 PHE B 23 6.549 -14.233 6.768 1.00 2.22 H new ATOM 0 HZ PHE B 23 5.087 -15.282 5.059 1.00 2.34 H new ATOM 2000 N ALA B 24 1.043 -10.604 10.835 1.00 1.35 N ATOM 2001 CA ALA B 24 0.881 -9.660 11.923 1.00 1.44 C ATOM 2002 C ALA B 24 0.440 -10.375 13.189 1.00 1.59 C ATOM 2003 O ALA B 24 0.793 -9.962 14.294 1.00 1.64 O ATOM 2004 CB ALA B 24 -0.111 -8.559 11.540 1.00 1.44 C ATOM 0 H ALA B 24 0.441 -10.399 10.038 1.00 1.35 H new ATOM 0 HA ALA B 24 1.845 -9.190 12.118 1.00 1.44 H new ATOM 0 HB1 ALA B 24 -0.218 -7.861 12.370 1.00 1.44 H new ATOM 0 HB2 ALA B 24 0.257 -8.026 10.663 1.00 1.44 H new ATOM 0 HB3 ALA B 24 -1.080 -9.005 11.313 1.00 1.44 H new ATOM 2010 N ARG B 25 -0.337 -11.447 13.042 1.00 1.68 N ATOM 2011 CA ARG B 25 -0.781 -12.240 14.177 1.00 1.89 C ATOM 2012 C ARG B 25 0.369 -12.880 14.957 1.00 1.88 C ATOM 2013 O ARG B 25 0.124 -13.288 16.087 1.00 2.03 O ATOM 2014 CB ARG B 25 -1.820 -13.276 13.728 1.00 2.01 C ATOM 2015 CG ARG B 25 -1.218 -14.322 12.787 1.00 2.16 C ATOM 2016 CD ARG B 25 -0.981 -15.680 13.467 1.00 2.14 C ATOM 2017 NE ARG B 25 -0.048 -16.509 12.682 1.00 2.37 N ATOM 2018 CZ ARG B 25 -0.230 -16.925 11.419 1.00 3.49 C ATOM 2019 NH1 ARG B 25 -1.423 -16.799 10.833 1.00 4.43 N ATOM 2020 NH2 ARG B 25 0.807 -17.436 10.753 1.00 4.22 N ATOM 0 H ARG B 25 -0.672 -11.784 12.139 1.00 1.68 H new ATOM 0 HA ARG B 25 -1.255 -11.556 14.880 1.00 1.89 H new ATOM 0 HB2 ARG B 25 -2.237 -13.774 14.603 1.00 2.01 H new ATOM 0 HB3 ARG B 25 -2.644 -12.769 13.226 1.00 2.01 H new ATOM 0 HG2 ARG B 25 -1.883 -14.460 11.934 1.00 2.16 H new ATOM 0 HG3 ARG B 25 -0.272 -13.948 12.396 1.00 2.16 H new ATOM 0 HD2 ARG B 25 -0.580 -15.524 14.468 1.00 2.14 H new ATOM 0 HD3 ARG B 25 -1.930 -16.204 13.582 1.00 2.14 H new ATOM 0 HE ARG B 25 0.817 -16.793 13.142 1.00 2.37 H new ATOM 0 HH11 ARG B 25 -2.202 -16.385 11.345 1.00 4.43 H new ATOM 0 HH12 ARG B 25 -1.556 -17.117 9.873 1.00 4.43 H new ATOM 0 HH21 ARG B 25 1.719 -17.505 11.205 1.00 4.22 H new ATOM 0 HH22 ARG B 25 0.688 -17.757 9.792 1.00 4.22 H new ATOM 2034 N GLN B 26 1.571 -13.031 14.375 1.00 1.78 N ATOM 2035 CA GLN B 26 2.473 -14.067 14.852 1.00 1.81 C ATOM 2036 C GLN B 26 2.814 -14.008 16.349 1.00 1.91 C ATOM 2037 O GLN B 26 2.482 -14.952 17.064 1.00 2.07 O ATOM 2038 CB GLN B 26 3.775 -13.995 14.040 1.00 1.63 C ATOM 2039 CG GLN B 26 4.324 -15.348 13.638 1.00 1.75 C ATOM 2040 CD GLN B 26 3.613 -15.914 12.413 1.00 1.95 C ATOM 2041 OE1 GLN B 26 2.652 -16.676 12.533 1.00 2.23 O ATOM 2042 NE2 GLN B 26 4.049 -15.538 11.218 1.00 2.28 N ATOM 0 H GLN B 26 1.923 -12.466 13.602 1.00 1.78 H new ATOM 0 HA GLN B 26 1.943 -15.009 14.713 1.00 1.81 H new ATOM 0 HB2 GLN B 26 3.599 -13.404 13.141 1.00 1.63 H new ATOM 0 HB3 GLN B 26 4.528 -13.468 14.626 1.00 1.63 H new ATOM 0 HG2 GLN B 26 5.390 -15.259 13.429 1.00 1.75 H new ATOM 0 HG3 GLN B 26 4.220 -16.043 14.471 1.00 1.75 H new ATOM 0 HE21 GLN B 26 4.846 -14.906 11.142 1.00 2.28 H new ATOM 0 HE22 GLN B 26 3.587 -15.880 10.376 1.00 2.28 H new ATOM 2051 N GLU B 27 3.540 -12.977 16.805 1.00 1.82 N ATOM 2052 CA GLU B 27 4.082 -13.026 18.159 1.00 1.87 C ATOM 2053 C GLU B 27 3.153 -12.396 19.200 1.00 2.02 C ATOM 2054 O GLU B 27 2.423 -13.079 19.912 1.00 2.14 O ATOM 2055 CB GLU B 27 5.448 -12.320 18.140 1.00 1.81 C ATOM 2056 CG GLU B 27 6.511 -13.072 17.335 1.00 1.87 C ATOM 2057 CD GLU B 27 7.841 -12.332 17.425 1.00 2.21 C ATOM 2058 OE1 GLU B 27 7.846 -11.109 17.154 1.00 2.77 O ATOM 2059 OE2 GLU B 27 8.829 -12.998 17.807 1.00 2.70 O ATOM 0 H GLU B 27 3.756 -12.132 16.276 1.00 1.82 H new ATOM 0 HA GLU B 27 4.186 -14.069 18.459 1.00 1.87 H new ATOM 0 HB2 GLU B 27 5.326 -11.321 17.722 1.00 1.81 H new ATOM 0 HB3 GLU B 27 5.799 -12.196 19.165 1.00 1.81 H new ATOM 0 HG2 GLU B 27 6.621 -14.086 17.718 1.00 1.87 H new ATOM 0 HG3 GLU B 27 6.200 -13.157 16.294 1.00 1.87 H new ATOM 2066 N GLY B 28 3.141 -11.060 19.228 1.00 2.26 N ATOM 2067 CA GLY B 28 2.122 -10.198 19.790 1.00 2.52 C ATOM 2068 C GLY B 28 1.101 -9.816 18.731 1.00 2.14 C ATOM 2069 O GLY B 28 1.420 -9.876 17.539 1.00 1.92 O ATOM 0 H GLY B 28 3.907 -10.521 18.825 1.00 2.26 H new ATOM 0 HA2 GLY B 28 1.624 -10.705 20.617 1.00 2.52 H new ATOM 0 HA3 GLY B 28 2.583 -9.299 20.199 1.00 2.52 H new ATOM 2073 N ARG B 29 -0.006 -9.213 19.179 1.00 2.38 N ATOM 2074 CA ARG B 29 -0.628 -8.055 18.533 1.00 2.37 C ATOM 2075 C ARG B 29 -0.815 -8.213 17.012 1.00 2.13 C ATOM 2076 O ARG B 29 0.120 -8.025 16.220 1.00 1.79 O ATOM 2077 CB ARG B 29 0.165 -6.793 18.923 1.00 2.35 C ATOM 2078 CG ARG B 29 -0.437 -6.051 20.124 1.00 2.68 C ATOM 2079 CD ARG B 29 -1.624 -5.185 19.675 1.00 2.65 C ATOM 2080 NE ARG B 29 -2.267 -4.504 20.804 1.00 3.10 N ATOM 2081 CZ ARG B 29 -3.357 -3.725 20.698 1.00 3.74 C ATOM 2082 NH1 ARG B 29 -3.933 -3.507 19.510 1.00 4.63 N ATOM 2083 NH2 ARG B 29 -3.877 -3.166 21.797 1.00 4.27 N ATOM 0 H ARG B 29 -0.502 -9.522 20.015 1.00 2.38 H new ATOM 0 HA ARG B 29 -1.650 -7.962 18.899 1.00 2.37 H new ATOM 0 HB2 ARG B 29 1.192 -7.074 19.155 1.00 2.35 H new ATOM 0 HB3 ARG B 29 0.204 -6.117 18.069 1.00 2.35 H new ATOM 0 HG2 ARG B 29 -0.765 -6.768 20.876 1.00 2.68 H new ATOM 0 HG3 ARG B 29 0.323 -5.425 20.591 1.00 2.68 H new ATOM 0 HD2 ARG B 29 -1.279 -4.444 18.954 1.00 2.65 H new ATOM 0 HD3 ARG B 29 -2.356 -5.811 19.165 1.00 2.65 H new ATOM 0 HE ARG B 29 -1.860 -4.630 21.731 1.00 3.10 H new ATOM 0 HH11 ARG B 29 -3.545 -3.935 18.669 1.00 4.63 H new ATOM 0 HH12 ARG B 29 -4.760 -2.913 19.445 1.00 4.63 H new ATOM 0 HH21 ARG B 29 -3.446 -3.332 22.706 1.00 4.27 H new ATOM 0 HH22 ARG B 29 -4.704 -2.573 21.725 1.00 4.27 H new ATOM 2097 N LYS B 30 -2.038 -8.587 16.616 1.00 2.33 N ATOM 2098 CA LYS B 30 -2.441 -8.922 15.253 1.00 2.08 C ATOM 2099 C LYS B 30 -2.661 -7.678 14.373 1.00 1.95 C ATOM 2100 O LYS B 30 -3.705 -7.519 13.730 1.00 2.37 O ATOM 2101 CB LYS B 30 -3.689 -9.824 15.308 1.00 2.36 C ATOM 2102 CG LYS B 30 -4.841 -9.223 16.139 1.00 2.72 C ATOM 2103 CD LYS B 30 -6.169 -9.920 15.814 1.00 3.07 C ATOM 2104 CE LYS B 30 -7.347 -9.393 16.651 1.00 3.74 C ATOM 2105 NZ LYS B 30 -7.254 -9.765 18.079 1.00 4.46 N ATOM 0 H LYS B 30 -2.811 -8.667 17.277 1.00 2.33 H new ATOM 0 HA LYS B 30 -1.626 -9.466 14.775 1.00 2.08 H new ATOM 0 HB2 LYS B 30 -4.040 -10.008 14.293 1.00 2.36 H new ATOM 0 HB3 LYS B 30 -3.412 -10.790 15.730 1.00 2.36 H new ATOM 0 HG2 LYS B 30 -4.621 -9.327 17.202 1.00 2.72 H new ATOM 0 HG3 LYS B 30 -4.925 -8.156 15.933 1.00 2.72 H new ATOM 0 HD2 LYS B 30 -6.394 -9.785 14.756 1.00 3.07 H new ATOM 0 HD3 LYS B 30 -6.061 -10.991 15.983 1.00 3.07 H new ATOM 0 HE2 LYS B 30 -7.388 -8.307 16.566 1.00 3.74 H new ATOM 0 HE3 LYS B 30 -8.279 -9.781 16.240 1.00 3.74 H new ATOM 0 HZ1 LYS B 30 -8.074 -9.383 18.591 1.00 4.46 H new ATOM 0 HZ2 LYS B 30 -7.243 -10.801 18.168 1.00 4.46 H new ATOM 0 HZ3 LYS B 30 -6.380 -9.373 18.484 1.00 4.46 H new ATOM 2119 N ASP B 31 -1.663 -6.800 14.370 1.00 1.81 N ATOM 2120 CA ASP B 31 -1.736 -5.421 13.913 1.00 1.89 C ATOM 2121 C ASP B 31 -0.318 -4.837 13.909 1.00 1.74 C ATOM 2122 O ASP B 31 0.126 -4.308 12.892 1.00 1.86 O ATOM 2123 CB ASP B 31 -2.717 -4.597 14.778 1.00 2.11 C ATOM 2124 CG ASP B 31 -2.535 -4.732 16.288 1.00 2.59 C ATOM 2125 OD1 ASP B 31 -1.577 -5.410 16.707 1.00 3.53 O ATOM 2126 OD2 ASP B 31 -3.375 -4.180 17.031 1.00 3.56 O ATOM 0 H ASP B 31 -0.732 -7.047 14.705 1.00 1.81 H new ATOM 0 HA ASP B 31 -2.132 -5.381 12.898 1.00 1.89 H new ATOM 0 HB2 ASP B 31 -2.615 -3.545 14.510 1.00 2.11 H new ATOM 0 HB3 ASP B 31 -3.735 -4.893 14.524 1.00 2.11 H new ATOM 2131 N SER B 32 0.407 -4.966 15.021 1.00 1.65 N ATOM 2132 CA SER B 32 1.823 -4.636 15.088 1.00 1.46 C ATOM 2133 C SER B 32 