USER MOD reduce.3.24.130724 H: found=0, std=0, add=1460, rem=0, adj=49 USER MOD reduce.3.24.130724 removed 1460 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 127 MET CE :methyl -124:sc= -0.429 (180deg=-1.63) USER MOD Set 1.2: A 168 MET CE :methyl -170:sc= -0.846 (180deg=-1.37) USER MOD Set 1.3: A 181 MET CE :methyl 158:sc=-0.000272 (180deg=0) USER MOD Set 2.1: A 114 MET CE :methyl -135:sc= -1.12 (180deg=-3.98!) USER MOD Set 2.2: A 177 CYS SG : rot -83:sc= 0.179 USER MOD Set 2.3: A 178 SER OG : rot 180:sc= 0 USER MOD Set 3.1: A 156 THR OG1 : rot 180:sc= -0.64 USER MOD Set 3.2: A 157 THR OG1 : rot 180:sc= 0 USER MOD Set 4.1: A 17 LYS NZ :NH3+ -137:sc= 0.459 (180deg=0) USER MOD Set 4.2: A 99 SER OG : rot -175:sc= 0.422 USER MOD Set 5.1: A 22 GLN : amide:sc= -3.73! K(o=-5.6!,f=-1.6) USER MOD Set 5.2: A 93 GLN : amide:sc= -1.86! K(o=-5.6!,f=-1.6) USER MOD Set 6.1: A 53 GLN : amide:sc= -7.62! C(o=-7.6!,f=-6.6!) USER MOD Set 6.2: A 57 GLN : amide:sc=-0.00122 K(o=-7.6,f=-7) USER MOD Set 7.1: A 39 TYR OH : rot 180:sc= 0 USER MOD Set 7.2: A 94 MET CE :methyl -140:sc= -0.198 (180deg=-1.7) USER MOD Single : A 1 MET CE :methyl -163:sc= -0.13 (180deg=-0.576) USER MOD Single : A 1 MET N :NH3+ -121:sc= 0.108 (180deg=-0.0349) USER MOD Single : A 2 ASN : amide:sc= -0.975 K(o=-0.98,f=0) USER MOD Single : A 4 THR OG1 : rot 61:sc= 0.281 USER MOD Single : A 7 HIS : no HD1:sc= -0.417 K(o=-0.42,f=-1.3) USER MOD Single : A 10 GLN : amide:sc= -2.82 K(o=-2.8,f=-4.8!) USER MOD Single : A 18 MET CE :methyl -155:sc= -0.0984 (180deg=-0.984) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 30 LYS NZ :NH3+ -166:sc= -0.0243 (180deg=-0.286) USER MOD Single : A 38 GLN : amide:sc= -0.517 K(o=-0.52,f=0) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 46 ASN : amide:sc= -0.331 X(o=-0.33,f=-0.045) USER MOD Single : A 52 SER OG : rot 63:sc= 0.281 USER MOD Single : A 54 ASN : amide:sc= -0.707 K(o=-0.71,f=-0.075) USER MOD Single : A 58 SER OG : rot -6:sc= 0.869 USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 CYS SG : rot 180:sc= -0.231 USER MOD Single : A 62 CYS SG : rot 110:sc= -2.89! USER MOD Single : A 65 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 THR OG1 : rot 41:sc= -0.114 USER MOD Single : A 70 LYS NZ :NH3+ -164:sc= -0.0117 (180deg=-0.163) USER MOD Single : A 76 GLN : amide:sc= -0.657 K(o=-0.66,f=-0.048) USER MOD Single : A 77 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 80 HIS : no HD1:sc= -2.3 X(o=-2.3,f=-2.4!) USER MOD Single : A 81 ASN : amide:sc= -0.477 K(o=-0.48,f=-6.3!) USER MOD Single : A 82 MET CE :methyl 172:sc= 0 (180deg=-0.0598) USER MOD Single : A 83 LYS NZ :NH3+ -171:sc= -5.67 (180deg=-5.9) USER MOD Single : A 88 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 89 HIS : no HD1:sc= -0.0326 X(o=-0.033,f=0) USER MOD Single : A 90 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 101 LYS NZ :NH3+ -114:sc= -6.09! (180deg=-6.5!) USER MOD Single : A 102 ASN : amide:sc= 0 K(o=0,f=-0.78) USER MOD Single : A 103 ASN : amide:sc= -6.61! C(o=-6.6!,f=-12!) USER MOD Single : A 109 LYS NZ :NH3+ 159:sc= -0.0844 (180deg=-0.455) USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0273) USER MOD Single : A 118 LYS NZ :NH3+ -166:sc= -0.0298 (180deg=-0.247) USER MOD Single : A 119 CYS SG : rot 100:sc= -1.18 USER MOD Single : A 120 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 ASN : amide:sc= -0.0501 X(o=-0.05,f=0) USER MOD Single : A 129 SER OG : rot 180:sc= 0 USER MOD Single : A 130 SER OG : rot 180:sc= 0 USER MOD Single : A 133 GLN : amide:sc= -0.318 X(o=-0.32,f=-0.68) USER MOD Single : A 137 CYS SG : rot 32:sc= -0.338 USER MOD Single : A 147 SER OG : rot 180:sc= -0.271 USER MOD Single : A 150 CYS SG : rot 53:sc= -0.458 USER MOD Single : A 154 THR OG1 : rot -58:sc= 0.0113 USER MOD Single : A 160 MET CE :methyl -142:sc= -0.0633 (180deg=-1.17) USER MOD Single : A 162 GLN : amide:sc= -0.54 K(o=-0.54,f=-2.9!) USER MOD Single : A 163 THR OG1 : rot 60:sc= 0.0168 USER MOD Single : A 166 LYS NZ :NH3+ 164:sc= -0.016 (180deg=-0.416) USER MOD Single : A 169 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.43) USER MOD Single : A 170 GLN : amide:sc= -6.82! K(o=-6.8!,f=-1.9) USER MOD Single : A 172 GLN : amide:sc= -0.849 K(o=-0.85,f=-1.8!) USER MOD Single : A 173 THR OG1 : rot 180:sc= 0 USER MOD Single : A 174 MET CE :methyl -166:sc= -0.0384 (180deg=-0.325) USER MOD Single : A 179 SER OG : rot -2:sc= 1.53 USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 48.005 17.279 5.780 1.00 23.45 N ATOM 2 CA MET A 1 46.551 16.999 5.892 1.00 23.52 C ATOM 3 C MET A 1 45.768 17.728 4.805 1.00 22.98 C ATOM 4 O MET A 1 46.340 18.463 3.999 1.00 22.59 O ATOM 5 CB MET A 1 46.036 17.422 7.270 1.00 23.59 C ATOM 6 CG MET A 1 46.598 16.589 8.411 1.00 24.22 C ATOM 7 SD MET A 1 46.237 14.831 8.231 1.00 24.41 S ATOM 8 CE MET A 1 44.446 14.851 8.229 1.00 24.75 C ATOM 0 H1 MET A 1 48.521 16.386 5.645 1.00 23.45 H new ATOM 0 H2 MET A 1 48.177 17.904 4.967 1.00 23.45 H new ATOM 0 H3 MET A 1 48.337 17.743 6.649 1.00 23.45 H new ATOM 0 HA MET A 1 46.404 15.927 5.764 1.00 23.52 H new ATOM 0 HB2 MET A 1 46.288 18.469 7.437 1.00 23.59 H new ATOM 0 HB3 MET A 1 44.948 17.350 7.280 1.00 23.59 H new ATOM 0 HG2 MET A 1 47.678 16.731 8.462 1.00 24.22 H new ATOM 0 HG3 MET A 1 46.185 16.946 9.354 1.00 24.22 H new ATOM 0 HE1 MET A 1 44.071 13.847 8.428 1.00 24.75 H new ATOM 0 HE2 MET A 1 44.089 15.532 9.002 1.00 24.75 H new ATOM 0 HE3 MET A 1 44.087 15.186 7.256 1.00 24.75 H new ATOM 20 N ASN A 2 44.454 17.518 4.787 1.00 23.05 N ATOM 21 CA ASN A 2 43.590 18.148 3.804 1.00 22.69 C ATOM 22 C ASN A 2 42.418 18.854 4.480 1.00 21.83 C ATOM 23 O ASN A 2 41.446 18.214 4.885 1.00 21.22 O ATOM 24 CB ASN A 2 43.069 17.105 2.811 1.00 23.25 C ATOM 25 CG ASN A 2 42.199 17.714 1.726 1.00 23.07 C ATOM 26 OD1 ASN A 2 41.266 17.077 1.236 1.00 22.66 O ATOM 27 ND2 ASN A 2 42.503 18.949 1.342 1.00 23.44 N ATOM 0 H ASN A 2 43.967 16.912 5.447 1.00 23.05 H new ATOM 0 HA ASN A 2 44.176 18.893 3.266 1.00 22.69 H new ATOM 0 HB2 ASN A 2 43.914 16.594 2.350 1.00 23.25 H new ATOM 0 HB3 ASN A 2 42.496 16.350 3.350 1.00 23.25 H new ATOM 0 HD21 ASN A 2 41.954 19.406 0.614 1.00 23.44 H new ATOM 0 HD22 ASN A 2 43.285 19.440 1.775 1.00 23.44 H new ATOM 34 N GLY A 3 42.519 20.174 4.598 1.00 21.87 N ATOM 35 CA GLY A 3 41.463 20.947 5.224 1.00 21.20 C ATOM 36 C GLY A 3 41.940 21.688 6.458 1.00 20.67 C ATOM 37 O GLY A 3 41.255 21.706 7.482 1.00 20.74 O ATOM 0 H GLY A 3 43.314 20.722 4.271 1.00 21.87 H new ATOM 0 HA2 GLY A 3 41.066 21.663 4.505 1.00 21.20 H new ATOM 0 HA3 GLY A 3 40.644 20.282 5.497 1.00 21.20 H new ATOM 41 N THR A 4 43.116 22.300 6.363 1.00 20.24 N ATOM 42 CA THR A 4 43.682 23.047 7.480 1.00 19.79 C ATOM 43 C THR A 4 43.770 24.532 7.159 1.00 19.54 C ATOM 44 O THR A 4 44.850 25.124 7.171 1.00 19.89 O ATOM 45 CB THR A 4 45.078 22.524 7.864 1.00 20.10 C ATOM 46 OG1 THR A 4 45.965 22.625 6.744 1.00 20.09 O ATOM 47 CG2 THR A 4 45.005 21.079 8.330 1.00 20.45 C ATOM 0 H THR A 4 43.696 22.293 5.524 1.00 20.24 H new ATOM 0 HA THR A 4 43.011 22.903 8.327 1.00 19.79 H new ATOM 0 HB THR A 4 45.457 23.135 8.683 1.00 20.10 H new ATOM 0 HG1 THR A 4 46.046 23.564 6.474 1.00 20.09 H new ATOM 0 HG21 THR A 4 46.003 20.732 8.596 1.00 20.45 H new ATOM 0 HG22 THR A 4 44.353 21.010 9.201 1.00 20.45 H new ATOM 0 HG23 THR A 4 44.606 20.458 7.528 1.00 20.45 H new ATOM 55 N LEU A 5 42.619 25.123 6.872 1.00 19.03 N ATOM 56 CA LEU A 5 42.535 26.533 6.559 1.00 18.86 C ATOM 57 C LEU A 5 42.193 27.315 7.827 1.00 19.00 C ATOM 58 O LEU A 5 42.070 28.539 7.806 1.00 19.08 O ATOM 59 CB LEU A 5 41.513 26.737 5.437 1.00 18.40 C ATOM 60 CG LEU A 5 40.082 26.947 5.889 1.00 18.36 C ATOM 61 CD1 LEU A 5 39.868 28.422 6.130 1.00 18.24 C ATOM 62 CD2 LEU A 5 39.102 26.414 4.854 1.00 18.37 C ATOM 0 H LEU A 5 41.723 24.636 6.851 1.00 19.03 H new ATOM 0 HA LEU A 5 43.492 26.912 6.199 1.00 18.86 H new ATOM 0 HB2 LEU A 5 41.818 27.599 4.843 1.00 18.40 H new ATOM 0 HB3 LEU A 5 41.544 25.869 4.779 1.00 18.40 H new ATOM 0 HG LEU A 5 39.903 26.396 6.813 1.00 18.36 H new ATOM 0 HD11 LEU A 5 38.842 28.592 6.456 1.00 18.24 H new ATOM 0 HD12 LEU A 5 40.556 28.768 6.901 1.00 18.24 H new ATOM 0 HD13 LEU A 5 40.051 28.972 5.207 1.00 18.24 H new ATOM 0 HD21 LEU A 5 38.082 26.576 5.201 1.00 18.37 H new ATOM 0 HD22 LEU A 5 39.251 26.936 3.909 1.00 18.37 H new ATOM 0 HD23 LEU A 5 39.270 25.347 4.709 1.00 18.37 H new ATOM 74 N ASP A 6 42.087 26.576 8.939 1.00 19.17 N ATOM 75 CA ASP A 6 41.771 27.144 10.254 1.00 19.48 C ATOM 76 C ASP A 6 40.277 27.418 10.399 1.00 19.17 C ATOM 77 O ASP A 6 39.751 27.454 11.513 1.00 19.54 O ATOM 78 CB ASP A 6 42.568 28.427 10.514 1.00 19.78 C ATOM 79 CG ASP A 6 42.464 28.889 11.955 1.00 20.15 C ATOM 80 OD1 ASP A 6 41.505 29.623 12.276 1.00 20.68 O ATOM 81 OD2 ASP A 6 43.342 28.518 12.763 1.00 19.98 O ATOM 0 H ASP A 6 42.219 25.565 8.951 1.00 19.17 H new ATOM 0 HA ASP A 6 42.058 26.402 10.999 1.00 19.48 H new ATOM 0 HB2 ASP A 6 43.615 28.258 10.264 1.00 19.78 H new ATOM 0 HB3 ASP A 6 42.206 29.216 9.855 1.00 19.78 H new ATOM 86 N HIS A 7 39.596 27.609 9.275 1.00 18.57 N ATOM 87 CA HIS A 7 38.160 27.871 9.287 1.00 18.29 C ATOM 88 C HIS A 7 37.443 27.034 8.231 1.00 17.53 C ATOM 89 O HIS A 7 36.839 27.576 7.304 1.00 17.32 O ATOM 90 CB HIS A 7 37.883 29.358 9.052 1.00 18.69 C ATOM 91 CG HIS A 7 38.652 30.266 9.961 1.00 19.51 C ATOM 92 ND1 HIS A 7 38.184 30.674 11.192 1.00 20.01 N ATOM 93 CD2 HIS A 7 39.865 30.849 9.811 1.00 20.02 C ATOM 94 CE1 HIS A 7 39.075 31.468 11.759 1.00 20.77 C ATOM 95 NE2 HIS A 7 40.104 31.590 10.942 1.00 20.78 N ATOM 0 H HIS A 7 40.014 27.588 8.345 1.00 18.57 H new ATOM 0 HA HIS A 7 37.777 27.591 10.268 1.00 18.29 H new ATOM 0 HB2 HIS A 7 38.125 29.604 8.018 1.00 18.69 H new ATOM 0 HB3 HIS A 7 36.817 29.545 9.183 1.00 18.69 H new ATOM 0 HD2 HIS A 7 40.522 30.750 8.960 1.00 20.02 H new ATOM 0 HE1 HIS A 7 38.978 31.937 12.727 1.00 20.77 H new ATOM 0 HE2 HIS A 7 40.941 32.145 11.121 1.00 20.78 H new ATOM 104 N PRO A 8 37.500 25.695 8.356 1.00 17.24 N ATOM 105 CA PRO A 8 36.840 24.794 7.414 1.00 16.62 C ATOM 106 C PRO A 8 35.335 24.788 7.622 1.00 16.32 C ATOM 107 O PRO A 8 34.567 24.581 6.682 1.00 16.10 O ATOM 108 CB PRO A 8 37.437 23.430 7.753 1.00 16.70 C ATOM 109 CG PRO A 8 37.780 23.528 9.198 1.00 17.24 C ATOM 110 CD PRO A 8 38.199 24.957 9.426 1.00 17.61 C ATOM 0 HA PRO A 8 36.993 25.085 6.375 1.00 16.62 H new ATOM 0 HB2 PRO A 8 36.724 22.626 7.567 1.00 16.70 H new ATOM 0 HB3 PRO A 8 38.319 23.220 7.148 1.00 16.70 H new ATOM 0 HG2 PRO A 8 36.925 23.267 9.821 1.00 17.24 H new ATOM 0 HG3 PRO A 8 38.584 22.839 9.456 1.00 17.24 H new ATOM 0 HD2 PRO A 8 37.905 25.309 10.415 1.00 17.61 H new ATOM 0 HD3 PRO A 8 39.280 25.075 9.355 1.00 17.61 H new ATOM 118 N ASP A 9 34.940 25.024 8.873 1.00 16.45 N ATOM 119 CA ASP A 9 33.532 25.073 9.267 1.00 16.33 C ATOM 120 C ASP A 9 32.893 23.685 9.290 1.00 15.32 C ATOM 121 O ASP A 9 32.098 23.379 10.179 1.00 15.25 O ATOM 122 CB ASP A 9 32.746 25.999 8.339 1.00 16.84 C ATOM 123 CG ASP A 9 31.278 26.082 8.709 1.00 17.14 C ATOM 124 OD1 ASP A 9 30.493 25.248 8.209 1.00 17.31 O ATOM 125 OD2 ASP A 9 30.914 26.980 9.495 1.00 17.28 O ATOM 0 H ASP A 9 35.589 25.187 9.643 1.00 16.45 H new ATOM 0 HA ASP A 9 33.497 25.469 10.282 1.00 16.33 H new ATOM 0 HB2 ASP A 9 33.183 26.997 8.372 1.00 16.84 H new ATOM 0 HB3 ASP A 9 32.839 25.644 7.313 1.00 16.84 H new ATOM 130 N GLN A 10 33.236 22.847 8.315 1.00 14.64 N ATOM 131 CA GLN A 10 32.681 21.504 8.239 1.00 13.72 C ATOM 132 C GLN A 10 33.740 20.496 7.786 1.00 13.15 C ATOM 133 O GLN A 10 34.637 20.836 7.012 1.00 12.93 O ATOM 134 CB GLN A 10 31.501 21.484 7.268 1.00 13.53 C ATOM 135 CG GLN A 10 31.896 21.742 5.822 1.00 14.16 C ATOM 136 CD GLN A 10 32.252 23.187 5.554 1.00 14.37 C ATOM 137 OE1 GLN A 10 31.698 24.099 6.167 1.00 15.03 O ATOM 138 NE2 GLN A 10 33.184 23.404 4.635 1.00 13.92 N ATOM 0 H GLN A 10 33.894 23.076 7.570 1.00 14.64 H new ATOM 0 HA GLN A 10 32.340 21.219 9.234 1.00 13.72 H new ATOM 0 HB2 GLN A 10 31.005 20.516 7.333 1.00 13.53 H new ATOM 0 HB3 GLN A 10 30.775 22.236 7.577 1.00 13.53 H new ATOM 0 HG2 GLN A 10 32.747 21.111 5.566 1.00 14.16 H new ATOM 0 HG3 GLN A 10 31.074 21.449 5.169 1.00 14.16 H new ATOM 0 HE21 GLN A 10 33.617 22.617 4.152 1.00 13.92 H new ATOM 0 HE22 GLN A 10 33.468 24.358 4.412 1.00 13.92 H new ATOM 147 N PRO A 11 33.650 19.238 8.263 1.00 13.08 N ATOM 148 CA PRO A 11 34.599 18.183 7.897 1.00 12.76 C ATOM 149 C PRO A 11 34.422 17.728 6.453 1.00 12.12 C ATOM 150 O PRO A 11 33.299 17.498 6.002 1.00 12.51 O ATOM 151 CB PRO A 11 34.266 17.031 8.861 1.00 13.25 C ATOM 152 CG PRO A 11 33.344 17.615 9.882 1.00 13.64 C ATOM 153 CD PRO A 11 32.632 18.742 9.197 1.00 13.53 C ATOM 0 HA PRO A 11 35.630 18.527 7.972 1.00 12.76 H new ATOM 0 HB2 PRO A 11 33.793 16.203 8.333 1.00 13.25 H new ATOM 0 HB3 PRO A 11 35.169 16.637 9.328 1.00 13.25 H new ATOM 0 HG2 PRO A 11 32.637 16.868 10.242 1.00 13.64 H new ATOM 0 HG3 PRO A 11 33.899 17.973 10.749 1.00 13.64 H new ATOM 0 HD2 PRO A 11 31.736 18.401 8.678 1.00 13.53 H new ATOM 0 HD3 PRO A 11 32.318 19.512 9.902 1.00 13.53 H new ATOM 161 N ASP A 12 35.538 17.599 5.736 1.00 11.29 N ATOM 162 CA ASP A 12 35.522 17.177 4.338 1.00 10.79 C ATOM 163 C ASP A 12 34.796 18.196 3.464 1.00 10.38 C ATOM 164 O ASP A 12 33.724 18.688 3.818 1.00 10.71 O ATOM 165 CB ASP A 12 34.870 15.800 4.186 1.00 11.15 C ATOM 166 CG ASP A 12 35.671 14.704 4.860 1.00 11.29 C ATOM 167 OD1 ASP A 12 36.566 14.131 4.203 1.00 11.33 O ATOM 168 OD2 ASP A 12 35.406 14.419 6.048 1.00 11.52 O ATOM 0 H ASP A 12 36.471 17.783 6.105 1.00 11.29 H new ATOM 0 HA ASP A 12 36.558 17.110 4.006 1.00 10.79 H new ATOM 0 HB2 ASP A 12 33.867 15.827 4.611 1.00 11.15 H new ATOM 0 HB3 ASP A 12 34.761 15.568 3.127 1.00 11.15 H new ATOM 173 N LEU A 13 35.395 18.512 2.323 1.00 9.86 N ATOM 174 CA LEU A 13 34.815 19.466 1.387 1.00 9.61 C ATOM 175 C LEU A 13 33.712 18.811 0.560 1.00 8.86 C ATOM 176 O LEU A 13 33.689 18.930 -0.665 1.00 8.64 O ATOM 177 CB LEU A 13 35.903 20.019 0.462 1.00 9.76 C ATOM 178 CG LEU A 13 37.327 19.972 1.024 1.00 10.45 C ATOM 179 CD1 LEU A 13 38.308 20.585 0.039 1.00 10.67 C ATOM 180 CD2 LEU A 13 37.400 20.684 2.368 1.00 11.11 C ATOM 0 H LEU A 13 36.287 18.119 2.023 1.00 9.86 H new ATOM 0 HA LEU A 13 34.378 20.285 1.958 1.00 9.61 H new ATOM 0 HB2 LEU A 13 35.881 19.459 -0.473 1.00 9.76 H new ATOM 0 HB3 LEU A 13 35.660 21.054 0.220 1.00 9.76 H new ATOM 0 HG LEU A 13 37.600 18.928 1.178 1.00 10.45 H new ATOM 0 HD11 LEU A 13 39.315 20.543 0.455 1.00 10.67 H new ATOM 0 HD12 LEU A 13 38.279 20.028 -0.898 1.00 10.67 H new ATOM 0 HD13 LEU A 13 38.035 21.624 -0.147 1.00 10.67 H new ATOM 0 HD21 LEU A 13 38.420 20.638 2.749 1.00 11.11 H new ATOM 0 HD22 LEU A 13 37.105 21.726 2.244 1.00 11.11 H new ATOM 0 HD23 LEU A 13 36.727 20.198 3.074 1.00 11.11 H new ATOM 192 N ASP A 14 32.802 18.121 1.241 1.00 8.68 N ATOM 193 CA ASP A 14 31.697 17.440 0.576 1.00 8.23 C ATOM 194 C ASP A 14 32.221 16.407 -0.417 1.00 7.17 C ATOM 195 O ASP A 14 31.741 16.314 -1.547 1.00 6.98 O ATOM 196 CB ASP A 14 30.797 18.452 -0.140 1.00 9.02 C ATOM 197 CG ASP A 14 30.150 19.430 0.819 1.00 9.69 C ATOM 198 OD1 ASP A 14 30.752 20.491 1.082 1.00 10.16 O ATOM 199 OD2 ASP A 14 29.039 19.134 1.310 1.00 9.93 O ATOM 0 H ASP A 14 32.809 18.019 2.256 1.00 8.68 H new ATOM 0 HA ASP A 14 31.109 16.924 1.335 1.00 8.23 H new ATOM 0 HB2 ASP A 14 31.386 19.003 -0.874 1.00 9.02 H new ATOM 0 HB3 ASP A 14 30.021 17.919 -0.689 1.00 9.02 H new ATOM 204 N ALA A 15 33.210 15.630 0.016 1.00 6.71 N ATOM 205 CA ALA A 15 33.804 14.606 -0.831 1.00 5.87 C ATOM 206 C ALA A 15 32.792 13.508 -1.145 1.00 5.33 C ATOM 207 O ALA A 15 32.045 13.606 -2.117 1.00 5.56 O ATOM 208 CB ALA A 15 35.046 14.025 -0.171 1.00 6.04 C ATOM 0 H ALA A 15 33.616 15.692 0.950 1.00 6.71 H new ATOM 0 HA ALA A 15 34.101 15.069 -1.772 1.00 5.87 H new ATOM 0 HB1 ALA A 15 35.478 13.261 -0.817 1.00 6.04 H new ATOM 0 HB2 ALA A 15 35.776 14.818 -0.008 1.00 6.04 H new ATOM 0 HB3 ALA A 15 34.775 13.580 0.786 1.00 6.04 H new ATOM 214 N ILE A 16 32.767 12.469 -0.311 1.00 4.74 N ATOM 215 CA ILE A 16 31.840 11.361 -0.503 1.00 4.26 C ATOM 216 C ILE A 16 32.006 10.301 0.583 1.00 3.73 C ATOM 217 O ILE A 16 33.112 10.056 1.066 1.00 3.57 O ATOM 218 CB ILE A 16 32.012 10.710 -1.898 1.00 4.00 C ATOM 219 CG1 ILE A 16 30.663 10.644 -2.622 1.00 4.44 C ATOM 220 CG2 ILE A 16 32.634 9.324 -1.794 1.00 3.10 C ATOM 221 CD1 ILE A 16 29.599 9.864 -1.874 1.00 4.12 C ATOM 0 H ILE A 16 33.377 12.374 0.501 1.00 4.74 H new ATOM 0 HA ILE A 16 30.835 11.777 -0.436 1.00 4.26 H new ATOM 0 HB ILE A 16 32.693 11.333 -2.478 1.00 4.00 H new ATOM 0 HG12 ILE A 16 30.303 11.659 -2.791 1.00 4.44 H new ATOM 0 HG13 ILE A 16 30.810 10.190 -3.602 1.00 4.44 H new ATOM 0 HG21 ILE A 16 32.740 8.897 -2.791 1.00 3.10 H new ATOM 0 HG22 ILE A 16 33.615 9.400 -1.326 1.00 3.10 H new ATOM 0 HG23 ILE A 16 31.993 8.682 -1.191 1.00 3.10 H new ATOM 0 HD11 ILE A 16 28.675 9.864 -2.452 1.00 4.12 H new ATOM 0 HD12 ILE A 16 29.936 8.838 -1.728 1.00 4.12 H new ATOM 0 HD13 ILE A 16 29.421 10.329 -0.904 1.00 4.12 H new ATOM 233 N LYS A 17 30.898 9.660 0.935 1.00 3.63 N ATOM 234 CA LYS A 17 30.898 8.622 1.952 1.00 3.33 C ATOM 235 C LYS A 17 30.329 7.328 1.385 1.00 2.84 C ATOM 236 O LYS A 17 29.362 7.344 0.623 1.00 3.10 O ATOM 237 CB LYS A 17 30.078 9.075 3.162 1.00 3.97 C ATOM 238 CG LYS A 17 30.022 8.049 4.283 1.00 4.67 C ATOM 239 CD LYS A 17 29.509 8.661 5.579 1.00 5.07 C ATOM 240 CE LYS A 17 28.075 9.155 5.445 1.00 5.85 C ATOM 241 NZ LYS A 17 27.584 9.776 6.707 1.00 6.09 N ATOM 0 H LYS A 17 29.982 9.845 0.526 1.00 3.63 H new ATOM 0 HA LYS A 17 31.925 8.441 2.270 1.00 3.33 H new ATOM 0 HB2 LYS A 17 30.502 10.001 3.550 1.00 3.97 H new ATOM 0 HB3 LYS A 17 29.062 9.301 2.837 1.00 3.97 H new ATOM 0 HG2 LYS A 17 29.374 7.223 3.989 1.00 4.67 H new ATOM 0 HG3 LYS A 17 31.016 7.632 4.445 1.00 