2.649 -5.704 14.381 1.00 1.33 C ATOM 2134 O SER B 32 2.290 -6.886 14.450 1.00 1.36 O ATOM 2135 CB SER B 32 2.288 -4.562 16.544 1.00 1.38 C ATOM 2136 OG SER B 32 2.407 -5.849 17.128 1.00 1.79 O ATOM 0 H SER B 32 0.022 -5.305 15.903 1.00 1.65 H new ATOM 0 HA SER B 32 1.963 -3.670 14.603 1.00 1.46 H new ATOM 0 HB2 SER B 32 3.250 -4.051 16.592 1.00 1.38 H new ATOM 0 HB3 SER B 32 1.581 -3.966 17.121 1.00 1.38 H new ATOM 0 HG SER B 32 2.953 -5.791 17.939 1.00 1.79 H new ATOM 2142 N LEU B 33 3.798 -5.327 13.812 1.00 1.35 N ATOM 2143 CA LEU B 33 4.854 -6.264 13.451 1.00 1.19 C ATOM 2144 C LEU B 33 6.162 -5.862 14.124 1.00 1.17 C ATOM 2145 O LEU B 33 6.655 -4.763 13.900 1.00 1.54 O ATOM 2146 CB LEU B 33 4.991 -6.390 11.926 1.00 1.00 C ATOM 2147 CG LEU B 33 3.715 -7.002 11.326 1.00 1.32 C ATOM 2148 CD1 LEU B 33 2.780 -5.939 10.752 1.00 2.88 C ATOM 2149 CD2 LEU B 33 4.029 -8.052 10.254 1.00 1.59 C ATOM 0 H LEU B 33 4.018 -4.356 13.590 1.00 1.35 H new ATOM 0 HA LEU B 33 4.587 -7.256 13.816 1.00 1.19 H new ATOM 0 HB2 LEU B 33 5.173 -5.409 11.488 1.00 1.00 H new ATOM 0 HB3 LEU B 33 5.851 -7.013 11.681 1.00 1.00 H new ATOM 0 HG LEU B 33 3.204 -7.496 12.153 1.00 1.32 H new ATOM 0 HD11 LEU B 33 1.893 -6.419 10.340 1.00 2.88 H new ATOM 0 HD12 LEU B 33 2.485 -5.249 11.542 1.00 2.88 H new ATOM 0 HD13 LEU B 33 3.294 -5.389 9.964 1.00 2.88 H new ATOM 0 HD21 LEU B 33 3.098 -8.457 9.858 1.00 1.59 H new ATOM 0 HD22 LEU B 33 4.596 -7.589 9.446 1.00 1.59 H new ATOM 0 HD23 LEU B 33 4.617 -8.857 10.695 1.00 1.59 H new ATOM 2161 N SER B 34 6.719 -6.740 14.958 1.00 1.33 N ATOM 2162 CA SER B 34 8.054 -6.579 15.517 1.00 1.28 C ATOM 2163 C SER B 34 9.063 -7.247 14.586 1.00 0.99 C ATOM 2164 O SER B 34 8.682 -7.884 13.601 1.00 1.15 O ATOM 2165 CB SER B 34 8.076 -7.164 16.933 1.00 1.74 C ATOM 2166 OG SER B 34 7.124 -6.471 17.715 1.00 2.56 O ATOM 0 H SER B 34 6.248 -7.591 15.266 1.00 1.33 H new ATOM 0 HA SER B 34 8.327 -5.527 15.596 1.00 1.28 H new ATOM 0 HB2 SER B 34 7.844 -8.229 16.908 1.00 1.74 H new ATOM 0 HB3 SER B 34 9.070 -7.065 17.369 1.00 1.74 H new ATOM 0 HG SER B 34 7.385 -5.529 17.789 1.00 2.56 H new ATOM 2172 N VAL B 35 10.363 -7.136 14.873 1.00 0.99 N ATOM 2173 CA VAL B 35 11.381 -7.669 13.973 1.00 0.93 C ATOM 2174 C VAL B 35 11.607 -9.162 14.234 1.00 1.02 C ATOM 2175 O VAL B 35 12.733 -9.646 14.287 1.00 2.06 O ATOM 2176 CB VAL B 35 12.650 -6.805 14.128 1.00 1.48 C ATOM 2177 CG1 VAL B 35 13.345 -6.913 15.493 1.00 1.44 C ATOM 2178 CG2 VAL B 35 13.649 -7.012 12.984 1.00 2.66 C ATOM 0 H VAL B 35 10.729 -6.687 15.712 1.00 0.99 H new ATOM 0 HA VAL B 35 11.062 -7.611 12.932 1.00 0.93 H new ATOM 0 HB VAL B 35 12.274 -5.784 14.072 1.00 1.48 H new ATOM 0 HG11 VAL B 35 14.225 -6.270 15.505 1.00 1.44 H new ATOM 0 HG12 VAL B 35 12.656 -6.600 16.278 1.00 1.44 H new ATOM 0 HG13 VAL B 35 13.647 -7.946 15.667 1.00 1.44 H new ATOM 0 HG21 VAL B 35 14.522 -6.380 13.145 1.00 2.66 H new ATOM 0 HG22 VAL B 35 13.958 -8.057 12.955 1.00 2.66 H new ATOM 0 HG23 VAL B 35 13.178 -6.747 12.037 1.00 2.66 H new ATOM 2188 N ASN B 36 10.507 -9.915 14.238 1.00 1.12 N ATOM 2189 CA ASN B 36 10.463 -11.352 14.039 1.00 1.19 C ATOM 2190 C ASN B 36 9.026 -11.679 13.625 1.00 1.24 C ATOM 2191 O ASN B 36 8.334 -12.483 14.235 1.00 1.81 O ATOM 2192 CB ASN B 36 10.910 -12.042 15.327 1.00 1.79 C ATOM 2193 CG ASN B 36 10.983 -13.555 15.148 1.00 2.31 C ATOM 2194 OD1 ASN B 36 11.613 -14.038 14.211 1.00 2.53 O ATOM 2195 ND2 ASN B 36 10.365 -14.318 16.040 1.00 3.08 N ATOM 0 H ASN B 36 9.581 -9.514 14.388 1.00 1.12 H new ATOM 0 HA ASN B 36 11.138 -11.708 13.261 1.00 1.19 H new ATOM 0 HB2 ASN B 36 11.887 -11.661 15.626 1.00 1.79 H new ATOM 0 HB3 ASN B 36 10.214 -11.802 16.131 1.00 1.79 H new ATOM 0 HD21 ASN B 36 10.406 -15.334 15.958 1.00 3.08 H new ATOM 0 HD22 ASN B 36 9.849 -13.889 16.808 1.00 3.08 H new ATOM 2202 N GLU B 37 8.610 -10.989 12.564 1.00 0.99 N ATOM 2203 CA GLU B 37 7.245 -10.837 12.073 1.00 1.20 C ATOM 2204 C GLU B 37 7.382 -9.981 10.821 1.00 1.26 C ATOM 2205 O GLU B 37 7.029 -10.387 9.716 1.00 1.49 O ATOM 2206 CB GLU B 37 6.344 -10.118 13.102 1.00 1.27 C ATOM 2207 CG GLU B 37 5.300 -11.061 13.704 1.00 1.22 C ATOM 2208 CD GLU B 37 4.194 -10.306 14.437 1.00 1.32 C ATOM 2209 OE1 GLU B 37 3.604 -9.362 13.878 1.00 1.94 O ATOM 2210 OE2 GLU B 37 3.832 -10.556 15.608 1.00 1.73 O ATOM 0 H GLU B 37 9.274 -10.482 11.980 1.00 0.99 H new ATOM 0 HA GLU B 37 6.781 -11.805 11.884 1.00 1.20 H new ATOM 0 HB2 GLU B 37 6.962 -9.704 13.899 1.00 1.27 H new ATOM 0 HB3 GLU B 37 5.841 -9.279 12.621 1.00 1.27 H new ATOM 0 HG2 GLU B 37 4.860 -11.667 12.912 1.00 1.22 H new ATOM 0 HG3 GLU B 37 5.789 -11.747 14.396 1.00 1.22 H new ATOM 2217 N PHE B 38 7.994 -8.804 10.998 1.00 1.09 N ATOM 2218 CA PHE B 38 8.476 -8.033 9.869 1.00 0.97 C ATOM 2219 C PHE B 38 9.507 -8.872 9.109 1.00 0.88 C ATOM 2220 O PHE B 38 9.315 -9.166 7.928 1.00 0.86 O ATOM 2221 CB PHE B 38 9.051 -6.690 10.346 1.00 0.93 C ATOM 2222 CG PHE B 38 9.769 -5.863 9.291 1.00 1.02 C ATOM 2223 CD1 PHE B 38 9.485 -6.019 7.917 1.00 1.60 C ATOM 2224 CD2 PHE B 38 10.772 -4.958 9.690 1.00 2.61 C ATOM 2225 CE1 PHE B 38 10.236 -5.324 6.960 1.00 2.27 C ATOM 2226 CE2 PHE B 38 11.494 -4.234 8.726 1.00 3.45 C ATOM 2227 CZ PHE B 38 11.213 -4.405 7.362 1.00 2.94 C ATOM 0 H PHE B 38 8.162 -8.376 11.908 1.00 1.09 H new ATOM 0 HA PHE B 38 7.657 -7.797 9.190 1.00 0.97 H new ATOM 0 HB2 PHE B 38 8.236 -6.093 10.756 1.00 0.93 H new ATOM 0 HB3 PHE B 38 9.746 -6.884 11.163 1.00 0.93 H new ATOM 0 HD1 PHE B 38 8.687 -6.676 7.603 1.00 1.60 H new ATOM 0 HD2 PHE B 38 10.987 -4.820 10.739 1.00 2.61 H new ATOM 0 HE1 PHE B 38 10.061 -5.498 5.909 1.00 2.27 H new ATOM 0 HE2 PHE B 38 12.266 -3.545 9.035 1.00 3.45 H new ATOM 0 HZ PHE B 38 11.750 -3.828 6.623 1.00 2.94 H new ATOM 2237 N LYS B 39 10.598 -9.278 9.778 1.00 0.88 N ATOM 2238 CA LYS B 39 11.668 -9.971 9.071 1.00 0.87 C ATOM 2239 C LYS B 39 11.153 -11.244 8.387 1.00 0.92 C ATOM 2240 O LYS B 39 11.580 -11.553 7.272 1.00 0.90 O ATOM 2241 CB LYS B 39 12.931 -10.188 9.922 1.00 0.88 C ATOM 2242 CG LYS B 39 14.092 -10.585 8.985 1.00 0.87 C ATOM 2243 CD LYS B 39 15.494 -10.252 9.528 1.00 1.10 C ATOM 2244 CE LYS B 39 16.492 -10.309 8.354 1.00 1.63 C ATOM 2245 NZ LYS B 39 17.871 -9.895 8.696 1.00 2.47 N ATOM 0 H LYS B 39 10.754 -9.141 10.777 1.00 0.88 H new ATOM 0 HA LYS B 39 12.002 -9.305 8.275 1.00 0.87 H new ATOM 0 HB2 LYS B 39 13.180 -9.279 10.469 1.00 0.88 H new ATOM 0 HB3 LYS B 39 12.759 -10.969 10.663 1.00 0.88 H new ATOM 0 HG2 LYS B 39 14.036 -11.656 8.792 1.00 0.87 H new ATOM 0 HG3 LYS B 39 13.958 -10.081 8.028 1.00 0.87 H new ATOM 0 HD2 LYS B 39 15.500 -9.262 9.984 1.00 1.10 H new ATOM 0 HD3 LYS B 39 15.779 -10.962 10.304 1.00 1.10 H new ATOM 0 HE2 LYS B 39 16.518 -11.327 7.966 1.00 1.63 H new ATOM 0 HE3 LYS B 39 16.124 -9.671 7.550 1.00 1.63 H new ATOM 0 HZ1 LYS B 39 18.371 -9.604 7.831 1.00 2.47 H new ATOM 0 HZ2 LYS B 39 17.839 -9.097 9.362 1.00 2.47 H new ATOM 0 HZ3 LYS B 39 18.374 -10.692 9.135 1.00 2.47 H new ATOM 2259 N GLU B 40 10.203 -11.947 9.014 1.00 1.02 N ATOM 2260 CA GLU B 40 9.532 -13.078 8.394 1.00 1.14 C ATOM 2261 C GLU B 40 9.019 -12.739 6.991 1.00 0.99 C ATOM 2262 O GLU B 40 9.152 -13.560 6.088 1.00 0.98 O ATOM 2263 CB GLU B 40 8.356 -13.570 9.246 1.00 1.41 C ATOM 2264 CG GLU B 40 8.742 -14.232 10.571 1.00 1.67 C ATOM 2265 CD GLU B 40 7.507 -14.861 11.211 1.00 2.91 C ATOM 2266 OE1 GLU B 40 6.413 -14.274 11.045 1.00 4.27 O ATOM 2267 OE2 GLU B 40 7.653 -15.948 11.804 1.00 3.23 O ATOM 0 H GLU B 40 9.884 -11.743 9.961 1.00 1.02 H new ATOM 0 HA GLU B 40 10.278 -13.869 8.317 1.00 1.14 H new ATOM 