4.67 H new ATOM 0 HD2 LYS A 17 29.565 7.921 6.377 1.00 5.07 H new ATOM 0 HD3 LYS A 17 30.153 9.491 5.869 1.00 5.07 H new ATOM 0 HE2 LYS A 17 28.015 9.882 4.635 1.00 5.85 H new ATOM 0 HE3 LYS A 17 27.427 8.321 5.174 1.00 5.85 H new ATOM 0 HZ1 LYS A 17 26.613 9.456 6.896 1.00 6.09 H new ATOM 0 HZ2 LYS A 17 28.201 9.494 7.495 1.00 6.09 H new ATOM 0 HZ3 LYS A 17 27.595 10.812 6.612 1.00 6.09 H new ATOM 255 N MET A 18 30.938 6.208 1.758 1.00 2.38 N ATOM 256 CA MET A 18 30.505 4.903 1.272 1.00 2.12 C ATOM 257 C MET A 18 30.265 3.937 2.412 1.00 2.26 C ATOM 258 O MET A 18 31.078 3.816 3.326 1.00 2.37 O ATOM 259 CB MET A 18 31.548 4.316 0.340 1.00 1.82 C ATOM 260 CG MET A 18 30.972 3.779 -0.956 1.00 2.03 C ATOM 261 SD MET A 18 30.617 2.018 -0.872 1.00 2.43 S ATOM 262 CE MET A 18 32.278 1.350 -0.857 1.00 3.14 C ATOM 0 H MET A 18 31.733 6.177 2.396 1.00 2.38 H new ATOM 0 HA MET A 18 29.567 5.051 0.736 1.00 2.12 H new ATOM 0 HB2 MET A 18 32.288 5.082 0.109 1.00 1.82 H new ATOM 0 HB3 MET A 18 32.072 3.511 0.856 1.00 1.82 H new ATOM 0 HG2 MET A 18 30.057 4.320 -1.195 1.00 2.03 H new ATOM 0 HG3 MET A 18 31.675 3.967 -1.768 1.00 2.03 H new ATOM 0 HE1 MET A 18 32.264 0.331 -1.245 1.00 3.14 H new ATOM 0 HE2 MET A 18 32.924 1.967 -1.481 1.00 3.14 H new ATOM 0 HE3 MET A 18 32.659 1.344 0.164 1.00 3.14 H new ATOM 272 N PHE A 19 29.142 3.255 2.340 1.00 2.46 N ATOM 273 CA PHE A 19 28.756 2.291 3.350 1.00 2.77 C ATOM 274 C PHE A 19 28.357 0.964 2.699 1.00 2.74 C ATOM 275 O PHE A 19 27.480 0.935 1.838 1.00 2.74 O ATOM 276 CB PHE A 19 27.601 2.886 4.138 1.00 3.31 C ATOM 277 CG PHE A 19 27.473 2.365 5.540 1.00 3.72 C ATOM 278 CD1 PHE A 19 27.346 1.007 5.786 1.00 3.78 C ATOM 279 CD2 PHE A 19 27.480 3.239 6.613 1.00 4.18 C ATOM 280 CE1 PHE A 19 27.231 0.531 7.078 1.00 4.26 C ATOM 281 CE2 PHE A 19 27.361 2.771 7.908 1.00 4.66 C ATOM 282 CZ PHE A 19 27.237 1.415 8.141 1.00 4.68 C ATOM 0 H PHE A 19 28.470 3.353 1.579 1.00 2.46 H new ATOM 0 HA PHE A 19 29.591 2.080 4.018 1.00 2.77 H new ATOM 0 HB2 PHE A 19 27.722 3.969 4.175 1.00 3.31 H new ATOM 0 HB3 PHE A 19 26.672 2.688 3.603 1.00 3.31 H new ATOM 0 HD1 PHE A 19 27.337 0.313 4.959 1.00 3.78 H new ATOM 0 HD2 PHE A 19 27.580 4.300 6.436 1.00 4.18 H new ATOM 0 HE1 PHE A 19 27.137 -0.530 7.257 1.00 4.26 H new ATOM 0 HE2 PHE A 19 27.365 3.464 8.736 1.00 4.66 H new ATOM 0 HZ PHE A 19 27.145 1.046 9.152 1.00 4.68 H new ATOM 292 N VAL A 20 28.985 -0.136 3.112 1.00 2.86 N ATOM 293 CA VAL A 20 28.667 -1.438 2.524 1.00 3.00 C ATOM 294 C VAL A 20 28.259 -2.464 3.574 1.00 3.64 C ATOM 295 O VAL A 20 28.755 -2.460 4.703 1.00 3.85 O ATOM 296 CB VAL A 20 29.837 -2.012 1.698 1.00 2.66 C ATOM 297 CG1 VAL A 20 30.583 -0.910 0.969 1.00 2.37 C ATOM 298 CG2 VAL A 20 30.779 -2.821 2.573 1.00 2.99 C ATOM 0 H VAL A 20 29.703 -0.155 3.836 1.00 2.86 H new ATOM 0 HA VAL A 20 27.822 -1.252 1.861 1.00 3.00 H new ATOM 0 HB VAL A 20 29.417 -2.684 0.949 1.00 2.66 H new ATOM 0 HG11 VAL A 20 31.402 -1.343 0.395 1.00 2.37 H new ATOM 0 HG12 VAL A 20 29.900 -0.393 0.294 1.00 2.37 H new ATOM 0 HG13 VAL A 20 30.983 -0.201 1.693 1.00 2.37 H new ATOM 0 HG21 VAL A 20 31.594 -3.213 1.965 1.00 2.99 H new ATOM 0 HG22 VAL A 20 31.186 -2.182 3.357 1.00 2.99 H new ATOM 0 HG23 VAL A 20 30.234 -3.649 3.026 1.00 2.99 H new ATOM 308 N GLY A 21 27.344 -3.337 3.173 1.00 3.97 N ATOM 309 CA GLY A 21 26.856 -4.382 4.050 1.00 4.60 C ATOM 310 C GLY A 21 26.827 -5.733 3.361 1.00 4.93 C ATOM 311 O GLY A 21 26.544 -5.811 2.164 1.00 4.85 O ATOM 0 H GLY A 21 26.927 -3.338 2.242 1.00 3.97 H new ATOM 0 HA2 GLY A 21 27.491 -4.439 4.934 1.00 4.60 H new ATOM 0 HA3 GLY A 21 25.853 -4.128 4.393 1.00 4.60 H new ATOM 315 N GLN A 22 27.131 -6.791 4.108 1.00 5.36 N ATOM 316 CA GLN A 22 27.123 -8.147 3.563 1.00 5.79 C ATOM 317 C GLN A 22 28.265 -8.346 2.571 1.00 5.48 C ATOM 318 O GLN A 22 28.099 -8.975 1.526 1.00 5.53 O ATOM 319 CB GLN A 22 25.775 -8.459 2.904 1.00 6.13 C ATOM 320 CG GLN A 22 25.563 -9.938 2.616 1.00 6.35 C ATOM 321 CD GLN A 22 24.185 -10.234 2.056 1.00 7.21 C ATOM 322 OE1 GLN A 22 23.632 -11.312 2.274 1.00 7.79 O ATOM 323 NE2 GLN A 22 23.620 -9.277 1.328 1.00 7.55 N ATOM 0 H GLN A 22 27.386 -6.736 5.094 1.00 5.36 H new ATOM 0 HA GLN A 22 27.270 -8.842 4.390 1.00 5.79 H new ATOM 0 HB2 GLN A 22 24.973 -8.106 3.552 1.00 6.13 H new ATOM 0 HB3 GLN A 22 25.699 -7.902 1.970 1.00 6.13 H new ATOM 0 HG2 GLN A 22 26.319 -10.278 1.908 1.00 6.35 H new ATOM 0 HG3 GLN A 22 25.707 -10.507 3.534 1.00 6.35 H new ATOM 0 HE21 GLN A 22 24.112 -8.398 1.171 1.00 7.55 H new ATOM 0 HE22 GLN A 22 22.694 -9.422 0.926 1.00 7.55 H new ATOM 332 N VAL A 23 29.424 -7.800 2.911 1.00 5.25 N ATOM 333 CA VAL A 23 30.607 -7.929 2.071 1.00 5.09 C ATOM 334 C VAL A 23 31.296 -9.267 2.349 1.00 5.64 C ATOM 335 O VAL A 23 31.365 -9.691 3.502 1.00 5.87 O ATOM 336 CB VAL A 23 31.593 -6.762 2.317 1.00 4.52 C ATOM 337 CG1 VAL A 23 31.769 -6.517 3.807 1.00 4.57 C ATOM 338 CG2 VAL A 23 32.939 -7.025 1.656 1.00 4.51 C ATOM 0 H VAL A 23 29.571 -7.262 3.765 1.00 5.25 H new ATOM 0 HA VAL A 23 30.294 -7.893 1.028 1.00 5.09 H new ATOM 0 HB VAL A 23 31.169 -5.866 1.864 1.00 4.52 H new ATOM 0 HG11 VAL A 23 32.466 -5.693 3.960 1.00 4.57 H new ATOM 0 HG12 VAL A 23 30.806 -6.265 4.251 1.00 4.57 H new ATOM 0 HG13 VAL A 23 32.162 -7.417 4.280 1.00 4.57 H new ATOM 0 HG21 VAL A 23 33.609 -6.187 1.848 1.00 4.51 H new ATOM 0 HG22 VAL A 23 33.373 -7.937 2.065 1.00 4.51 H new ATOM 0 HG23 VAL A 23 32.800 -7.140 0.581 1.00 4.51 H new ATOM 348 N PRO A 24 31.803 -9.952 1.297 1.00 5.91 N ATOM 349 CA PRO A 24 32.475 -11.240 1.415 1.00 6.48 C ATOM 350 C PRO A 24 33.111 -11.457 2.783 1.00 6.48 C ATOM 351 O PRO A 24 32.781 -12.415 3.482 1.00 7.01 O ATOM 352 CB PRO A 24 33.544 -11.145 0.324 1.00 6.70 C ATOM 353 CG PRO A 24 33.043 -10.135 -0.666 1.00 6.51 C ATOM 354 CD PRO A 24 31.775 -9.539 -0.106 1.00 5.77 C ATOM 0 HA PRO A 24 31.790 -12.081 1.306 1.00 6.48 H new ATOM 0 HB2 PRO A 24 34.502 -10.837 0.743 1.00 6.70 H new ATOM 0 HB3 PRO A 24 33.701 -12.113 -0.153 1.00 6.70 H new ATOM 0 HG2 PRO A 24 33.790 -9.359 -0.833 1.00 6.51 H new ATOM 0 HG3 PRO A 24 32.852 -10.606 -1.630 1.00 6.51 H new ATOM 0 HD2 PRO A 24 31.762 -8.454 -0.206 1.00 5.77 H new ATOM 0 HD3 PRO A 24 30.891 -9.917 -0.620 1.00 5.77 H new ATOM 362 N ARG A 25 34.020 -10.565 3.159 1.00 6.06 N ATOM 363 CA ARG A 25 34.697 -10.659 4.448 1.00 6.01 C ATOM 364 C ARG A 25 35.335 -12.032 4.638 1.00 6.40 C ATOM 365 O ARG A 25 35.614 -12.450 5.763 1.00 6.39 O ATOM 366 CB ARG A 25 33.710 -10.388 5.585 1.00 5.95 C ATOM 367 CG ARG A 25 33.478 -8.912 5.856 1.00 5.62 C ATOM 368 CD ARG A 25 34.732 -8.245 6.397 1.00 5.99 C ATOM 369 NE ARG A 25 35.679 -7.905 5.340 1.00 6.24 N ATOM 370 CZ ARG A 25 36.924 -7.502 5.572 1.00 6.85 C ATOM 371 NH1 ARG A 25 37.363 -7.378 6.817 1.00 7.30 N ATOM 372 NH2 ARG A 25 37.731 -7.222 4.560 1.00 7.24 N ATOM 0 H ARG A 25 34.306 -9.768 2.590 1.00 6.06 H new ATOM 0 HA ARG A 25 35.486 -9.907 4.466 1.00 6.01 H new ATOM 0 HB2 ARG A 25 32.756 -10.858 5.346 1.00 5.95 H new ATOM 0 HB3 ARG A 25 34.079 -10.861 6.495 1.00 5.95 H new ATOM 0 HG2 ARG A 25 33.168 -8.416 4.936 1.00 5.62 H new ATOM 0 HG3 ARG A 25 32.664 -8.795 6.572 1.00 5.62 H new ATOM 0 HD2 ARG A 25 34.455 -7.340 6.938 1.00 5.99 H new ATOM 0 HD3 ARG A 25 35.214 -8.910 7.114 1.00 5.99 H new ATOM 0 HE ARG A 25 35.369 -7.981 4.371 1.00 6.24 H new ATOM 0 HH11 ARG A 25 36.745 -7.592 7.599 1.00 7.30 H new ATOM 0 HH12 ARG A 25 38.319 -7.069 6.992 1.00 7.30 H new ATOM 0 HH21 ARG A 25 37.397 -7.315 3.601 1.00 7.24 H new ATOM 0 HH22 ARG A 25 38.686 -6.913 4.740 1.00 7.24 H new ATOM 386 N THR A 26 35.556 -12.729 3.534 1.00 6.80 N ATOM 387 CA THR A 26 36.162 -14.054 3.574 1.00 7.23 C ATOM 388 C THR A 26 37.671 -13.943 3.748 1.00 7.16 C ATOM 389 O THR A 26 38.334 -14.894 4.161 1.00 7.49 O ATOM 390 CB THR A 26 35.853 -14.856 2.294 1.00 7.59 C ATOM 391 OG1 THR A 26 36.466 -16.149 2.364 1.00 8.00 O ATOM 392 CG2 THR A 26 36.351 -14.119 1.059 1.00 7.42 C ATOM 0 H THR A 26 35.325 -12.400 2.597 1.00 6.80 H new ATOM 0 HA THR A 26 35.733 -14.583 4.425 1.00 7.23 H new ATOM 0 HB THR A 26 34.772 -14.971 2.217 1.00 7.59 H new ATOM 0 HG1 THR A 26 36.263 -16.652 1.548 1.00 8.00 H new ATOM 0 HG21 THR A 26 36.122 -14.704 0.169 1.00 7.42 H new ATOM 0 HG22 THR A 26 35.860 -13.148 0.992 1.00 7.42 H new ATOM 0 HG23 THR A 26 37.429 -13.976 1.131 1.00 7.42 H new ATOM 400 N TRP A 27 38.201 -12.768 3.426 1.00 6.78 N ATOM 401 CA TRP A 27 39.623 -12.506 3.544 1.00 6.78 C ATOM 402 C TRP A 27 39.875 -11.421 4.596 1.00 6.52 C ATOM 403 O TRP A 27 39.049 -11.215 5.486 1.00 6.48 O ATOM 404 CB TRP A 27 40.176 -12.099 2.177 1.00 6.61 C ATOM 405 CG TRP A 27 39.962 -13.141 1.121 1.00 6.78 C ATOM 406 CD1 TRP A 27 40.236 -14.476 1.220 1.00 7.11 C ATOM 407 CD2 TRP A 27 39.439 -12.935 -0.197 1.00 6.87 C ATOM 408 NE1 TRP A 27 39.909 -15.113 0.049 1.00 7.30 N ATOM 409 CE2 TRP A 27 39.418 -14.190 -0.837 1.00 7.14 C ATOM 410 CE3 TRP A 27 38.982 -11.814 -0.897 1.00 7.00 C ATOM 411 CZ2 TRP A 27 38.962 -14.354 -2.142 1.00 7.39 C ATOM 412 CZ3 TRP A 27 38.530 -11.980 -2.194 1.00 7.36 C ATOM 413 CH2 TRP A 27 38.521 -13.240 -2.803 1.00 7.49 C ATOM 0 H TRP A 27 37.658 -11.978 3.078 1.00 6.78 H new ATOM 0 HA TRP A 27 40.139 -13.408 3.872 1.00 6.78 H new ATOM 0 HB2 TRP A 27 39.702 -11.169 1.862 1.00 6.61 H new ATOM 0 HB3 TRP A 27 41.243 -11.898 2.269 1.00 6.61 H new ATOM 0 HD1 TRP A 27 40.650 -14.960 2.093 1.00 7.11 H new ATOM 0 HE1 TRP A 27 40.014 -16.111 -0.132 1.00 7.30 H new ATOM 0 HE3 TRP A 27 38.982 -10.838 -0.434 1.00 7.00 H new ATOM 0 HZ2 TRP A 27 38.956 -15.325 -2.615 1.00 7.39 H new ATOM 0 HZ3 TRP A 27 38.178 -11.122 -2.747 1.00 7.36 H new ATOM 0 HH2 TRP A 27 38.158 -13.335 -3.816 1.00 7.49 H new ATOM 424 N SER A 28 41.007 -10.726 4.499 1.00 6.41 N ATOM 425 CA SER A 28 41.338 -9.678 5.455 1.00 6.22 C ATOM 426 C SER A 28 41.043 -8.299 4.878 1.00 5.65 C ATOM 427 O SER A 28 40.594 -8.174 3.738 1.00 5.37 O ATOM 428 CB SER A 28 42.812 -9.771 5.853 1.00 6.54 C ATOM 429 OG SER A 28 43.110 -11.037 6.414 1.00 6.97 O ATOM 0 H SER A 28 41.706 -10.871 3.770 1.00 6.41 H new ATOM 0 HA SER A 28 40.718 -9.821 6.340 1.00 6.22 H new ATOM 0 HB2 SER A 28 43.439 -9.601 4.978 1.00 6.54 H new ATOM 0 HB3 SER A 28 43.048 -8.987 6.572 1.00 6.54 H new ATOM 0 HG SER A 28 44.058 -11.071 6.658 1.00 6.97 H new ATOM 435 N GLU A 29 41.293 -7.267 5.675 1.00 5.49 N ATOM 436 CA GLU A 29 41.059 -5.894 5.247 1.00 4.97 C ATOM 437 C GLU A 29 41.819 -5.598 3.958 1.00 4.84 C ATOM 438 O GLU A 29 41.298 -4.942 3.057 1.00 4.48 O ATOM 439 CB GLU A 29 41.497 -4.921 6.342 1.00 4.89 C ATOM 440 CG GLU A 29 40.923 -3.522 6.182 1.00 4.40 C ATOM 441 CD GLU A 29 41.495 -2.539 7.184 1.00 4.54 C ATOM 442 OE1 GLU A 29 42.559 -1.949 6.897 1.00 4.58 O ATOM 443 OE2 GLU A 29 40.879 -2.356 8.256 1.00 4.76 O ATOM 0 H GLU A 29 41.659 -7.356 6.623 1.00 5.49 H new ATOM 0 HA GLU A 29 39.992 -5.768 5.061 1.00 4.97 H new ATOM 0 HB2 GLU A 29 41.196 -5.319 7.311 1.00 4.89 H new ATOM 0 HB3 GLU A 29 42.585 -4.859 6.347 1.00 4.89 H new ATOM 0 HG2 GLU A 29 41.124 -3.164 5.172 1.00 4.40 H new ATOM 0 HG3 GLU A 29 39.840 -3.563 6.296 1.00 4.40 H new ATOM 450 N LYS A 30 43.041 -6.117 3.868 1.00 5.20 N ATOM 451 CA LYS A 30 43.882 -5.893 2.697 1.00 5.23 C ATOM 452 C LYS A 30 43.163 -6.294 1.414 1.00 5.19 C ATOM 453 O LYS A 30 43.126 -5.538 0.452 1.00 4.95 O ATOM 454 CB LYS A 30 45.188 -6.681 2.842 1.00 5.76 C ATOM 455 CG LYS A 30 45.969 -6.844 1.544 1.00 6.10 C ATOM 456 CD LYS A 30 46.408 -5.502 0.981 1.00 6.00 C ATOM 457 CE LYS A 30 47.225 -5.675 -0.290 1.00 6.45 C ATOM 458 NZ LYS A 30 48.475 -6.448 -0.045 1.00 7.08 N ATOM 0 H LYS A 30 43.470 -6.695 4.591 1.00 5.20 H new ATOM 0 HA LYS A 30 44.106 -4.828 2.633 1.00 5.23 H new ATOM 0 HB2 LYS A 30 45.822 -6.180 3.573 1.00 5.76 H new ATOM 0 HB3 LYS A 30 44.960 -7.669 3.242 1.00 5.76 H new ATOM 0 HG2 LYS A 30 46.845 -7.468 1.722 1.00 6.10 H new ATOM 0 HG3 LYS A 30 45.352 -7.362 0.810 1.00 6.10 H new ATOM 0 HD2 LYS A 30 45.531 -4.889 0.771 1.00 6.00 H new ATOM 0 HD3 LYS A 30 46.999 -4.969 1.726 1.00 6.00 H new ATOM 0 HE2 LYS A 30 46.623 -6.186 -1.042 1.00 6.45 H new ATOM 0 HE3 LYS A 30 47.477 -4.695 -0.696 1.00 6.45 H new ATOM 0 HZ1 LYS A 30 49.112 -6.345 -0.860 1.00 7.08 H new ATOM 0 HZ2 LYS A 30 48.945 -6.087 0.810 1.00 7.08 H new ATOM 0 HZ3 LYS A 30 48.242 -7.453 0.087 1.00 7.08 H new ATOM 472 N ASP A 31 42.562 -7.466 1.395 1.00 5.49 N ATOM 473 CA ASP A 31 41.845 -7.888 0.208 1.00 5.55 C ATOM 474 C ASP A 31 40.754 -6.875 -0.108 1.00 5.01 C ATOM 475 O ASP A 31 40.592 -6.451 -1.251 1.00 4.91 O ATOM 476 CB ASP A 31 41.242 -9.279 0.406 1.00 6.02 C ATOM 477 CG ASP A 31 42.304 -10.359 0.481 1.00 6.57 C ATOM 478 OD1 ASP A 31 42.889 -10.540 1.569 1.00 6.86 O ATOM 479 OD2 ASP A 31 42.549 -11.023 -0.547 1.00 6.91 O ATOM 0 H ASP A 31 42.554 -8.131 2.169 1.00 5.49 H new ATOM 0 HA ASP A 31 42.542 -7.941 -0.629 1.00 5.55 H new ATOM 0 HB2 ASP A 31 40.650 -9.290 1.321 1.00 6.02 H new ATOM 0 HB3 ASP A 31 40.561 -9.498 -0.416 1.00 6.02 H new ATOM 484 N LEU A 32 40.068 -6.439 0.945 1.00 4.72 N ATOM 485 CA LEU A 32 38.973 -5.490 0.840 1.00 4.23 C ATOM 486 C LEU A 32 39.422 -4.147 0.277 1.00 3.82 C ATOM 487 O LEU A 32 38.693 -3.509 -0.475 1.00 3.55 O ATOM 488 CB LEU A 32 38.351 -5.284 2.214 1.00 4.13 C ATOM 489 CG LEU A 32 37.221 -4.261 2.261 1.00 3.86 C ATOM 490 CD1 LEU A 32 35.895 -4.951 2.526 1.00 4.25 C ATOM 491 CD2 LEU A 32 37.514 -3.207 3.316 1.00 3.73 C ATOM 0 H LEU A 32 40.261 -6.739 1.901 1.00 4.72 H new ATOM 0 HA LEU A 32 38.241 -5.906 0.147 1.00 4.23 H new ATOM 0 HB2 LEU A 32 37.970 -6.241 2.571 1.00 4.13 H new ATOM 0 HB3 LEU A 32 39.132 -4.973 2.907 1.00 4.13 H new ATOM 0 HG LEU A 32 37.151 -3.763 1.294 1.00 3.86 H new ATOM 0 HD11 LEU A 32 35.098 -4.208 2.557 1.00 4.25 H new ATOM 0 HD12 LEU A 32 35.692 -5.668 1.730 1.00 4.25 H new ATOM 0 HD13 LEU A 32 35.941 -5.473 3.482 1.00 4.25 H new ATOM 0 HD21 LEU A 32 36.701 -2.482 3.341 1.00 3.73 H new ATOM 0 HD22 LEU A 32 37.605 -3.684 4.292 1.00 3.73 H new ATOM 0 HD23 LEU A 32 38.447 -2.698 3.073 1.00 3.73 H new ATOM 503 N ARG A 33 40.607 -3.694 0.642 1.00 3.89 N ATOM 504 CA ARG A 33 41.072 -2.425 0.143 1.00 3.67 C ATOM 505 C ARG A 33 41.170 -2.457 -1.380 1.00 3.83 C ATOM 506 O ARG A 33 40.798 -1.517 -2.043 1.00 3.57 O ATOM 507 CB ARG A 33 42.409 -2.017 0.790 1.00 3.95 C ATOM 508 CG ARG A 33 43.552 -2.971 0.550 1.00 4.34 C ATOM 509 CD ARG A 33 44.897 -2.272 0.673 1.00 4.72 C ATOM 510 NE ARG A 33 45.053 -1.207 -0.313 1.00 5.30 N ATOM 511 CZ ARG A 33 46.167 -0.499 -0.463 1.00 5.77 C ATOM 512 NH1 ARG A 33 47.222 -0.746 0.304 1.00 5.63 N ATOM 513 NH2 ARG A 33 46.230 0.455 -1.382 1.00 6.56 N ATOM 0 H ARG A 33 41.249 -4.178 1.269 1.00 3.89 H new ATOM 0 HA ARG A 33 40.343 -1.663 0.420 1.00 3.67 H new ATOM 0 HB2 ARG A 33 42.692 -1.034 0.414 1.00 3.95 H new ATOM 0 HB3 ARG A 33 42.259 -1.917 1.865 1.00 3.95 H new ATOM 0 HG2 ARG A 33 43.500 -3.790 1.267 1.00 4.34 H new ATOM 0 HG3 ARG A 33 43.458 -3.410 -0.443 1.00 4.34 H new ATOM 0 HD2 ARG A 33 44.999 -1.856 1.675 1.00 4.72 H new ATOM 0 HD3 ARG A 33 45.697 -3.001 0.548 1.00 4.72 H new ATOM 0 HE ARG A 33 44.262 -0.994 -0.921 1.00 5.30 H new ATOM 0 HH11 ARG A 33 47.178 -1.481 1.010 1.00 5.63 H new ATOM 0 HH12 ARG A 33 48.076 -0.201 0.187 1.00 5.63 H new ATOM 0 HH21 ARG A 33 45.422 0.646 -1.975 1.00 6.56 H new ATOM 0 HH22 ARG A 33 47.086 0.998 -1.496 1.00 6.56 H new ATOM 527 N GLU A 34 41.584 -3.569 -1.951 1.00 4.29 N ATOM 528 CA GLU A 34 41.734 -3.637 -3.402 1.00 4.54 C ATOM 529 C GLU A 34 40.447 -3.267 -4.164 1.00 4.17 C ATOM 530 O GLU A 34 40.500 -2.564 -5.180 1.00 4.17 O ATOM 531 CB GLU A 34 42.192 -5.032 -3.818 1.00 5.12 C ATOM 532 CG GLU A 34 43.475 -5.481 -3.138 1.00 5.67 C ATOM 533 CD GLU A 34 43.941 -6.842 -3.619 1.00 6.50 C ATOM 534 OE1 GLU A 34 43.389 -7.859 -3.149 1.00 6.86 O ATOM 535 OE2 GLU A 34 44.861 -6.890 -4.463 1.00 6.88 O ATOM 0 H GLU A 34 41.820 -4.426 -1.451 1.00 4.29 H new ATOM 0 HA GLU A 34 42.487 -2.896 -3.669 1.00 4.54 H new ATOM 0 HB2 GLU A 34 41.401 -5.747 -3.591 1.00 5.12 H new ATOM 0 HB3 GLU A 34 42.338 -5.050 -4.898 1.00 5.12 H new ATOM 0 HG2 GLU A 34 44.258 -4.746 -3.324 1.00 5.67 H new ATOM 0 HG3 GLU A 34 43.319 -5.514 -2.060 1.00 5.67 H new ATOM 542 N LEU A 35 39.292 -3.671 -3.643 1.00 3.97 N ATOM 543 CA LEU A 35 38.022 -3.441 -4.348 1.00 3.73 C ATOM 544 C LEU A 35 37.613 -1.974 -4.388 1.00 3.22 C ATOM 545 O LEU A 35 36.985 -1.536 -5.350 1.00 3.17 O ATOM 546 CB LEU A 35 36.872 -4.260 -3.739 1.00 3.73 C ATOM 547 CG LEU A 35 37.157 -4.923 -2.394 1.00 4.04 C ATOM 548 CD1 LEU A 35 35.858 -5.356 -1.719 1.00 4.24 C ATOM 549 CD2 LEU A 35 38.080 -6.114 -2.577 1.00 4.42 C ATOM 0 H LEU A 35 39.202 -4.153 -2.749 1.00 3.97 H new ATOM 0 HA LEU A 35 38.206 -3.771 -5.370 1.00 3.73 H new ATOM 0 HB2 LEU A 35 36.009 -3.605 -3.622 1.00 3.73 H new ATOM 0 HB3 LEU A 35 36.589 -5.036 -4.451 1.00 3.73 H new ATOM 0 HG LEU A 35 37.651 -4.194 -1.751 1.00 4.04 H new ATOM 0 HD11 LEU A 35 36.084 -5.826 -0.762 1.00 4.24 H new ATOM 0 HD12 LEU A 35 35.225 -4.484 -1.554 1.00 4.24 H new ATOM 0 HD13 LEU A 35 35.335 -6.068 -2.358 1.00 4.24 H new ATOM 0 HD21 LEU A 35 38.274 -6.576 -1.609 1.00 4.42 H new ATOM 0 HD22 LEU A 35 37.609 -6.841 -3.238 1.00 4.42 H new ATOM 0 HD23 LEU A 35 39.021 -5.781 -3.015 1.00 4.42 H new ATOM 561 N PHE A 36 37.970 -1.218 -3.363 1.00 2.92 N ATOM 562 CA PHE A 36 37.583 0.187 -3.301 1.00 2.53 C ATOM 563 C PHE A 36 38.032 0.979 -4.527 1.00 2.79 C ATOM 564 O PHE A 36 37.455 2.021 -4.838 1.00 2.71 O ATOM 565 CB PHE A 36 38.076 0.850 -2.006 1.00 2.33 C ATOM 566 CG PHE A 36 39.562 0.860 -1.778 1.00 2.64 C ATOM 567 CD1 PHE A 36 40.486 0.992 -2.803 1.00 3.18 C ATOM 568 CD2 PHE A 36 40.029 0.733 -0.497 1.00 2.74 C ATOM 569 CE1 PHE A 36 41.846 0.992 -2.543 1.00 3.84 C ATOM 570 CE2 PHE A 36 41.381 0.736 -0.226 1.00 3.25 C ATOM 571 CZ PHE A 36 42.293 0.864 -1.249 1.00 3.84 C ATOM 0 H PHE A 36 38.521 -1.546 -2.570 1.00 2.92 H new ATOM 0 HA PHE A 36 36.493 0.203 -3.298 1.00 2.53 H new ATOM 0 HB2 PHE A 36 37.723 1.881 -1.995 1.00 2.33 H new ATOM 0 HB3 PHE A 36 37.606 0.343 -1.163 1.00 2.33 H new ATOM 0 HD1 PHE A 36 40.140 1.097 -3.821 1.00 3.18 H new ATOM 0 HD2 PHE A 36 39.326 0.629 0.316 1.00 2.74 H new ATOM 0 HE1 PHE A 36 42.553 1.092 -3.353 1.00 3.84 H new ATOM 0 HE2 PHE A 36 41.726 0.638 0.793 1.00 3.25 H new ATOM 0 HZ PHE A 36 43.352 0.864 -1.037 1.00 3.84 H new ATOM 581 N GLU A 37 39.056 0.492 -5.223 1.00 3.23 N ATOM 582 CA GLU A 37 39.576 1.209 -6.380 1.00 3.62 C ATOM 583 C GLU A 37 38.556 1.235 -7.505 1.00 3.69 C ATOM 584 O GLU A 37 38.409 2.240 -8.202 1.00 3.94 O ATOM 585 CB GLU A 37 40.886 0.580 -6.843 1.00 4.13 C ATOM 586 CG GLU A 37 41.900 0.446 -5.719 1.00 4.40 C ATOM 587 CD GLU A 37 43.163 -0.276 -6.147 1.00 5.13 C ATOM 588 OE1 GLU A 37 44.075 0.389 -6.684 1.00 5.27 O ATOM 589 OE2 GLU A 37 43.241 -1.507 -5.946 1.00 5.70 O ATOM 0 H GLU A 37 39.535 -0.383 -5.009 1.00 3.23 H new ATOM 0 HA GLU A 37 39.773 2.241 -6.089 1.00 3.62 H new ATOM 0 HB2 GLU A 37 40.683 -0.405 -7.263 1.00 4.13 H new ATOM 0 HB3 GLU A 37 41.313 1.186 -7.642 1.00 4.13 H new ATOM 0 HG2 GLU A 37 42.161 1.439 -5.352 1.00 4.40 H new ATOM 0 HG3 GLU A 37 41.444 -0.091 -4.887 1.00 4.40 H new ATOM 596 N GLN A 38 37.829 0.137 -7.657 1.00 3.55 N ATOM 597 CA GLN A 38 36.815 0.032 -8.694 1.00 3.66 C ATOM 598 C GLN A 38 35.600 0.891 -8.360 1.00 3.45 C ATOM 599 O GLN A 38 34.546 0.754 -8.982 1.00 3.63 O ATOM 600 CB GLN A 38 36.384 -1.423 -8.865 1.00 3.66 C ATOM 601 CG GLN A 38 37.548 -2.388 -9.011 1.00 4.03 C ATOM 602 CD GLN A 38 37.100 -3.833 -9.047 1.00 4.19 C ATOM 603 OE1 GLN A 38 36.818 -4.381 -10.113 1.00 4.53 O ATOM 604 NE2 GLN A 38 37.031 -4.460 -7.879 1.00 4.12 N ATOM 0 H GLN A 38 37.924 -0.694 -7.074 1.00 3.55 H new ATOM 0 HA GLN A 38 37.249 0.393 -9.627 1.00 3.66 H new ATOM 0 HB2 GLN A 38 35.783 -1.719 -8.005 1.00 3.66 H new ATOM 0 HB3 GLN A 38 35.744 -1.503 -9.744 1.00 3.66 H new ATOM 0 HG2 GLN A 38 38.095 -2.157 -9.925 1.00 4.03 H new ATOM 0 HG3 GLN A 38 38.240 -2.246 -8.181 1.00 4.03 H new ATOM 0 HE21 GLN A 38 37.274 -3.967 -7.020 1.00 4.12 H new ATOM 0 HE22 GLN A 38 36.735 -5.435 -7.840 1.00 4.12 H new ATOM 613 N TYR A 39 35.747 1.778 -7.376 1.00 3.16 N ATOM 614 CA TYR A 39 34.647 2.642 -6.971 1.00 3.09 C ATOM 615 C TYR A 39 35.089 4.095 -6.804 1.00 3.43 C ATOM 616 O TYR A 39 34.248 4.992 -6.743 1.00 3.70 O ATOM 617 CB TYR A 39 34.029 2.131 -5.668 1.00 2.67 C ATOM 618 CG TYR A 39 33.595 0.685 -5.741 1.00 2.49 C ATOM 619 CD1 TYR A 39 32.478 0.314 -6.475 1.00 2.65 C ATOM 620 CD2 TYR A 39 34.298 -0.307 -5.070 1.00 2.40 C ATOM 621 CE1 TYR A 39 32.072 -1.005 -6.540 1.00 2.74 C ATOM 622 CE2 TYR A 39 33.900 -1.629 -5.129 1.00 2.52 C ATOM 623 CZ TYR A 39 32.807 -1.978 -5.881 1.00 2.70 C ATOM 624 OH TYR A 39 32.387 -3.289 -5.929 1.00 3.03 O ATOM 0 H TYR A 39 36.611 1.914 -6.851 1.00 3.16 H new ATOM 0 HA TYR A 39 33.901 2.614 -7.766 1.00 3.09 H new ATOM 0 HB2 TYR A 39 34.752 2.246 -4.861 1.00 2.67 H new ATOM 0 HB3 TYR A 39 33.168 2.750 -5.415 1.00 2.67 H new ATOM 0 HD1 TYR A 39 31.916 1.069 -7.005 1.00 2.65 H new ATOM 0 HD2 TYR A 39 35.171 -0.041 -4.492 1.00 2.40 H new ATOM 0 HE1 TYR A 39 31.189 -1.276 -7.100 1.00 2.74 H new ATOM 0 HE2 TYR A 39 34.447 -2.385 -4.585 1.00 2.52 H new ATOM 0 HH TYR A 39 33.008 -3.850 -5.419 1.00 3.03 H new ATOM 634 N GLY A 40 36.400 4.338 -6.732 1.00 3.54 N ATOM 635 CA GLY A 40 36.864 5.711 -6.578 1.00 3.95 C ATOM 636 C GLY A 40 38.206 5.843 -5.880 1.00 4.02 C ATOM 637 O GLY A 40 39.016 4.915 -5.884 1.00 3.95 O ATOM 0 H GLY A 40 37.132 3.629 -6.776 1.00 3.54 H new ATOM 0 HA2 GLY A 40 36.934 6.171 -7.564 1.00 3.95 H new ATOM 0 HA3 GLY A 40 36.118 6.273 -6.016 1.00 3.95 H new ATOM 641 N ALA A 41 38.432 7.015 -5.277 1.00 4.22 N ATOM 642 CA ALA A 41 39.683 7.306 -4.580 1.00 4.36 C ATOM 643 C ALA A 41 39.526 7.246 -3.062 1.00 3.96 C ATOM 644 O ALA A 41 39.186 8.243 -2.423 1.00 3.97 O ATOM 645 CB ALA A 41 40.204 8.673 -4.994 1.00 4.90 C ATOM 0 H ALA A 41 37.758 7.780 -5.260 1.00 4.22 H new ATOM 0 HA ALA A 41 40.401 6.537 -4.865 1.00 4.36 H new ATOM 0 HB1 ALA A 41 41.137 8.881 -4.469 1.00 4.90 H new ATOM 0 HB2 ALA A 41 40.382 8.684 -6.069 1.00 4.90 H new ATOM 0 HB3 ALA A 41 39.467 9.435 -4.741 1.00 4.90 H new ATOM 651 N VAL A 42 39.788 6.072 -2.497 1.00 3.69 N ATOM 652 CA VAL A 42 39.699 5.851 -1.048 1.00 3.34 C ATOM 653 C VAL A 42 40.531 6.870 -0.265 1.00 3.70 C ATOM 654 O VAL A 42 41.428 7.513 -0.811 1.00 4.23 O ATOM 655 CB VAL A 42 40.155 4.414 -0.698 1.00 3.12 C ATOM 656 CG1 VAL A 42 41.074 3.900 -1.772 1.00 2.79 C ATOM 657 CG2 VAL A 42 40.859 4.326 0.648 1.00 3.91 C ATOM 0 H VAL A 42 40.068 5.245 -3.025 1.00 3.69 H new ATOM 0 HA VAL A 42 38.656 5.981 -0.759 1.00 3.34 H new ATOM 0 HB VAL A 42 39.255 3.803 -0.634 1.00 3.12 H new ATOM 0 HG11 VAL A 42 41.394 2.888 -1.524 1.00 2.79 H new ATOM 0 HG12 VAL A 42 40.548 3.890 -2.727 1.00 2.79 H new ATOM 0 HG13 VAL A 42 41.947 4.549 -1.845 1.00 2.79 H new ATOM 0 HG21 VAL A 42 41.155 3.294 0.837 1.00 3.91 H new ATOM 0 HG22 VAL A 42 41.745 4.961 0.638 1.00 3.91 H new ATOM 0 HG23 VAL A 42 40.183 4.660 1.435 1.00 3.91 H new ATOM 667 N TYR A 43 40.219 7.002 1.022 1.00 3.46 N ATOM 668 CA TYR A 43 40.917 7.925 1.905 1.00 3.81 C ATOM 669 C TYR A 43 40.856 7.419 3.343 1.00 3.64 C ATOM 670 O TYR A 43 41.854 7.445 4.064 1.00 3.92 O ATOM 671 CB TYR A 43 40.300 9.325 1.811 1.00 4.02 C ATOM 672 CG TYR A 43 40.938 10.337 2.739 1.00 4.43 C ATOM 673 CD1 TYR A 43 42.060 11.058 2.349 1.00 4.86 C ATOM 674 CD2 TYR A 43 40.416 10.570 4.007 1.00 4.46 C ATOM 675 CE1 TYR A 43 42.643 11.983 3.195 1.00 5.24 C ATOM 676 CE2 TYR A 43 40.994 11.493 4.856 1.00 4.87 C ATOM 677 CZ TYR A 43 42.107 12.197 4.447 1.00 5.22 C ATOM 678 OH TYR A 43 42.684 13.117 5.289 1.00 5.63 O ATOM 0 H TYR A 43 39.477 6.472 1.479 1.00 3.46 H new ATOM 0 HA TYR A 43 41.960 7.984 1.594 1.00 3.81 H new ATOM 0 HB2 TYR A 43 40.386 9.682 0.785 1.00 4.02 H new ATOM 0 HB3 TYR A 43 39.236 9.259 2.037 1.00 4.02 H new ATOM 0 HD1 TYR A 43 42.483 10.893 1.369 1.00 4.86 H new ATOM 0 HD2 TYR A 43 39.545 10.021 4.333 1.00 4.46 H new ATOM 0 HE1 TYR A 43 43.515 12.536 2.876 1.00 5.24 H new ATOM 0 HE2 TYR A 43 40.576 11.663 5.837 1.00 4.87 H new ATOM 0 HH TYR A 43 42.184 13.148 6.132 1.00 5.63 H new ATOM 688 N GLU A 44 39.675 6.955 3.751 1.00 3.26 N ATOM 689 CA GLU A 44 39.483 6.437 5.106 1.00 3.20 C ATOM 690 C GLU A 44 38.647 5.156 5.090 1.00 2.81 C ATOM 691 O GLU A 44 37.570 5.117 4.496 1.00 2.54 O ATOM 692 CB GLU A 44 38.808 7.491 5.987 1.00 3.40 C ATOM 693 CG GLU A 44 38.623 7.052 7.430 1.00 3.50 C ATOM 694 CD GLU A 44 38.001 8.132 8.293 1.00 4.22 C ATOM 695 OE1 GLU A 44 36.755 8.208 8.343 1.00 4.91 O ATOM 696 OE2 GLU A 44 38.758 8.904 8.919 1.00 4.36 O ATOM 0 H GLU A 44 38.840 6.927 3.166 1.00 3.26 H new ATOM 0 HA GLU A 44 40.464 6.202 5.519 1.00 3.20 H new ATOM 0 HB2 GLU A 44 39.403 8.404 5.968 1.00 3.40 H new ATOM 0 HB3 GLU A 44 37.834 7.737 5.563 1.00 3.40 H new ATOM 0 HG2 GLU A 44 37.993 6.163 7.457 1.00 3.50 H new ATOM 0 HG3 GLU A 44 39.590 6.771 7.847 1.00 3.50 H new ATOM 703 N ILE A 45 39.150 4.110 5.748 1.00 2.90 N ATOM 704 CA ILE A 45 38.451 2.829 5.801 1.00 2.73 C ATOM 705 C ILE A 45 38.398 2.267 7.219 1.00 3.01 C ATOM 706 O ILE A 45 39.429 2.099 7.870 1.00 3.32 O ATOM 707 CB ILE A 45 39.131 1.797 4.897 1.00 2.75 C ATOM 708 CG1 ILE A 45 39.006 2.198 3.437 1.00 2.52 C ATOM 709 CG2 ILE A 45 38.527 0.422 5.114 1.00 2.81 C ATOM 710 CD1 ILE A 45 40.033 1.533 2.554 1.00 2.72 C ATOM 0 H ILE A 45 40.038 4.127 6.250 1.00 2.90 H new ATOM 0 HA ILE A 45 37.435 3.018 5.455 1.00 2.73 H new ATOM 0 HB ILE A 45 40.189 1.761 5.157 1.00 2.75 H new ATOM 0 HG12 ILE A 45 38.008 1.943 3.080 1.00 2.52 H new ATOM 0 HG13 ILE A 45 39.108 3.280 3.353 1.00 2.52 H new ATOM 0 HG21 ILE A 45 39.022 -0.299 4.464 1.00 2.81 H new ATOM 0 HG22 ILE A 45 38.662 0.125 6.154 1.00 2.81 H new ATOM 0 HG23 ILE A 45 37.463 0.451 4.880 1.00 2.81 H new ATOM 0 HD11 ILE A 45 39.893 1.859 1.523 1.00 2.72 H new ATOM 0 HD12 ILE A 45 41.033 1.808 2.889 1.00 2.72 H new ATOM 0 HD13 ILE A 45 39.916 0.451 2.611 1.00 2.72 H new ATOM 722 N ASN A 46 37.189 1.978 7.684 1.00 2.98 N ATOM 723 CA ASN A 46 36.990 1.431 9.021 1.00 3.34 C ATOM 724 C ASN A 46 35.975 0.288 9.019 1.00 3.49 C ATOM 725 O ASN A 46 35.019 0.298 8.244 1.00 3.30 O ATOM 726 CB ASN A 46 36.523 2.537 9.954 1.00 3.44 C ATOM 727 CG ASN A 46 37.672 3.335 10.543 1.00 3.89 C ATOM 728 OD1 ASN A 46 37.668 4.566 10.508 1.00 4.29 O ATOM 729 ND2 ASN A 46 38.656 2.642 11.105 1.00 4.16 N ATOM 0 H ASN A 46 36.329 2.114 7.153 1.00 2.98 H new ATOM 0 HA ASN A 46 37.941 1.027 9.368 1.00 3.34 H new ATOM 0 HB2 ASN A 46 35.861 3.210 9.409 1.00 3.44 H new ATOM 0 HB3 ASN A 46 35.938 2.100 10.763 1.00 3.44 H new ATOM 0 HD21 ASN A 46 39.446 3.129 11.528 1.00 4.16 H new ATOM 0 HD22 ASN A 46 38.622 1.623 11.113 1.00 4.16 H new ATOM 736 N VAL A 47 36.191 -0.697 9.888 1.00 3.90 N ATOM 737 CA VAL A 47 35.281 -1.836 10.001 1.00 4.21 C ATOM 738 C VAL A 47 34.669 -1.902 11.399 1.00 4.58 C ATOM 739 O VAL A 47 35.381 -1.791 12.399 1.00 4.76 O ATOM 740 CB VAL A 47 35.997 -3.164 9.698 1.00 4.49 C ATOM 741 CG1 VAL A 47 34.998 -4.310 9.643 1.00 4.76 C ATOM 742 CG2 VAL A 47 36.779 -3.062 8.397 1.00 4.27 C ATOM 0 H VAL A 47 36.988 -0.730 10.524 1.00 3.90 H new ATOM 0 HA VAL A 47 34.491 -1.690 9.264 1.00 4.21 H new ATOM 0 HB VAL A 47 36.702 -3.369 10.503 1.00 4.49 H new ATOM 0 HG11 VAL A 47 35.523 -5.241 9.428 1.00 4.76 H new ATOM 0 HG12 VAL A 47 34.488 -4.395 10.603 1.00 4.76 H new ATOM 0 HG13 VAL A 47 34.266 -4.117 8.859 1.00 4.76 H new ATOM 0 HG21 VAL A 47 37.279 -4.010 8.198 1.00 4.27 H new ATOM 0 HG22 VAL A 47 36.096 -2.833 7.579 1.00 4.27 H new ATOM 0 HG23 VAL A 47 37.523 -2.270 8.481 1.00 4.27 H new ATOM 752 N LEU A 48 33.352 -2.086 11.467 1.00 4.75 N ATOM 753 CA LEU A 48 32.658 -2.150 12.753 1.00 5.16 C ATOM 754 C LEU A 48 32.267 -3.574 13.103 1.00 5.98 C ATOM 755 O LEU A 48 31.130 -3.846 13.492 1.00 6.68 O ATOM 756 CB LEU A 48 31.420 -1.262 12.749 1.00 5.21 C ATOM 757 CG LEU A 48 31.653 0.179 12.301 1.00 4.88 C ATOM 758 CD1 LEU A 48 32.936 0.744 12.898 1.00 4.66 C ATOM 759 CD2 LEU A 48 31.679 0.262 10.784 1.00 4.67 C ATOM 0 H LEU A 48 32.747 -2.193 10.653 1.00 4.75 H new ATOM 0 HA LEU A 48 33.352 -1.787 13.511 1.00 5.16 H new ATOM 0 HB2 LEU A 48 30.672 -1.712 12.096 1.00 5.21 H new ATOM 0 HB3 LEU A 48 30.999 -1.249 13.754 1.00 5.21 H new ATOM 0 HG LEU A 48 30.825 0.786 12.668 1.00 4.88 H new ATOM 0 HD11 LEU A 48 33.073 1.771 12.560 1.00 4.66 H new ATOM 0 HD12 LEU A 48 32.870 0.726 13.986 1.00 4.66 H new ATOM 0 HD13 LEU A 48 33.784 0.140 12.576 1.00 4.66 H new ATOM 0 HD21 LEU A 48 31.846 1.295 10.479 1.00 4.67 H new ATOM 0 HD22 LEU A 48 32.484 -0.365 10.399 1.00 4.67 H new ATOM 0 HD23 LEU A 48 30.726 -0.085 10.384 1.00 4.67 H new ATOM 771 N ARG A 49 33.226 -4.470 12.942 1.00 6.10 N ATOM 772 CA ARG A 49 33.055 -5.886 13.260 1.00 6.94 C ATOM 773 C ARG A 49 32.085 -6.098 14.422 1.00 7.60 C ATOM 774 O ARG A 49 31.112 -6.836 14.297 1.00 7.80 O ATOM 775 CB ARG A 49 34.410 -6.517 13.615 1.00 7.01 C ATOM 776 CG ARG A 49 35.579 -5.533 13.670 1.00 6.73 C ATOM 777 CD ARG A 49 35.389 -4.461 14.741 1.00 6.74 C ATOM 778 NE ARG A 49 35.140 -5.043 16.056 1.00 6.98 N ATOM 779 CZ ARG A 49 35.626 -4.545 17.189 1.00 7.61 C ATOM 780 NH1 ARG A 49 36.387 -3.458 17.166 1.00 8.05 N ATOM 781 NH2 ARG A 49 35.355 -5.133 18.346 1.00 8.04 N ATOM 0 H ARG A 49 34.153 -4.238 12.585 1.00 6.10 H new ATOM 0 HA ARG A 49 32.638 -6.366 12.375 1.00 6.94 H new ATOM 0 HB2 ARG A 49 34.323 -7.011 14.583 1.00 7.01 H new ATOM 0 HB3 ARG A 49 34.638 -7.291 12.882 1.00 7.01 H new ATOM 0 HG2 ARG A 49 36.501 -6.080 13.867 1.00 6.73 H new ATOM 0 HG3 ARG A 49 35.693 -5.054 12.697 1.00 6.73 H new ATOM 0 HD2 ARG A 49 36.277 -3.831 14.785 1.00 6.74 H new ATOM 0 HD3 ARG A 49 34.554 -3.816 14.465 1.00 6.74 H new ATOM 0 HE ARG A 49 34.560 -5.880 16.109 1.00 6.98 H new ATOM 0 HH11 ARG A 49 36.600 -3.003 16.278 1.00 8.05 H new ATOM 0 HH12 ARG A 49 36.759 -3.077 18.036 1.00 8.05 H new ATOM 0 HH21 ARG A 49 34.772 -5.970 18.369 1.00 8.04 H new ATOM 0 HH22 ARG A 49 35.729 -4.749 19.213 1.00 8.04 H new ATOM 795 N ASP A 50 32.350 -5.448 15.549 1.00 8.17 N ATOM 796 CA ASP A 50 31.499 -5.588 16.725 1.00 8.93 C ATOM 797 C ASP A 50 30.918 -4.241 17.158 1.00 10.00 C ATOM 798 O ASP A 50 30.135 -3.637 16.425 1.00 10.66 O ATOM 799 CB ASP A 50 32.288 -6.249 17.862 1.00 8.92 C ATOM 800 CG ASP A 50 31.446 -6.474 19.103 1.00 9.49 C ATOM 801 OD1 ASP A 50 30.371 -7.096 18.984 1.00 10.05 O ATOM 802 OD2 ASP A 50 31.859 -6.020 20.192 1.00 9.56 O ATOM 0 H ASP A 50 33.145 -4.821 15.674 1.00 8.17 H new ATOM 0 HA ASP A 50 30.655 -6.229 16.469 1.00 8.93 H new ATOM 0 HB2 ASP A 50 32.683 -7.205 17.517 1.00 8.92 H new ATOM 0 HB3 ASP A 50 33.144 -5.624 18.117 1.00 8.92 H new ATOM 807 N ARG A 51 31.295 -3.795 18.354 1.00 10.35 N ATOM 808 CA ARG A 51 30.832 -2.526 18.919 1.00 11.49 C ATOM 809 C ARG A 51 29.419 -2.649 19.484 1.00 12.18 C ATOM 810 O ARG A 51 29.206 -2.441 20.678 1.00 13.08 O ATOM 811 CB ARG A 51 30.893 -1.395 17.888 1.00 11.98 C ATOM 812 CG ARG A 51 32.281 -1.170 17.313 1.00 11.65 C ATOM 813 CD ARG A 51 32.325 0.077 16.446 1.00 12.32 C ATOM 814 NE ARG A 51 31.905 1.265 17.181 1.00 13.34 N ATOM 815 CZ ARG A 51 32.432 2.472 17.000 1.00 14.19 C ATOM 816 NH1 ARG A 51 33.397 2.653 16.106 1.00 14.21 N ATOM 817 NH2 ARG A 51 31.994 3.502 17.712 1.00 15.15 N ATOM 0 H ARG A 51 31.934 -4.306 18.963 1.00 10.35 H new ATOM 0 HA ARG A 51 31.508 -2.278 19.737 1.00 11.49 H new ATOM 0 HB2 ARG A 51 30.204 -1.619 17.074 1.00 11.98 H new ATOM 0 HB3 ARG A 51 30.548 -0.472 18.353 1.00 11.98 H new ATOM 0 HG2 ARG A 51 33.002 -1.076 18.125 1.00 11.65 H new ATOM 0 HG3 ARG A 51 32.577 -2.037 16.722 1.00 11.65 H new ATOM 0 HD2 ARG A 51 33.338 0.222 16.070 1.00 12.32 H new ATOM 0 HD3 ARG A 51 31.679 -0.061 15.579 1.00 12.32 H new ATOM 0 HE ARG A 51 31.164 1.164 17.874 1.00 13.34 H new ATOM 0 HH11 ARG A 51 33.736 1.864 15.555 1.00 14.21 H new ATOM 0 HH12 ARG A 51 33.799 3.581 15.970 1.00 14.21 H new ATOM 0 HH21 ARG A 51 31.252 3.368 18.399 1.00 15.15 H new ATOM 0 HH22 ARG A 51 32.399 4.428 17.572 1.00 15.15 H new ATOM 831 N SER A 52 28.454 -2.989 18.632 1.00 11.87 N ATOM 832 CA SER A 52 27.072 -3.128 19.078 1.00 12.68 C ATOM 833 C SER A 52 26.196 -3.806 18.025 1.00 13.26 C ATOM 834 O SER A 52 25.227 -3.218 17.542 1.00 14.27 O ATOM 835 CB SER A 52 26.491 -1.755 19.426 1.00 13.39 C ATOM 836 OG SER A 52 26.528 -0.886 18.308 1.00 13.55 O ATOM 0 H SER A 52 28.602 -3.171 17.639 1.00 11.87 H new ATOM 0 HA SER A 52 27.078 -3.762 19.965 1.00 12.68 H new ATOM 0 HB2 SER A 52 25.462 -1.868 19.768 1.00 13.39 H new ATOM 0 HB3 SER A 52 27.054 -1.317 20.250 1.00 13.39 H new ATOM 0 HG SER A 52 25.970 -1.252 17.590 1.00 13.55 H new ATOM 842 N GLN A 53 26.539 -5.041 17.669 1.00 12.75 N ATOM 843 CA GLN A 53 25.766 -5.792 16.690 1.00 13.40 C ATOM 844 C GLN A 53 25.175 -7.042 17.330 1.00 13.68 C ATOM 845 O GLN A 53 25.229 -7.204 18.547 1.00 13.65 O ATOM 846 CB GLN A 53 26.650 -6.174 15.503 1.00 13.00 C ATOM 847 CG GLN A 53 28.015 -6.717 15.903 1.00 12.36 C ATOM 848 CD GLN A 53 28.235 -8.148 15.448 1.00 12.33 C ATOM 849 OE1 GLN A 53 29.362 -8.557 15.173 1.00 12.42 O ATOM 850 NE2 GLN A 53 27.158 -8.919 15.372 1.00 12.38 N ATOM 0 H GLN A 53 27.346 -5.540 18.044 1.00 12.75 H new ATOM 0 HA GLN A 53 24.950 -5.164 16.333 1.00 13.40 H new ATOM 0 HB2 GLN A 53 26.133 -6.923 14.903 1.00 13.00 H new ATOM 0 HB3 GLN A 53 26.789 -5.298 14.869 1.00 13.00 H new ATOM 0 HG2 GLN A 53 28.792 -6.082 15.478 1.00 12.36 H new ATOM 0 HG3 GLN A 53 28.118 -6.665 16.987 1.00 12.36 H new ATOM 0 HE21 GLN A 53 26.241 -8.540 15.609 1.00 12.38 H new ATOM 0 HE22 GLN A 53 27.247 -9.891 15.076 1.00 12.38 H new ATOM 859 N ASN A 54 24.597 -7.916 16.512 1.00 14.10 N ATOM 860 CA ASN A 54 24.017 -9.158 17.012 1.00 14.53 C ATOM 861 C ASN A 54 25.077 -9.952 17.741 1.00 13.85 C ATOM 862 O ASN A 54 26.254 -9.668 17.553 1.00 13.42 O ATOM 863 CB ASN A 54 23.413 -9.962 15.856 1.00 15.46 C ATOM 864 CG ASN A 54 22.489 -9.125 14.992 1.00 16.16 C ATOM 865 OD1 ASN A 54 21.288 -9.040 15.247 1.00 16.77 O ATOM 866 ND2 ASN A 54 23.049 -8.501 13.960 1.00 16.22 N ATOM 0 H ASN A 54 24.518 -7.788 15.503 1.00 14.10 H new ATOM 0 HA ASN A 54 23.214 -8.931 17.713 1.00 14.53 H new ATOM 0 HB2 ASN A 54 24.216 -10.366 15.239 1.00 15.46 H new ATOM 0 HB3 ASN A 54 22.861 -10.812 16.257 1.00 15.46 H new ATOM 0 HD21 ASN A 54 22.478 -7.924 13.342 1.00 16.22 H new ATOM 0 HD22 ASN A 54 24.049 -8.600 13.786 1.00 16.22 H new ATOM 873 N PRO A 55 24.690 -10.981 18.544 1.00 13.90 N ATOM 874 CA PRO A 55 25.606 -11.767 19.337 1.00 13.47 C ATOM 875 C PRO A 55 27.057 -11.433 19.042 1.00 12.33 C ATOM 876 O PRO A 55 27.781 -12.223 18.437 1.00 11.94 O ATOM 877 CB PRO A 55 25.195 -13.170 18.915 1.00 13.78 C ATOM 878 CG PRO A 55 23.698 -13.065 18.732 1.00 14.58 C ATOM 879 CD PRO A 55 23.360 -11.579 18.658 1.00 14.57 C ATOM 0 HA PRO A 55 25.552 -11.601 20.413 1.00 13.47 H new ATOM 0 HB2 PRO A 55 25.691 -13.472 17.993 1.00 13.78 H new ATOM 0 HB3 PRO A 55 25.455 -13.909 19.673 1.00 13.78 H new ATOM 0 HG2 PRO A 55 23.384 -13.578 17.823 1.00 14.58 H new ATOM 0 HG3 PRO A 55 23.174 -13.539 19.562 1.00 14.58 H new ATOM 0 HD2 PRO A 55 22.730 -11.344 17.800 1.00 14.57 H new ATOM 0 HD3 PRO A 55 22.830 -11.234 19.546 1.00 14.57 H new ATOM 887 N PRO A 56 27.481 -10.228 19.501 1.00 11.90 N ATOM 888 CA PRO A 56 28.800 -9.670 19.318 1.00 10.89 C ATOM 889 C PRO A 56 29.787 -10.648 18.722 1.00 10.43 C ATOM 890 O PRO A 56 30.256 -11.580 19.374 1.00 10.34 O ATOM 891 CB PRO A 56 29.113 -9.272 20.750 1.00 11.10 C ATOM 892 CG PRO A 56 27.768 -8.847 21.311 1.00 12.06 C ATOM 893 CD PRO A 56 26.718 -9.297 20.322 1.00 12.52 C ATOM 0 HA PRO A 56 28.858 -8.851 18.601 1.00 10.89 H new ATOM 0 HB2 PRO A 56 29.536 -10.104 21.313 1.00 11.10 H new ATOM 0 HB3 PRO A 56 29.838 -8.459 20.790 1.00 