0 HB2 GLU B 40 7.703 -12.724 9.458 1.00 1.41 H new ATOM 0 HB3 GLU B 40 7.775 -14.281 8.659 1.00 1.41 H new ATOM 0 HG2 GLU B 40 9.503 -14.994 10.400 1.00 1.67 H new ATOM 0 HG3 GLU B 40 9.176 -13.493 11.245 1.00 1.67 H new ATOM 2274 N LEU B 41 8.422 -11.560 6.786 1.00 0.93 N ATOM 2275 CA LEU B 41 7.777 -11.252 5.518 1.00 0.86 C ATOM 2276 C LEU B 41 8.843 -11.173 4.432 1.00 0.77 C ATOM 2277 O LEU B 41 8.712 -11.787 3.375 1.00 0.77 O ATOM 2278 CB LEU B 41 6.980 -9.940 5.599 1.00 0.88 C ATOM 2279 CG LEU B 41 6.045 -9.794 4.379 1.00 0.79 C ATOM 2280 CD1 LEU B 41 4.627 -10.252 4.734 1.00 1.92 C ATOM 2281 CD2 LEU B 41 6.016 -8.360 3.838 1.00 1.74 C ATOM 0 H LEU B 41 8.375 -10.813 7.479 1.00 0.93 H new ATOM 0 HA LEU B 41 7.066 -12.042 5.277 1.00 0.86 H new ATOM 0 HB2 LEU B 41 6.393 -9.921 6.517 1.00 0.88 H new ATOM 0 HB3 LEU B 41 7.666 -9.094 5.641 1.00 0.88 H new ATOM 0 HG LEU B 41 6.444 -10.432 3.591 1.00 0.79 H new ATOM 0 HD11 LEU B 41 3.981 -10.143 3.863 1.00 1.92 H new ATOM 0 HD12 LEU B 41 4.649 -11.298 5.041 1.00 1.92 H new ATOM 0 HD13 LEU B 41 4.241 -9.642 5.551 1.00 1.92 H new ATOM 0 HD21 LEU B 41 5.345 -8.308 2.981 1.00 1.74 H new ATOM 0 HD22 LEU B 41 5.663 -7.684 4.617 1.00 1.74 H new ATOM 0 HD23 LEU B 41 7.020 -8.067 3.531 1.00 1.74 H new ATOM 2293 N VAL B 42 9.908 -10.418 4.709 1.00 0.72 N ATOM 2294 CA VAL B 42 10.952 -10.141 3.733 1.00 0.67 C ATOM 2295 C VAL B 42 11.742 -11.409 3.441 1.00 0.73 C ATOM 2296 O VAL B 42 12.105 -11.672 2.300 1.00 0.73 O ATOM 2297 CB VAL B 42 11.840 -8.967 4.167 1.00 0.64 C ATOM 2298 CG1 VAL B 42 11.085 -7.641 4.026 1.00 0.62 C ATOM 2299 CG2 VAL B 42 12.380 -9.084 5.587 1.00 0.68 C ATOM 0 H VAL B 42 10.067 -9.983 5.618 1.00 0.72 H new ATOM 0 HA VAL B 42 10.486 -9.825 2.800 1.00 0.67 H new ATOM 0 HB VAL B 42 12.700 -8.995 3.498 1.00 0.64 H new ATOM 0 HG11 VAL B 42 11.730 -6.820 4.338 1.00 0.62 H new ATOM 0 HG12 VAL B 42 10.793 -7.497 2.986 1.00 0.62 H new ATOM 0 HG13 VAL B 42 10.194 -7.661 4.654 1.00 0.62 H new ATOM 0 HG21 VAL B 42 12.997 -8.215 5.814 1.00 0.68 H new ATOM 0 HG22 VAL B 42 11.548 -9.132 6.290 1.00 0.68 H new ATOM 0 HG23 VAL B 42 12.982 -9.989 5.674 1.00 0.68 H new ATOM 2309 N THR B 43 11.974 -12.207 4.480 1.00 0.85 N ATOM 2310 CA THR B 43 12.593 -13.509 4.346 1.00 0.98 C ATOM 2311 C THR B 43 11.729 -14.416 3.459 1.00 1.01 C ATOM 2312 O THR B 43 12.221 -15.004 2.501 1.00 1.07 O ATOM 2313 CB THR B 43 12.780 -14.072 5.761 1.00 1.10 C ATOM 2314 OG1 THR B 43 13.608 -13.196 6.501 1.00 1.11 O ATOM 2315 CG2 THR B 43 13.424 -15.461 5.763 1.00 1.26 C ATOM 0 H THR B 43 11.734 -11.961 5.440 1.00 0.85 H new ATOM 0 HA THR B 43 13.565 -13.443 3.857 1.00 0.98 H new ATOM 0 HB THR B 43 11.789 -14.161 6.207 1.00 1.10 H new ATOM 0 HG1 THR B 43 13.058 -12.500 6.918 1.00 1.11 H new ATOM 0 HG21 THR B 43 13.532 -15.810 6.790 1.00 1.26 H new ATOM 0 HG22 THR B 43 12.793 -16.155 5.208 1.00 1.26 H new ATOM 0 HG23 THR B 43 14.406 -15.408 5.293 1.00 1.26 H new ATOM 2323 N GLN B 44 10.453 -14.574 3.821 1.00 1.03 N ATOM 2324 CA GLN B 44 9.574 -15.584 3.256 1.00 1.14 C ATOM 2325 C GLN B 44 8.965 -15.161 1.912 1.00 1.15 C ATOM 2326 O GLN B 44 9.108 -15.859 0.911 1.00 1.22 O ATOM 2327 CB GLN B 44 8.510 -15.933 4.310 1.00 1.20 C ATOM 2328 CG GLN B 44 7.793 -17.253 3.989 1.00 1.30 C ATOM 2329 CD GLN B 44 6.657 -17.560 4.964 1.00 1.44 C ATOM 2330 OE1 GLN B 44 5.661 -18.171 4.595 1.00 2.03 O ATOM 2331 NE2 GLN B 44 6.778 -17.139 6.220 1.00 1.59 N ATOM 0 H GLN B 44 10.001 -13.992 4.526 1.00 1.03 H new ATOM 0 HA GLN B 44 10.154 -16.476 3.018 1.00 1.14 H new ATOM 0 HB2 GLN B 44 8.981 -16.005 5.290 1.00 1.20 H new ATOM 0 HB3 GLN B 44 7.778 -15.127 4.367 1.00 1.20 H new ATOM 0 HG2 GLN B 44 7.394 -17.208 2.976 1.00 1.30 H new ATOM 0 HG3 GLN B 44 8.516 -18.069 4.011 1.00 1.30 H new ATOM 0 HE21 GLN B 44 7.614 -16.632 6.510 1.00 1.59 H new ATOM 0 HE22 GLN B 44 6.035 -17.323 6.894 1.00 1.59 H new ATOM 2340 N GLN B 45 8.209 -14.060 1.909 1.00 1.14 N ATOM 2341 CA GLN B 45 7.249 -13.750 0.853 1.00 1.26 C ATOM 2342 C GLN B 45 7.869 -13.125 -0.396 1.00 1.26 C ATOM 2343 O GLN B 45 7.372 -13.357 -1.499 1.00 1.54 O ATOM 2344 CB GLN B 45 6.170 -12.797 1.386 1.00 1.34 C ATOM 2345 CG GLN B 45 5.422 -13.327 2.612 1.00 2.10 C ATOM 2346 CD GLN B 45 4.680 -14.621 2.300 1.00 1.96 C ATOM 2347 OE1 GLN B 45 5.172 -15.705 2.584 1.00 2.89 O ATOM 2348 NE2 GLN B 45 3.494 -14.519 1.709 1.00 2.26 N ATOM 0 H GLN B 45 8.248 -13.355 2.646 1.00 1.14 H new ATOM 0 HA GLN B 45 6.826 -14.710 0.556 1.00 1.26 H new ATOM 0 HB2 GLN B 45 6.635 -11.844 1.640 1.00 1.34 H new ATOM 0 HB3 GLN B 45 5.450 -12.599 0.592 1.00 1.34 H new ATOM 0 HG2 GLN B 45 6.129 -13.499 3.424 1.00 2.10 H new ATOM 0 HG3 GLN B 45 4.713 -12.575 2.960 1.00 2.10 H new ATOM 0 HE21 GLN B 45 3.113 -13.600 1.486 1.00 2.26 H new ATOM 0 HE22 GLN B 45 2.965 -15.360 1.478 1.00 2.26 H new ATOM 2357 N LEU B 46 8.853 -12.239 -0.197 1.00 1.03 N ATOM 2358 CA LEU B 46 9.204 -11.185 -1.150 1.00 1.00 C ATOM 2359 C LEU B 46 9.376 -11.655 -2.598 1.00 1.60 C ATOM 2360 O LEU B 46 8.816 -11.010 -3.475 1.00 2.12 O ATOM 2361 CB LEU B 46 10.359 -10.323 -0.625 1.00 0.90 C ATOM 2362 CG LEU B 46 9.885 -9.031 0.069 1.00 1.00 C ATOM 2363 CD1 LEU B 46 9.566 -7.940 -0.952 1.00 1.63 C ATOM 2364 CD2 LEU B 46 8.662 -9.196 0.984 1.00 1.72 C ATOM 0 H LEU B 46 9.433 -12.236 0.642 1.00 1.03 H new ATOM 0 HA LEU B 46 8.331 -10.536 -1.217 1.00 1.00 H new ATOM 0 HB2 LEU B 46 10.951 -10.909 0.078 1.00 0.90 H new ATOM 0 HB3 LEU B 46 11.016 -10.062 -1.455 1.00 0.90 H new ATOM 0 HG LEU B 46 10.728 -8.751 0.701 1.00 1.00 H new ATOM 0 HD11 LEU B 46 9.234 -7.041 -0.432 1.00 1.63 H new ATOM 0 HD12 LEU B 46 10.459 -7.714 -1.534 1.00 1.63 H new ATOM 0 HD13 LEU B 46 8.776 -8.286 -1.619 1.00 1.63 H new ATOM 0 HD21 LEU B 46 8.405 -8.233 1.426 1.00 1.72 H new ATOM 0 HD22 LEU B 46 7.818 -9.564 0.401 1.00 1.72 H new ATOM 0 HD23 LEU B 46 8.894 -9.908 1.776 1.00 1.72 H new ATOM 2376 N PRO B 47 10.060 -12.774 -2.869 1.00 1.88 N ATOM 2377 CA PRO B 47 11.332 -13.137 -2.280 1.00 1.97 C ATOM 2378 C PRO B 47 12.447 -12.326 -2.962 1.00 1.68 C ATOM 2379 O PRO B 47 13.415 -11.942 -2.313 1.00 1.88 O ATOM 2380 CB PRO B 47 11.474 -14.629 -2.589 1.00 2.45 C ATOM 2381 CG PRO B 47 10.789 -14.780 -3.951 1.00 2.47 C ATOM 2382 CD PRO B 47 9.703 -13.699 -3.934 1.00 2.47 C ATOM 0 HA PRO B 47 11.394 -12.937 -1.210 1.00 1.97 H new ATOM 0 HB2 PRO B 47 12.520 -14.932 -2.630 1.00 2.45 H new ATOM 0 HB3 PRO B 47 10.994 -15.244 -1.828 1.00 2.45 H new ATOM 0 HG2 PRO B 47 11.491 -14.629 -4.771 1.00 2.47 H new ATOM 0 HG3 PRO B 47 10.362 -15.775 -4.076 1.00 2.47 H new ATOM 0 HD2 PRO B 47 9.652 -13.185 -4.894 1.00 2.47 H new ATOM 0 HD3 PRO B 47 8.721 -14.138 -3.755 1.00 2.47 H new ATOM 2390 N HIS B 48 12.315 -12.081 -4.274 1.00 1.52 N ATOM 2391 CA HIS B 48 13.322 -11.455 -5.116 1.00 1.40 C ATOM 2392 C HIS B 48 13.156 -9.936 -5.104 1.00 1.22 C ATOM 2393 O HIS B 48 14.151 -9.221 -5.211 1.00 1.64 O ATOM 2394 CB HIS B 48 13.195 -12.019 -6.541 1.00 1.38 C ATOM 2395 CG HIS B 48 14.289 -11.617 -7.507 1.00 1.49 C ATOM 2396 ND1 HIS B 48 15.105 -10.510 -7.419 1.00 2.07 N ATOM 2397 CD2 HIS B 48 14.617 -12.274 -8.663 1.00 2.62 C ATOM 2398 CE1 HIS B 48 15.909 -10.508 -8.496 1.00 2.06 C ATOM 2399 NE2 HIS B 48 15.652 -11.565 -9.283 1.00 2.37 N ATOM 0 H HIS B 48 11.469 -12.326 -4.788 1.00 1.52 H new ATOM 0 HA HIS B 48 14.318 -11.677 -4.733 1.00 1.40 H new ATOM 0 HB2 HIS B 48 13.171 -13.107 -6.480 1.00 1.38 H new ATOM 0 HB3 HIS B 48 12.237 -11.702 -6.953 1.00 1.38 H new ATOM 0 HD1 HIS B 48 15.100 -9.817 -6.671 1.00 2.07 H new ATOM 0 HD2 HIS B 48 14.158 -13.180 -9.031 1.00 2.62 