11.10 H new ATOM 0 HG2 PRO A 56 27.597 -9.299 22.288 1.00 12.06 H new ATOM 0 HG3 PRO A 56 27.731 -7.766 21.449 1.00 12.06 H new ATOM 0 HD2 PRO A 56 25.872 -9.779 20.812 1.00 12.52 H new ATOM 0 HD3 PRO A 56 26.319 -8.467 19.739 1.00 12.52 H new ATOM 901 N GLN A 57 30.086 -10.400 17.459 1.00 10.30 N ATOM 902 CA GLN A 57 30.975 -11.247 16.690 1.00 10.00 C ATOM 903 C GLN A 57 31.814 -10.430 15.700 1.00 8.88 C ATOM 904 O GLN A 57 32.815 -9.825 16.084 1.00 8.54 O ATOM 905 CB GLN A 57 30.149 -12.315 15.962 1.00 10.45 C ATOM 906 CG GLN A 57 28.750 -11.846 15.559 1.00 11.57 C ATOM 907 CD GLN A 57 28.028 -12.851 14.683 1.00 12.05 C ATOM 908 OE1 GLN A 57 28.255 -14.056 14.787 1.00 11.79 O ATOM 909 NE2 GLN A 57 27.155 -12.359 13.811 1.00 12.91 N ATOM 0 H GLN A 57 29.718 -9.604 16.939 1.00 10.30 H new ATOM 0 HA GLN A 57 31.674 -11.733 17.371 1.00 10.00 H new ATOM 0 HB2 GLN A 57 30.688 -12.631 15.068 1.00 10.45 H new ATOM 0 HB3 GLN A 57 30.057 -13.191 16.605 1.00 10.45 H new ATOM 0 HG2 GLN A 57 28.160 -11.662 16.457 1.00 11.57 H new ATOM 0 HG3 GLN A 57 28.828 -10.897 15.029 1.00 11.57 H new ATOM 0 HE21 GLN A 57 26.998 -11.352 13.759 1.00 12.91 H new ATOM 0 HE22 GLN A 57 26.641 -12.988 13.193 1.00 12.91 H new ATOM 918 N SER A 58 31.400 -10.405 14.431 1.00 8.48 N ATOM 919 CA SER A 58 32.119 -9.664 13.400 1.00 7.48 C ATOM 920 C SER A 58 31.241 -9.471 12.168 1.00 7.24 C ATOM 921 O SER A 58 31.333 -10.228 11.201 1.00 7.69 O ATOM 922 CB SER A 58 33.406 -10.395 13.011 1.00 7.67 C ATOM 923 OG SER A 58 34.322 -10.437 14.092 1.00 7.71 O ATOM 0 H SER A 58 30.569 -10.891 14.095 1.00 8.48 H new ATOM 0 HA SER A 58 32.378 -8.686 13.805 1.00 7.48 H new ATOM 0 HB2 SER A 58 33.168 -11.410 12.694 1.00 7.67 H new ATOM 0 HB3 SER A 58 33.868 -9.895 12.160 1.00 7.67 H new ATOM 0 HG SER A 58 33.978 -9.897 14.834 1.00 7.71 H new ATOM 929 N LYS A 59 30.390 -8.451 12.210 1.00 6.67 N ATOM 930 CA LYS A 59 29.491 -8.157 11.104 1.00 6.51 C ATOM 931 C LYS A 59 30.269 -7.744 9.860 1.00 6.29 C ATOM 932 O LYS A 59 31.250 -7.006 9.945 1.00 6.35 O ATOM 933 CB LYS A 59 28.516 -7.047 11.499 1.00 6.45 C ATOM 934 CG LYS A 59 29.192 -5.714 11.777 1.00 6.21 C ATOM 935 CD LYS A 59 28.239 -4.727 12.432 1.00 6.05 C ATOM 936 CE LYS A 59 27.102 -4.338 11.501 1.00 6.48 C ATOM 937 NZ LYS A 59 26.048 -3.558 12.208 1.00 6.59 N ATOM 0 H LYS A 59 30.305 -7.813 13.002 1.00 6.67 H new ATOM 0 HA LYS A 59 28.931 -9.064 10.873 1.00 6.51 H new ATOM 0 HB2 LYS A 59 27.786 -6.915 10.701 1.00 6.45 H new ATOM 0 HB3 LYS A 59 27.965 -7.358 12.387 1.00 6.45 H new ATOM 0 HG2 LYS A 59 30.055 -5.871 12.424 1.00 6.21 H new ATOM 0 HG3 LYS A 59 29.566 -5.294 10.843 1.00 6.21 H new ATOM 0 HD2 LYS A 59 27.830 -5.166 13.342 1.00 6.05 H new ATOM 0 HD3 LYS A 59 28.788 -3.833 12.728 1.00 6.05 H new ATOM 0 HE2 LYS A 59 27.496 -3.749 10.673 1.00 6.48 H new ATOM 0 HE3 LYS A 59 26.661 -5.237 11.071 1.00 6.48 H new ATOM 0 HZ1 LYS A 59 25.291 -3.312 11.539 1.00 6.59 H new ATOM 0 HZ2 LYS A 59 25.654 -4.130 12.982 1.00 6.59 H new ATOM 0 HZ3 LYS A 59 26.463 -2.687 12.597 1.00 6.59 H new ATOM 951 N GLY A 60 29.826 -8.234 8.709 1.00 6.22 N ATOM 952 CA GLY A 60 30.481 -7.901 7.460 1.00 6.09 C ATOM 953 C GLY A 60 30.056 -6.547 6.928 1.00 5.44 C ATOM 954 O GLY A 60 29.457 -6.451 5.858 1.00 5.15 O ATOM 0 H GLY A 60 29.023 -8.857 8.619 1.00 6.22 H new ATOM 0 HA2 GLY A 60 31.561 -7.908 7.606 1.00 6.09 H new ATOM 0 HA3 GLY A 60 30.254 -8.667 6.719 1.00 6.09 H new ATOM 958 N CYS A 61 30.364 -5.498 7.683 1.00 5.25 N ATOM 959 CA CYS A 61 30.013 -4.141 7.288 1.00 4.69 C ATOM 960 C CYS A 61 31.216 -3.215 7.419 1.00 4.28 C ATOM 961 O CYS A 61 31.870 -3.172 8.461 1.00 4.52 O ATOM 962 CB CYS A 61 28.860 -3.617 8.145 1.00 4.94 C ATOM 963 SG CYS A 61 27.328 -4.565 7.985 1.00 5.62 S ATOM 0 H CYS A 61 30.857 -5.563 8.574 1.00 5.25 H new ATOM 0 HA CYS A 61 29.699 -4.162 6.245 1.00 4.69 H new ATOM 0 HB2 CYS A 61 29.169 -3.620 9.190 1.00 4.94 H new ATOM 0 HB3 CYS A 61 28.663 -2.580 7.874 1.00 4.94 H new ATOM 0 HG CYS A 61 26.414 -4.045 8.750 1.00 5.62 H new ATOM 969 N CYS A 62 31.505 -2.478 6.353 1.00 3.72 N ATOM 970 CA CYS A 62 32.635 -1.555 6.344 1.00 3.34 C ATOM 971 C CYS A 62 32.308 -0.316 5.521 1.00 2.85 C ATOM 972 O CYS A 62 31.579 -0.396 4.534 1.00 2.73 O ATOM 973 CB CYS A 62 33.885 -2.243 5.790 1.00 3.28 C ATOM 974 SG CYS A 62 33.763 -2.698 4.046 1.00 2.98 S ATOM 0 H CYS A 62 30.973 -2.501 5.483 1.00 3.72 H new ATOM 0 HA CYS A 62 32.833 -1.247 7.371 1.00 3.34 H new ATOM 0 HB2 CYS A 62 34.740 -1.581 5.923 1.00 3.28 H new ATOM 0 HB3 CYS A 62 34.083 -3.141 6.376 1.00 3.28 H new ATOM 0 HG CYS A 62 34.552 -1.940 3.344 1.00 2.98 H new ATOM 980 N PHE A 63 32.844 0.829 5.929 1.00 2.68 N ATOM 981 CA PHE A 63 32.588 2.071 5.215 1.00 2.38 C ATOM 982 C PHE A 63 33.890 2.732 4.772 1.00 2.10 C ATOM 983 O PHE A 63 34.873 2.766 5.512 1.00 2.27 O ATOM 984 CB PHE A 63 31.757 3.031 6.075 1.00 2.72 C ATOM 985 CG PHE A 63 32.480 3.586 7.269 1.00 3.01 C ATOM 986 CD1 PHE A 63 32.553 2.865 8.449 1.00 3.36 C ATOM 987 CD2 PHE A 63 33.075 4.835 7.213 1.00 3.06 C ATOM 988 CE1 PHE A 63 33.209 3.379 9.550 1.00 3.65 C ATOM 989 CE2 PHE A 63 33.731 5.356 8.313 1.00 3.39 C ATOM 990 CZ PHE A 63 33.798 4.626 9.482 1.00 3.65 C ATOM 0 H PHE A 63 33.452 0.922 6.742 1.00 2.68 H new ATOM 0 HA PHE A 63 32.015 1.829 4.320 1.00 2.38 H new ATOM 0 HB2 PHE A 63 31.423 3.860 5.451 1.00 2.72 H new ATOM 0 HB3 PHE A 63 30.863 2.510 6.418 1.00 2.72 H new ATOM 0 HD1 PHE A 63 32.092 1.890 8.509 1.00 3.36 H new ATOM 0 HD2 PHE A 63 33.026 5.409 6.299 1.00 3.06 H new ATOM 0 HE1 PHE A 63 33.261 2.806 10.464 1.00 3.65 H new ATOM 0 HE2 PHE A 63 34.190 6.332 8.257 1.00 3.39 H new ATOM 0 HZ PHE A 63 34.311 5.030 10.343 1.00 3.65 H new ATOM 1000 N VAL A 64 33.875 3.252 3.550 1.00 1.83 N ATOM 1001 CA VAL A 64 35.033 3.909 2.964 1.00 1.80 C ATOM 1002 C VAL A 64 34.680 5.327 2.525 1.00 1.98 C ATOM 1003 O VAL A 64 33.560 5.590 2.105 1.00 2.06 O ATOM 1004 CB VAL A 64 35.558 3.118 1.748 1.00 1.69 C ATOM 1005 CG1 VAL A 64 36.821 3.750 1.191 1.00 1.96 C ATOM 1006 CG2 VAL A 64 35.791 1.662 2.120 1.00 2.19 C ATOM 0 H VAL A 64 33.059 3.229 2.939 1.00 1.83 H new ATOM 0 HA VAL A 64 35.811 3.949 3.726 1.00 1.80 H new ATOM 0 HB VAL A 64 34.800 3.151 0.965 1.00 1.69 H new ATOM 0 HG11 VAL A 64 37.170 3.173 0.335 1.00 1.96 H new ATOM 0 HG12 VAL A 64 36.609 4.772 0.877 1.00 1.96 H new ATOM 0 HG13 VAL A 64 37.593 3.760 1.961 1.00 1.96 H new ATOM 0 HG21 VAL A 64 36.161 1.119 1.250 1.00 2.19 H new ATOM 0 HG22 VAL A 64 36.526 1.605 2.923 1.00 2.19 H new ATOM 0 HG23 VAL A 64 34.853 1.217 2.453 1.00 2.19 H new ATOM 1016 N THR A 65 35.642 6.235 2.620 1.00 2.26 N ATOM 1017 CA THR A 65 35.423 7.625 2.232 1.00 2.63 C ATOM 1018 C THR A 65 36.415 8.021 1.153 1.00 2.83 C ATOM 1019 O THR A 65 37.612 7.760 1.276 1.00 2.93 O ATOM 1020 CB THR A 65 35.576 8.569 3.442 1.00 3.06 C ATOM 1021 OG1 THR A 65 34.546 8.308 4.401 1.00 3.07 O ATOM 1022 CG2 THR A 65 35.518 10.030 3.016 1.00 3.50 C ATOM 0 H THR A 65 36.582 6.036 2.962 1.00 2.26 H new ATOM 0 HA THR A 65 34.406 7.714 1.849 1.00 2.63 H new ATOM 0 HB THR A 65 36.551 8.381 3.891 1.00 3.06 H new ATOM 0 HG1 THR A 65 34.652 8.910 5.167 1.00 3.07 H new ATOM 0 HG21 THR A 65 35.629 10.669 3.892 1.00 3.50 H new ATOM 0 HG22 THR A 65 36.324 10.236 2.312 1.00 3.50 H new ATOM 0 HG23 THR A 65 34.559 10.232 2.539 1.00 3.50 H new ATOM 1030 N PHE A 66 35.908 8.662 0.102 1.00 3.01 N ATOM 1031 CA PHE A 66 36.746 9.069 -1.022 1.00 3.31 C ATOM 1032 C PHE A 66 37.029 10.565 -0.999 1.00 3.79 C ATOM 1033 O PHE A 66 36.526 11.293 -0.145 1.00 3.94 O ATOM 1034 CB PHE A 66 36.074 8.706 -2.353 1.00 3.27 C ATOM 1035 CG PHE A 66 35.640 7.268 -2.471 1.00 3.23 C ATOM 1036 CD1 PHE A 66 36.335 6.269 -1.806 1.00 3.49 C ATOM 1037 CD2 PHE A 66 34.540 6.912 -3.235 1.00 3.34 C ATOM 1038 CE1 PHE A 66 35.943 4.948 -1.900 1.00 3.79 C ATOM 1039 CE2 PHE A 66 34.143 5.593 -3.334 1.00 3.52 C ATOM 1040 CZ PHE A 66 34.830 4.618 -2.708 1.00 3.72 C ATOM 0 H PHE A 66 34.923 8.910 0.006 1.00 3.01 H new ATOM 0 HA PHE A 66 37.691 8.534 -0.928 1.00 3.31 H new ATOM 0 HB2 PHE A 66 35.202 9.346 -2.490 1.00 3.27 H new ATOM 0 HB3 PHE A 66 36.765 8.930 -3.166 1.00 3.27 H new ATOM 0 HD1 PHE A 66 37.195 6.528 -1.206 1.00 3.49 H new ATOM 0 HD2 PHE A 66 33.986 7.676 -3.760 1.00 3.34 H new ATOM 0 HE1 PHE A 66 36.479 4.178 -1.364 1.00 3.79 H new ATOM 0 HE2 PHE A 66 33.272 5.340 -3.920 1.00 3.52 H new ATOM 0 HZ PHE A 66 34.532 3.586 -2.823 1.00 3.72 H new ATOM 1050 N TYR A 67 37.842 11.009 -1.953 1.00 4.15 N ATOM 1051 CA TYR A 67 38.188 12.417 -2.073 1.00 4.67 C ATOM 1052 C TYR A 67 37.972 12.892 -3.503 1.00 4.93 C ATOM 1053 O TYR A 67 38.255 14.041 -3.844 1.00 5.34 O ATOM 1054 CB TYR A 67 39.628 12.675 -1.621 1.00 5.09 C ATOM 1055 CG TYR A 67 40.696 11.967 -2.425 1.00 5.42 C ATOM 1056 CD1 TYR A 67 41.182 12.513 -3.606 1.00 5.58 C ATOM 1057 CD2 TYR A 67 41.196 10.737 -2.017 1.00 5.82 C ATOM 1058 CE1 TYR A 67 42.138 11.855 -4.356 1.00 6.07 C ATOM 1059 CE2 TYR A 67 42.155 10.074 -2.759 1.00 6.28 C ATOM 1060 CZ TYR A 67 42.696 10.694 -3.879 1.00 6.38 C ATOM 1061 OH TYR A 67 43.574 9.977 -4.670 1.00 6.97 O ATOM 0 H TYR A 67 38.274 10.409 -2.656 1.00 4.15 H new ATOM 0 HA TYR A 67 37.532 12.987 -1.416 1.00 4.67 H new ATOM 0 HB2 TYR A 67 39.817 13.748 -1.662 1.00 5.09 H new ATOM 0 HB3 TYR A 67 39.723 12.374 -0.578 1.00 5.09 H new ATOM 0 HD1 TYR A 67 40.807 13.468 -3.944 1.00 5.58 H new ATOM 0 HD2 TYR A 67 40.829 10.291 -1.104 1.00 5.82 H new ATOM 0 HE1 TYR A 67 42.445 12.252 -5.313 1.00 6.07 H new ATOM 0 HE2 TYR A 67 42.480 9.085 -2.472 1.00 6.28 H new ATOM 0 HH TYR A 67 43.878 9.183 -4.184 1.00 6.97 H new ATOM 1071 N THR A 68 37.467 11.986 -4.331 1.00 4.78 N ATOM 1072 CA THR A 68 37.172 12.285 -5.727 1.00 5.09 C ATOM 1073 C THR A 68 35.706 12.000 -6.019 1.00 4.71 C ATOM 1074 O THR A 68 35.359 10.931 -6.525 1.00 4.43 O ATOM 1075 CB THR A 68 38.042 11.457 -6.692 1.00 5.46 C ATOM 1076 OG1 THR A 68 37.936 10.064 -6.379 1.00 5.14 O ATOM 1077 CG2 THR A 68 39.497 11.891 -6.621 1.00 6.11 C ATOM 0 H THR A 68 37.251 11.028 -4.056 1.00 4.78 H new ATOM 0 HA THR A 68 37.395 13.340 -5.885 1.00 5.09 H new ATOM 0 HB THR A 68 37.680 11.628 -7.706 1.00 5.46 H new ATOM 0 HG1 THR A 68 37.005 9.847 -6.164 1.00 5.14 H new ATOM 0 HG21 THR A 68 40.090 11.291 -7.312 1.00 6.11 H new ATOM 0 HG22 THR A 68 39.577 12.943 -6.894 1.00 6.11 H new ATOM 0 HG23 THR A 68 39.870 11.750 -5.606 1.00 6.11 H new ATOM 1085 N ARG A 69 34.848 12.961 -5.698 1.00 4.80 N ATOM 1086 CA ARG A 69 33.415 12.809 -5.916 1.00 4.60 C ATOM 1087 C ARG A 69 33.113 12.449 -7.366 1.00 4.68 C ATOM 1088 O ARG A 69 32.186 11.686 -7.641 1.00 4.42 O ATOM 1089 CB ARG A 69 32.656 14.083 -5.525 1.00 4.95 C ATOM 1090 CG ARG A 69 33.528 15.326 -5.384 1.00 5.58 C ATOM 1091 CD ARG A 69 34.193 15.706 -6.698 1.00 5.81 C ATOM 1092 NE ARG A 69 35.609 15.349 -6.718 1.00 5.91 N ATOM 1093 CZ ARG A 69 36.456 15.733 -7.668 1.00 6.49 C ATOM 1094 NH1 ARG A 69 36.029 16.474 -8.683 1.00 7.00 N ATOM 1095 NH2 ARG A 69 37.731 15.376 -7.605 1.00 6.63 N ATOM 0 H ARG A 69 35.120 13.854 -5.286 1.00 4.80 H new ATOM 0 HA ARG A 69 33.076 11.993 -5.278 1.00 4.60 H new ATOM 0 HB2 ARG A 69 31.889 14.277 -6.275 1.00 4.95 H new ATOM 0 HB3 ARG A 69 32.141 13.908 -4.580 1.00 4.95 H new ATOM 0 HG2 ARG A 69 32.919 16.158 -5.032 1.00 5.58 H new ATOM 0 HG3 ARG A 69 34.293 15.149 -4.628 1.00 5.58 H new ATOM 0 HD2 ARG A 69 33.682 15.207 -7.521 1.00 5.81 H new ATOM 0 HD3 ARG A 69 34.087 16.779 -6.861 1.00 5.81 H new ATOM 0 HE ARG A 69 35.969 14.771 -5.959 1.00 5.91 H new ATOM 0 HH11 ARG A 69 35.049 16.750 -8.736 1.00 7.00 H new ATOM 0 HH12 ARG A 69 36.681 16.767 -9.410 1.00 7.00 H new ATOM 0 HH21 ARG A 69 38.063 14.806 -6.827 1.00 6.63 H new ATOM 0 HH22 ARG A 69 38.380 15.671 -8.334 1.00 6.63 H new ATOM 1109 N LYS A 70 33.902 12.988 -8.291 1.00 5.09 N ATOM 1110 CA LYS A 70 33.698 12.712 -9.710 1.00 5.26 C ATOM 1111 C LYS A 70 33.716 11.210 -9.967 1.00 4.89 C ATOM 1112 O LYS A 70 32.863 10.681 -10.680 1.00 4.81 O ATOM 1113 CB LYS A 70 34.766 13.405 -10.557 1.00 5.77 C ATOM 1114 CG LYS A 70 34.615 13.143 -12.048 1.00 5.89 C ATOM 1115 CD LYS A 70 35.354 14.177 -12.876 1.00 6.19 C ATOM 1116 CE LYS A 70 34.538 15.449 -13.009 1.00 6.65 C ATOM 1117 NZ LYS A 70 33.380 15.274 -13.931 1.00 6.82 N ATOM 0 H LYS A 70 34.682 13.613 -8.087 1.00 5.09 H new ATOM 0 HA LYS A 70 32.723 13.106 -9.996 1.00 5.26 H new ATOM 0 HB2 LYS A 70 34.722 14.479 -10.378 1.00 5.77 H new ATOM 0 HB3 LYS A 70 35.751 13.068 -10.234 1.00 5.77 H new ATOM 0 HG2 LYS A 70 34.995 12.149 -12.283 1.00 5.89 H new ATOM 0 HG3 LYS A 70 33.558 13.151 -12.314 1.00 5.89 H new ATOM 0 HD2 LYS A 70 36.314 14.403 -12.411 1.00 6.19 H new ATOM 0 HD3 LYS A 70 35.567 13.772 -13.865 1.00 6.19 H new ATOM 0 HE2 LYS A 70 34.177 15.753 -12.026 1.00 6.65 H new ATOM 0 HE3 LYS A 70 35.176 16.253 -13.376 1.00 6.65 H new ATOM 0 HZ1 LYS A 70 33.013 16.207 -14.208 1.00 6.82 H new ATOM 0 HZ2 LYS A 70 33.687 14.757 -14.779 1.00 6.82 H new ATOM 0 HZ3 LYS A 70 32.631 14.736 -13.450 1.00 6.82 H new ATOM 1131 N ALA A 71 34.691 10.524 -9.379 1.00 4.71 N ATOM 1132 CA ALA A 71 34.805 9.082 -9.537 1.00 4.41 C ATOM 1133 C ALA A 71 33.611 8.382 -8.900 1.00 3.94 C ATOM 1134 O ALA A 71 33.134 7.364 -9.399 1.00 3.77 O ATOM 1135 CB ALA A 71 36.104 8.580 -8.924 1.00 4.40 C ATOM 0 H ALA A 71 35.411 10.944 -8.791 1.00 4.71 H new ATOM 0 HA ALA A 71 34.814 8.851 -10.602 1.00 4.41 H new ATOM 0 HB1 ALA A 71 36.173 7.500 -9.051 1.00 4.40 H new ATOM 0 HB2 ALA A 71 36.949 9.058 -9.420 1.00 4.40 H new ATOM 0 HB3 ALA A 71 36.122 8.822 -7.861 1.00 4.40 H new ATOM 1141 N ALA A 72 33.126 8.951 -7.798 1.00 3.78 N ATOM 1142 CA ALA A 72 31.989 8.387 -7.085 1.00 3.40 C ATOM 1143 C ALA A 72 30.763 8.326 -7.986 1.00 3.51 C ATOM 1144 O ALA A 72 29.906 7.457 -7.824 1.00 3.28 O ATOM 1145 CB ALA A 72 31.689 9.203 -5.835 1.00 3.39 C ATOM 0 H ALA A 72 33.505 9.802 -7.382 1.00 3.78 H new ATOM 0 HA ALA A 72 32.244 7.370 -6.785 1.00 3.40 H new ATOM 0 HB1 ALA A 72 30.836 8.769 -5.313 1.00 3.39 H new ATOM 0 HB2 ALA A 72 32.559 9.196 -5.178 1.00 3.39 H new ATOM 0 HB3 ALA A 72 31.457 10.230 -6.118 1.00 3.39 H new ATOM 1151 N LEU A 73 30.694 9.247 -8.942 1.00 3.95 N ATOM 1152 CA LEU A 73 29.572 9.300 -9.872 1.00 4.16 C ATOM 1153 C LEU A 73 29.396 7.958 -10.568 1.00 4.02 C ATOM 1154 O LEU A 73 28.280 7.451 -10.689 1.00 3.99 O ATOM 1155 CB LEU A 73 29.796 10.402 -10.913 1.00 4.66 C ATOM 1156 CG LEU A 73 30.015 11.804 -10.340 1.00 4.93 C ATOM 1157 CD1 LEU A 73 30.404 12.777 -11.442 1.00 5.43 C ATOM 1158 CD2 LEU A 73 28.763 12.287 -9.619 1.00 4.92 C ATOM 0 H LEU A 73 31.401 9.966 -9.093 1.00 3.95 H new ATOM 0 HA LEU A 73 28.667 9.525 -9.308 1.00 4.16 H new ATOM 0 HB2 LEU A 73 30.661 10.136 -11.520 1.00 4.66 H new ATOM 0 HB3 LEU A 73 28.935 10.430 -11.580 1.00 4.66 H new ATOM 0 HG LEU A 73 30.832 11.757 -9.619 1.00 4.93 H new ATOM 0 HD11 LEU A 73 30.555 13.768 -11.015 1.00 5.43 H new ATOM 0 HD12 LEU A 73 31.327 12.441 -11.915 1.00 5.43 H new ATOM 0 HD13 LEU A 73 29.609 12.820 -12.187 1.00 5.43 H new ATOM 0 HD21 LEU A 73 28.937 13.286 -9.218 1.00 4.92 H new ATOM 0 HD22 LEU A 73 27.929 12.317 -10.320 1.00 4.92 H new ATOM 0 HD23 LEU A 73 28.527 11.604 -8.803 1.00 4.92 H new ATOM 1170 N GLU A 74 30.508 7.378 -11.010 1.00 4.00 N ATOM 1171 CA GLU A 74 30.478 6.091 -11.691 1.00 3.94 C ATOM 1172 C GLU A 74 29.943 5.009 -10.763 1.00 3.55 C ATOM 1173 O GLU A 74 29.200 4.124 -11.191 1.00 3.57 O ATOM 1174 CB GLU A 74 31.879 5.716 -12.178 1.00 4.07 C ATOM 1175 CG GLU A 74 32.733 6.915 -12.556 1.00 4.42 C ATOM 1176 CD GLU A 74 33.838 6.560 -13.532 1.00 4.73 C ATOM 1177 OE1 GLU A 74 33.572 6.546 -14.751 1.00 4.99 O ATOM 1178 OE2 GLU A 74 34.970 6.293 -13.074 1.00 4.77 O ATOM 0 H GLU A 74 31.440 7.780 -10.908 1.00 4.00 H new ATOM 0 HA GLU A 74 29.814 6.173 -12.552 1.00 3.94 H new ATOM 0 HB2 GLU A 74 32.387 5.151 -11.397 1.00 4.07 H new ATOM 0 HB3 GLU A 74 31.790 5.057 -13.042 1.00 4.07 H new ATOM 0 HG2 GLU A 74 32.098 7.684 -12.996 1.00 4.42 H new ATOM 0 HG3 GLU A 74 33.173 7.342 -11.655 1.00 4.42 H new ATOM 1185 N ALA A 75 30.312 5.096 -9.488 1.00 3.24 N ATOM 1186 CA ALA A 75 29.874 4.122 -8.501 1.00 2.89 C ATOM 1187 C ALA A 75 28.358 4.068 -8.438 1.00 2.95 C ATOM 1188 O ALA A 75 27.776 3.009 -8.207 1.00 2.87 O ATOM 1189 CB ALA A 75 30.453 4.453 -7.134 1.00 2.61 C ATOM 0 H ALA A 75 30.913 5.832 -9.117 1.00 3.24 H new ATOM 0 HA ALA A 75 30.239 3.140 -8.802 1.00 2.89 H new ATOM 0 HB1 ALA A 75 30.115 3.714 -6.407 1.00 2.61 H new ATOM 0 HB2 ALA A 75 31.542 4.439 -7.187 1.00 2.61 H new ATOM 0 HB3 ALA A 75 30.118 5.444 -6.827 1.00 2.61 H new ATOM 1195 N GLN A 76 27.721 5.215 -8.653 1.00 3.20 N ATOM 1196 CA GLN A 76 26.269 5.291 -8.623 1.00 3.38 C ATOM 1197 C GLN A 76 25.672 4.314 -9.627 1.00 3.55 C ATOM 1198 O GLN A 76 24.740 3.577 -9.315 1.00 3.58 O ATOM 1199 CB GLN A 76 25.803 6.715 -8.932 1.00 3.75 C ATOM 1200 CG GLN A 76 26.467 7.777 -8.070 1.00 3.74 C ATOM 1201 CD GLN A 76 26.284 7.524 -6.586 1.00 3.45 C ATOM 1202 OE1 GLN A 76 25.308 7.971 -5.983 1.00 3.63 O ATOM 1203 NE2 GLN A 76 27.230 6.809 -5.987 1.00 3.07 N ATOM 0 H GLN A 76 28.188 6.100 -8.849 1.00 3.20 H new ATOM 0 HA GLN A 76 25.927 5.022 -7.624 1.00 3.38 H new ATOM 0 HB2 GLN A 76 26.004 6.934 -9.981 1.00 3.75 H new ATOM 0 HB3 GLN A 76 24.723 6.772 -8.795 1.00 3.75 H new ATOM 0 HG2 GLN A 76 27.532 7.812 -8.300 1.00 3.74 H new ATOM 0 HG3 GLN A 76 26.054 8.754 -8.322 1.00 3.74 H new ATOM 0 HE21 GLN A 76 28.022 6.458 -6.526 1.00 3.07 H new ATOM 0 HE22 GLN A 76 27.164 6.611 -4.989 1.00 3.07 H new ATOM 1212 N ASN A 77 26.233 4.297 -10.831 1.00 3.74 N ATOM 1213 CA ASN A 77 25.760 3.408 -11.878 1.00 3.96 C ATOM 1214 C ASN A 77 25.956 1.953 -11.469 1.00 3.80 C ATOM 1215 O ASN A 77 25.176 1.078 -11.843 1.00 3.98 O ATOM 1216 CB ASN A 77 26.509 3.696 -13.177 1.00 4.24 C ATOM 1217 CG ASN A 77 25.978 4.926 -13.888 1.00 4.49 C ATOM 1218 OD1 ASN A 77 25.068 4.835 -14.712 1.00 4.84 O ATOM 1219 