H new ATOM 0 HE1 HIS B 48 16.659 -9.759 -8.700 1.00 2.06 H new ATOM 2407 N LEU B 49 11.911 -9.453 -5.045 1.00 1.19 N ATOM 2408 CA LEU B 49 11.575 -8.043 -5.181 1.00 0.98 C ATOM 2409 C LEU B 49 12.525 -7.098 -4.430 1.00 0.99 C ATOM 2410 O LEU B 49 13.200 -6.281 -5.053 1.00 1.16 O ATOM 2411 CB LEU B 49 10.122 -7.855 -4.732 1.00 0.82 C ATOM 2412 CG LEU B 49 9.485 -6.548 -5.214 1.00 0.72 C ATOM 2413 CD1 LEU B 49 9.459 -6.489 -6.745 1.00 0.75 C ATOM 2414 CD2 LEU B 49 8.035 -6.496 -4.733 1.00 0.81 C ATOM 0 H LEU B 49 11.096 -10.048 -4.898 1.00 1.19 H new ATOM 0 HA LEU B 49 11.693 -7.767 -6.229 1.00 0.98 H new ATOM 0 HB2 LEU B 49 9.528 -8.693 -5.097 1.00 0.82 H new ATOM 0 HB3 LEU B 49 10.082 -7.887 -3.643 1.00 0.82 H new ATOM 0 HG LEU B 49 10.070 -5.717 -4.820 1.00 0.72 H new ATOM 0 HD11 LEU B 49 9.002 -5.552 -7.065 1.00 0.75 H new ATOM 0 HD12 LEU B 49 10.478 -6.546 -7.129 1.00 0.75 H new ATOM 0 HD13 LEU B 49 8.878 -7.327 -7.132 1.00 0.75 H new ATOM 0 HD21 LEU B 49 7.572 -5.569 -5.071 1.00 0.81 H new ATOM 0 HD22 LEU B 49 7.486 -7.345 -5.140 1.00 0.81 H new ATOM 0 HD23 LEU B 49 8.011 -6.537 -3.644 1.00 0.81 H new ATOM 2426 N LEU B 50 12.569 -7.198 -3.096 1.00 0.94 N ATOM 2427 CA LEU B 50 13.499 -6.428 -2.275 1.00 0.99 C ATOM 2428 C LEU B 50 14.847 -7.137 -2.237 1.00 1.00 C ATOM 2429 O LEU B 50 14.953 -8.328 -2.518 1.00 2.04 O ATOM 2430 CB LEU B 50 12.970 -6.237 -0.840 1.00 1.25 C ATOM 2431 CG LEU B 50 11.910 -5.133 -0.697 1.00 0.92 C ATOM 2432 CD1 LEU B 50 11.293 -5.200 0.707 1.00 1.32 C ATOM 2433 CD2 LEU B 50 12.509 -3.731 -0.866 1.00 0.97 C ATOM 0 H LEU B 50 11.960 -7.816 -2.560 1.00 0.94 H new ATOM 0 HA LEU B 50 13.607 -5.440 -2.723 1.00 0.99 H new ATOM 0 HB2 LEU B 50 12.545 -7.179 -0.494 1.00 1.25 H new ATOM 0 HB3 LEU B 50 13.809 -6.006 -0.184 1.00 1.25 H new ATOM 0 HG LEU B 50 11.167 -5.300 -1.477 1.00 0.92 H new ATOM 0 HD11 LEU B 50 10.541 -4.418 0.812 1.00 1.32 H new ATOM 0 HD12 LEU B 50 10.827 -6.174 0.853 1.00 1.32 H new ATOM 0 HD13 LEU B 50 12.073 -5.055 1.454 1.00 1.32 H new ATOM 0 HD21 LEU B 50 11.723 -2.984 -0.757 1.00 0.97 H new ATOM 0 HD22 LEU B 50 13.273 -3.568 -0.106 1.00 0.97 H new ATOM 0 HD23 LEU B 50 12.957 -3.644 -1.856 1.00 0.97 H new ATOM 2445 N LYS B 51 15.880 -6.395 -1.841 1.00 1.05 N ATOM 2446 CA LYS B 51 17.237 -6.878 -1.700 1.00 1.18 C ATOM 2447 C LYS B 51 17.850 -6.209 -0.477 1.00 1.26 C ATOM 2448 O LYS B 51 17.409 -5.130 -0.085 1.00 1.94 O ATOM 2449 CB LYS B 51 18.046 -6.637 -2.986 1.00 1.48 C ATOM 2450 CG LYS B 51 18.333 -5.170 -3.346 1.00 1.83 C ATOM 2451 CD LYS B 51 17.062 -4.341 -3.586 1.00 3.00 C ATOM 2452 CE LYS B 51 17.356 -3.109 -4.447 1.00 3.89 C ATOM 2453 NZ LYS B 51 16.131 -2.347 -4.752 1.00 5.59 N ATOM 0 H LYS B 51 15.783 -5.408 -1.603 1.00 1.05 H new ATOM 0 HA LYS B 51 17.248 -7.957 -1.549 1.00 1.18 H new ATOM 0 HB2 LYS B 51 18.998 -7.159 -2.894 1.00 1.48 H new ATOM 0 HB3 LYS B 51 17.511 -7.095 -3.818 1.00 1.48 H new ATOM 0 HG2 LYS B 51 18.910 -4.713 -2.542 1.00 1.83 H new ATOM 0 HG3 LYS B 51 18.953 -5.138 -4.242 1.00 1.83 H new ATOM 0 HD2 LYS B 51 16.309 -4.959 -4.076 1.00 3.00 H new ATOM 0 HD3 LYS B 51 16.644 -4.028 -2.630 1.00 3.00 H new ATOM 0 HE2 LYS B 51 18.065 -2.464 -3.928 1.00 3.89 H new ATOM 0 HE3 LYS B 51 17.831 -3.421 -5.377 1.00 3.89 H new ATOM 0 HZ1 LYS B 51 16.295 -1.743 -5.583 1.00 5.59 H new ATOM 0 HZ2 LYS B 51 15.352 -3.007 -4.952 1.00 5.59 H new ATOM 0 HZ3 LYS B 51 15.880 -1.753 -3.936 1.00 5.59 H new ATOM 2467 N ASP B 52 18.834 -6.892 0.111 1.00 1.20 N ATOM 2468 CA ASP B 52 19.373 -6.659 1.439 1.00 1.27 C ATOM 2469 C ASP B 52 18.313 -6.986 2.481 1.00 1.07 C ATOM 2470 O ASP B 52 17.630 -6.121 3.025 1.00 1.39 O ATOM 2471 CB ASP B 52 20.009 -5.283 1.661 1.00 1.69 C ATOM 2472 CG ASP B 52 20.493 -5.176 3.106 1.00 2.72 C ATOM 2473 OD1 ASP B 52 20.774 -6.242 3.707 1.00 3.75 O ATOM 2474 OD2 ASP B 52 20.551 -4.036 3.605 1.00 3.24 O ATOM 0 H ASP B 52 19.299 -7.667 -0.361 1.00 1.20 H new ATOM 0 HA ASP B 52 20.219 -7.337 1.549 1.00 1.27 H new ATOM 0 HB2 ASP B 52 20.844 -5.141 0.975 1.00 1.69 H new ATOM 0 HB3 ASP B 52 19.285 -4.497 1.449 1.00 1.69 H new ATOM 2479 N VAL B 53 18.225 -8.283 2.767 1.00 1.08 N ATOM 2480 CA VAL B 53 17.568 -8.799 3.949 1.00 1.22 C ATOM 2481 C VAL B 53 18.605 -8.999 5.066 1.00 1.62 C ATOM 2482 O VAL B 53 18.305 -9.615 6.091 1.00 1.93 O ATOM 2483 CB VAL B 53 16.811 -10.085 3.581 1.00 1.15 C ATOM 2484 CG1 VAL B 53 15.730 -9.799 2.528 1.00 1.32 C ATOM 2485 CG2 VAL B 53 17.729 -11.211 3.083 1.00 1.56 C ATOM 0 H VAL B 53 18.617 -9.011 2.169 1.00 1.08 H new ATOM 0 HA VAL B 53 16.831 -8.092 4.331 1.00 1.22 H new ATOM 0 HB VAL B 53 16.348 -10.432 4.504 1.00 1.15 H new ATOM 0 HG11 VAL B 53 15.207 -10.724 2.283 1.00 1.32 H new ATOM 0 HG12 VAL B 53 15.019 -9.074 2.924 1.00 1.32 H new ATOM 0 HG13 VAL B 53 16.196 -9.396 1.629 1.00 1.32 H new ATOM 0 HG21 VAL B 53 17.130 -12.089 2.841 1.00 1.56 H new ATOM 0 HG22 VAL B 53 18.262 -10.879 2.192 1.00 1.56 H new ATOM 0 HG23 VAL B 53 18.448 -11.466 3.862 1.00 1.56 H new ATOM 2495 N GLY B 54 19.828 -8.479 4.900 1.00 1.94 N ATOM 2496 CA GLY B 54 20.840 -8.515 5.932 1.00 2.51 C ATOM 2497 C GLY B 54 20.541 -7.364 6.877 1.00 2.23 C ATOM 2498 O GLY B 54 20.027 -7.588 7.977 1.00 2.49 O ATOM 0 H GLY B 54 20.132 -8.023 4.040 1.00 1.94 H new ATOM 0 HA2 GLY B 54 20.818 -9.467 6.462 1.00 2.51 H new ATOM 0 HA3 GLY B 54 21.836 -8.413 5.501 1.00 2.51 H new ATOM 2502 N SER B 55 20.779 -6.136 6.404 1.00 1.85 N ATOM 2503 CA SER B 55 20.575 -4.906 7.157 1.00 1.68 C ATOM 2504 C SER B 55 19.092 -4.527 7.132 1.00 1.31 C ATOM 2505 O SER B 55 18.685 -3.425 6.762 1.00 1.29 O ATOM 2506 CB SER B 55 21.496 -3.791 6.631 1.00 1.93 C ATOM 2507 OG SER B 55 21.991 -3.009 7.703 1.00 3.06 O ATOM 0 H SER B 55 21.128 -5.972 5.460 1.00 1.85 H new ATOM 0 HA SER B 55 20.850 -5.058 8.201 1.00 1.68 H new ATOM 0 HB2 SER B 55 22.327 -4.229 6.078 1.00 1.93 H new ATOM 0 HB3 SER B 55 20.948 -3.157 5.934 1.00 1.93 H new ATOM 0 HG SER B 55 21.275 -2.855 8.354 1.00 3.06 H new ATOM 2513 N LEU B 56 18.259 -5.473 7.563 1.00 1.18 N ATOM 2514 CA LEU B 56 16.837 -5.300 7.696 1.00 0.96 C ATOM 2515 C LEU B 56 16.569 -4.171 8.697 1.00 0.86 C ATOM 2516 O LEU B 56 15.642 -3.384 8.513 1.00 0.81 O ATOM 2517 CB LEU B 56 16.275 -6.672 8.086 1.00 0.98 C ATOM 2518 CG LEU B 56 14.750 -6.789 8.154 1.00 0.89 C ATOM 2519 CD1 LEU B 56 14.224 -6.316 9.507 1.00 0.92 C ATOM 2520 CD2 LEU B 56 14.067 -6.074 6.990 1.00 0.90 C ATOM 0 H LEU B 56 18.577 -6.404 7.834 1.00 1.18 H new ATOM 0 HA LEU B 56 16.335 -4.987 6.780 1.00 0.96 H new ATOM 0 HB2 LEU B 56 16.642 -7.408 7.370 1.00 0.98 H new ATOM 0 HB3 LEU B 56 16.682 -6.944 9.060 1.00 0.98 H new ATOM 0 HG LEU B 56 14.497 -7.845 8.056 1.00 0.89 H new ATOM 0 HD11 LEU B 56 13.138 -6.410 9.528 1.00 0.92 H new ATOM 0 HD12 LEU B 56 14.657 -6.927 10.299 1.00 0.92 H new ATOM 0 HD13 LEU B 56 14.501 -5.273 9.661 1.00 0.92 H new ATOM 0 HD21 LEU B 56 12.986 -6.183 7.080 1.00 0.90 H new ATOM 0 HD22 LEU B 56 14.327 -5.016 7.010 1.00 0.90 H new ATOM 0 HD23 LEU B 56 14.399 -6.512 6.049 1.00 0.90 H new ATOM 2532 N ASP B 57 17.429 -4.057 9.714 1.00 1.00 N ATOM 2533 CA ASP B 57 17.459 -2.964 10.674 1.00 1.08 C ATOM 2534 C ASP B 57 17.320 -1.595 9.994 1.00 0.99 C ATOM 2535 O ASP B 57 16.548 -0.762 10.457 1.00 1.03 O ATOM 2536 CB ASP B 57 18.747 -3.042 11.507 1.00 1.44 C ATOM 2537 CG ASP B 57 19.949 -2.511 10.742 1.00 2.84 C ATOM 2538 OD1 ASP B 57 20.135 -2.969 9.594 1.00 3.39 O ATOM 2539 OD2 ASP B 57 20.576 -1.562 11.260 1.00 4.24 O ATOM 0 H ASP B 57 18.150 -4.756 9.893 1.00 1.00 H new ATOM 0 HA ASP B 57 16.600 -3.070 11.336 1.00 1.08 H new ATOM 0 HB2 ASP B 57 18.620 -2.470 12.426 1.00 1.44 H new ATOM 0 HB3 ASP B 57 18.930 -4.077 11.798 1.00 1.44 H new ATOM 2544 N GLU B 58 18.058 -1.341 8.907 1.00 1.00 N ATOM 2545 CA GLU B 58 17.958 -0.097 8.157 1.00 1.05 C ATOM 2546 C GLU B 58 16.513 0.141 7.719 1.00 0.93 C ATOM 2547 O GLU B 58 15.972 1.233 7.907 1.00 1.06 O ATOM 2548 CB GLU B 58 18.922 -0.101 6.963 1.00 1.18 C ATOM 2549 CG GLU B 58 18.786 1.200 6.160 1.00 1.63 C ATOM 2550 CD GLU B 58 19.652 1.190 4.910 1.00 1.75 C ATOM 2551 OE1 GLU B 58 19.162 0.636 3.900 1.00 1.88 O ATOM 2552 OE2 GLU B 58 20.772 1.732 4.983 1.00 2.67 O ATOM 0 H GLU B 58 18.740 -1.997 8.527 1.00 1.00 H new ATOM 0 HA GLU B 58 18.251 0.729 8.805 1.00 1.05 H new ATOM 0 HB2 GLU B 58 19.947 -0.212 7.316 1.00 1.18 H new ATOM 0 HB3 GLU B 58 18.711 -0.956 6.320 1.00 1.18 H new ATOM 0 HG2 GLU B 58 17.743 1.345 5.878 1.00 1.63 H new ATOM 0 HG3 GLU B 58 19.066 2.045 6.789 1.00 1.63 H new ATOM 2559 N LYS B 59 15.882 -0.884 7.137 1.00 0.76 N ATOM 2560 CA LYS B 59 14.491 -0.765 6.741 1.00 0.69 C ATOM 2561 C LYS B 59 13.682 -0.444 8.003 1.00 0.71 C ATOM 2562 O LYS B 59 12.938 0.530 8.036 1.00 0.78 O ATOM 2563 CB LYS B 59 13.960 -2.039 6.060 1.00 0.69 C ATOM 2564 CG LYS B 59 14.883 -2.848 5.130 1.00 1.80 C ATOM 2565 CD LYS B 59 15.397 -2.167 3.851 1.00 1.60 C ATOM 2566 CE LYS B 59 16.680 -1.368 4.138 1.00 2.48 C ATOM 2567 NZ LYS B 59 17.522 -1.162 2.944 1.00 3.38 N ATOM 0 H LYS B 59 16.311 -1.787 6.936 1.00 0.76 H new ATOM 0 HA LYS B 59 14.394 0.029 6.000 1.00 0.69 H new ATOM 0 HB2 LYS B 59 13.620 -2.712 6.847 1.00 0.69 H new ATOM 0 HB3 LYS B 59 13.081 -1.756 5.481 1.00 0.69 H new ATOM 0 HG2 LYS B 59 15.749 -3.163 5.711 1.00 1.80 H new ATOM 0 HG3 LYS B 59 14.351 -3.752 4.836 1.00 1.80 H new ATOM 0 HD2 LYS B 59 15.594 -2.919 3.087 1.00 1.60 H new ATOM 0 HD3 LYS B 59 14.630 -1.502 3.454 1.00 1.60 H new ATOM 0 HE2 LYS B 59 16.409 -0.398 4.554 1.00 2.48 H new ATOM 0 HE3 LYS B 59 17.262 -1.890 4.898 1.00 2.48 H new ATOM 0 HZ1 LYS B 59 18.369 -0.618 3.206 1.00 3.38 H new ATOM 0 HZ2 LYS B 59 17.809 -2.084 2.558 1.00 3.38 H new ATOM 0 HZ3 LYS B 59 16.983 -0.638 2.225 1.00 3.38 H new ATOM 2581 N MET B 60 13.872 -1.256 9.049 1.00 0.79 N ATOM 2582 CA MET B 60 13.128 -1.189 10.302 1.00 0.89 C ATOM 2583 C MET B 60 13.123 0.240 10.837 1.00 0.93 C ATOM 2584 O MET B 60 12.064 0.851 10.946 1.00 0.98 O ATOM 2585 CB MET B 60 13.704 -2.203 11.308 1.00 1.09 C ATOM 2586 CG MET B 60 12.765 -2.509 12.485 1.00 0.99 C ATOM 2587 SD MET B 60 12.431 -1.179 13.674 1.00 1.89 S ATOM 2588 CE MET B 60 14.068 -0.917 14.390 1.00 2.89 C ATOM 0 H MET B 60 14.570 -1.999 9.042 1.00 0.79 H new ATOM 0 HA MET B 60 12.087 -1.463 10.131 1.00 0.89 H new ATOM 0 HB2 MET B 60 13.930 -3.132 10.784 1.00 1.09 H new ATOM 0 HB3 MET B 60 14.647 -1.819 11.698 1.00 1.09 H new ATOM 0 HG2 MET B 60 11.810 -2.838 12.074 1.00 0.99 H new ATOM 0 HG3 MET B 60 13.183 -3.352 13.035 1.00 0.99 H new ATOM 0 HE1 MET B 60 13.993 -0.217 15.222 1.00 2.89 H new ATOM 0 HE2 MET B 60 14.464 -1.867 14.749 1.00 2.89 H new ATOM 0 HE3 MET B 60 14.736 -0.509 13.631 1.00 2.89 H new ATOM 2598 N LYS B 61 14.303 0.795 11.120 1.00 0.99 N ATOM 2599 CA LYS B 61 14.411 2.114 11.721 1.00 1.07 C ATOM 2600 C LYS B 61 13.756 3.186 10.848 1.00 1.07 C ATOM 2601 O LYS B 61 13.152 4.118 11.380 1.00 1.18 O ATOM 2602 CB LYS B 61 15.871 2.440 12.086 1.00 1.22 C ATOM 2603 CG LYS B 61 16.786 2.590 10.861 1.00 2.86 C ATOM 2604 CD LYS B 61 18.273 2.728 11.224 1.00 3.11 C ATOM 2605 CE LYS B 61 18.867 1.430 11.807 1.00 3.22 C ATOM 2606 NZ LYS B 61 20.053 0.953 11.061 1.00 4.98 N ATOM 0 H LYS B 61 15.199 0.343 10.939 1.00 0.99 H new ATOM 0 HA LYS B 61 13.853 2.108 12.657 1.00 1.07 H new ATOM 0 HB2 LYS B 61 15.896 3.364 12.664 1.00 1.22 H new ATOM 0 HB3 LYS B 61 16.262 1.651 12.728 1.00 1.22 H new ATOM 0 HG2 LYS B 61 16.657 1.724 10.212 1.00 2.86 H new ATOM 0 HG3 LYS B 61 16.476 3.465 10.290 1.00 2.86 H new ATOM 0 HD2 LYS B 61 18.835 3.012 10.334 1.00 3.11 H new ATOM 0 HD3 LYS B 61 18.393 3.534 11.948 1.00 3.11 H new ATOM 0 HE2 LYS B 61 19.142 1.598 12.848 1.00 3.22 H new ATOM 0 HE3 LYS B 61 18.103 0.652 11.801 1.00 3.22 H new ATOM 0 HZ1 LYS B 61 19.983 -0.075 10.919 1.00 4.98 H new ATOM 0 HZ2 LYS B 61 20.096 1.428 10.137 1.00 4.98 H new ATOM 0 HZ3 LYS B 61 20.914 1.170 11.602 1.00 4.98 H new ATOM 2620 N SER B 62 13.882 3.044 9.522 1.00 1.01 N ATOM 2621 CA SER B 62 13.295 3.955 8.546 1.00 1.10 C ATOM 2622 C SER B 62 11.766 3.844 8.528 1.00 1.08 C ATOM 2623 O SER B 62 11.074 4.847 8.353 1.00 1.22 O ATOM 2624 CB SER B 62 13.889 3.667 7.160 1.00 1.15 C ATOM 2625 OG SER B 62 13.461 4.643 6.229 1.00 1.70 O ATOM 0 H SER B 62 14.404 2.278 9.096 1.00 1.01 H new ATOM 0 HA SER B 62 13.536 4.979 8.830 1.00 1.10 H new ATOM 0 HB2 SER B 62 14.977 3.662 7.217 1.00 1.15 H new ATOM 0 HB3 SER B 62 13.583 2.676 6.825 1.00 1.15 H new ATOM 0 HG SER B 62 13.848 4.449 5.350 1.00 1.70 H new ATOM 2631 N LEU B 63 11.231 2.631 8.672 1.00 0.97 N ATOM 2632 CA LEU B 63 9.800 2.359 8.662 1.00 0.99 C ATOM 2633 C LEU B 63 9.166 2.843 9.969 1.00 1.00 C ATOM 2634 O LEU B 63 8.209 3.612 9.961 1.00 1.08 O ATOM 2635 CB LEU B 63 9.565 0.850 8.497 1.00 0.96 C ATOM 2636 CG LEU B 63 9.977 0.278 7.131 1.00 1.14 C ATOM 2637 CD1 LEU B 63 10.227 -1.228 7.252 1.00 1.05 C ATOM 2638 CD2 LEU B 63 8.884 0.498 6.092 1.00 1.53 C ATOM 0 H LEU B 63 11.798 1.793 8.802 1.00 0.97 H new ATOM 0 HA LEU B 63 9.340 2.890 7.828 1.00 0.99 H new ATOM 0 HB2 LEU B 63 10.116 0.324 9.276 1.00 0.96 H new ATOM 0 HB3 LEU B 63 8.507 0.642 8.658 1.00 0.96 H new ATOM 0 HG LEU B 63 10.884 0.793 6.815 1.00 1.14 H new ATOM 0 HD11 LEU B 63 10.519 -1.628 6.281 1.00 1.05 H new ATOM 0 HD12 LEU B 63 11.025 -1.408 7.973 1.00 1.05 H new ATOM 0 HD13 LEU B 63 9.316 -1.722 7.589 1.00 1.05 H new ATOM 0 HD21 LEU B 63 9.202 0.084 5.136 1.00 1.53 H new ATOM 0 HD22 LEU B 63 7.969 0.002 6.416 1.00 1.53 H new ATOM 0 HD23 LEU B 63 8.698 1.566 5.981 1.00 1.53 H new ATOM 2650 N ASP B 64 9.720 2.371 11.088 1.00 0.96 N ATOM 2651 CA ASP B 64 9.187 2.422 12.445 1.00 1.02 C ATOM 2652 C ASP B 64 8.987 3.816 13.041 1.00 1.13 C ATOM 2653 O ASP B 64 8.489 3.903 14.155 1.00 1.21 O ATOM 2654 CB ASP B 64 9.971 1.494 13.387 1.00 1.00 C ATOM 2655 CG ASP B 64 9.203 1.207 14.673 1.00 1.16 C ATOM 2656 OD1 ASP B 64 7.960 1.095 14.587 1.00 2.38 O ATOM 2657 OD2 ASP B 64 9.829 1.130 15.751 1.00 2.53 O ATOM 0 H ASP B 64 10.627 1.906 11.063 1.00 0.96 H new ATOM 0 HA ASP B 64 8.168 2.048 12.346 1.00 1.02 H new ATOM 0 HB2 ASP B 64 10.186 0.556 12.876 1.00 1.00 H new ATOM 0 HB3 ASP B 64 10.930 1.951 13.631 1.00 1.00 H new ATOM 2662 N VAL B 65 9.489 4.876 12.398 1.00 1.19 N ATOM 2663 CA VAL B 65 10.252 6.011 12.929 1.00 1.29 C ATOM 2664 C VAL B 65 9.945 6.531 14.343 1.00 1.41 C ATOM 2665 O VAL B 65 10.846 7.104 14.951 1.00 1.56 O ATOM 2666 CB VAL B 65 10.148 7.193 11.943 1.00 1.42 C ATOM 2667 CG1 VAL B 65 10.635 6.810 10.545 1.00 1.59 C ATOM 2668 CG2 VAL B 65 8.717 7.739 11.829 1.00 1.67 C ATOM 0 H VAL B 65 9.358 4.969 11.391 1.00 1.19 H new ATOM 0 HA VAL B 65 11.252 5.591 13.032 1.00 1.29 H new ATOM 0 HB VAL B 65 10.791 7.971 12.354 1.00 1.42 H new ATOM 0 HG11 VAL B 65 10.546 7.669 9.880 1.00 1.59 H new ATOM 0 HG12 VAL B 65 11.678 6.498 10.596 1.00 1.59 H new ATOM 0 HG13 VAL B 65 10.029 5.990 10.161 1.00 1.59 H new ATOM 0 HG21 VAL B 65 8.699 8.569 11.123 1.00 1.67 H new ATOM 0 HG22 VAL B 65 8.053 6.949 11.477 1.00 1.67 H new ATOM 0 HG23 VAL B 65 8.381 8.087 12.806 1.00 1.67 H new ATOM 2678 N ASN B 66 8.743 6.339 14.900 1.00 1.44 N ATOM 2679 CA ASN B 66 8.528 6.530 16.334 1.00 1.56 C ATOM 2680 C ASN B 66 9.503 5.676 17.158 