ND2 ASN A 77 26.547 6.083 -13.573 1.00 4.70 N ATOM 0 H ASN A 77 27.017 4.891 -11.103 1.00 3.74 H new ATOM 0 HA ASN A 77 24.695 3.582 -12.034 1.00 3.96 H new ATOM 0 HB2 ASN A 77 27.568 3.834 -12.960 1.00 4.24 H new ATOM 0 HB3 ASN A 77 26.429 2.834 -13.839 1.00 4.24 H new ATOM 0 HD21 ASN A 77 26.233 6.944 -14.020 1.00 4.70 H new ATOM 0 HD22 ASN A 77 27.298 6.111 -12.884 1.00 4.70 H new ATOM 1226 N ALA A 78 27.009 1.710 -10.699 1.00 3.52 N ATOM 1227 CA ALA A 78 27.329 0.370 -10.227 1.00 3.42 C ATOM 1228 C ALA A 78 26.415 -0.064 -9.082 1.00 3.30 C ATOM 1229 O ALA A 78 26.207 -1.260 -8.873 1.00 3.41 O ATOM 1230 CB ALA A 78 28.784 0.307 -9.793 1.00 3.23 C ATOM 0 H ALA A 78 27.660 2.430 -10.386 1.00 3.52 H new ATOM 0 HA ALA A 78 27.167 -0.322 -11.054 1.00 3.42 H new ATOM 0 HB1 ALA A 78 29.016 -0.698 -9.441 1.00 3.23 H new ATOM 0 HB2 ALA A 78 29.427 0.553 -10.638 1.00 3.23 H new ATOM 0 HB3 ALA A 78 28.955 1.021 -8.988 1.00 3.23 H new ATOM 1236 N LEU A 79 25.874 0.900 -8.340 1.00 3.16 N ATOM 1237 CA LEU A 79 25.009 0.581 -7.208 1.00 3.14 C ATOM 1238 C LEU A 79 24.000 1.686 -6.904 1.00 3.35 C ATOM 1239 O LEU A 79 22.793 1.445 -6.922 1.00 3.66 O ATOM 1240 CB LEU A 79 25.869 0.316 -5.973 1.00 2.85 C ATOM 1241 CG LEU A 79 26.948 1.370 -5.703 1.00 2.57 C ATOM 1242 CD1 LEU A 79 26.638 2.141 -4.429 1.00 2.41 C ATOM 1243 CD2 LEU A 79 28.320 0.716 -5.619 1.00 2.50 C ATOM 0 H LEU A 79 26.017 1.897 -8.500 1.00 3.16 H new ATOM 0 HA LEU A 79 24.437 -0.308 -7.476 1.00 3.14 H new ATOM 0 HB2 LEU A 79 25.218 0.251 -5.101 1.00 2.85 H new ATOM 0 HB3 LEU A 79 26.350 -0.656 -6.084 1.00 2.85 H new ATOM 0 HG LEU A 79 26.956 2.077 -6.533 1.00 2.57 H new ATOM 0 HD11 LEU A 79 27.416 2.884 -4.255 1.00 2.41 H new ATOM 0 HD12 LEU A 79 25.675 2.641 -4.531 1.00 2.41 H new ATOM 0 HD13 LEU A 79 26.601 1.451 -3.586 1.00 2.41 H new ATOM 0 HD21 LEU A 79 29.075 1.478 -5.427 1.00 2.50 H new ATOM 0 HD22 LEU A 79 28.326 -0.013 -4.809 1.00 2.50 H new ATOM 0 HD23 LEU A 79 28.542 0.214 -6.561 1.00 2.50 H new ATOM 1255 N HIS A 80 24.490 2.890 -6.617 1.00 3.27 N ATOM 1256 CA HIS A 80 23.616 4.010 -6.277 1.00 3.53 C ATOM 1257 C HIS A 80 22.884 3.716 -4.969 1.00 3.49 C ATOM 1258 O HIS A 80 23.342 2.897 -4.171 1.00 3.37 O ATOM 1259 CB HIS A 80 22.605 4.281 -7.397 1.00 3.94 C ATOM 1260 CG HIS A 80 22.389 5.738 -7.675 1.00 4.25 C ATOM 1261 ND1 HIS A 80 22.434 6.275 -8.945 1.00 4.68 N ATOM 1262 CD2 HIS A 80 22.121 6.772 -6.842 1.00 4.44 C ATOM 1263 CE1 HIS A 80 22.204 7.574 -8.881 1.00 4.89 C ATOM 1264 NE2 HIS A 80 22.010 7.899 -7.616 1.00 4.71 N ATOM 0 H HIS A 80 25.485 3.115 -6.613 1.00 3.27 H new ATOM 0 HA HIS A 80 24.232 4.901 -6.155 1.00 3.53 H new ATOM 0 HB2 HIS A 80 22.948 3.793 -8.309 1.00 3.94 H new ATOM 0 HB3 HIS A 80 21.651 3.826 -7.131 1.00 3.94 H new ATOM 0 HD2 HIS A 80 22.015 6.719 -5.769 1.00 4.44 H new ATOM 0 HE1 HIS A 80 22.179 8.254 -9.720 1.00 4.89 H new ATOM 0 HE2 HIS A 80 21.810 8.837 -7.270 1.00 4.71 H new ATOM 1273 N ASN A 81 21.752 4.373 -4.751 1.00 3.77 N ATOM 1274 CA ASN A 81 20.976 4.161 -3.533 1.00 3.89 C ATOM 1275 C ASN A 81 20.186 2.856 -3.606 1.00 3.88 C ATOM 1276 O ASN A 81 19.805 2.291 -2.581 1.00 4.01 O ATOM 1277 CB ASN A 81 20.029 5.334 -3.295 1.00 4.31 C ATOM 1278 CG ASN A 81 19.006 5.493 -4.404 1.00 4.75 C ATOM 1279 OD1 ASN A 81 19.272 5.171 -5.561 1.00 4.86 O ATOM 1280 ND2 ASN A 81 17.828 5.992 -4.052 1.00 5.40 N ATOM 0 H ASN A 81 21.351 5.054 -5.397 1.00 3.77 H new ATOM 0 HA ASN A 81 21.673 4.093 -2.698 1.00 3.89 H new ATOM 0 HB2 ASN A 81 19.512 5.192 -2.346 1.00 4.31 H new ATOM 0 HB3 ASN A 81 20.609 6.252 -3.207 1.00 4.31 H new ATOM 0 HD21 ASN A 81 17.099 6.122 -4.754 1.00 5.40 H new ATOM 0 HD22 ASN A 81 17.651 6.245 -3.080 1.00 5.40 H new ATOM 1287 N MET A 82 19.948 2.379 -4.824 1.00 3.89 N ATOM 1288 CA MET A 82 19.203 1.141 -5.032 1.00 4.02 C ATOM 1289 C MET A 82 20.012 0.158 -5.868 1.00 3.90 C ATOM 1290 O MET A 82 20.460 0.480 -6.968 1.00 4.17 O ATOM 1291 CB MET A 82 17.867 1.428 -5.715 1.00 4.60 C ATOM 1292 CG MET A 82 17.985 2.379 -6.890 1.00 4.89 C ATOM 1293 SD MET A 82 16.580 2.274 -8.016 1.00 5.67 S ATOM 1294 CE MET A 82 15.235 2.743 -6.929 1.00 5.71 C ATOM 0 H MET A 82 20.261 2.831 -5.683 1.00 3.89 H new ATOM 0 HA MET A 82 19.012 0.694 -4.056 1.00 4.02 H new ATOM 0 HB2 MET A 82 17.434 0.489 -6.059 1.00 4.60 H new ATOM 0 HB3 MET A 82 17.176 1.849 -4.984 1.00 4.60 H new ATOM 0 HG2 MET A 82 18.072 3.400 -6.518 1.00 4.89 H new ATOM 0 HG3 MET A 82 18.901 2.161 -7.438 1.00 4.89 H new ATOM 0 HE1 MET A 82 14.322 2.863 -7.511 1.00 5.71 H new ATOM 0 HE2 MET A 82 15.087 1.967 -6.178 1.00 5.71 H new ATOM 0 HE3 MET A 82 15.477 3.684 -6.436 1.00 5.71 H new ATOM 1304 N LYS A 83 20.184 -1.047 -5.341 1.00 3.68 N ATOM 1305 CA LYS A 83 20.952 -2.081 -6.021 1.00 3.64 C ATOM 1306 C LYS A 83 20.337 -3.458 -5.833 1.00 3.70 C ATOM 1307 O LYS A 83 19.670 -3.728 -4.835 1.00 3.74 O ATOM 1308 CB LYS A 83 22.400 -2.111 -5.543 1.00 3.51 C ATOM 1309 CG LYS A 83 23.222 -3.151 -6.288 1.00 3.75 C ATOM 1310 CD LYS A 83 24.661 -3.187 -5.821 1.00 3.35 C ATOM 1311 CE LYS A 83 24.779 -3.731 -4.406 1.00 3.68 C ATOM 1312 NZ LYS A 83 26.199 -3.906 -3.998 1.00 4.16 N ATOM 0 H LYS A 83 19.800 -1.333 -4.440 1.00 3.68 H new ATOM 0 HA LYS A 83 20.932 -1.828 -7.081 1.00 3.64 H new ATOM 0 HB2 LYS A 83 22.848 -1.127 -5.681 1.00 3.51 H new ATOM 0 HB3 LYS A 83 22.425 -2.326 -4.475 1.00 3.51 H new ATOM 0 HG2 LYS A 83 22.772 -4.134 -6.149 1.00 3.75 H new ATOM 0 HG3 LYS A 83 23.194 -2.936 -7.356 1.00 3.75 H new ATOM 0 HD2 LYS A 83 25.248 -3.806 -6.499 1.00 3.35 H new ATOM 0 HD3 LYS A 83 25.082 -2.182 -5.861 1.00 3.35 H new ATOM 0 HE2 LYS A 83 24.283 -3.052 -3.713 1.00 3.68 H new ATOM 0 HE3 LYS A 83 24.261 -4.688 -4.340 1.00 3.68 H new ATOM 0 HZ1 LYS A 83 26.240 -4.418 -3.093 1.00 4.16 H new ATOM 0 HZ2 LYS A 83 26.705 -4.449 -4.726 1.00 4.16 H new ATOM 0 HZ3 LYS A 83 26.646 -2.973 -3.889 1.00 4.16 H new ATOM 1326 N VAL A 84 20.574 -4.325 -6.810 1.00 4.00 N ATOM 1327 CA VAL A 84 20.073 -5.685 -6.766 1.00 4.21 C ATOM 1328 C VAL A 84 21.249 -6.651 -6.768 1.00 4.29 C ATOM 1329 O VAL A 84 22.277 -6.393 -7.394 1.00 4.68 O ATOM 1330 CB VAL A 84 19.161 -6.001 -7.963 1.00 4.91 C ATOM 1331 CG1 VAL A 84 19.927 -5.864 -9.269 1.00 5.39 C ATOM 1332 CG2 VAL A 84 18.580 -7.397 -7.823 1.00 5.32 C ATOM 0 H VAL A 84 21.114 -4.104 -7.646 1.00 4.00 H new ATOM 0 HA VAL A 84 19.483 -5.795 -5.856 1.00 4.21 H new ATOM 0 HB VAL A 84 18.340 -5.284 -7.976 1.00 4.91 H new ATOM 0 HG11 VAL A 84 19.265 -6.092 -10.105 1.00 5.39 H new ATOM 0 HG12 VAL A 84 20.299 -4.844 -9.368 1.00 5.39 H new ATOM 0 HG13 VAL A 84 20.767 -6.558 -9.272 1.00 5.39 H new ATOM 0 HG21 VAL A 84 17.936 -7.610 -8.676 1.00 5.32 H new ATOM 0 HG22 VAL A 84 19.389 -8.126 -7.788 1.00 5.32 H new ATOM 0 HG23 VAL A 84 17.997 -7.458 -6.904 1.00 5.32 H new ATOM 1342 N LEU A 85 21.093 -7.761 -6.060 1.00 4.15 N ATOM 1343 CA LEU A 85 22.162 -8.739 -5.930 1.00 4.34 C ATOM 1344 C LEU A 85 21.878 -10.026 -6.697 1.00 4.70 C ATOM 1345 O LEU A 85 20.725 -10.438 -6.834 1.00 4.80 O ATOM 1346 CB LEU A 85 22.390 -9.065 -4.457 1.00 4.21 C ATOM 1347 CG LEU A 85 23.056 -7.961 -3.631 1.00 4.11 C ATOM 1348 CD1 LEU A 85 22.182 -6.720 -3.570 1.00 3.90 C ATOM 1349 CD2 LEU A 85 23.352 -8.467 -2.233 1.00 4.45 C ATOM 0 H LEU A 85 20.235 -8.006 -5.566 1.00 4.15 H new ATOM 0 HA LEU A 85 23.057 -8.292 -6.363 1.00 4.34 H new ATOM 0 HB2 LEU A 85 21.428 -9.304 -4.003 1.00 4.21 H new ATOM 0 HB3 LEU A 85 23.004 -9.963 -4.393 1.00 4.21 H new ATOM 0 HG LEU A 85 23.993 -7.688 -4.117 1.00 4.11 H new ATOM 0 HD11 LEU A 85 22.680 -5.953 -2.977 1.00 3.90 H new ATOM 0 HD12 LEU A 85 22.012 -6.345 -4.579 1.00 3.90 H new ATOM 0 HD13 LEU A 85 21.226 -6.970 -3.110 1.00 3.90 H new ATOM 0 HD21 LEU A 85 23.826 -7.675 -1.652 1.00 4.45 H new ATOM 0 HD22 LEU A 85 22.422 -8.765 -1.749 1.00 4.45 H new ATOM 0 HD23 LEU A 85 24.022 -9.325 -2.291 1.00 4.45 H new ATOM 1361 N PRO A 86 22.949 -10.667 -7.214 1.00 5.11 N ATOM 1362 CA PRO A 86 22.865 -11.916 -7.964 1.00 5.57 C ATOM 1363 C PRO A 86 21.723 -12.814 -7.505 1.00 5.64 C ATOM 1364 O PRO A 86 20.772 -13.060 -8.246 1.00 5.96 O ATOM 1365 CB PRO A 86 24.213 -12.564 -7.648 1.00 5.85 C ATOM 1366 CG PRO A 86 25.164 -11.425 -7.489 1.00 5.81 C ATOM 1367 CD PRO A 86 24.349 -10.214 -7.100 1.00 5.38 C ATOM 0 HA PRO A 86 22.668 -11.753 -9.024 1.00 5.57 H new ATOM 0 HB2 PRO A 86 24.159 -13.163 -6.739 1.00 5.85 H new ATOM 0 HB3 PRO A 86 24.528 -13.231 -8.451 1.00 5.85 H new ATOM 0 HG2 PRO A 86 25.909 -11.649 -6.725 1.00 5.81 H new ATOM 0 HG3 PRO A 86 25.705 -11.243 -8.418 1.00 5.81 H new ATOM 0 HD2 PRO A 86 24.580 -9.887 -6.086 1.00 5.38 H new ATOM 0 HD3 PRO A 86 24.549 -9.370 -7.760 1.00 5.38 H new ATOM 1375 N GLY A 87 21.832 -13.300 -6.277 1.00 5.51 N ATOM 1376 CA GLY A 87 20.814 -14.170 -5.725 1.00 5.74 C ATOM 1377 C GLY A 87 21.186 -15.632 -5.854 1.00 6.21 C ATOM 1378 O GLY A 87 20.377 -16.514 -5.565 1.00 6.52 O ATOM 0 H GLY A 87 22.612 -13.106 -5.650 1.00 5.51 H new ATOM 0 HA2 GLY A 87 20.660 -13.927 -4.674 1.00 5.74 H new ATOM 0 HA3 GLY A 87 19.868 -13.990 -6.236 1.00 5.74 H new ATOM 1382 N MET A 88 22.416 -15.888 -6.292 1.00 6.40 N ATOM 1383 CA MET A 88 22.897 -17.253 -6.464 1.00 6.91 C ATOM 1384 C MET A 88 23.394 -17.833 -5.144 1.00 6.86 C ATOM 1385 O MET A 88 22.893 -18.859 -4.684 1.00 7.07 O ATOM 1386 CB MET A 88 24.015 -17.302 -7.509 1.00 7.26 C ATOM 1387 CG MET A 88 23.529 -17.103 -8.936 1.00 7.46 C ATOM 1388 SD MET A 88 22.866 -15.451 -9.227 1.00 7.81 S ATOM 1389 CE MET A 88 22.358 -15.589 -10.938 1.00 8.29 C ATOM 0 H MET A 88 23.096 -15.167 -6.534 1.00 6.40 H new ATOM 0 HA MET A 88 22.059 -17.858 -6.811 1.00 6.91 H new ATOM 0 HB2 MET A 88 24.752 -16.534 -7.275 1.00 7.26 H new ATOM 0 HB3 MET A 88 24.524 -18.264 -7.439 1.00 7.26 H new ATOM 0 HG2 MET A 88 24.355 -17.284 -9.624 1.00 7.46 H new ATOM 0 HG3 MET A 88 22.760 -17.842 -9.159 1.00 7.46 H new ATOM 0 HE1 MET A 88 21.926 -14.644 -11.267 1.00 8.29 H new ATOM 0 HE2 MET A 88 23.223 -15.827 -11.556 1.00 8.29 H new ATOM 0 HE3 MET A 88 21.615 -16.380 -11.034 1.00 8.29 H new ATOM 1399 N HIS A 89 24.378 -17.174 -4.536 1.00 6.83 N ATOM 1400 CA HIS A 89 24.936 -17.645 -3.270 1.00 6.90 C ATOM 1401 C HIS A 89 25.884 -16.614 -2.656 1.00 6.45 C ATOM 1402 O HIS A 89 26.135 -16.633 -1.451 1.00 6.58 O ATOM 1403 CB HIS A 89 25.680 -18.965 -3.491 1.00 7.63 C ATOM 1404 CG HIS A 89 26.124 -19.630 -2.224 1.00 8.02 C ATOM 1405 ND1 HIS A 89 25.376 -20.592 -1.578 1.00 8.70 N ATOM 1406 CD2 HIS A 89 27.249 -19.474 -1.488 1.00 8.06 C ATOM 1407 CE1 HIS A 89 26.022 -20.997 -0.499 1.00 9.11 C ATOM 1408 NE2 HIS A 89 27.160 -20.335 -0.423 1.00 8.74 N ATOM 0 H HIS A 89 24.803 -16.319 -4.896 1.00 6.83 H new ATOM 0 HA HIS A 89 24.110 -17.798 -2.575 1.00 6.90 H new ATOM 0 HB2 HIS A 89 25.033 -19.648 -4.041 1.00 7.63 H new ATOM 0 HB3 HIS A 89 26.552 -18.779 -4.117 1.00 7.63 H new ATOM 0 HD2 HIS A 89 28.064 -18.798 -1.699 1.00 8.06 H new ATOM 0 HE1 HIS A 89 25.677 -21.743 0.201 1.00 9.11 H new ATOM 0 HE2 HIS A 89 27.861 -20.445 0.309 1.00 8.74 H new ATOM 1417 N HIS A 90 26.403 -15.714 -3.487 1.00 6.08 N ATOM 1418 CA HIS A 90 27.334 -14.689 -3.018 1.00 5.77 C ATOM 1419 C HIS A 90 26.757 -13.284 -3.187 1.00 5.44 C ATOM 1420 O HIS A 90 27.098 -12.580 -4.138 1.00 5.60 O ATOM 1421 CB HIS A 90 28.655 -14.796 -3.776 1.00 6.09 C ATOM 1422 CG HIS A 90 29.477 -15.984 -3.382 1.00 6.55 C ATOM 1423 ND1 HIS A 90 29.397 -17.202 -4.024 1.00 7.04 N ATOM 1424 CD2 HIS A 90 30.402 -16.137 -2.405 1.00 6.91 C ATOM 1425 CE1 HIS A 90 30.234 -18.054 -3.458 1.00 7.58 C ATOM 1426 NE2 HIS A 90 30.857 -17.432 -2.474 1.00 7.51 N ATOM 0 H HIS A 90 26.196 -15.673 -4.485 1.00 6.08 H new ATOM 0 HA HIS A 90 27.505 -14.859 -1.955 1.00 5.77 H new ATOM 0 HB2 HIS A 90 28.448 -14.846 -4.845 1.00 6.09 H new ATOM 0 HB3 HIS A 90 29.236 -13.890 -3.606 1.00 6.09 H new ATOM 0 HD2 HIS A 90 30.723 -15.382 -1.702 1.00 6.91 H new ATOM 0 HE1 HIS A 90 30.383 -19.083 -3.750 1.00 7.58 H new ATOM 0 HE2 HIS A 90 31.562 -17.846 -1.864 1.00 7.51 H new ATOM 1435 N PRO A 91 25.876 -12.852 -2.265 1.00 5.15 N ATOM 1436 CA PRO A 91 25.263 -11.529 -2.319 1.00 4.98 C ATOM 1437 C PRO A 91 26.044 -10.476 -1.533 1.00 4.84 C ATOM 1438 O PRO A 91 26.449 -10.710 -0.395 1.00 5.14 O ATOM 1439 CB PRO A 91 23.921 -11.788 -1.652 1.00 5.10 C ATOM 1440 CG PRO A 91 24.251 -12.756 -0.569 1.00 5.17 C ATOM 1441 CD PRO A 91 25.370 -13.624 -1.109 1.00 5.17 C ATOM 0 HA PRO A 91 25.213 -11.131 -3.333 1.00 4.98 H new ATOM 0 HB2 PRO A 91 23.488 -10.871 -1.252 1.00 5.10 H new ATOM 0 HB3 PRO A 91 23.197 -12.203 -2.354 1.00 5.10 H new ATOM 0 HG2 PRO A 91 24.563 -12.236 0.337 1.00 5.17 H new ATOM 0 HG3 PRO A 91 23.382 -13.359 -0.307 1.00 5.17 H new ATOM 0 HD2 PRO A 91 26.148 -13.787 -0.363 1.00 5.17 H new ATOM 0 HD3 PRO A 91 25.007 -14.607 -1.410 1.00 5.17 H new ATOM 1449 N ILE A 92 26.250 -9.320 -2.153 1.00 4.52 N ATOM 1450 CA ILE A 92 26.952 -8.216 -1.508 1.00 4.42 C ATOM 1451 C ILE A 92 26.172 -6.923 -1.709 1.00 3.99 C ATOM 1452 O ILE A 92 25.570 -6.716 -2.762 1.00 3.99 O ATOM 1453 CB ILE A 92 28.398 -8.053 -2.032 1.00 4.77 C ATOM 1454 CG1 ILE A 92 28.427 -7.321 -3.380 1.00 4.68 C ATOM 1455 CG2 ILE A 92 29.065 -9.414 -2.165 1.00 5.46 C ATOM 1456 CD1 ILE A 92 28.536 -5.817 -3.253 1.00 4.43 C ATOM 0 H ILE A 92 25.940 -9.122 -3.104 1.00 4.52 H new ATOM 0 HA ILE A 92 27.020 -8.446 -0.445 1.00 4.42 H new ATOM 0 HB ILE A 92 28.948 -7.451 -1.309 1.00 4.77 H new ATOM 0 HG12 ILE A 92 29.269 -7.689 -3.965 1.00 4.68 H new ATOM 0 HG13 ILE A 92 27.522 -7.565 -3.936 1.00 4.68 H new ATOM 0 HG21 ILE A 92 30.082 -9.286 -2.535 1.00 5.46 H new ATOM 0 HG22 ILE A 92 29.092 -9.903 -1.191 1.00 5.46 H new ATOM 0 HG23 ILE A 92 28.499 -10.030 -2.865 1.00 5.46 H new ATOM 0 HD11 ILE A 92 28.551 -5.368 -4.246 1.00 4.43 H new ATOM 0 HD12 ILE A 92 27.680 -5.436 -2.695 1.00 4.43 H new ATOM 0 HD13 ILE A 92 29.455 -5.562 -2.726 1.00 4.43 H new ATOM 1468 N GLN A 93 26.202 -6.040 -0.722 1.00 3.75 N ATOM 1469 CA GLN A 93 25.458 -4.791 -0.817 1.00 3.44 C ATOM 1470 C GLN A 93 26.369 -3.580 -0.669 1.00 3.12 C ATOM 1471 O GLN A 93 27.192 -3.511 0.244 1.00 3.04 O ATOM 1472 CB GLN A 93 24.366 -4.750 0.253 1.00 3.51 C ATOM 1473 CG GLN A 93 23.516 -6.013 0.312 1.00 3.77 C ATOM 1474 CD GLN A 93 22.197 -5.789 1.022 1.00 3.84 C ATOM 1475 OE1 GLN A 93 21.678 -6.678 1.694 1.00 4.15 O ATOM 1476 NE2 GLN A 93 21.640 -4.593 0.862 1.00 4.02 N ATOM 0 H GLN A 93 26.726 -6.161 0.144 1.00 3.75 H new ATOM 0 HA GLN A 93 25.004 -4.751 -1.807 1.00 3.44 H new ATOM 0 HB2 GLN A 93 24.830 -4.589 1.226 1.00 3.51 H new ATOM 0 HB3 GLN A 93 23.717 -3.895 0.064 1.00 3.51 H new ATOM 0 HG2 GLN A 93 23.325 -6.366 -0.701 1.00 3.77 H new ATOM 0 HG3 GLN A 93 24.072 -6.798 0.824 1.00 3.77 H new ATOM 0 HE21 GLN A 93 22.107 -3.885 0.295 1.00 4.02 H new ATOM 0 HE22 GLN A 93 20.746 -4.383 1.306 1.00 4.02 H new ATOM 1485 N MET A 94 26.211 -2.626 -1.583 1.00 3.01 N ATOM 1486 CA MET A 94 27.012 -1.411 -1.569 1.00 2.75 C ATOM 1487 C MET A 94 26.138 -0.182 -1.780 1.00 2.77 C ATOM 1488 O MET A 94 25.401 -0.088 -2.763 1.00 2.91 O ATOM 1489 CB MET A 94 28.090 -1.471 -2.648 1.00 2.65 C ATOM 1490 CG MET A 94 29.173 -0.425 -2.466 1.00 2.30 C ATOM 1491 SD MET A 94 30.615 -0.725 -3.504 1.00 2.33 S ATOM 1492 CE MET A 94 31.242 -2.238 -2.780 1.00 2.41 C ATOM 0 H MET A 94 25.533 -2.674 -2.343 1.00 3.01 H new ATOM 0 HA MET A 94 27.490 -1.334 -0.592 1.00 2.75 H new ATOM 0 HB2 MET A 94 28.545 -2.461 -2.644 1.00 2.65 H new ATOM 0 HB3 MET A 94 27.625 -1.338 -3.625 1.00 2.65 H new ATOM 0 HG2 MET A 94 28.764 0.559 -2.696 1.00 2.30 H new ATOM 0 HG3 MET A 94 29.481 -0.406 -1.421 1.00 2.30 H new ATOM 0 HE1 MET A 94 32.331 -2.198 -2.740 1.00 2.41 H new ATOM 0 HE2 MET A 94 30.846 -2.350 -1.771 1.00 2.41 H new ATOM 0 HE3 MET A 94 30.932 -3.088 -3.388 1.00 2.41 H new ATOM 1502 N LYS A 95 26.224 0.750 -0.843 1.00 2.73 N ATOM 1503 CA LYS A 95 25.445 1.981 -0.901 1.00 2.87 C ATOM 1504 C LYS A 95 26.284 3.143 -0.384 1.00 2.75 C ATOM 1505 O LYS A 95 27.124 2.952 0.484 1.00 2.63 O ATOM 1506 CB LYS A 95 24.155 1.839 -0.095 1.00 3.24 C ATOM 1507 CG LYS A 95 24.377 1.715 1.404 1.00 3.26 C ATOM 1508 CD LYS A 95 23.206 1.025 2.085 1.00 3.68 C ATOM 1509 CE LYS A 95 23.170 -0.462 1.762 1.00 3.80 C ATOM 1510 NZ LYS A 95 22.070 -1.160 2.481 1.00 4.40 N ATOM 0 H LYS A 95 26.830 0.677 -0.026 1.00 2.73 H new ATOM 0 HA LYS A 95 25.170 2.181 -1.937 1.00 2.87 H new ATOM 0 HB2 LYS A 95 23.520 2.704 -0.288 1.00 3.24 H new ATOM 0 HB3 LYS A 95 23.613 0.961 -0.446 1.00 3.24 H new ATOM 0 HG2 LYS A 95 25.292 1.153 1.592 1.00 3.26 H new ATOM 0 HG3 LYS A 95 24.518 2.706 1.835 1.00 3.26 H new ATOM 0 HD2 LYS A 95 23.279 1.162 3.164 1.00 3.68 H new ATOM 0 HD3 LYS A 95 22.273 1.490 1.767 1.00 3.68 H new ATOM 0 HE2 LYS A 95 23.044 -0.597 0.688 1.00 3.80 H new ATOM 0 HE3 LYS A 95 24.124 -0.915 2.031 1.00 3.80 H new ATOM 0 HZ1 LYS A 95 22.080 -2.170 2.234 1.00 4.40 H new ATOM 0 HZ2 LYS A 95 22.203 -1.053 3.507 1.00 4.40 H new ATOM 0 HZ3 LYS A 95 21.157 -0.745 2.205 1.00 4.40 H new ATOM 1524 N PRO A 96 26.082 4.363 -0.901 1.00 2.85 N ATOM 1525 CA PRO A 96 26.844 5.518 -0.472 1.00 2.87 C ATOM 1526 C PRO A 96 26.033 6.488 0.380 1.00 3.26 C ATOM 1527 O PRO A 96 24.878 6.789 0.079 1.00 3.59 O ATOM 1528 CB PRO A 96 27.155 6.164 -1.814 1.00 2.87 C ATOM 1529 CG PRO A 96 25.956 5.857 -2.677 1.00 2.97 C ATOM 1530 CD PRO A 96 25.198 4.723 -2.009 1.00 3.03 C ATOM 0 HA PRO A 96 27.700 5.254 0.149 1.00 2.87 H new ATOM 0 HB2 PRO A 96 27.303 7.239 -1.711 1.00 2.87 H new ATOM 0 HB3 PRO A 96 28.069 5.757 -2.247 1.00 2.87 H new ATOM 0 HG2 PRO A 96 25.320 6.737 -2.779 1.00 2.97 H new ATOM 0 HG3 PRO A 96 26.268 5.571 -3.681 1.00 2.97 H new ATOM 0 HD2 PRO A 96 24.216 5.042 -1.658 1.00 3.03 H new ATOM 0 HD3 PRO A 96 25.037 3.886 -2.689 1.00 3.03 H new ATOM 1538 N ALA A 97 26.660 6.964 1.452 1.00 3.26 N ATOM 1539 CA ALA A 97 26.025 7.902 2.366 1.00 3.66 C ATOM 1540 C ALA A 97 24.789 7.292 3.015 1.00 3.56 C ATOM 1541 O ALA A 97 23.656 7.624 2.667 1.00 3.83 O ATOM 1542 CB ALA A 97 25.669 9.184 1.642 1.00 3.99 C ATOM 0 H ALA A 97 27.615 6.712 1.708 1.00 3.26 H new ATOM 0 HA ALA A 97 26.736 8.133 3.159 1.00 3.66 H new ATOM 0 HB1 ALA A 97 25.195 9.876 2.338 1.00 3.99 H new ATOM 0 HB2 ALA A 97 26.575 9.638 1.240 1.00 3.99 H new ATOM 0 HB3 ALA A 97 24.981 8.962 0.826 1.00 3.99 H new ATOM 1548 N ASP A 98 25.028 6.392 3.957 1.00 3.37 N ATOM 1549 CA ASP A 98 23.953 5.717 4.678 1.00 3.32 C ATOM 1550 C ASP A 98 23.075 6.717 5.412 1.00 3.17 C ATOM 1551 O ASP A 98 21.884 6.488 5.609 1.00 3.27 O ATOM 1552 CB ASP A 98 24.536 4.718 5.673 1.00 3.42 C ATOM 1553 CG ASP A 98 23.487 3.778 6.235 1.00 3.94 C ATOM 1554 OD1 ASP A 98 23.092 2.834 5.520 1.00 4.23 O ATOM 1555 OD2 ASP A 98 23.064 3.983 7.392 1.00 4.40 O ATOM 0 H ASP A 98 25.965 6.109 4.244 1.00 3.37 H new ATOM 0 HA ASP A 98 23.339 5.188 3.949 1.00 3.32 H new ATOM 0 HB2 ASP A 98 25.316 4.135 5.183 1.00 3.42 H new ATOM 0 HB3 ASP A 98 25.010 5.260 6.492 1.00 3.42 H new ATOM 1560 N SER A 99 23.676 7.822 5.817 1.00 3.17 N ATOM 1561 CA SER A 99 22.949 8.861 6.531 1.00 3.44 C ATOM 1562 C SER A 99 21.859 9.459 5.648 1.00 3.74 C ATOM 1563 O SER A 99 20.834 9.933 6.141 1.00 4.12 O ATOM 1564 CB SER A 99 23.905 9.958 7.004 1.00 3.73 C ATOM 1565 OG SER A 99 24.859 9.447 7.919 1.00 3.81 O ATOM 0 H SER A 99 24.664 8.024 5.665 1.00 3.17 H new ATOM 0 HA SER A 99 22.479 8.408 7.404 1.00 3.44 H new ATOM 0 HB2 SER A 99 24.417 10.393 6.146 1.00 3.73 H new ATOM 0 HB3 SER A 99 23.337 10.760 7.476 1.00 3.73 H new ATOM 0 HG SER A 99 25.407 10.182 8.265 1.00 3.81 H new ATOM 1571 N GLU A 100 22.091 9.430 4.341 1.00 3.82 N ATOM 1572 CA GLU A 100 21.135 9.956 3.376 1.00 4.40 C ATOM 1573 C GLU A 100 20.939 8.964 2.232 1.00 4.57 C ATOM 1574 O GLU A 100 21.025 9.320 1.055 1.00 5.20 O ATOM 1575 CB GLU A 100 21.616 11.311 2.850 1.00 4.96 C ATOM 1576 CG GLU A 100 22.928 11.251 2.084 1.00 4.97 C ATOM 1577 CD GLU A 100 23.352 12.608 1.555 1.00 5.69 C ATOM 1578 OE1 GLU A 100 22.943 12.961 0.429 1.00 6.33 O ATOM 1579 OE2 GLU A 100 24.094 13.318 2.266 1.00 5.72 O ATOM 0 H GLU A 100 22.939 9.045 3.924 1.00 3.82 H new ATOM 0 HA GLU A 100 20.173 10.100 3.868 1.00 4.40 H new ATOM 0 HB2 GLU A 100 20.847 11.730 2.200 1.00 4.96 H new ATOM 0 HB3 GLU A 100 21.730 11.995 3.691 1.00 4.96 H new ATOM 0 HG2 GLU A 100 23.708 10.858 2.736 1.00 4.97 H new ATOM 0 HG3 GLU A 100 22.828 10.555 1.251 1.00 4.97 H new ATOM 1586 N LYS A 101 20.658 7.716 2.595 1.00 4.17 N ATOM 1587 CA LYS A 101 20.459 6.650 1.620 1.00 4.52 C ATOM 1588 C LYS A 101 19.392 7.018 0.595 1.00 5.04 C ATOM 1589 O LYS A 101 19.450 6.570 -0.550 1.00 5.75 O ATOM 1590 CB LYS A 101 20.051 5.356 2.329 1.00 4.09 C ATOM 1591 CG LYS A 101 18.739 5.467 3.095 1.00 3.50 C ATOM 1592 CD LYS A 101 18.975 5.766 4.566 1.00 2.97 C ATOM 1593 CE LYS A 101 18.147 6.950 5.041 1.00 2.57 C ATOM 1594 NZ LYS A 101 18.305 8.134 4.154 1.00 2.71 N ATOM 0 H LYS A 101 20.563 7.417 3.566 1.00 4.17 H new ATOM 0 HA LYS A 101 21.404 6.505 1.097 1.00 4.52 H new ATOM 0 HB2 LYS A 101 19.964 4.559 1.591 1.00 4.09 H new ATOM 0 HB3 LYS A 101 20.842 5.066 3.020 1.00 4.09 H new ATOM 0 HG2 LYS A 101 18.126 6.255 2.657 1.00 3.50 H new ATOM 0 HG3 LYS A 101 18.180 4.537 2.997 1.00 3.50 H new ATOM 0 HD2 LYS A 101 18.726 4.887 5.160 1.00 2.97 H new ATOM 0 HD3 LYS A 101 20.033 5.973 4.730 1.00 2.97 H new ATOM 0 HE2 LYS A 101 17.096 6.664 5.080 1.00 2.57 H new ATOM 0 HE3 LYS A 101 18.443 7.215 6.056 1.00 2.57 H new ATOM 0 HZ1 LYS A 101 18.779 8.898 4.676 1.00 2.71 H new ATOM 0 HZ2 LYS A 101 18.878 7.873 3.326 1.00 2.71 H new ATOM 0 HZ3 LYS A 101 17.369 8.459 3.839 1.00 2.71 H new ATOM 1608 N ASN A 102 18.427 7.831 1.015 1.00 4.88 N ATOM 1609 CA ASN A 102 17.323 8.249 0.150 1.00 5.53 C ATOM 1610 C ASN A 102 16.344 7.096 -0.060 1.00 5.30 C ATOM 1611 O ASN A 102 15.158 7.313 -0.311 1.00 5.56 O ATOM 1612 CB ASN A 102 17.835 8.765 -1.200 1.00 6.54 C ATOM 1613 CG ASN A 102 16.717 9.297 -2.075 1.00 7.30 C ATOM 1614 OD1 ASN A 102 15.708 9.799 -1.577 1.00 7.44 O ATOM 1615 ND2 ASN A 102 16.889 9.187 -3.387 1.00 8.00 N ATOM 0 H ASN A 102 18.386 8.218 1.958 1.00 4.88 H new ATOM 0 HA ASN A 102 16.803 9.068 0.647 1.00 5.53 H new ATOM 0 HB2 ASN A 102 18.567 9.554 -1.031 1.00 6.54 H new ATOM 0 HB3 ASN A 102 18.350 7.959 -1.723 1.00 6.54 H new ATOM 0 HD21 ASN A 102 16.169 9.525 -4.026 1.00 8.00 H new ATOM 0 HD22 ASN A 102 17.741 8.764 -3.756 1.00 8.00 H new ATOM 1622 N ASN A 103 16.849 5.867 0.045 1.00 4.96 N ATOM 1623 CA ASN A 103 16.040 4.684 -0.109 1.00 4.80 C ATOM 1624 C ASN A 103 15.432 4.288 1.230 1.00 3.82 C ATOM 1625 O ASN A 103 15.146 3.116 1.476 1.00 3.71 O ATOM 1626 CB ASN A 103 16.905 3.548 -0.641 1.00 5.48 C ATOM 1627 CG ASN A 103 18.291 3.533 -0.028 1.00 5.68 C ATOM 1628 OD1 ASN A 103 19.250 4.030 -0.616 1.00 5.93 O ATOM 1629 ND2 ASN A 103 18.405 2.968 1.168 1.00 5.77 N ATOM 0 H ASN A 103 17.832 5.676 0.239 1.00 4.96 H new ATOM 0 HA ASN A 103 15.233 4.888 -0.813 1.00 4.80 H new ATOM 0 HB2 ASN A 103 16.413 2.597 -0.440 1.00 5.48 H new ATOM 0 HB3 ASN A 103 16.992 3.639 -1.724 1.00 5.48 H new ATOM 0 HD21 ASN A 103 19.313 2.935 1.632 1.00 5.77 H new ATOM 0 HD22 ASN A 103 17.585 2.567 1.623 1.00 5.77 H new ATOM 1636 N ALA A 104 15.237 5.280 2.092 1.00 3.34 N ATOM 1637 CA ALA A 104 14.675 5.048 3.412 1.00 2.62 C ATOM 1638 C ALA A 104 13.254 4.526 3.291 1.00 2.40 C ATOM 1639 O ALA A 104 12.744 3.848 4.183 1.00 2.26 O ATOM 1640 CB ALA A 104 14.697 6.328 4.224 1.00 2.66 C ATOM 0 H ALA A 104 15.462 6.255 1.896 1.00 3.34 H new ATOM 0 HA ALA A 104 15.280 4.300 3.924 1.00 2.62 H new ATOM 0 HB1 ALA A 104 14.273 6.140 5.211 1.00 2.66 H new ATOM 0 HB2 ALA A 104 15.725 6.674 4.330 1.00 2.66 H new ATOM 0 HB3 ALA A 104 14.108 7.092 3.716 1.00 2.66 H new ATOM 1646 N VAL A 105 12.622 4.856 2.174 1.00 2.72 N ATOM 1647 CA VAL A 105 11.258 4.432 1.914 1.00 2.60 C ATOM 1648 C VAL A 105 11.190 2.923 1.708 1.00 2.45 C ATOM 1649 O VAL A 105 10.202 2.281 2.063 1.00 2.19 O ATOM 1650 CB VAL A 105 10.679 5.148 0.682 1.00 3.26 C ATOM 1651 CG1 VAL A 105 10.715 6.657 0.873 1.00 3.86 C ATOM 1652 CG2 VAL A 105 11.430 4.748 -0.581 1.00 3.76 C ATOM 0 H VAL A 105 13.036 5.419 1.431 1.00 2.72 H new ATOM 0 HA VAL A 105 10.661 4.699 2.786 1.00 2.60 H new ATOM 0 HB VAL A 105 9.639 4.841 0.569 1.00 3.26 H new ATOM 0 HG11 VAL A 105 10.301 7.145 -0.009 1.00 3.86 H new ATOM 0 HG12 VAL A 105 10.124 6.927 1.748 1.00 3.86 H new ATOM 0 HG13 VAL A 105 11.746 6.981 1.017 1.00 3.86 H new ATOM 0 HG21 VAL A 105 11.002 5.267 -1.439 1.00 3.76 H new ATOM 0 HG22 VAL A 105 12.481 5.018 -0.480 1.00 3.76 H new ATOM 0 HG23 VAL A 105 11.345 3.671 -0.729 1.00 3.76 H new ATOM 1662 N GLU A 106 12.253 2.367 1.134 1.00 2.96 N ATOM 1663 CA GLU A 106 12.330 0.935 0.883 1.00 3.40 C ATOM 1664 C GLU A 106 12.155 0.150 2.178 1.00 3.33 C ATOM 1665 O GLU A 106 11.767 -1.019 2.160 1.00 3.80 O ATOM 1666 CB GLU A 106 13.668 0.574 0.233 1.00 4.24 C ATOM 1667 CG GLU A 106 13.931 1.303 -1.077 1.00 4.29 C ATOM 1668 CD GLU A 106 14.977 0.609 -1.928 1.00 4.91 C ATOM 1669 OE1 GLU A 106 16.178 0.731 -1.612 1.00 5.12 O ATOM 1670 OE2 GLU A 106 14.593 -0.056 -2.914 1.00 5.41 O ATOM 0 H GLU A 106 13.075 2.891 0.834 1.00 2.96 H new ATOM 0 HA GLU A 106 11.523 0.669 0.201 1.00 3.40 H new ATOM 0 HB2 GLU A 106 14.473 0.800 0.932 1.00 4.24 H new ATOM 0 HB3 GLU A 106 13.695 -0.501 0.052 1.00 4.24 H new ATOM 0 HG2 GLU A 106 13.001 1.378 -1.640 1.00 4.29 H new ATOM 0 HG3 GLU A 106 14.258 2.321 -0.863 1.00 4.29 H new ATOM 1677 N ASP A 107 12.446 0.802 3.302 1.00 3.02 N ATOM 1678 CA ASP A 107 12.333 0.165 4.607 1.00 3.41 C ATOM 1679 C ASP A 107 10.905 -0.295 4.866 1.00 3.52 C ATOM 1680 O ASP A 107 10.685 -1.416 5.322 1.00 4.26 O ATOM 1681 CB ASP A 107 12.791 1.117 5.709 1.00 3.25 C ATOM 1682 CG ASP A 107 14.285 1.371 5.672 1.00 3.30 C ATOM 1683 OD1 ASP A 107 14.711 2.299 4.952 1.00 3.72 O ATOM 1684 OD2 ASP A 107 15.029 0.645 6.361 1.00 3.41 O ATOM 0 H ASP A 107 12.762 1.771 3.332 1.00 3.02 H new ATOM 0 HA ASP A 107 12.981 -0.712 4.612 1.00 3.41 H new ATOM 0 HB2 ASP A 107 12.262 2.065 5.609 1.00 3.25 H new ATOM 0 HB3 ASP A 107 12.520 0.701 6.680 1.00 3.25 H new ATOM 1689 N ARG A 108 9.933 0.572 4.583 1.00 2.89 N ATOM 1690 CA ARG A 108 8.530 0.208 4.772 1.00 3.04 C ATOM 1691 C ARG A 108 7.739 0.464 3.508 1.00 2.46 C ATOM 1692 O ARG A 108 7.384 1.608 3.227 1.00 1.90 O ATOM 1693 CB ARG A 108 7.954 1.103 5.856 1.00 3.22 C ATOM 1694 CG ARG A 108 8.615 2.471 5.876 1.00 2.91 C ATOM 1695 CD ARG A 108 9.714 2.546 6.919 1.00 3.48 C ATOM 1696 NE ARG A 108 10.336 3.868 6.966 1.00 3.38 N ATOM 1697 CZ ARG A 108 11.460 4.130 7.624 1.00 3.81 C ATOM 1698 NH1 ARG A 108 12.079 3.171 8.298 1.00 4.30 N ATOM 1699 NH2 ARG A 108 11.964 5.356 7.611 1.00 3.91 N ATOM 0 H ARG A 108 10.087 1.516 4.228 1.00 2.89 H new ATOM 0 HA ARG A 108 8.469 -0.848 5.035 1.00 3.04 H new ATOM 0 HB2 ARG A 108 6.882 1.221 5.697 1.00 3.22 H new ATOM 0 HB3 ARG A 108 8.082 0.624 6.827 1.00 3.22 H new ATOM 0 HG2 ARG A 108 9.031 2.689 4.892 1.00 2.91 H new ATOM 0 HG3 ARG A 108 7.865 3.235 6.081 1.00 2.91 H new ATOM 0 HD2 ARG A 108 9.301 2.305 7.898 1.00 3.48 H new ATOM 0 HD3 ARG A 108 10.474 1.796 6.700 1.00 3.48 H new ATOM 0 HE ARG A 108 9.882 4.632 6.466 1.00 3.38 H new ATOM 0 HH11 ARG A 108 11.693 2.227 8.313 1.00 4.30 H new ATOM 0 HH12 ARG A 108 12.942 3.377 8.802 1.00 4.30 H new ATOM 0 HH21 ARG A 108 11.489 6.097 7.096 1.00 3.91 H new ATOM 0 HH22 ARG A 108 12.827 5.558 8.116 1.00 3.91 H new ATOM 1713 N LYS A 109 7.317 -0.615 2.863 1.00 2.91 N ATOM 1714 CA LYS A 109 6.568 -0.517 1.622 1.00 2.73 C ATOM 1715 C LYS A 109 5.272 -1.318 1.621 1.00 3.05 C ATOM 1716 O LYS A 109 5.207 -2.422 2.160 1.00 3.83 O ATOM 1717 CB LYS A 109 7.448 -0.949 0.454 1.00 3.38 C ATOM 1718 CG LYS A 109 8.106 0.218 -0.257 1.00 3.27 C ATOM 1719 CD LYS A 109 7.112 0.946 -1.146 1.00 3.31 C ATOM 1720 CE LYS A 109 7.811 1.918 -2.083 1.00 3.81 C ATOM 1721 NZ LYS A 109 8.733 1.221 -3.022 1.00 4.37 N ATOM 0 H LYS A 109 7.482 -1.570 3.181 1.00 2.91 H new ATOM 0 HA LYS A 109 6.279 0.529 1.517 1.00 2.73 H new ATOM 0 HB2 LYS A 109 8.220 -1.626 0.819 1.00 3.38 H new ATOM 0 HB3 LYS A 109 6.845 -1.509 -0.260 1.00 3.38 H new ATOM 0 HG2 LYS A 109 8.517 0.911 0.477 1.00 3.27 H new ATOM 0 HG3 LYS A 109 8.941 -0.142 -0.858 1.00 3.27 H new ATOM 0 HD2 LYS A 109 6.545 0.221 -1.729 1.00 3.31 H new ATOM 0 HD3 LYS A 109 6.396 1.487 -0.527 1.00 3.31 H new ATOM 0 HE2 LYS A 109 7.065 2.473 -2.652 1.00 3.81 H new ATOM 0 HE3 LYS A 109 8.372 2.646 -1.497 1.00 3.81 H new ATOM 0 HZ1 LYS A 109 8.911 1.828 -3.848 1.00 4.37 H new ATOM 0 HZ2 LYS A 109 9.632 1.019 -2.540 1.00 4.37 H new ATOM 0 HZ3 LYS A 109 8.300 0.329 -3.335 1.00 4.37 H new ATOM 1735 N LEU A 110 4.244 -0.742 1.011 1.00 2.58 N ATOM 1736 CA LEU A 110 2.954 -1.406 0.863 1.00 2.86 C ATOM 1737 C LEU A 110 2.492 -1.320 -0.584 1.00 3.03 C ATOM 1738 O LEU A 110 2.712 -0.307 -1.254 1.00 2.83 O ATOM 1739 CB LEU A 110 1.889 -0.806 1.788 1.00 2.44 C ATOM 1740 CG LEU A 110 1.990 -1.221 3.259 1.00 3.17 C ATOM 1741 CD1 LEU A 110 2.168 -2.728 3.391 1.00 4.14 C ATOM 1742 CD2 LEU A 110 3.132 -0.485 3.929 1.00 3.11 C ATOM 0 H LEU A 110 4.280 0.194 0.607 1.00 2.58 H new ATOM 0 HA LEU A 110 3.086 -2.450 1.148 1.00 2.86 H new ATOM 0 HB2 LEU A 110 1.951 0.281 1.729 1.00 2.44 H new ATOM 0 HB3 LEU A 110 0.905 -1.090 1.414 1.00 2.44 H new ATOM 0 HG LEU A 110 1.059 -0.952 3.758 1.00 3.17 H new ATOM 0 HD11 LEU A 110 2.237 -2.995 4.445 1.00 4.14 H new ATOM 0 HD12 LEU A 110 1.314 -3.236 2.943 1.00 4.14 H new ATOM 0 HD13 LEU A 110 3.081 -3.033 2.879 1.00 4.14 H new ATOM 0 HD21 LEU A 110 3.196 -0.787 4.974 1.00 3.11 H new ATOM 0 HD22 LEU A 110 4.067 -0.727 3.424 1.00 3.11 H new ATOM 0 HD23 LEU A 110 2.956 0.589 3.871 1.00 3.11 H new ATOM 1754 N PHE A 111 1.845 -2.376 -1.056 1.00 3.75 N ATOM 1755 CA PHE A 111 1.352 -2.418 -2.424 1.00 4.24 C ATOM 1756 C PHE A 111 -0.148 -2.670 -2.448 1.00 4.19 C ATOM 1757 O PHE A 111 -0.635 -3.655 -1.894 1.00 4.56 O ATOM 1758 CB PHE A 111 2.083 -3.508 -3.215 1.00 5.34 C ATOM 1759 CG PHE A 111 1.525 -3.735 -4.593 1.00 6.09 C ATOM 1760 CD1 PHE A 111 1.620 -2.751 -5.563 1.00 6.18 C ATOM 1761 CD2 PHE A 111 0.906 -4.932 -4.915 1.00 6.87 C ATOM 1762 CE1 PHE A 111 1.111 -2.957 -6.831 1.00 6.97 C ATOM 1763 CE2 PHE A 111 0.392 -5.142 -6.181 1.00 7.61 C ATOM 1764 CZ PHE A 111 0.489 -4.155 -7.138 1.00 7.63 C ATOM 0 H PHE A 111 1.649 -3.216 -0.511 1.00 3.75 H new ATOM 0 HA PHE A 111 1.546 -1.452 -2.889 1.00 4.24 H new ATOM 0 HB2 PHE A 111 3.136 -3.239 -3.299 1.00 5.34 H new ATOM 0 HB3 PHE A 111 2.037 -4.443 -2.656 1.00 5.34 H new ATOM 0 HD1 PHE A 111 2.097 -1.812 -5.326 1.00 6.18 H new ATOM 0 HD2 PHE A 111 0.824 -5.709 -4.169 1.00 6.87 H new ATOM 0 HE1 PHE A 111 1.198 -2.185 -7.581 1.00 6.97 H new ATOM 0 HE2 PHE A 111 -0.086 -6.080 -6.420 1.00 7.61 H new ATOM 0 HZ PHE A 111 0.081 -4.316 -8.125 1.00 7.63 H new ATOM 1774 N ILE A 112 -0.871 -1.768 -3.099 1.00 3.92 N ATOM 1775 CA ILE A 112 -2.319 -1.868 -3.202 1.00 3.86 C ATOM 1776 C ILE A 112 -2.731 -2.120 -4.650 1.00 4.75 C ATOM 1777 O ILE A 112 -2.235 -1.465 -5.566 1.00 5.06 O ATOM 1778 CB ILE A 112 -3.005 -0.589 -2.681 1.00 2.95 C ATOM 1779 CG1 ILE A 112 -2.726 -0.391 -1.185 1.00 2.19 C ATOM 1780 CG2 ILE A 112 -4.500 -0.652 -2.930 1.00 2.90 C ATOM 1781 CD1 ILE A 112 -1.353 0.172 -0.883 1.00 2.02 C ATOM 0 H ILE A 112 -0.473 -0.953 -3.567 1.00 3.92 H new ATOM 0 HA ILE A 112 -2.640 -2.707 -2.584 1.00 3.86 H new ATOM 0 HB ILE A 112 -2.593 0.262 -3.223 1.00 2.95 H new ATOM 0 HG12 ILE A 112 -3.481 0.278 -0.771 1.00 2.19 H new ATOM 0 HG13 ILE A 112 -2.835 -1.349 -0.676 1.00 2.19 H new ATOM 0 HG21 ILE A 112 -4.970 0.258 -2.557 1.00 2.90 H new ATOM 0 HG22 ILE A 112 -4.687 -0.744 -4.000 1.00 2.90 H new ATOM 0 HG23 ILE A 112 -4.919 -1.515 -2.413 1.00 2.90 H new ATOM 0 HD11 ILE A 112 -1.234 0.282 0.195 1.00 2.02 H new ATOM 0 HD12 ILE A 112 -0.590 -0.506 -1.265 1.00 2.02 H new ATOM 0 HD13 ILE A 112 -1.246 1.146 -1.361 1.00 2.02 H new ATOM 1793 N GLY A 113 -3.652 -3.062 -4.849 1.00 5.33 N ATOM 1794 CA GLY A 113 -4.086 -3.397 -6.194 1.00 6.24 C ATOM 1795 C GLY A 113 -5.528 -3.032 -6.495 1.00 6.09 C ATOM 1796 O GLY A 113 -5.816 -2.504 -7.569 1.00 6.49 O ATOM 0 H GLY A 113 -4.103 -3.596 -4.106 1.00 5.33 H new ATOM 0 HA2 GLY A 113 -3.438 -2.890 -6.909 1.00 6.24 H new ATOM 0 HA3 GLY A 113 -3.955 -4.468 -6.349 1.00 6.24 H new ATOM 1800 N MET A 114 -6.445 -3.324 -5.572 1.00 5.69 N ATOM 1801 CA MET A 114 -7.852 -3.021 -5.793 1.00 5.55 C ATOM 1802 C MET A 114 -8.429 -2.090 -4.727 1.00 4.56 C ATOM 1803 O MET A 114 -8.732 -2.514 -3.613 1.00 4.05 O ATOM 1804 CB MET A 114 -8.666 -4.314 -5.840 1.00 6.00 C ATOM 1805 CG MET A 114 -8.019 -5.481 -5.104 1.00 5.90 C ATOM 1806 SD MET A 114 -7.164 -6.622 -6.214 1.00 7.01 S ATOM 1807 CE MET A 114 -8.456 -7.016 -7.392 1.00 7.54 C ATOM 0 H MET A 114 -6.239 -3.765 -4.676 1.00 5.69 H new ATOM 0 HA MET A 114 -7.918 -2.501 -6.749 1.00 5.55 H new ATOM 0 HB2 MET A 114 -9.650 -4.127 -5.410 1.00 6.00 H new ATOM 0 HB3 MET A 114 -8.821 -4.596 -6.881 1.00 6.00 H new ATOM 0 HG2 MET A 114 -7.310 -5.095 -4.372 1.00 5.90 H new ATOM 0 HG3 MET A 114 -8.785 -6.025 -4.551 1.00 5.90 H new ATOM 0 HE1 MET A 114 -8.467 -8.091 -7.574 1.00 7.54 H new ATOM 0 HE2 MET A 114 -9.421 -6.706 -6.991 1.00 7.54 H new ATOM 0 HE3 MET A 114 -8.267 -6.492 -8.329 1.00 7.54 H new ATOM 1817 N ILE A 115 -8.567 -0.816 -5.082 1.00 4.53 N ATOM 1818 CA ILE A 115 -9.142 0.181 -4.179 1.00 3.90 C ATOM 1819 C ILE A 115 -10.302 0.909 -4.845 1.00 4.44 C ATOM 1820 O ILE A 115 -10.410 0.932 -6.072 1.00 5.25 O ATOM 1821 CB ILE A 115 -8.111 1.211 -3.688 1.00 3.67 C ATOM 1822 CG1 ILE A 115 -7.069 1.485 -4.770 1.00 4.42 C ATOM 1823 CG2 ILE A 115 -7.462 0.720 -2.405 1.00 2.85 C ATOM 1824 CD1 ILE A 115 -6.060 2.549 -4.398 1.00 4.43 C ATOM 0 H ILE A 115 -8.288 -0.447 -5.991 1.00 4.53 H new ATOM 0 HA ILE A 115 -9.499 -0.371 -3.309 1.00 3.90 H new ATOM 0 HB ILE A 115 -8.619 2.152 -3.476 1.00 3.67 H new ATOM 0 HG12 ILE A 115 -6.539 0.559 -4.993 1.00 4.42 H new ATOM 0 HG13 ILE A 115 -7.580 1.787 -5.684 1.00 4.42 H new ATOM 0 HG21 ILE A 115 -6.733 1.454 -2.062 1.00 2.85 H new ATOM 0 HG22 ILE A 115 -8.226 0.583 -1.640 1.00 2.85 H new ATOM 0 HG23 ILE A 115 -6.961 -0.230 -2.591 1.00 2.85 H new ATOM 0 HD11 ILE A 115 -5.355 2.685 -5.218 1.00 4.43 H new ATOM 0 HD12 ILE A 115 -6.577 3.489 -4.205 1.00 4.43 H new ATOM 0 HD13 ILE A 115 -5.520 2.241 -3.503 1.00 4.43 H new ATOM 1836 N SER A 116 -11.168 1.501 -4.030 1.00 4.14 N ATOM 1837 CA SER A 116 -12.333 2.212 -4.546 1.00 4.74 C ATOM 1838 C SER A 116 -11.913 3.435 -5.352 1.00 5.61 C ATOM 1839 O SER A 116 -11.027 4.189 -4.951 1.00 5.67 O ATOM 1840 CB SER A 116 -13.243 2.636 -3.392 1.00 4.50 C ATOM 1841 OG SER A 116 -14.395 3.307 -3.873 1.00 4.35 O ATOM 0 H SER A 116 -11.086 1.503 -3.013 1.00 4.14 H new ATOM 0 HA SER A 116 -12.879 1.537 -5.206 1.00 4.74 H new ATOM 0 HB2 SER A 116 -13.542 1.758 -2.819 1.00 4.50 H new ATOM 0 HB3 SER A 116 -12.695 3.289 -2.713 1.00 4.50 H new ATOM 0 HG SER A 116 -14.962 3.567 -3.117 1.00 4.35 H new ATOM 1847 N LYS A 117 -12.564 3.614 -6.495 1.00 6.37 N ATOM 1848 CA LYS A 117 -12.271 4.725 -7.393 1.00 7.35 C ATOM 1849 C LYS A 117 -12.534 6.071 -6.728 1.00 7.65 C ATOM 1850 O LYS A 117 -12.148 7.116 -7.252 1.00 8.40 O ATOM 1851 CB LYS A 117 -13.103 4.596 -8.671 1.00 8.11 C ATOM 1852 CG LYS A 117 -12.606 3.511 -9.617 1.00 8.25 C ATOM 1853 CD LYS A 117 -12.926 2.116 -9.097 1.00 7.50 C ATOM 1854 CE LYS A 117 -11.839 1.121 -9.469 1.00 7.13 C ATOM 1855 NZ LYS A 117 -11.641 1.033 -10.943 1.00 7.69 N ATOM 0 H LYS A 117 -13.306 2.997 -6.825 1.00 6.37 H new ATOM 0 HA LYS A 117 -11.211 4.682 -7.644 1.00 7.35 H new ATOM 0 HB2 LYS A 117 -14.138 4.384 -8.401 1.00 8.11 H new ATOM 0 HB3 LYS A 117 -13.099 5.552 -9.195 1.00 8.11 H new ATOM 0 HG2 LYS A 117 -13.063 3.647 -10.597 1.00 8.25 H new ATOM 0 HG3 LYS A 117 -11.529 3.611 -9.750 1.00 8.25 H new ATOM 0 HD2 LYS A 117 -13.037 2.147 -8.013 1.00 