1.00 1.55 C ATOM 2681 O ASN B 66 9.867 6.064 18.264 1.00 1.79 O ATOM 2682 CB ASN B 66 7.062 6.300 16.735 1.00 1.66 C ATOM 2683 CG ASN B 66 6.731 4.861 17.138 1.00 1.89 C ATOM 2684 OD1 ASN B 66 7.204 3.891 16.550 1.00 1.92 O ATOM 2685 ND2 ASN B 66 5.890 4.681 18.148 1.00 2.85 N ATOM 0 H ASN B 66 7.912 6.054 14.382 1.00 1.44 H new ATOM 0 HA ASN B 66 8.743 7.574 16.563 1.00 1.56 H new ATOM 0 HB2 ASN B 66 6.818 6.962 17.566 1.00 1.66 H new ATOM 0 HB3 ASN B 66 6.421 6.587 15.901 1.00 1.66 H new ATOM 0 HD21 ASN B 66 5.635 3.737 18.437 1.00 2.85 H new ATOM 0 HD22 ASN B 66 5.498 5.487 18.635 1.00 2.85 H new ATOM 2692 N GLN B 67 9.955 4.548 16.594 1.00 1.39 N ATOM 2693 CA GLN B 67 11.103 3.789 17.070 1.00 1.53 C ATOM 2694 C GLN B 67 10.748 3.022 18.352 1.00 1.54 C ATOM 2695 O GLN B 67 11.341 3.235 19.409 1.00 1.62 O ATOM 2696 CB GLN B 67 12.329 4.722 17.195 1.00 1.91 C ATOM 2697 CG GLN B 67 13.638 4.043 16.774 1.00 2.33 C ATOM 2698 CD GLN B 67 13.698 3.651 15.295 1.00 2.54 C ATOM 2699 OE1 GLN B 67 14.229 2.595 14.970 1.00 3.04 O ATOM 2700 NE2 GLN B 67 13.180 4.484 14.389 1.00 3.61 N ATOM 0 H GLN B 67 9.516 4.133 15.772 1.00 1.39 H new ATOM 0 HA GLN B 67 11.381 3.022 16.347 1.00 1.53 H new ATOM 0 HB2 GLN B 67 12.170 5.608 16.580 1.00 1.91 H new ATOM 0 HB3 GLN B 67 12.417 5.062 18.227 1.00 1.91 H new ATOM 0 HG2 GLN B 67 14.469 4.714 16.994 1.00 2.33 H new ATOM 0 HG3 GLN B 67 13.781 3.149 17.381 1.00 2.33 H new ATOM 0 HE21 GLN B 67 12.744 5.356 14.688 1.00 3.61 H new ATOM 0 HE22 GLN B 67 13.220 4.248 13.397 1.00 3.61 H new ATOM 2709 N ASP B 68 9.770 2.121 18.240 1.00 1.60 N ATOM 2710 CA ASP B 68 9.218 1.309 19.326 1.00 1.57 C ATOM 2711 C ASP B 68 9.425 -0.201 19.100 1.00 1.45 C ATOM 2712 O ASP B 68 9.292 -0.970 20.050 1.00 1.91 O ATOM 2713 CB ASP B 68 7.729 1.655 19.551 1.00 1.61 C ATOM 2714 CG ASP B 68 6.879 1.400 18.323 1.00 1.46 C ATOM 2715 OD1 ASP B 68 7.343 0.713 17.399 1.00 1.62 O ATOM 2716 OD2 ASP B 68 5.827 2.035 18.094 1.00 1.56 O ATOM 0 H ASP B 68 9.319 1.928 17.345 1.00 1.60 H new ATOM 0 HA ASP B 68 9.770 1.555 20.233 1.00 1.57 H new ATOM 0 HB2 ASP B 68 7.345 1.065 20.383 1.00 1.61 H new ATOM 0 HB3 ASP B 68 7.643 2.703 19.837 1.00 1.61 H new ATOM 2721 N SER B 69 9.747 -0.652 17.880 1.00 1.37 N ATOM 2722 CA SER B 69 9.837 -2.069 17.523 1.00 1.17 C ATOM 2723 C SER B 69 8.456 -2.754 17.504 1.00 0.99 C ATOM 2724 O SER B 69 8.360 -3.981 17.557 1.00 1.06 O ATOM 2725 CB SER B 69 10.856 -2.802 18.413 1.00 1.38 C ATOM 2726 OG SER B 69 11.429 -3.905 17.731 1.00 2.58 O ATOM 0 H SER B 69 9.956 -0.028 17.101 1.00 1.37 H new ATOM 0 HA SER B 69 10.210 -2.129 16.500 1.00 1.17 H new ATOM 0 HB2 SER B 69 11.642 -2.110 18.717 1.00 1.38 H new ATOM 0 HB3 SER B 69 10.366 -3.148 19.323 1.00 1.38 H new ATOM 0 HG SER B 69 12.074 -4.353 18.317 1.00 2.58 H new ATOM 2732 N GLU B 70 7.389 -1.966 17.365 1.00 1.05 N ATOM 2733 CA GLU B 70 6.083 -2.391 16.897 1.00 1.07 C ATOM 2734 C GLU B 70 5.773 -1.536 15.672 1.00 1.07 C ATOM 2735 O GLU B 70 5.356 -0.378 15.792 1.00 1.07 O ATOM 2736 CB GLU B 70 5.003 -2.222 17.979 1.00 1.24 C ATOM 2737 CG GLU B 70 4.940 -3.417 18.947 1.00 1.45 C ATOM 2738 CD GLU B 70 3.524 -3.655 19.464 1.00 2.03 C ATOM 2739 OE1 GLU B 70 2.855 -2.655 19.795 1.00 3.12 O ATOM 2740 OE2 GLU B 70 3.099 -4.833 19.438 1.00 2.89 O ATOM 0 H GLU B 70 7.420 -0.971 17.587 1.00 1.05 H new ATOM 0 HA GLU B 70 6.089 -3.453 16.651 1.00 1.07 H new ATOM 0 HB2 GLU B 70 5.201 -1.311 18.545 1.00 1.24 H new ATOM 0 HB3 GLU B 70 4.032 -2.096 17.501 1.00 1.24 H new ATOM 0 HG2 GLU B 70 5.297 -4.314 18.441 1.00 1.45 H new ATOM 0 HG3 GLU B 70 5.609 -3.238 19.789 1.00 1.45 H new ATOM 2747 N LEU B 71 5.987 -2.107 14.488 1.00 1.16 N ATOM 2748 CA LEU B 71 5.594 -1.508 13.228 1.00 1.16 C ATOM 2749 C LEU B 71 4.066 -1.601 13.175 1.00 1.20 C ATOM 2750 O LEU B 71 3.539 -2.669 12.870 1.00 1.21 O ATOM 2751 CB LEU B 71 6.225 -2.271 12.053 1.00 1.11 C ATOM 2752 CG LEU B 71 7.751 -2.163 11.852 1.00 1.03 C ATOM 2753 CD1 LEU B 71 8.079 -0.908 11.043 1.00 1.08 C ATOM 2754 CD2 LEU B 71 8.603 -2.183 13.129 1.00 1.15 C ATOM 0 H LEU B 71 6.446 -3.012 14.383 1.00 1.16 H new ATOM 0 HA LEU B 71 5.930 -0.474 13.153 1.00 1.16 H new ATOM 0 HB2 LEU B 71 5.978 -3.326 12.170 1.00 1.11 H new ATOM 0 HB3 LEU B 71 5.743 -1.930 11.137 1.00 1.11 H new ATOM 0 HG LEU B 71 8.022 -3.074 11.318 1.00 1.03 H new ATOM 0 HD11 LEU B 71 9.158 -0.836 10.904 1.00 1.08 H new ATOM 0 HD12 LEU B 71 7.591 -0.964 10.070 1.00 1.08 H new ATOM 0 HD13 LEU B 71 7.723 -0.027 11.577 1.00 1.08 H new ATOM 0 HD21 LEU B 71 9.657 -2.101 12.864 1.00 1.15 H new ATOM 0 HD22 LEU B 71 8.323 -1.344 13.767 1.00 1.15 H new ATOM 0 HD23 LEU B 71 8.435 -3.118 13.664 1.00 1.15 H new ATOM 2766 N LYS B 72 3.351 -0.527 13.524 1.00 1.24 N ATOM 2767 CA LYS B 72 1.887 -0.509 13.517 1.00 1.27 C ATOM 2768 C LYS B 72 1.362 -0.181 12.117 1.00 1.42 C ATOM 2769 O LYS B 72 2.133 0.134 11.209 1.00 1.47 O ATOM 2770 CB LYS B 72 1.321 0.432 14.600 1.00 1.26 C ATOM 2771 CG LYS B 72 1.905 1.850 14.555 1.00 2.44 C ATOM 2772 CD LYS B 72 1.201 2.843 15.490 1.00 2.95 C ATOM 2773 CE LYS B 72 -0.165 3.300 14.957 1.00 3.46 C ATOM 2774 NZ LYS B 72 -0.757 4.354 15.809 1.00 4.62 N ATOM 0 H LYS B 72 3.772 0.354 13.819 1.00 1.24 H new ATOM 0 HA LYS B 72 1.531 -1.507 13.772 1.00 1.27 H new ATOM 0 HB2 LYS B 72 0.238 0.491 14.487 1.00 1.26 H new ATOM 0 HB3 LYS B 72 1.516 -0.000 15.582 1.00 1.26 H new ATOM 0 HG2 LYS B 72 2.962 1.805 14.818 1.00 2.44 H new ATOM 0 HG3 LYS B 72 1.846 2.224 13.533 1.00 2.44 H new ATOM 0 HD2 LYS B 72 1.068 2.381 16.468 1.00 2.95 H new ATOM 0 HD3 LYS B 72 1.840 3.715 15.633 1.00 2.95 H new ATOM 0 HE2 LYS B 72 -0.052 3.674 13.940 1.00 3.46 H new ATOM 0 HE3 LYS B 72 -0.842 2.447 14.910 1.00 3.46 H new ATOM 0 HZ1 LYS B 72 -1.678 4.639 15.419 1.00 4.62 H new ATOM 0 HZ2 LYS B 72 -0.887 3.988 16.774 1.00 4.62 H new ATOM 0 HZ3 LYS B 72 -0.122 5.178 15.834 1.00 4.62 H new ATOM 2788 N PHE B 73 0.038 -0.231 11.935 1.00 1.53 N ATOM 2789 CA PHE B 73 -0.598 -0.075 10.631 1.00 1.62 C ATOM 2790 C PHE B 73 -0.983 1.387 10.356 1.00 1.63 C ATOM 2791 O PHE B 73 -2.130 1.688 10.047 1.00 1.68 O ATOM 2792 CB PHE B 73 -1.803 -1.026 10.536 1.00 1.71 C ATOM 2793 CG PHE B 73 -2.452 -1.236 9.171 1.00 2.52 C ATOM 2794 CD1 PHE B 73 -1.903 -0.706 7.983 1.00 4.19 C ATOM 2795 CD2 PHE B 73 -3.631 -2.003 9.101 1.00 2.96 C ATOM 2796 CE1 PHE B 73 -2.529 -0.940 6.745 1.00 5.62 C ATOM 2797 CE2 PHE B 73 -4.253 -2.239 7.862 1.00 4.46 C ATOM 2798 CZ PHE B 73 -3.696 -1.717 6.686 1.00 5.62 C ATOM 0 H PHE B 73 -0.623 -0.382 12.697 1.00 1.53 H new ATOM 0 HA PHE B 73 0.115 -0.345 9.852 1.00 1.62 H new ATOM 0 HB2 PHE B 73 -1.487 -2.001 10.908 1.00 1.71 H new ATOM 0 HB3 PHE B 73 -2.571 -0.659 11.217 1.00 1.71 H new ATOM 0 HD1 PHE B 73 -0.998 -0.118 8.025 1.00 4.19 H new ATOM 0 HD2 PHE B 73 -4.060 -2.412 10.004 1.00 2.96 H new ATOM 0 HE1 PHE B 73 -2.112 -0.522 5.841 1.00 5.62 H new ATOM 0 HE2 PHE B 73 -5.160 -2.823 7.816 1.00 4.46 H new ATOM 0 HZ PHE B 73 -4.166 -1.913 5.733 1.00 5.62 H new ATOM 2808 N ASN B 74 -0.002 2.291 10.370 1.00 1.75 N ATOM 2809 CA ASN B 74 0.549 2.778 9.106 1.00 1.45 C ATOM 2810 C ASN B 74 1.955 3.341 9.385 1.00 1.47 C ATOM 2811 O ASN B 74 2.291 4.443 8.962 1.00 1.73 O ATOM 2812 CB ASN B 74 -0.405 3.851 8.524 1.00 1.56 C ATOM 2813 CG ASN B 74 -0.210 4.192 7.048 1.00 1.82 C ATOM 2814 OD1 ASN B 74 -1.180 4.155 6.293 1.00 2.26 O ATOM 2815 ND2 ASN B 74 0.986 4.566 6.624 1.00 2.30 N ATOM 0 H ASN B 74 0.415 2.689 11.211 1.00 1.75 H new ATOM 0 HA ASN B 74 0.637 1.980 8.369 1.00 1.45 H new ATOM 0 HB2 ASN B 74 -1.431 3.511 8.665 1.00 1.56 H new ATOM 0 HB3 ASN