7.50 H new ATOM 0 HD3 LYS A 117 -13.880 1.784 -9.506 1.00 7.50 H new ATOM 0 HE2 LYS A 117 -10.902 1.414 -8.995 1.00 7.13 H new ATOM 0 HE3 LYS A 117 -12.100 0.137 -9.079 1.00 7.13 H new ATOM 0 HZ1 LYS A 117 -10.991 0.250 -11.160 1.00 7.69 H new ATOM 0 HZ2 LYS A 117 -12.556 0.862 -11.407 1.00 7.69 H new ATOM 0 HZ3 LYS A 117 -11.237 1.925 -11.293 1.00 7.69 H new ATOM 1869 N LYS A 118 -13.196 6.043 -5.576 1.00 7.20 N ATOM 1870 CA LYS A 118 -13.500 7.264 -4.842 1.00 7.69 C ATOM 1871 C LYS A 118 -12.495 7.474 -3.715 1.00 7.36 C ATOM 1872 O LYS A 118 -12.852 7.918 -2.623 1.00 7.36 O ATOM 1873 CB LYS A 118 -14.923 7.207 -4.278 1.00 7.64 C ATOM 1874 CG LYS A 118 -16.008 7.425 -5.324 1.00 7.99 C ATOM 1875 CD LYS A 118 -16.069 6.279 -6.323 1.00 7.52 C ATOM 1876 CE LYS A 118 -17.172 6.489 -7.347 1.00 7.69 C ATOM 1877 NZ LYS A 118 -18.516 6.558 -6.710 1.00 7.78 N ATOM 0 H LYS A 118 -13.532 5.188 -5.132 1.00 7.20 H new ATOM 0 HA LYS A 118 -13.430 8.106 -5.531 1.00 7.69 H new ATOM 0 HB2 LYS A 118 -15.078 6.237 -3.804 1.00 7.64 H new ATOM 0 HB3 LYS A 118 -15.026 7.962 -3.499 1.00 7.64 H new ATOM 0 HG2 LYS A 118 -16.974 7.528 -4.830 1.00 7.99 H new ATOM 0 HG3 LYS A 118 -15.820 8.359 -5.853 1.00 7.99 H new ATOM 0 HD2 LYS A 118 -15.110 6.189 -6.833 1.00 7.52 H new ATOM 0 HD3 LYS A 118 -16.237 5.342 -5.793 1.00 7.52 H new ATOM 0 HE2 LYS A 118 -16.984 7.410 -7.899 1.00 7.69 H new ATOM 0 HE3 LYS A 118 -17.155 5.674 -8.071 1.00 7.69 H new ATOM 0 HZ1 LYS A 118 -19.251 6.463 -7.439 1.00 7.78 H new ATOM 0 HZ2 LYS A 118 -18.613 5.787 -6.019 1.00 7.78 H new ATOM 0 HZ3 LYS A 118 -18.624 7.472 -6.226 1.00 7.78 H new ATOM 1891 N CYS A 119 -11.236 7.152 -3.993 1.00 7.20 N ATOM 1892 CA CYS A 119 -10.171 7.297 -3.008 1.00 6.89 C ATOM 1893 C CYS A 119 -9.134 8.315 -3.457 1.00 7.58 C ATOM 1894 O CYS A 119 -8.777 8.378 -4.634 1.00 7.88 O ATOM 1895 CB CYS A 119 -9.483 5.951 -2.770 1.00 5.83 C ATOM 1896 SG CYS A 119 -10.569 4.676 -2.089 1.00 5.00 S ATOM 0 H CYS A 119 -10.928 6.788 -4.895 1.00 7.20 H new ATOM 0 HA CYS A 119 -10.626 7.649 -2.082 1.00 6.89 H new ATOM 0 HB2 CYS A 119 -9.070 5.595 -3.714 1.00 5.83 H new ATOM 0 HB3 CYS A 119 -8.644 6.099 -2.090 1.00 5.83 H new ATOM 0 HG CYS A 119 -10.958 3.883 -3.043 1.00 5.00 H new ATOM 1902 N THR A 120 -8.652 9.113 -2.510 1.00 7.94 N ATOM 1903 CA THR A 120 -7.636 10.110 -2.803 1.00 8.60 C ATOM 1904 C THR A 120 -6.323 9.721 -2.135 1.00 8.03 C ATOM 1905 O THR A 120 -6.323 9.015 -1.125 1.00 7.32 O ATOM 1906 CB THR A 120 -8.056 11.514 -2.333 1.00 9.61 C ATOM 1907 OG1 THR A 120 -9.484 11.598 -2.249 1.00 9.96 O ATOM 1908 CG2 THR A 120 -7.541 12.574 -3.298 1.00 10.47 C ATOM 0 H THR A 120 -8.950 9.087 -1.535 1.00 7.94 H new ATOM 0 HA THR A 120 -7.510 10.143 -3.885 1.00 8.60 H new ATOM 0 HB THR A 120 -7.624 11.691 -1.348 1.00 9.61 H new ATOM 0 HG1 THR A 120 -9.742 12.494 -1.948 1.00 9.96 H new ATOM 0 HG21 THR A 120 -7.847 13.561 -2.951 1.00 10.47 H new ATOM 0 HG22 THR A 120 -6.453 12.526 -3.344 1.00 10.47 H new ATOM 0 HG23 THR A 120 -7.954 12.394 -4.290 1.00 10.47 H new ATOM 1916 N GLU A 121 -5.207 10.174 -2.692 1.00 8.38 N ATOM 1917 CA GLU A 121 -3.901 9.827 -2.146 1.00 7.86 C ATOM 1918 C GLU A 121 -3.751 10.270 -0.690 1.00 7.95 C ATOM 1919 O GLU A 121 -3.353 9.477 0.164 1.00 7.23 O ATOM 1920 CB GLU A 121 -2.799 10.440 -3.022 1.00 8.41 C ATOM 1921 CG GLU A 121 -1.502 10.738 -2.287 1.00 8.20 C ATOM 1922 CD GLU A 121 -0.483 11.436 -3.163 1.00 8.99 C ATOM 1923 OE1 GLU A 121 0.256 10.738 -3.888 1.00 9.38 O ATOM 1924 OE2 GLU A 121 -0.420 12.683 -3.124 1.00 9.31 O ATOM 0 H GLU A 121 -5.179 10.777 -3.514 1.00 8.38 H new ATOM 0 HA GLU A 121 -3.807 8.741 -2.154 1.00 7.86 H new ATOM 0 HB2 GLU A 121 -2.587 9.759 -3.846 1.00 8.41 H new ATOM 0 HB3 GLU A 121 -3.174 11.365 -3.461 1.00 8.41 H new ATOM 0 HG2 GLU A 121 -1.716 11.361 -1.418 1.00 8.20 H new ATOM 0 HG3 GLU A 121 -1.077 9.806 -1.914 1.00 8.20 H new ATOM 1931 N ASN A 122 -4.120 11.511 -0.394 1.00 8.92 N ATOM 1932 CA ASN A 122 -4.010 12.024 0.967 1.00 9.27 C ATOM 1933 C ASN A 122 -4.896 11.220 1.906 1.00 8.93 C ATOM 1934 O ASN A 122 -4.474 10.818 2.993 1.00 8.77 O ATOM 1935 CB ASN A 122 -4.403 13.501 1.013 1.00 10.46 C ATOM 1936 CG ASN A 122 -4.137 14.129 2.367 1.00 10.98 C ATOM 1937 OD1 ASN A 122 -3.057 14.665 2.614 1.00 11.25 O ATOM 1938 ND2 ASN A 122 -5.123 14.063 3.256 1.00 11.25 N ATOM 0 H ASN A 122 -4.495 12.176 -1.071 1.00 8.92 H new ATOM 0 HA ASN A 122 -2.974 11.927 1.290 1.00 9.27 H new ATOM 0 HB2 ASN A 122 -3.849 14.045 0.248 1.00 10.46 H new ATOM 0 HB3 ASN A 122 -5.461 13.600 0.771 1.00 10.46 H new ATOM 0 HD21 ASN A 122 -5.000 14.466 4.185 1.00 11.25 H new ATOM 0 HD22 ASN A 122 -6.003 13.609 3.009 1.00 11.25 H new ATOM 1945 N ASP A 123 -6.123 10.976 1.464 1.00 8.91 N ATOM 1946 CA ASP A 123 -7.091 10.226 2.247 1.00 8.65 C ATOM 1947 C ASP A 123 -6.541 8.866 2.653 1.00 7.63 C ATOM 1948 O ASP A 123 -6.802 8.387 3.759 1.00 7.63 O ATOM 1949 CB ASP A 123 -8.373 10.034 1.439 1.00 8.67 C ATOM 1950 CG ASP A 123 -9.556 9.662 2.310 1.00 8.97 C ATOM 1951 OD1 ASP A 123 -10.241 10.582 2.806 1.00 9.52 O ATOM 1952 OD2 ASP A 123 -9.799 8.451 2.499 1.00 8.72 O ATOM 0 H ASP A 123 -6.472 11.291 0.559 1.00 8.91 H new ATOM 0 HA ASP A 123 -7.304 10.795 3.152 1.00 8.65 H new ATOM 0 HB2 ASP A 123 -8.599 10.953 0.898 1.00 8.67 H new ATOM 0 HB3 ASP A 123 -8.216 9.255 0.693 1.00 8.67 H new ATOM 1957 N ILE A 124 -5.756 8.257 1.768 1.00 6.86 N ATOM 1958 CA ILE A 124 -5.198 6.940 2.036 1.00 5.85 C ATOM 1959 C ILE A 124 -4.418 6.931 3.343 1.00 6.05 C ATOM 1960 O ILE A 124 -4.587 6.030 4.167 1.00 5.79 O ATOM 1961 CB ILE A 124 -4.286 6.479 0.880 1.00 5.17 C ATOM 1962 CG1 ILE A 124 -5.130 5.960 -0.284 1.00 4.90 C ATOM 1963 CG2 ILE A 124 -3.300 5.414 1.346 1.00 4.29 C ATOM 1964 CD1 ILE A 124 -5.989 4.760 0.061 1.00 4.19 C ATOM 0 H ILE A 124 -5.495 8.654 0.865 1.00 6.86 H new ATOM 0 HA ILE A 124 -6.033 6.244 2.123 1.00 5.85 H new ATOM 0 HB ILE A 124 -3.709 7.339 0.539 1.00 5.17 H new ATOM 0 HG12 ILE A 124 -5.774 6.765 -0.639 1.00 4.90 H new ATOM 0 HG13 ILE A 124 -4.468 5.695 -1.109 1.00 4.90 H new ATOM 0 HG21 ILE A 124 -2.671 5.109 0.509 1.00 4.29 H new ATOM 0 HG22 ILE A 124 -2.674 5.820 2.141 1.00 4.29 H new ATOM 0 HG23 ILE A 124 -3.848 4.550 1.721 1.00 4.29 H new ATOM 0 HD11 ILE A 124 -6.556 4.454 -0.818 1.00 4.19 H new ATOM 0 HD12 ILE A 124 -5.352 3.938 0.386 1.00 4.19 H new ATOM 0 HD13 ILE A 124 -6.678 5.024 0.863 1.00 4.19 H new ATOM 1976 N ARG A 125 -3.596 7.951 3.545 1.00 6.68 N ATOM 1977 CA ARG A 125 -2.798 8.049 4.751 1.00 7.01 C ATOM 1978 C ARG A 125 -3.692 7.949 5.976 1.00 7.61 C ATOM 1979 O ARG A 125 -3.400 7.201 6.906 1.00 7.60 O ATOM 1980 CB ARG A 125 -2.028 9.372 4.761 1.00 7.78 C ATOM 1981 CG ARG A 125 -1.365 9.690 6.091 1.00 8.22 C ATOM 1982 CD ARG A 125 -0.614 11.011 6.029 1.00 8.67 C ATOM 1983 NE ARG A 125 0.516 10.955 5.107 1.00 9.09 N ATOM 1984 CZ ARG A 125 1.212 12.024 4.730 1.00 9.67 C ATOM 1985 NH1 ARG A 125 0.901 13.223 5.204 1.00 9.86 N ATOM 1986 NH2 ARG A 125 2.224 11.893 3.882 1.00 10.27 N ATOM 0 H ARG A 125 -3.467 8.720 2.888 1.00 6.68 H new ATOM 0 HA ARG A 125 -2.083 7.227 4.773 1.00 7.01 H new ATOM 0 HB2 ARG A 125 -1.264 9.342 3.984 1.00 7.78 H new ATOM 0 HB3 ARG A 125 -2.712 10.181 4.505 1.00 7.78 H new ATOM 0 HG2 ARG A 125 -2.120 9.735 6.875 1.00 8.22 H new ATOM 0 HG3 ARG A 125 -0.676 8.889 6.357 1.00 8.22 H new ATOM 0 HD2 ARG A 125 -1.297 11.802 5.718 1.00 8.67 H new ATOM 0 HD3 ARG A 125 -0.257 11.272 7.025 1.00 8.67 H new ATOM 0 HE ARG A 125 0.787 10.046 4.731 1.00 9.09 H new ATOM 0 HH11 ARG A 125 0.126 13.327 5.859 1.00 9.86 H new ATOM 0 HH12 ARG A 125 1.436 14.041 4.913 1.00 9.86 H new ATOM 0 HH21 ARG A 125 2.469 10.972 3.519 1.00 10.27 H new ATOM 0 HH22 ARG A 125 2.757 12.713 3.593 1.00 10.27 H new ATOM 2000 N VAL A 126 -4.812 8.663 5.939 1.00 8.22 N ATOM 2001 CA VAL A 126 -5.746 8.669 7.052 1.00 8.90 C ATOM 2002 C VAL A 126 -6.182 7.253 7.406 1.00 8.37 C ATOM 2003 O VAL A 126 -6.191 6.871 8.576 1.00 8.88 O ATOM 2004 CB VAL A 126 -6.993 9.514 6.727 1.00 9.46 C ATOM 2005 CG1 VAL A 126 -7.964 9.513 7.897 1.00 10.20 C ATOM 2006 CG2 VAL A 126 -6.593 10.934 6.358 1.00 10.10 C ATOM 0 H VAL A 126 -5.092 9.244 5.149 1.00 8.22 H new ATOM 0 HA VAL A 126 -5.228 9.110 7.904 1.00 8.90 H new ATOM 0 HB VAL A 126 -7.497 9.067 5.870 1.00 9.46 H new ATOM 0 HG11 VAL A 126 -8.837 10.115 7.646 1.00 10.20 H new ATOM 0 HG12 VAL A 126 -8.277 8.491 8.109 1.00 10.20 H new ATOM 0 HG13 VAL A 126 -7.475 9.932 8.776 1.00 10.20 H new ATOM 0 HG21 VAL A 126 -7.486 11.516 6.132 1.00 10.10 H new ATOM 0 HG22 VAL A 126 -6.064 11.392 7.194 1.00 10.10 H new ATOM 0 HG23 VAL A 126 -5.942 10.913 5.484 1.00 10.10 H new ATOM 2016 N MET A 127 -6.511 6.468 6.387 1.00 7.45 N ATOM 2017 CA MET A 127 -6.957 5.100 6.603 1.00 7.01 C ATOM 2018 C MET A 127 -5.849 4.273 7.242 1.00 6.90 C ATOM 2019 O MET A 127 -6.088 3.506 8.177 1.00 7.35 O ATOM 2020 CB MET A 127 -7.392 4.468 5.280 1.00 6.01 C ATOM 2021 CG MET A 127 -8.430 3.366 5.440 1.00 5.80 C ATOM 2022 SD MET A 127 -7.772 1.886 6.230 1.00 4.71 S ATOM 2023 CE MET A 127 -6.635 1.323 4.971 1.00 4.35 C ATOM 0 H MET A 127 -6.477 6.755 5.409 1.00 7.45 H new ATOM 0 HA MET A 127 -7.811 5.118 7.280 1.00 7.01 H new ATOM 0 HB2 MET A 127 -7.797 5.245 4.632 1.00 6.01 H new ATOM 0 HB3 MET A 127 -6.515 4.059 4.777 1.00 6.01 H new ATOM 0 HG2 MET A 127 -9.265 3.744 6.029 1.00 5.80 H new ATOM 0 HG3 MET A 127 -8.825 3.102 4.459 1.00 5.80 H new ATOM 0 HE1 MET A 127 -6.879 0.298 4.693 1.00 4.35 H new ATOM 0 HE2 MET A 127 -6.715 1.966 4.094 1.00 4.35 H new ATOM 0 HE3 MET A 127 -5.616 1.362 5.357 1.00 4.35 H new ATOM 2033 N PHE A 128 -4.628 4.467 6.760 1.00 6.45 N ATOM 2034 CA PHE A 128 -3.485 3.729 7.270 1.00 6.34 C ATOM 2035 C PHE A 128 -3.083 4.266 8.635 1.00 7.39 C ATOM 2036 O PHE A 128 -2.446 3.571 9.427 1.00 7.66 O ATOM 2037 CB PHE A 128 -2.309 3.808 6.293 1.00 5.52 C ATOM 2038 CG PHE A 128 -2.464 2.927 5.085 1.00 4.45 C ATOM 2039 CD1 PHE A 128 -3.530 3.104 4.217 1.00 4.02 C ATOM 2040 CD2 PHE A 128 -1.547 1.924 4.818 1.00 4.07 C ATOM 2041 CE1 PHE A 128 -3.677 2.295 3.106 1.00 3.10 C ATOM 2042 CE2 PHE A 128 -1.690 1.112 3.709 1.00 3.27 C ATOM 2043 CZ PHE A 128 -2.747 1.297 2.852 1.00 2.70 C ATOM 0 H PHE A 128 -4.406 5.129 6.017 1.00 6.45 H new ATOM 0 HA PHE A 128 -3.767 2.681 7.375 1.00 6.34 H new ATOM 0 HB2 PHE A 128 -2.190 4.841 5.965 1.00 5.52 H new ATOM 0 HB3 PHE A 128 -1.394 3.532 6.817 1.00 5.52 H new ATOM 0 HD1 PHE A 128 -4.253 3.882 4.411 1.00 4.02 H new ATOM 0 HD2 PHE A 128 -0.710 1.775 5.484 1.00 4.07 H new ATOM 0 HE1 PHE A 128 -4.513 2.439 2.438 1.00 3.10 H new ATOM 0 HE2 PHE A 128 -0.970 0.331 3.516 1.00 3.27 H new ATOM 0 HZ PHE A 128 -2.854 0.667 1.982 1.00 2.70 H new ATOM 2053 N SER A 129 -3.461 5.513 8.895 1.00 8.07 N ATOM 2054 CA SER A 129 -3.143 6.161 10.157 1.00 9.09 C ATOM 2055 C SER A 129 -3.856 5.462 11.307 1.00 9.73 C ATOM 2056 O SER A 129 -3.424 5.542 12.456 1.00 10.48 O ATOM 2057 CB SER A 129 -3.528 7.638 10.106 1.00 9.77 C ATOM 2058 OG SER A 129 -3.389 8.247 11.379 1.00 10.65 O ATOM 0 H SER A 129 -3.989 6.095 8.245 1.00 8.07 H new ATOM 0 HA SER A 129 -2.068 6.090 10.324 1.00 9.09 H new ATOM 0 HB2 SER A 129 -2.900 8.156 9.381 1.00 9.77 H new ATOM 0 HB3 SER A 129 -4.558 7.737 9.763 1.00 9.77 H new ATOM 0 HG SER A 129 -3.640 9.192 11.319 1.00 10.65 H new ATOM 2064 N SER A 130 -4.955 4.780 10.989 1.00 9.49 N ATOM 2065 CA SER A 130 -5.722 4.062 11.998 1.00 10.16 C ATOM 2066 C SER A 130 -4.842 3.028 12.693 1.00 10.26 C ATOM 2067 O SER A 130 -5.102 2.635 13.831 1.00 11.09 O ATOM 2068 CB SER A 130 -6.931 3.376 11.360 1.00 9.81 C ATOM 2069 OG SER A 130 -7.695 2.679 12.328 1.00 10.25 O ATOM 0 H SER A 130 -5.331 4.711 10.043 1.00 9.49 H new ATOM 0 HA SER A 130 -6.076 4.779 12.738 1.00 10.16 H new ATOM 0 HB2 SER A 130 -7.556 4.120 10.867 1.00 9.81 H new ATOM 0 HB3 SER A 130 -6.594 2.682 10.590 1.00 9.81 H new ATOM 0 HG SER A 130 -8.462 2.251 11.893 1.00 10.25 H new ATOM 2075 N PHE A 131 -3.797 2.596 11.994 1.00 9.46 N ATOM 2076 CA PHE A 131 -2.866 1.608 12.524 1.00 9.57 C ATOM 2077 C PHE A 131 -1.646 2.288 13.137 1.00 9.98 C ATOM 2078 O PHE A 131 -1.322 2.070 14.304 1.00 10.80 O ATOM 2079 CB PHE A 131 -2.439 0.656 11.410 1.00 8.58 C ATOM 2080 CG PHE A 131 -3.564 0.287 10.484 1.00 8.00 C ATOM 2081 CD1 PHE A 131 -4.719 -0.302 10.975 1.00 8.07 C ATOM 2082 CD2 PHE A 131 -3.470 0.537 9.125 1.00 7.49 C ATOM 2083 CE1 PHE A 131 -5.758 -0.632 10.128 1.00 7.58 C ATOM 2084 CE2 PHE A 131 -4.506 0.206 8.272 1.00 6.97 C ATOM 2085 CZ PHE A 131 -5.651 -0.379 8.775 1.00 6.97 C ATOM 0 H PHE A 131 -3.574 2.918 11.052 1.00 9.46 H new ATOM 0 HA PHE A 131 -3.366 1.041 13.309 1.00 9.57 H new ATOM 0 HB2 PHE A 131 -1.638 1.118 10.833 1.00 8.58 H new ATOM 0 HB3 PHE A 131 -2.029 -0.252 11.853 1.00 8.58 H new ATOM 0 HD1 PHE A 131 -4.807 -0.505 12.032 1.00 8.07 H new ATOM 0 HD2 PHE A 131 -2.577 0.996 8.727 1.00 7.49 H new ATOM 0 HE1 PHE A 131 -6.654 -1.088 10.523 1.00 7.58 H new ATOM 0 HE2 PHE A 131 -4.420 0.405 7.214 1.00 6.97 H new ATOM 0 HZ PHE A 131 -6.462 -0.638 8.111 1.00 6.97 H new ATOM 2095 N GLY A 132 -0.977 3.114 12.340 1.00 9.45 N ATOM 2096 CA GLY A 132 0.199 3.819 12.815 1.00 9.82 C ATOM 2097 C GLY A 132 0.482 5.070 12.007 1.00 9.42 C ATOM 2098 O GLY A 132 -0.229 5.368 11.048 1.00 9.41 O ATOM 0 H GLY A 132 -1.229 3.308 11.371 1.00 9.45 H new ATOM 0 HA2 GLY A 132 0.061 4.088 13.862 1.00 9.82 H new ATOM 0 HA3 GLY A 132 1.062 3.155 12.768 1.00 9.82 H new ATOM 2102 N GLN A 133 1.519 5.804 12.393 1.00 9.20 N ATOM 2103 CA GLN A 133 1.894 7.025 11.688 1.00 8.95 C ATOM 2104 C GLN A 133 2.430 6.699 10.298 1.00 7.78 C ATOM 2105 O GLN A 133 3.267 5.814 10.143 1.00 7.16 O ATOM 2106 CB GLN A 133 2.945 7.796 12.490 1.00 9.43 C ATOM 2107 CG GLN A 133 3.584 8.945 11.727 1.00 9.26 C ATOM 2108 CD GLN A 133 2.580 10.007 11.321 1.00 9.65 C ATOM 2109 OE1 GLN A 133 1.576 10.220 11.999 1.00 10.41 O ATOM 2110 NE2 GLN A 133 2.850 10.680 10.208 1.00 9.25 N ATOM 0 H GLN A 133 2.115 5.576 13.189 1.00 9.20 H new ATOM 0 HA GLN A 133 1.006 7.647 11.579 1.00 8.95 H new ATOM 0 HB2 GLN A 133 2.481 8.188 13.395 1.00 9.43 H new ATOM 0 HB3 GLN A 133 3.726 7.104 12.806 1.00 9.43 H new ATOM 0 HG2 GLN A 133 4.358 9.400 12.345 1.00 9.26 H new ATOM 0 HG3 GLN A 133 4.075 8.555 10.835 1.00 9.26 H new ATOM 0 HE21 GLN A 133 3.695 10.470 9.677 1.00 9.25 H new ATOM 0 HE22 GLN A 133 2.212 11.407 9.884 1.00 9.25 H new ATOM 2119 N ILE A 134 1.940 7.409 9.288 1.00 7.58 N ATOM 2120 CA ILE A 134 2.386 7.180 7.919 1.00 6.58 C ATOM 2121 C ILE A 134 3.405 8.230 7.485 1.00 6.62 C ATOM 2122 O ILE A 134 3.286 9.404 7.833 1.00 7.42 O ATOM 2123 CB ILE A 134 1.196 7.133 6.933 1.00 6.45 C ATOM 2124 CG1 ILE A 134 0.710 5.690 6.779 1.00 6.02 C ATOM 2125 CG2 ILE A 134 1.576 7.718 5.574 1.00 5.90 C ATOM 2126 CD1 ILE A 134 0.123 5.113 8.051 1.00 6.94 C ATOM 0 H ILE A 134 1.239 8.143 9.390 1.00 7.58 H new ATOM 0 HA ILE A 134 2.874 6.206 7.899 1.00 6.58 H new ATOM 0 HB ILE A 134 0.389 7.743 7.339 1.00 6.45 H new ATOM 0 HG12 ILE A 134 -0.041 5.650 5.990 1.00 6.02 H new ATOM 0 HG13 ILE A 134 1.544 5.066 6.457 1.00 6.02 H new ATOM 0 HG21 ILE A 134 0.717 7.670 4.904 1.00 5.90 H new ATOM 0 HG22 ILE A 134 1.882 8.757 5.698 1.00 5.90 H new ATOM 0 HG23 ILE A 134 2.400 7.145 5.149 1.00 5.90 H new ATOM 0 HD11 ILE A 134 -0.201 4.088 7.870 1.00 6.94 H new ATOM 0 HD12 ILE A 134 0.878 5.121 8.837 1.00 6.94 H new ATOM 0 HD13 ILE A 134 -0.731 5.714 8.363 1.00 6.94 H new ATOM 2138 N GLU A 135 4.410 7.797 6.717 1.00 5.83 N ATOM 2139 CA GLU A 135 5.449 8.702 6.251 1.00 5.88 C ATOM 2140 C GLU A 135 5.101 9.256 4.880 1.00 5.91 C ATOM 2141 O GLU A 135 5.081 10.471 4.680 1.00 6.67 O ATOM 2142 CB GLU A 135 6.797 7.986 6.211 1.00 5.10 C ATOM 2143 CG GLU A 135 7.464 7.887 7.571 1.00 5.50 C ATOM 2144 CD GLU A 135 7.856 9.242 8.129 1.00 6.06 C ATOM 2145 OE1 GLU A 135 8.945 9.739 7.773 1.00 6.00 O ATOM 2146 OE2 GLU A 135 7.072 9.806 8.922 1.00 6.66 O ATOM 0 H GLU A 135 4.520 6.831 6.410 1.00 5.83 H new ATOM 0 HA GLU A 135 5.519 9.536 6.949 1.00 5.88 H new ATOM 0 HB2 GLU A 135 6.656 6.983 5.809 1.00 5.10 H new ATOM 0 HB3 GLU A 135 7.461 8.513 5.526 1.00 5.10 H new ATOM 0 HG2 GLU A 135 6.787 7.393 8.268 1.00 5.50 H new ATOM 0 HG3 GLU A 135 8.352 7.260 7.491 1.00 5.50 H new ATOM 2153 N GLU A 136 4.829 8.365 3.932 1.00 5.21 N ATOM 2154 CA GLU A 136 4.469 8.784 2.588 1.00 5.43 C ATOM 2155 C GLU A 136 3.236 8.039 2.095 1.00 5.05 C ATOM 2156 O GLU A 136 3.112 6.828 2.275 1.00 4.20 O ATOM 2157 CB GLU A 136 5.636 8.556 1.626 1.00 5.17 C ATOM 2158 CG GLU A 136 5.571 9.425 0.380 1.00 5.90 C ATOM 2159 CD GLU A 136 6.788 9.263 -0.510 1.00 5.96 C ATOM 2160 OE1 GLU A 136 7.887 9.685 -0.095 1.00 6.14 O ATOM 2161 OE2 GLU A 136 6.642 8.710 -1.621 1.00 5.95 O ATOM 0 H GLU A 136 4.852 7.355 4.071 1.00 5.21 H new ATOM 0 HA GLU A 136 4.238 9.849 2.620 1.00 5.43 H new ATOM 0 HB2 GLU A 136 6.572 8.753 2.149 1.00 5.17 H new ATOM 0 HB3 GLU A 136 5.652 7.508 1.328 1.00 5.17 H new ATOM 0 HG2 GLU A 136 4.675 9.173 -0.187 1.00 5.90 H new ATOM 0 HG3 GLU A 136 5.478 10.470 0.675 1.00 5.90 H new ATOM 2168 N CYS A 137 2.327 8.778 1.473 1.00 5.74 N ATOM 2169 CA CYS A 137 1.102 8.202 0.938 1.00 5.52 C ATOM 2170 C CYS A 137 0.982 8.524 -0.543 1.00 5.95 C ATOM 2171 O CYS A 137 1.069 9.686 -0.941 1.00 6.88 O ATOM 2172 CB CYS A 137 -0.117 8.736 1.691 1.00 6.14 C ATOM 2173 SG CYS A 137 -0.245 10.539 1.707 1.00 7.54 S ATOM 0 H CYS A 137 2.417 9.783 1.326 1.00 5.74 H new ATOM 0 HA CYS A 137 1.141 7.120 1.067 1.00 5.52 H new ATOM 0 HB2 CYS A 137 -1.019 8.323 1.240 1.00 6.14 H new ATOM 0 HB3 CYS A 137 -0.082 8.376 2.719 1.00 6.14 H new ATOM 0 HG CYS A 137 0.249 11.019 0.604 1.00 7.54 H new ATOM 2179 N ARG A 138 0.788 7.495 -1.357 1.00 5.43 N ATOM 2180 CA ARG A 138 0.678 7.685 -2.796 1.00 6.08 C ATOM 2181 C ARG A 138 -0.454 6.859 -3.384 1.00 5.90 C ATOM 2182 O ARG A 138 -0.695 5.721 -2.977 1.00 5.02 O ATOM 2183 CB ARG A 138 1.995 7.325 -3.484 1.00 6.07 C