B 74 -0.289 4.765 9.106 1.00 1.56 H new ATOM 0 HD21 ASN B 74 1.121 4.833 5.649 1.00 2.30 H new ATOM 0 HD22 ASN B 74 1.773 4.587 7.272 1.00 2.30 H new ATOM 2822 N GLU B 75 2.810 2.567 10.056 1.00 1.37 N ATOM 2823 CA GLU B 75 4.243 2.527 9.846 1.00 1.31 C ATOM 2824 C GLU B 75 4.513 1.441 8.806 1.00 1.20 C ATOM 2825 O GLU B 75 4.983 1.708 7.702 1.00 1.12 O ATOM 2826 CB GLU B 75 4.938 2.232 11.179 1.00 1.32 C ATOM 2827 CG GLU B 75 4.656 3.316 12.235 1.00 1.44 C ATOM 2828 CD GLU B 75 5.024 2.826 13.621 1.00 1.31 C ATOM 2829 OE1 GLU B 75 5.007 1.608 13.874 1.00 1.37 O ATOM 2830 OE2 GLU B 75 5.349 3.600 14.538 1.00 2.32 O ATOM 0 H GLU B 75 2.502 1.928 10.789 1.00 1.37 H new ATOM 0 HA GLU B 75 4.632 3.478 9.483 1.00 1.31 H new ATOM 0 HB2 GLU B 75 4.603 1.265 11.555 1.00 1.32 H new ATOM 0 HB3 GLU B 75 6.013 2.156 11.017 1.00 1.32 H new ATOM 0 HG2 GLU B 75 5.224 4.216 12.000 1.00 1.44 H new ATOM 0 HG3 GLU B 75 3.601 3.589 12.209 1.00 1.44 H new ATOM 2837 N TYR B 76 4.156 0.203 9.179 1.00 1.23 N ATOM 2838 CA TYR B 76 4.541 -1.015 8.479 1.00 1.21 C ATOM 2839 C TYR B 76 4.208 -0.927 7.007 1.00 1.10 C ATOM 2840 O TYR B 76 5.022 -1.271 6.151 1.00 1.09 O ATOM 2841 CB TYR B 76 3.806 -2.228 9.060 1.00 1.31 C ATOM 2842 CG TYR B 76 4.326 -3.527 8.480 1.00 1.67 C ATOM 2843 CD1 TYR B 76 5.565 -4.023 8.916 1.00 3.51 C ATOM 2844 CD2 TYR B 76 3.634 -4.188 7.448 1.00 1.73 C ATOM 2845 CE1 TYR B 76 6.053 -5.233 8.409 1.00 4.31 C ATOM 2846 CE2 TYR B 76 4.126 -5.407 6.940 1.00 2.40 C ATOM 2847 CZ TYR B 76 5.329 -5.937 7.439 1.00 3.46 C ATOM 2848 OH TYR B 76 5.774 -7.161 7.045 1.00 4.46 O ATOM 0 H TYR B 76 3.576 0.025 9.999 1.00 1.23 H new ATOM 0 HA TYR B 76 5.617 -1.130 8.606 1.00 1.21 H new ATOM 0 HB2 TYR B 76 3.923 -2.240 10.144 1.00 1.31 H new ATOM 0 HB3 TYR B 76 2.739 -2.139 8.856 1.00 1.31 H new ATOM 0 HD1 TYR B 76 6.142 -3.471 9.643 1.00 3.51 H new ATOM 0 HD2 TYR B 76 2.727 -3.762 7.046 1.00 1.73 H new ATOM 0 HE1 TYR B 76 6.993 -5.626 8.768 1.00 4.31 H new ATOM 0 HE2 TYR B 76 3.581 -5.932 6.170 1.00 2.40 H new ATOM 0 HH TYR B 76 5.012 -7.716 6.778 1.00 4.46 H new ATOM 2858 N TRP B 77 2.979 -0.479 6.745 1.00 1.01 N ATOM 2859 CA TRP B 77 2.411 -0.404 5.422 1.00 0.87 C ATOM 2860 C TRP B 77 3.405 0.191 4.408 1.00 0.72 C ATOM 2861 O TRP B 77 3.479 -0.303 3.281 1.00 0.69 O ATOM 2862 CB TRP B 77 1.073 0.346 5.483 1.00 0.85 C ATOM 2863 CG TRP B 77 0.550 0.601 4.120 1.00 0.82 C ATOM 2864 CD1 TRP B 77 0.040 -0.338 3.292 1.00 2.05 C ATOM 2865 CD2 TRP B 77 0.693 1.812 3.328 1.00 1.44 C ATOM 2866 NE1 TRP B 77 -0.169 0.220 2.053 1.00 2.26 N ATOM 2867 CE2 TRP B 77 0.151 1.556 2.041 1.00 1.40 C ATOM 2868 CE3 TRP B 77 1.301 3.070 3.528 1.00 3.18 C ATOM 2869 CZ2 TRP B 77 0.088 2.536 1.049 1.00 1.94 C ATOM 2870 CZ3 TRP B 77 1.306 4.028 2.500 1.00 3.90 C ATOM 2871 CH2 TRP B 77 0.614 3.799 1.314 1.00 3.02 C ATOM 0 H TRP B 77 2.345 -0.153 7.474 1.00 1.01 H new ATOM 0 HA TRP B 77 2.206 -1.410 5.057 1.00 0.87 H new ATOM 0 HB2 TRP B 77 0.349 -0.238 6.052 1.00 0.85 H new ATOM 0 HB3 TRP B 77 1.204 1.291 6.010 1.00 0.85 H new ATOM 0 HD1 TRP B 77 -0.170 -1.363 3.561 1.00 2.05 H new ATOM 0 HE1 TRP B 77 -0.518 -0.294 1.244 1.00 2.26 H new ATOM 0 HE3 TRP B 77 1.765 3.298 4.476 1.00 3.18 H new ATOM 0 HZ2 TRP B 77 -0.361 2.319 0.091 1.00 1.94 H new ATOM 0 HZ3 TRP B 77 1.852 4.951 2.631 1.00 3.90 H new ATOM 0 HH2 TRP B 77 0.485 4.599 0.600 1.00 3.02 H new ATOM 2882 N ARG B 78 4.206 1.190 4.815 1.00 0.72 N ATOM 2883 CA ARG B 78 5.286 1.757 4.004 1.00 0.66 C ATOM 2884 C ARG B 78 6.054 0.687 3.220 1.00 0.58 C ATOM 2885 O ARG B 78 6.333 0.878 2.039 1.00 0.62 O ATOM 2886 CB ARG B 78 6.307 2.449 4.906 1.00 0.72 C ATOM 2887 CG ARG B 78 5.909 3.797 5.517 1.00 1.02 C ATOM 2888 CD ARG B 78 6.986 4.090 6.571 1.00 1.67 C ATOM 2889 NE ARG B 78 7.062 5.504 6.975 1.00 2.25 N ATOM 2890 CZ ARG B 78 8.222 6.151 7.190 1.00 3.18 C ATOM 2891 NH1 ARG B 78 9.350 5.728 6.610 1.00 3.96 N ATOM 2892 NH2 ARG B 78 8.265 7.220 7.992 1.00 4.15 N ATOM 0 H ARG B 78 4.116 1.630 5.731 1.00 0.72 H new ATOM 0 HA ARG B 78 4.812 2.451 3.310 1.00 0.66 H new ATOM 0 HB2 ARG B 78 6.552 1.769 5.722 1.00 0.72 H new ATOM 0 HB3 ARG B 78 7.220 2.597 4.330 1.00 0.72 H new ATOM 0 HG2 ARG B 78 5.876 4.579 4.759 1.00 1.02 H new ATOM 0 HG3 ARG B 78 4.918 3.748 5.968 1.00 1.02 H new ATOM 0 HD2 ARG B 78 6.791 3.481 7.454 1.00 1.67 H new ATOM 0 HD3 ARG B 78 7.956 3.782 6.180 1.00 1.67 H new ATOM 0 HE ARG B 78 6.190 6.019 7.098 1.00 2.25 H new ATOM 0 HH11 ARG B 78 9.334 4.910 6.000 1.00 3.96 H new ATOM 0 HH12 ARG B 78 10.226 6.223 6.777 1.00 3.96 H new ATOM 0 HH21 ARG B 78 7.414 7.551 8.447 1.00 4.15 H new ATOM 0 HH22 ARG B 78 9.149 7.704 8.149 1.00 4.15 H new ATOM 2906 N LEU B 79 6.405 -0.429 3.868 1.00 0.59 N ATOM 2907 CA LEU B 79 7.154 -1.517 3.265 1.00 0.63 C ATOM 2908 C LEU B 79 6.547 -1.944 1.932 1.00 0.68 C ATOM 2909 O LEU B 79 7.266 -2.123 0.947 1.00 0.77 O ATOM 2910 CB LEU B 79 7.154 -2.708 4.233 1.00 0.77 C ATOM 2911 CG LEU B 79 8.067 -3.844 3.748 1.00 0.82 C ATOM 2912 CD1 LEU B 79 9.527 -3.477 4.012 1.00 0.68 C ATOM 2913 CD2 LEU B 79 7.686 -5.138 4.476 1.00 1.23 C ATOM 0 H LEU B 79 6.168 -0.597 4.846 1.00 0.59 H new ATOM 0 HA LEU B 79 8.171 -1.176 3.073 1.00 0.63 H new ATOM 0 HB2 LEU B 79 7.482 -2.375 5.218 1.00 0.77 H new ATOM 0 HB3 LEU B 79 6.137 -3.083 4.346 1.00 0.77 H new ATOM 0 HG LEU B 79 7.942 -3.995 2.676 1.00 0.82 H new ATOM 0 HD11 LEU B 79 10.173 -4.284 3.667 1.00 0.68 H new ATOM 0 HD12 LEU B 79 9.774 -2.560 3.477 1.00 0.68 H new ATOM 0 HD13 LEU B 79 9.676 -3.324 5.081 1.00 0.68 H new ATOM 0 HD21 LEU B 79 8.330 -5.949 4.137 1.00 1.23 H new ATOM 0 HD22 LEU B 79 7.810 -5.001 5.550 1.00 1.23 H new ATOM 0 HD23 LEU B 79 6.647 -5.385 4.259 1.00 1.23 H new ATOM 2925 N ILE B 80 5.218 -2.101 1.900 1.00 0.72 N ATOM 2926 CA ILE B 80 4.522 -2.555 0.716 1.00 0.86 C ATOM 2927 C ILE B 80 4.702 -1.490 -0.381 1.00 0.99 C ATOM 2928 O ILE B 80 4.728 -1.797 -1.567 1.00 1.13 O ATOM 2929 CB ILE B 80 3.073 -2.932 1.080 1.00 0.91 C ATOM 2930 CG1 ILE B 80 3.075 -4.042 2.153 1.00 1.27 C ATOM 2931 CG2 ILE B 80 2.303 -3.412 -0.162 1.00 1.21 C ATOM 2932 CD1 ILE B 80 1.670 -4.430 2.624 1.00 1.43 C ATOM 0 H ILE B 80 4.608 -1.915 2.696 1.00 0.72 H new ATOM 0 HA ILE B 80 4.936 -3.475 0.302 1.00 0.86 H new ATOM 0 HB ILE B 80 2.576 -2.045 1.473 1.00 0.91 H new ATOM 0 HG12 ILE B 80 3.573 -4.925 1.752 1.00 1.27 H new ATOM 0 HG13 ILE B 80 3.659 -3.708 3.011 1.00 1.27 H new ATOM 0 HG21 ILE B 80 1.283 -3.672 0.120 1.00 1.21 H new ATOM 0 HG22 ILE B 80 2.282 -2.616 -0.907 1.00 1.21 H new ATOM 0 HG23 ILE B 80 2.798 -4.288 -0.581 1.00 1.21 H new ATOM 0 HD11 ILE B 80 1.742 -5.214 3.377 1.00 1.43 H new ATOM 0 HD12 ILE B 80 1.177 -3.558 3.054 1.00 1.43 H new ATOM 0 HD13 ILE B 80 1.090 -4.794 1.776 1.00 1.43 H new ATOM 2944 N GLY B 81 4.917 -0.240 0.028 1.00 1.11 N ATOM 2945 CA GLY B 81 5.164 0.920 -0.803 1.00 1.31 C ATOM 2946 C GLY B 81 6.511 0.873 -1.468 1.00 1.29 C ATOM 2947 O GLY B 81 6.667 1.179 -2.650 1.00 1.47 O ATOM 0 H GLY B 81 4.922 -0.003 1.020 1.00 1.11 H new ATOM 0 HA2 GLY B 81 4.388 0.989 -1.565 1.00 1.31 H new ATOM 0 HA3 GLY B 81 5.094 1.821 -0.194 1.00 1.31 H new ATOM 2951 N GLU B 82 7.496 0.517 -0.665 1.00 1.12 N ATOM 2952 CA GLU B 82 8.865 0.461 -1.099 1.00 1.16 C ATOM 2953 C GLU B 82 8.965 -0.694 -2.086 1.00 1.23 C ATOM 2954 O GLU B 82 9.341 -0.482 -3.232 1.00 1.41 O ATOM 2955 CB GLU B 82 9.743 0.334 0.139 1.00 1.03 C ATOM 2956 CG GLU B 82 9.424 1.502 1.098 1.00 0.93 C ATOM 2957 CD GLU B 82 10.420 2.641 0.955 1.00 1.18 C ATOM 2958 OE1 GLU B 82 10.241 3.407 -0.021 1.00 2.01 O ATOM 2959 OE2 GLU B 82 11.321 2.738 1.811 1.00 2.00 O ATOM 0 H GLU B 82 7.360 0.258 0.312 1.00 1.12 H new ATOM 0 HA GLU B 82 9.210 1.355 -1.618 1.00 1.16 H new ATOM 0 HB2 GLU B 82 9.562 -0.620 0.634 1.00 1.03 H new ATOM 0 HB3 GLU B 82 10.796 0.353 -0.142 1.00 1.03 H new ATOM 0 HG2 GLU B 82 8.418 1.872 0.898 1.00 0.93 H new ATOM 0 HG3 GLU B 82 9.432 1.140 2.126 1.00 0.93 H new ATOM 2966 N LEU B 83 8.522 -1.891 -1.694 1.00 1.15 N ATOM 2967 CA LEU B 83 8.487 -2.999 -2.639 1.00 1.18 C ATOM 2968 C LEU B 83 7.621 -2.668 -3.868 1.00 1.12 C ATOM 2969 O LEU B 83 7.994 -3.013 -4.987 1.00 1.12 O ATOM 2970 CB LEU B 83 8.208 -4.335 -1.935 1.00 1.68 C ATOM 2971 CG LEU B 83 6.798 -4.517 -1.369 1.00 0.67 C ATOM 2972 CD1 LEU B 83 5.799 -5.061 -2.392 1.00 1.76 C ATOM 2973 CD2 LEU B 83 6.804 -5.483 -0.177 1.00 1.53 C ATOM 0 H LEU B 83 8.192 -2.111 -0.754 1.00 1.15 H new ATOM 0 HA LEU B 83 9.480 -3.145 -3.065 1.00 1.18 H new ATOM 0 HB2 LEU B 83 8.400 -5.142 -2.642 1.00 1.68 H new ATOM 0 HB3 LEU B 83 8.922 -4.449 -1.119 1.00 1.68 H new ATOM 0 HG LEU B 83 6.484 -3.518 -1.067 1.00 0.67 H new ATOM 0 HD11 LEU B 83 4.820 -5.166 -1.924 1.00 1.76 H new ATOM 0 HD12 LEU B 83 5.728 -4.371 -3.233 1.00 1.76 H new ATOM 0 HD13 LEU B 83 6.137 -6.034 -2.748 1.00 1.76 H new ATOM 0 HD21 LEU B 83 5.790 -5.594 0.206 1.00 1.53 H new ATOM 0 HD22 LEU B 83 7.179 -6.455 -0.498 1.00 1.53 H new ATOM 0 HD23 LEU B 83 7.447 -5.087 0.609 1.00 1.53 H new ATOM 2985 N ALA B 84 6.503 -1.949 -3.702 1.00 1.16 N ATOM 2986 CA ALA B 84 5.696 -1.528 -4.841 1.00 1.20 C ATOM 2987 C ALA B 84 6.502 -0.674 -5.818 1.00 1.16 C ATOM 2988 O ALA B 84 6.600 -1.016 -6.994 1.00 1.50 O ATOM 2989 CB ALA B 84 4.416 -0.804 -4.407 1.00 1.24 C ATOM 0 H ALA B 84 6.144 -1.651 -2.795 1.00 1.16 H new ATOM 0 HA ALA B 84 5.394 -2.437 -5.361 1.00 1.20 H new ATOM 0 HB1 ALA B 84 3.848 -0.509 -5.289 1.00 1.24 H new ATOM 0 HB2 ALA B 84 3.812 -1.471 -3.792 1.00 1.24 H new ATOM 0 HB3 ALA B 84 4.678 0.084 -3.831 1.00 1.24 H new ATOM 2995 N LYS B 85 7.071 0.449 -5.362 1.00 0.85 N ATOM 2996 CA LYS B 85 7.821 1.312 -6.267 1.00 0.85 C ATOM 2997 C LYS B 85 9.040 0.574 -6.824 1.00 0.86 C ATOM 2998 O LYS B 85 9.389 0.810 -7.977 1.00 0.92 O ATOM 2999 CB LYS B 85 8.194 2.666 -5.631 1.00 1.04 C ATOM 3000 CG LYS B 85 9.371 2.507 -4.665 1.00 1.65 C ATOM 3001 CD LYS B 85 9.771 3.722 -3.828 1.00 1.90 C ATOM 3002 CE LYS B 85 8.632 4.436 -3.085 1.00 1.00 C ATOM 3003 NZ LYS B 85 9.062 4.876 -1.741 1.00 1.29 N ATOM 0 H LYS B 85 7.026 0.771 -4.395 1.00 0.85 H new ATOM 0 HA LYS B 85 7.166 1.557 -7.103 1.00 0.85 H new ATOM 0 HB2 LYS B 85 8.453 3.381 -6.412 1.00 1.04 H new ATOM 0 HB3 LYS B 85 7.334 3.072 -5.099 1.00 1.04 H new ATOM 0 HG2 LYS B 85 9.136 1.691 -3.981 1.00 1.65 H new ATOM 0 HG3 LYS B 85 10.241 2.197 -5.244 1.00 1.65 H new ATOM 0 HD2 LYS B 85 10.513 3.404 -3.095 1.00 1.90 H new ATOM 0 HD3 LYS B 85 10.259 4.444 -4.483 1.00 1.90 H new ATOM 0 HE2 LYS B 85 8.301 5.298 -3.664 1.00 1.00 H new ATOM 0 HE3 LYS B 85 7.777 3.766 -2.995 1.00 1.00 H new ATOM 0 HZ1 LYS B 85 8.416 5.613 -1.394 1.00 1.29 H new ATOM 0 HZ2 LYS B 85 9.045 4.066 -1.089 1.00 1.29 H new ATOM 0 HZ3 LYS B 85 10.028 5.258 -1.793 1.00 1.29 H new ATOM 3017 N GLU B 86 9.701 -0.273 -6.016 1.00 0.88 N ATOM 3018 CA GLU B 86 10.955 -0.942 -6.358 1.00 0.98 C ATOM 3019 C GLU B 86 10.932 -1.505 -7.779 1.00 0.92 C ATOM 3020 O GLU B 86 11.935 -1.412 -8.484 1.00 1.03 O ATOM 3021 CB GLU B 86 11.272 -2.073 -5.363 1.00 1.19 C ATOM 3022 CG GLU B 86 11.904 -1.584 -4.044 1.00 1.46 C ATOM 3023 CD GLU B 86 13.389 -1.911 -3.964 1.00 2.94 C ATOM 3024 OE1 GLU B 86 13.758 -3.059 -4.295 1.00 4.90 O ATOM 3025 OE2 GLU B 86 14.210 -1.036 -3.607 1.00 2.70 O ATOM 0 H GLU B 86 9.364 -0.513 -5.084 1.00 0.88 H new ATOM 0 HA GLU B 86 11.737 -0.185 -6.300 1.00 0.98 H new ATOM 0 HB2 GLU B 86 10.353 -2.613 -5.136 1.00 1.19 H new ATOM 0 HB3 GLU B 86 11.949 -2.783 -5.838 1.00 1.19 H new ATOM 0 HG2 GLU B 86 11.765 -0.507 -3.954 1.00 1.46 H new ATOM 0 HG3 GLU B 86 11.386 -2.044 -3.202 1.00 1.46 H new ATOM 3032 N ILE B 87 9.791 -2.064 -8.203 1.00 0.85 N ATOM 3033 CA ILE B 87 9.623 -2.610 -9.539 1.00 0.87 C ATOM 3034 C ILE B 87 10.143 -1.643 -10.618 1.00 0.93 C ATOM 3035 O ILE B 87 10.854 -2.068 -11.526 1.00 1.07 O ATOM 3036 CB ILE B 87 8.158 -3.064 -9.729 1.00 0.82 C ATOM 3037 CG1 ILE B 87 8.075 -4.174 -10.793 1.00 0.95 C ATOM 3038 CG2 ILE B 87 7.210 -1.907 -10.080 1.00 0.80 C ATOM 3039 CD1 ILE B 87 6.849 -5.057 -10.563 1.00 0.87 C ATOM 0 H ILE B 87 8.959 -2.146 -7.619 1.00 0.85 H new ATOM 0 HA ILE B 87 10.242 -3.499 -9.659 1.00 0.87 H new ATOM 0 HB ILE B 87 7.824 -3.457 -8.769 1.00 0.82 H new ATOM 0 HG12 ILE B 87 8.026 -3.728 -11.787 1.00 0.95 H new ATOM 0 HG13 ILE B 87 8.978 -4.783 -10.761 1.00 0.95 H new ATOM 0 HG21 ILE B 87 6.197 -2.291 -10.200 1.00 0.80 H new ATOM 0 HG22 ILE B 87 7.225 -1.168 -9.279 1.00 0.80 H new ATOM 0 HG23 ILE B 87 7.534 -1.440 -11.010 1.00 0.80 H new ATOM 0 HD11 ILE B 87 6.812 -5.834 -11.327 1.00 0.87 H new ATOM 0 HD12 ILE B 87 6.913 -5.519 -9.578 1.00 0.87 H new ATOM 0 HD13 ILE B 87 5.946 -4.448 -10.620 1.00 0.87 H new ATOM 3051 N ARG B 88 9.811 -0.347 -10.520 1.00 0.92 N ATOM 3052 CA ARG B 88 10.467 0.705 -11.296 1.00 1.12 C ATOM 3053 C ARG B 88 11.764 1.189 -10.627 1.00 1.16 C ATOM 3054 O ARG B 88 12.799 1.325 -11.280 1.00 1.56 O ATOM 3055 CB ARG B 88 9.490 1.836 -11.683 1.00 1.36 C ATOM 3056 CG ARG B 88 8.797 2.549 -10.513 1.00 2.04 C ATOM 3057 CD ARG B 88 7.716 3.547 -10.963 1.00 2.41 C ATOM 3058 NE ARG B 88 8.248 4.688 -11.734 1.00 2.53 N ATOM 3059 CZ ARG B 88 7.557 5.822 -11.967 1.00 3.72 C ATOM 3060 NH1 ARG B 88 6.307 5.955 -11.532 1.00 5.13 N ATOM 3061 NH2 ARG B 88 8.083 6.855 -12.628 1.00 4.07 N ATOM 0 H ARG B 88 9.079 -0.003 -9.899 1.00 0.92 H new ATOM 0 HA ARG B 88 10.782 0.270 -12.244 1.00 1.12 H new ATOM 0 HB2 ARG B 88 10.036 2.579 -12.265 1.00 1.36 H new ATOM 0 HB3 ARG B 88 8.723 1.420 -12.336 1.00 1.36 H new ATOM 0 HG2 ARG B 88 8.344 1.804 -9.859 1.00 2.04 H new ATOM 0 HG3 ARG B 88 9.546 3.077 -9.923 1.00 2.04 H new ATOM 0 HD2 ARG B 88 6.979 3.022 -11.570 1.00 2.41 H new ATOM 0 HD3 ARG B 88 7.194 3.925 -10.084 1.00 2.41 H new ATOM 0 HE ARG B 88 9.192 4.614 -12.112 1.00 2.53 H new ATOM 0 HH11 ARG B 88 5.863 5.195 -11.017 1.00 5.13 H new ATOM 0 HH12 ARG B 88 5.793 6.817 -11.713 1.00 5.13 H new ATOM 0 HH21 ARG B 88 9.040 6.803 -12.977 1.00 4.07 H new ATOM 0 HH22 ARG B 88 7.528 7.696 -12.784 1.00 4.07 H new ATOM 3075 N LYS B 89 11.708 1.532 -9.336 1.00 0.94 N ATOM 3076 CA LYS B 89 12.795 2.202 -8.645 1.00 1.16 C ATOM 3077 C LYS B 89 13.860 1.211 -8.175 1.00 1.39 C ATOM 3078 O LYS B 89 13.873 0.802 -7.018 1.00 1.58 O ATOM 3079 CB LYS B 89 12.217 3.071 -7.518 1.00 1.20 C ATOM 3080 CG LYS B 89 12.118 4.514 -8.019 1.00 2.03 C ATOM 3081 CD LYS B 89 11.468 5.386 -6.948 1.00 2.31 C ATOM 3082 CE LYS B 89 11.650 6.882 -7.251 1.00 3.62 C ATOM 3083 NZ LYS B 89 11.043 7.278 -8.539 1.00 5.16 N ATOM 0 H LYS B 89 10.898 1.348 -8.744 1.00 0.94 H new ATOM 0 HA LYS B 89 13.317 2.865 -9.334 1.00 1.16 H new ATOM 0 HB2 LYS B 89 11.234 2.704 -7.223 1.00 1.20 H new ATOM 0 HB3 LYS B 89 12.854 3.019 -6.635 1.00 1.20 H new ATOM 0 HG2 LYS B 89 13.111 4.895 -8.259 1.00 2.03 H new ATOM 0 HG3 LYS B 89 11.532 4.551 -8.937 1.00 2.03 H new ATOM 0 HD2 LYS B 89 10.405 5.154 -6.884 1.00 2.31 H new ATOM 0 HD3 LYS B 89 11.904 5.155 -5.976 1.00 2.31 H new ATOM 0 HE2 LYS B 89 11.204 7.469 -6.448 1.00 3.62 H new ATOM 0 HE3 LYS B 89 12.714 7.119 -7.267 1.00 3.62 H new ATOM 0 HZ1 LYS B 89 11.736 7.815 -9.099 1.00 5.16 H new ATOM 0 HZ2 LYS B 89 10.758 6.427 -9.065 1.00 5.16 H new ATOM 0 HZ3 LYS B 89 10.207 7.871 -8.361 1.00 5.16 H new