ATOM 2184 CG ARG A 138 3.153 7.114 -2.520 1.00 5.34 C ATOM 2185 CD ARG A 138 4.418 6.695 -3.250 1.00 5.40 C ATOM 2186 NE ARG A 138 5.472 6.285 -2.324 1.00 4.64 N ATOM 2187 CZ ARG A 138 6.727 6.049 -2.691 1.00 4.78 C ATOM 2188 NH1 ARG A 138 7.093 6.198 -3.956 1.00 5.71 N ATOM 2189 NH2 ARG A 138 7.620 5.664 -1.789 1.00 4.08 N ATOM 0 H ARG A 138 0.704 6.527 -1.048 1.00 5.43 H new ATOM 0 HA ARG A 138 0.456 8.738 -2.971 1.00 6.08 H new ATOM 0 HB2 ARG A 138 1.852 6.417 -4.070 1.00 6.07 H new ATOM 0 HB3 ARG A 138 2.257 8.118 -4.184 1.00 6.07 H new ATOM 0 HG2 ARG A 138 3.339 8.035 -1.967 1.00 5.34 H new ATOM 0 HG3 ARG A 138 2.884 6.352 -1.789 1.00 5.34 H new ATOM 0 HD2 ARG A 138 4.190 5.872 -3.928 1.00 5.40 H new ATOM 0 HD3 ARG A 138 4.775 7.523 -3.862 1.00 5.40 H new ATOM 0 HE ARG A 138 5.230 6.174 -1.339 1.00 4.64 H new ATOM 0 HH11 ARG A 138 6.410 6.495 -4.653 1.00 5.71 H new ATOM 0 HH12 ARG A 138 8.058 6.016 -4.233 1.00 5.71 H new ATOM 0 HH21 ARG A 138 7.343 5.549 -0.814 1.00 4.08 H new ATOM 0 HH22 ARG A 138 8.584 5.483 -2.070 1.00 4.08 H new ATOM 2203 N ILE A 139 -1.148 7.452 -4.346 1.00 6.77 N ATOM 2204 CA ILE A 139 -2.256 6.798 -5.021 1.00 6.80 C ATOM 2205 C ILE A 139 -2.131 6.963 -6.524 1.00 7.75 C ATOM 2206 O ILE A 139 -1.612 7.969 -7.009 1.00 8.55 O ATOM 2207 CB ILE A 139 -3.637 7.326 -4.552 1.00 6.95 C ATOM 2208 CG1 ILE A 139 -4.345 6.250 -3.724 1.00 5.96 C ATOM 2209 CG2 ILE A 139 -4.509 7.761 -5.735 1.00 7.85 C ATOM 2210 CD1 ILE A 139 -5.795 6.560 -3.415 1.00 6.13 C ATOM 0 H ILE A 139 -0.958 8.397 -4.678 1.00 6.77 H new ATOM 0 HA ILE A 139 -2.203 5.742 -4.758 1.00 6.80 H new ATOM 0 HB ILE A 139 -3.473 8.208 -3.932 1.00 6.95 H new ATOM 0 HG12 ILE A 139 -4.294 5.302 -4.260 1.00 5.96 H new ATOM 0 HG13 ILE A 139 -3.806 6.115 -2.786 1.00 5.96 H new ATOM 0 HG21 ILE A 139 -5.468 8.125 -5.366 1.00 7.85 H new ATOM 0 HG22 ILE A 139 -4.006 8.557 -6.284 1.00 7.85 H new ATOM 0 HG23 ILE A 139 -4.674 6.911 -6.397 1.00 7.85 H new ATOM 0 HD11 ILE A 139 -6.223 5.749 -2.826 1.00 6.13 H new ATOM 0 HD12 ILE A 139 -5.856 7.490 -2.850 1.00 6.13 H new ATOM 0 HD13 ILE A 139 -6.351 6.664 -4.347 1.00 6.13 H new ATOM 2222 N LEU A 140 -2.603 5.971 -7.252 1.00 7.74 N ATOM 2223 CA LEU A 140 -2.564 6.014 -8.695 1.00 8.72 C ATOM 2224 C LEU A 140 -3.982 5.948 -9.228 1.00 9.04 C ATOM 2225 O LEU A 140 -4.738 4.998 -8.954 1.00 8.48 O ATOM 2226 CB LEU A 140 -1.741 4.847 -9.240 1.00 8.72 C ATOM 2227 CG LEU A 140 -0.420 4.597 -8.514 1.00 8.18 C ATOM 2228 CD1 LEU A 140 0.231 3.320 -9.019 1.00 8.31 C ATOM 2229 CD2 LEU A 140 0.520 5.780 -8.692 1.00 8.71 C ATOM 0 H LEU A 140 -3.019 5.124 -6.864 1.00 7.74 H new ATOM 0 HA LEU A 140 -2.094 6.943 -9.018 1.00 8.72 H new ATOM 0 HB2 LEU A 140 -2.344 3.941 -9.189 1.00 8.72 H new ATOM 0 HB3 LEU A 140 -1.531 5.030 -10.294 1.00 8.72 H new ATOM 0 HG LEU A 140 -0.629 4.481 -7.451 1.00 8.18 H new ATOM 0 HD11 LEU A 140 1.171 3.157 -8.491 1.00 8.31 H new ATOM 0 HD12 LEU A 140 -0.436 2.477 -8.841 1.00 8.31 H new ATOM 0 HD13 LEU A 140 0.426 3.409 -10.088 1.00 8.31 H new ATOM 0 HD21 LEU A 140 1.455 5.584 -8.168 1.00 8.71 H new ATOM 0 HD22 LEU A 140 0.722 5.927 -9.753 1.00 8.71 H new ATOM 0 HD23 LEU A 140 0.057 6.678 -8.283 1.00 8.71 H new ATOM 2241 N ARG A 141 -4.302 6.981 -10.003 1.00 9.99 N ATOM 2242 CA ARG A 141 -5.609 7.166 -10.605 1.00 10.47 C ATOM 2243 C ARG A 141 -5.456 7.584 -12.067 1.00 11.63 C ATOM 2244 O ARG A 141 -4.487 8.256 -12.423 1.00 12.15 O ATOM 2245 CB ARG A 141 -6.403 8.216 -9.815 1.00 10.48 C ATOM 2246 CG ARG A 141 -5.631 9.497 -9.531 1.00 10.88 C ATOM 2247 CD ARG A 141 -6.474 10.495 -8.753 1.00 11.35 C ATOM 2248 NE ARG A 141 -7.839 10.585 -9.266 1.00 11.42 N ATOM 2249 CZ ARG A 141 -8.388 11.710 -9.718 1.00 11.99 C ATOM 2250 NH1 ARG A 141 -7.688 12.838 -9.729 1.00 12.56 N ATOM 2251 NH2 ARG A 141 -9.638 11.708 -10.158 1.00 12.08 N ATOM 0 H ARG A 141 -3.643 7.725 -10.232 1.00 9.99 H new ATOM 0 HA ARG A 141 -6.158 6.225 -10.574 1.00 10.47 H new ATOM 0 HB2 ARG A 141 -7.307 8.465 -10.370 1.00 10.48 H new ATOM 0 HB3 ARG A 141 -6.721 7.779 -8.868 1.00 10.48 H new ATOM 0 HG2 ARG A 141 -4.729 9.262 -8.965 1.00 10.88 H new ATOM 0 HG3 ARG A 141 -5.310 9.945 -10.471 1.00 10.88 H new ATOM 0 HD2 ARG A 141 -6.501 10.204 -7.703 1.00 11.35 H new ATOM 0 HD3 ARG A 141 -6.005 11.478 -8.799 1.00 11.35 H new ATOM 0 HE ARG A 141 -8.404 9.736 -9.278 1.00 11.42 H new ATOM 0 HH11 ARG A 141 -6.726 12.844 -9.390 1.00 12.56 H new ATOM 0 HH12 ARG A 141 -8.112 13.698 -10.076 1.00 12.56 H new ATOM 0 HH21 ARG A 141 -10.180 10.844 -10.150 1.00 12.08 H new ATOM 0 HH22 ARG A 141 -10.058 12.571 -10.504 1.00 12.08 H new ATOM 2265 N GLY A 142 -6.403 7.189 -12.911 1.00 12.05 N ATOM 2266 CA GLY A 142 -6.312 7.527 -14.323 1.00 13.16 C ATOM 2267 C GLY A 142 -7.391 8.497 -14.778 1.00 13.83 C ATOM 2268 O GLY A 142 -8.483 8.524 -14.212 1.00 13.45 O ATOM 0 H GLY A 142 -7.225 6.646 -12.648 1.00 12.05 H new ATOM 0 HA2 GLY A 142 -5.333 7.963 -14.523 1.00 13.16 H new ATOM 0 HA3 GLY A 142 -6.381 6.614 -14.914 1.00 13.16 H new ATOM 2272 N PRO A 143 -7.102 9.317 -15.812 1.00 14.87 N ATOM 2273 CA PRO A 143 -8.052 10.307 -16.333 1.00 15.64 C ATOM 2274 C PRO A 143 -9.222 9.678 -17.085 1.00 15.86 C ATOM 2275 O PRO A 143 -10.063 10.388 -17.636 1.00 16.55 O ATOM 2276 CB PRO A 143 -7.201 11.151 -17.284 1.00 16.66 C ATOM 2277 CG PRO A 143 -6.108 10.240 -17.723 1.00 16.59 C ATOM 2278 CD PRO A 143 -5.824 9.339 -16.552 1.00 15.42 C ATOM 0 HA PRO A 143 -8.516 10.875 -15.527 1.00 15.64 H new ATOM 0 HB2 PRO A 143 -7.787 11.504 -18.133 1.00 16.66 H new ATOM 0 HB3 PRO A 143 -6.804 12.033 -16.782 1.00 16.66 H new ATOM 0 HG2 PRO A 143 -6.409 9.662 -18.596 1.00 16.59 H new ATOM 0 HG3 PRO A 143 -5.219 10.804 -18.006 1.00 16.59 H new ATOM 0 HD2 PRO A 143 -5.531 8.340 -16.876 1.00 15.42 H new ATOM 0 HD3 PRO A 143 -5.011 9.725 -15.937 1.00 15.42 H new ATOM 2286 N ASP A 144 -9.273 8.349 -17.109 1.00 15.31 N ATOM 2287 CA ASP A 144 -10.355 7.642 -17.790 1.00 15.50 C ATOM 2288 C ASP A 144 -11.707 8.081 -17.242 1.00 15.23 C ATOM 2289 O ASP A 144 -12.738 7.938 -17.900 1.00 15.58 O ATOM 2290 CB ASP A 144 -10.196 6.130 -17.619 1.00 14.89 C ATOM 2291 CG ASP A 144 -11.276 5.351 -18.343 1.00 15.23 C ATOM 2292 OD1 ASP A 144 -12.330 5.084 -17.728 1.00 15.02 O ATOM 2293 OD2 ASP A 144 -11.066 5.005 -19.524 1.00 15.79 O ATOM 0 H ASP A 144 -8.582 7.742 -16.668 1.00 15.31 H new ATOM 0 HA ASP A 144 -10.306 7.887 -18.851 1.00 15.50 H new ATOM 0 HB2 ASP A 144 -9.219 5.825 -17.994 1.00 14.89 H new ATOM 0 HB3 ASP A 144 -10.222 5.882 -16.558 1.00 14.89 H new ATOM 2298 N GLY A 145 -11.685 8.616 -16.028 1.00 14.64 N ATOM 2299 CA GLY A 145 -12.899 9.073 -15.384 1.00 14.42 C ATOM 2300 C GLY A 145 -12.922 8.694 -13.921 1.00 13.31 C ATOM 2301 O GLY A 145 -13.763 9.166 -13.156 1.00 13.11 O ATOM 0 H GLY A 145 -10.838 8.742 -15.474 1.00 14.64 H new ATOM 0 HA2 GLY A 145 -12.980 10.156 -15.483 1.00 14.42 H new ATOM 0 HA3 GLY A 145 -13.764 8.642 -15.887 1.00 14.42 H new ATOM 2305 N LEU A 146 -11.986 7.830 -13.541 1.00 12.64 N ATOM 2306 CA LEU A 146 -11.876 7.368 -12.167 1.00 11.55 C ATOM 2307 C LEU A 146 -10.473 6.833 -11.886 1.00 11.12 C ATOM 2308 O LEU A 146 -9.669 6.671 -12.804 1.00 11.67 O ATOM 2309 CB LEU A 146 -12.934 6.291 -11.871 1.00 10.90 C ATOM 2310 CG LEU A 146 -13.092 5.163 -12.909 1.00 11.20 C ATOM 2311 CD1 LEU A 146 -13.805 5.661 -14.158 1.00 12.22 C ATOM 2312 CD2 LEU A 146 -11.746 4.555 -13.275 1.00 11.35 C ATOM 0 H LEU A 146 -11.289 7.435 -14.173 1.00 12.64 H new ATOM 0 HA LEU A 146 -12.056 8.217 -11.508 1.00 11.55 H new ATOM 0 HB2 LEU A 146 -12.695 5.836 -10.910 1.00 10.90 H new ATOM 0 HB3 LEU A 146 -13.899 6.786 -11.758 1.00 10.90 H new ATOM 0 HG LEU A 146 -13.704 4.385 -12.452 1.00 11.20 H new ATOM 0 HD11 LEU A 146 -13.902 4.843 -14.872 1.00 12.22 H new ATOM 0 HD12 LEU A 146 -14.796 6.028 -13.890 1.00 12.22 H new ATOM 0 HD13 LEU A 146 -13.229 6.469 -14.608 1.00 12.22 H new ATOM 0 HD21 LEU A 146 -11.892 3.763 -14.009 1.00 11.35 H new ATOM 0 HD22 LEU A 146 -11.101 5.326 -13.697 1.00 11.35 H new ATOM 0 HD23 LEU A 146 -11.279 4.140 -12.382 1.00 11.35 H new ATOM 2324 N SER A 147 -10.180 6.564 -10.619 1.00 10.17 N ATOM 2325 CA SER A 147 -8.879 6.038 -10.234 1.00 9.69 C ATOM 2326 C SER A 147 -8.715 4.599 -10.702 1.00 9.46 C ATOM 2327 O SER A 147 -9.577 3.757 -10.456 1.00 8.99 O ATOM 2328 CB SER A 147 -8.715 6.107 -8.714 1.00 8.75 C ATOM 2329 OG SER A 147 -7.459 5.587 -8.314 1.00 8.22 O ATOM 0 H SER A 147 -10.827 6.702 -9.842 1.00 10.17 H new ATOM 0 HA SER A 147 -8.111 6.647 -10.710 1.00 9.69 H new ATOM 0 HB2 SER A 147 -8.807 7.141 -8.381 1.00 8.75 H new ATOM 0 HB3 SER A 147 -9.515 5.545 -8.233 1.00 8.75 H new ATOM 0 HG SER A 147 -7.377 5.643 -7.339 1.00 8.22 H new ATOM 2335 N ARG A 148 -7.603 4.322 -11.385 1.00 9.89 N ATOM 2336 CA ARG A 148 -7.322 2.974 -11.866 1.00 9.93 C ATOM 2337 C ARG A 148 -7.523 1.973 -10.735 1.00 8.90 C ATOM 2338 O ARG A 148 -7.889 0.821 -10.967 1.00 8.92 O ATOM 2339 CB ARG A 148 -5.897 2.884 -12.411 1.00 10.37 C ATOM 2340 CG ARG A 148 -4.848 3.404 -11.446 1.00 9.67 C ATOM 2341 CD ARG A 148 -3.753 2.381 -11.209 1.00 9.77 C ATOM 2342 NE ARG A 148 -2.946 2.156 -12.406 1.00 10.74 N ATOM 2343 CZ ARG A 148 -2.181 1.083 -12.591 1.00 11.24 C ATOM 2344 NH1 ARG A 148 -2.120 0.139 -11.662 1.00 10.90 N ATOM 2345 NH2 ARG A 148 -1.479 0.953 -13.708 1.00 12.22 N ATOM 0 H ARG A 148 -6.887 5.011 -11.615 1.00 9.89 H new ATOM 0 HA ARG A 148 -8.011 2.738 -12.677 1.00 9.93 H new ATOM 0 HB2 ARG A 148 -5.674 1.845 -12.653 1.00 10.37 H new ATOM 0 HB3 ARG A 148 -5.836 3.449 -13.341 1.00 10.37 H new ATOM 0 HG2 ARG A 148 -4.411 4.321 -11.842 1.00 9.67 H new ATOM 0 HG3 ARG A 148 -5.320 3.659 -10.497 1.00 9.67 H new ATOM 0 HD2 ARG A 148 -3.110 2.720 -10.397 1.00 9.77 H new ATOM 0 HD3 ARG A 148 -4.200 1.439 -10.890 1.00 9.77 H new ATOM 0 HE ARG A 148 -2.970 2.862 -13.142 1.00 10.74 H new ATOM 0 HH11 ARG A 148 -2.661 0.234 -10.802 1.00 10.90 H new ATOM 0 HH12 ARG A 148 -1.533 -0.682 -11.807 1.00 10.90 H new ATOM 0 HH21 ARG A 148 -1.525 1.676 -14.426 1.00 12.22 H new ATOM 0 HH22 ARG A 148 -0.893 0.130 -13.849 1.00 12.22 H new ATOM 2359 N GLY A 149 -7.273 2.427 -9.508 1.00 8.07 N ATOM 2360 CA GLY A 149 -7.472 1.584 -8.348 1.00 7.06 C ATOM 2361 C GLY A 149 -6.196 1.010 -7.758 1.00 6.63 C ATOM 2362 O GLY A 149 -6.235 -0.076 -7.181 1.00 6.24 O ATOM 0 H GLY A 149 -6.935 3.367 -9.300 1.00 8.07 H new ATOM 0 HA2 GLY A 149 -7.985 2.162 -7.579 1.00 7.06 H new ATOM 0 HA3 GLY A 149 -8.132 0.761 -8.622 1.00 7.06 H new ATOM 2366 N CYS A 150 -5.071 1.725 -7.867 1.00 6.80 N ATOM 2367 CA CYS A 150 -3.815 1.213 -7.303 1.00 6.41 C ATOM 2368 C CYS A 150 -3.168 2.250 -6.399 1.00 5.95 C ATOM 2369 O CYS A 150 -3.276 3.438 -6.652 1.00 6.46 O ATOM 2370 CB CYS A 150 -2.844 0.796 -8.405 1.00 7.32 C ATOM 2371 SG CYS A 150 -1.225 0.268 -7.800 1.00 8.04 S ATOM 0 H CYS A 150 -5.002 2.633 -8.326 1.00 6.80 H new ATOM 0 HA CYS A 150 -4.055 0.332 -6.708 1.00 6.41 H new ATOM 0 HB2 CYS A 150 -3.289 -0.018 -8.978 1.00 7.32 H new ATOM 0 HB3 CYS A 150 -2.709 1.632 -9.091 1.00 7.32 H new ATOM 0 HG CYS A 150 -1.379 -0.655 -6.897 1.00 8.04 H new ATOM 2377 N ALA A 151 -2.513 1.798 -5.331 1.00 5.10 N ATOM 2378 CA ALA A 151 -1.875 2.722 -4.397 1.00 4.66 C ATOM 2379 C ALA A 151 -0.594 2.163 -3.780 1.00 4.11 C ATOM 2380 O ALA A 151 -0.460 0.956 -3.580 1.00 3.84 O ATOM 2381 CB ALA A 151 -2.855 3.113 -3.306 1.00 4.12 C ATOM 0 H ALA A 151 -2.411 0.811 -5.093 1.00 5.10 H new ATOM 0 HA ALA A 151 -1.585 3.602 -4.971 1.00 4.66 H new ATOM 0 HB1 ALA A 151 -2.372 3.802 -2.613 1.00 4.12 H new ATOM 0 HB2 ALA A 151 -3.723 3.597 -3.753 1.00 4.12 H new ATOM 0 HB3 ALA A 151 -3.174 2.221 -2.767 1.00 4.12 H new ATOM 2387 N PHE A 152 0.349 3.061 -3.497 1.00 4.15 N ATOM 2388 CA PHE A 152 1.617 2.697 -2.870 1.00 3.65 C ATOM 2389 C PHE A 152 1.805 3.517 -1.593 1.00 3.07 C ATOM 2390 O PHE A 152 1.488 4.706 -1.570 1.00 3.60 O ATOM 2391 CB PHE A 152 2.787 2.948 -3.827 1.00 4.44 C ATOM 2392 CG PHE A 152 2.892 1.944 -4.941 1.00 5.27 C ATOM 2393 CD1 PHE A 152 2.052 2.020 -6.040 1.00 5.74 C ATOM 2394 CD2 PHE A 152 3.827 0.922 -4.886 1.00 5.76 C ATOM 2395 CE1 PHE A 152 2.140 1.097 -7.063 1.00 6.61 C ATOM 2396 CE2 PHE A 152 3.920 -0.005 -5.907 1.00 6.72 C ATOM 2397 CZ PHE A 152 3.097 0.093 -7.003 1.00 7.13 C ATOM 0 H PHE A 152 0.255 4.057 -3.695 1.00 4.15 H new ATOM 0 HA PHE A 152 1.596 1.635 -2.625 1.00 3.65 H new ATOM 0 HB2 PHE A 152 2.683 3.944 -4.258 1.00 4.44 H new ATOM 0 HB3 PHE A 152 3.716 2.942 -3.258 1.00 4.44 H new ATOM 0 HD1 PHE A 152 1.319 2.811 -6.097 1.00 5.74 H new ATOM 0 HD2 PHE A 152 4.490 0.849 -4.036 1.00 5.76 H new ATOM 0 HE1 PHE A 152 1.467 1.156 -7.906 1.00 6.61 H new ATOM 0 HE2 PHE A 152 4.640 -0.807 -5.843 1.00 6.72 H new ATOM 0 HZ PHE A 152 3.195 -0.610 -7.817 1.00 7.13 H new ATOM 2407 N VAL A 153 2.309 2.890 -0.530 1.00 2.26 N ATOM 2408 CA VAL A 153 2.500 3.594 0.740 1.00 2.07 C ATOM 2409 C VAL A 153 3.772 3.155 1.467 1.00 1.71 C ATOM 2410 O VAL A 153 4.162 1.991 1.411 1.00 1.46 O ATOM 2411 CB VAL A 153 1.291 3.379 1.677 1.00 1.96 C ATOM 2412 CG1 VAL A 153 1.496 4.102 3.001 1.00 2.68 C ATOM 2413 CG2 VAL A 153 0.002 3.840 1.012 1.00 2.36 C ATOM 0 H VAL A 153 2.589 1.909 -0.521 1.00 2.26 H new ATOM 0 HA VAL A 153 2.595 4.651 0.490 1.00 2.07 H new ATOM 0 HB VAL A 153 1.209 2.311 1.880 1.00 1.96 H new ATOM 0 HG11 VAL A 153 0.632 3.936 3.644 1.00 2.68 H new ATOM 0 HG12 VAL A 153 2.391 3.718 3.490 1.00 2.68 H new ATOM 0 HG13 VAL A 153 1.612 5.170 2.818 1.00 2.68 H new ATOM 0 HG21 VAL A 153 -0.835 3.679 1.691 1.00 2.36 H new ATOM 0 HG22 VAL A 153 0.076 4.901 0.772 1.00 2.36 H new ATOM 0 HG23 VAL A 153 -0.159 3.271 0.096 1.00 2.36 H new ATOM 2423 N THR A 154 4.415 4.104 2.153 1.00 2.20 N ATOM 2424 CA THR A 154 5.630 3.821 2.918 1.00 2.13 C ATOM 2425 C THR A 154 5.530 4.440 4.303 1.00 2.87 C ATOM 2426 O THR A 154 5.322 5.652 4.431 1.00 3.63 O ATOM 2427 CB THR A 154 6.863 4.423 2.221 1.00 2.53 C ATOM 2428 OG1 THR A 154 7.141 3.718 1.005 1.00 2.59 O ATOM 2429 CG2 THR A 154 8.090 4.400 3.123 1.00 2.45 C ATOM 0 H THR A 154 4.112 5.077 2.193 1.00 2.20 H new ATOM 0 HA THR A 154 5.734 2.738 2.989 1.00 2.13 H new ATOM 0 HB THR A 154 6.633 5.464 1.993 1.00 2.53 H new ATOM 0 HG1 THR A 154 7.283 2.769 1.202 1.00 2.59 H new ATOM 0 HG21 THR A 154 8.939 4.834 2.594 1.00 2.45 H new ATOM 0 HG22 THR A 154 7.890 4.979 4.024 1.00 2.45 H new ATOM 0 HG23 THR A 154 8.321 3.371 3.397 1.00 2.45 H new ATOM 2437 N PHE A 155 5.655 3.640 5.354 1.00 3.05 N ATOM 2438 CA PHE A 155 5.565 4.247 6.675 1.00 4.10 C ATOM 2439 C PHE A 155 6.361 3.631 7.818 1.00 4.59 C ATOM 2440 O PHE A 155 6.537 2.422 7.910 1.00 4.50 O ATOM 2441 CB PHE A 155 4.145 4.526 7.085 1.00 4.47 C ATOM 2442 CG PHE A 155 3.330 3.410 7.626 1.00 5.26 C ATOM 2443 CD1 PHE A 155 3.398 3.118 8.966 1.00 6.22 C ATOM 2444 CD2 PHE A 155 2.429 2.728 6.830 1.00 5.12 C ATOM 2445 CE1 PHE A 155 2.586 2.169 9.521 1.00 7.05 C ATOM 2446 CE2 PHE A 155 1.619 1.755 7.373 1.00 5.96 C ATOM 2447 CZ PHE A 155 1.691 1.480 8.723 1.00 6.93 C ATOM 0 H PHE A 155 5.809 2.632 5.327 1.00 3.05 H new ATOM 0 HA PHE A 155 6.095 5.184 6.504 1.00 4.10 H new ATOM 0 HB2 PHE A 155 4.166 5.315 7.837 1.00 4.47 H new ATOM 0 HB3 PHE A 155 3.622 4.927 6.217 1.00 4.47 H new ATOM 0 HD1 PHE A 155 4.103 3.646 9.591 1.00 6.22 H new ATOM 0 HD2 PHE A 155 2.360 2.959 5.777 1.00 5.12 H new ATOM 0 HE1 PHE A 155 2.643 1.958 10.579 1.00 7.05 H new ATOM 0 HE2 PHE A 155 0.930 1.210 6.745 1.00 5.96 H new ATOM 0 HZ PHE A 155 1.049 0.727 9.156 1.00 6.93 H new ATOM 2457 N THR A 156 6.769 4.545 8.707 1.00 5.34 N ATOM 2458 CA THR A 156 7.525 4.281 9.931 1.00 5.91 C ATOM 2459 C THR A 156 8.358 3.021 9.906 1.00 6.07 C ATOM 2460 O THR A 156 9.588 3.077 9.908 1.00 5.70 O ATOM 2461 CB THR A 156 6.597 4.231 11.154 1.00 7.03 C ATOM 2462 OG1 THR A 156 5.636 3.178 11.010 1.00 7.51 O ATOM 2463 CG2 THR A 156 5.885 5.561 11.323 1.00 7.22 C ATOM 0 H THR A 156 6.569 5.538 8.583 1.00 5.34 H new ATOM 0 HA THR A 156 8.220 5.118 10.001 1.00 5.91 H new ATOM 0 HB THR A 156 7.201 4.035 12.040 1.00 7.03 H new ATOM 0 HG1 THR A 156 5.053 3.158 11.797 1.00 7.51 H new ATOM 0 HG21 THR A 156 5.230 5.515 12.193 1.00 7.22 H new ATOM 0 HG22 THR A 156 6.621 6.352 11.465 1.00 7.22 H new ATOM 0 HG23 THR A 156 5.292 5.772 10.433 1.00 7.22 H new ATOM 2471 N THR A 157 7.688 1.890 9.888 1.00 6.77 N ATOM 2472 CA THR A 157 8.383 0.609 9.908 1.00 7.26 C ATOM 2473 C THR A 157 7.637 -0.463 9.138 1.00 6.99 C ATOM 2474 O THR A 157 6.521 -0.249 8.666 1.00 6.85 O ATOM 2475 CB THR A 157 8.614 0.113 11.348 1.00 8.46 C ATOM 2476 OG1 THR A 157 7.389 0.165 12.087 1.00 8.78 O ATOM 2477 CG2 THR A 157 9.672 0.951 12.052 1.00 8.87 C ATOM 0 H THR A 157 6.671 1.824 9.860 1.00 6.77 H new ATOM 0 HA THR A 157 9.343 0.785 9.423 1.00 7.26 H new ATOM 0 HB THR A 157 8.966 -0.917 11.298 1.00 8.46 H new ATOM 0 HG1 THR A 157 7.544 -0.154 13.001 1.00 8.78 H new ATOM 0 HG21 THR A 157 9.815 0.579 13.067 1.00 8.87 H new ATOM 0 HG22 THR A 157 10.612 0.884 11.505 1.00 8.87 H new ATOM 0 HG23 THR A 157 9.347 1.991 12.089 1.00 8.87 H new ATOM 2485 N ARG A 158 8.272 -1.621 9.019 1.00 7.05 N ATOM 2486 CA ARG A 158 7.688 -2.742 8.309 1.00 7.06 C ATOM 2487 C ARG A 158 6.603 -3.422 9.133 1.00 7.86 C ATOM 2488 O ARG A 158 5.507 -3.664 8.637 1.00 7.67 O ATOM 2489 CB ARG A 158 8.774 -3.755 7.956 1.00 7.38 C ATOM 2490 CG ARG A 158 9.602 -4.154 9.158 1.00 7.76 C ATOM 2491 CD ARG A 158 11.076 -3.865 8.938 1.00 8.64 C ATOM 2492 NE ARG A 158 11.340 -2.431 8.875 1.00 8.78 N ATOM 2493 CZ ARG A 158 12.528 -1.909 8.582 1.00 9.57 C ATOM 2494 NH1 ARG A 158 13.554 -2.703 8.303 1.00 10.24 N ATOM 2495 NH2 ARG A 158 12.687 -0.594 8.563 1.00 9.80 N ATOM 0 H ARG A 158 9.196 -1.805 9.409 1.00 7.05 H new ATOM 0 HA ARG A 158 7.230 -2.358 7.397 1.00 7.06 H new ATOM 0 HB2 ARG A 158 8.312 -4.643 7.525 1.00 7.38 H new ATOM 0 HB3 ARG A 158 9.427 -3.333 7.192 1.00 7.38 H new ATOM 0 HG2 ARG A 158 9.252 -3.615 10.038 1.00 7.76 H new ATOM 0 HG3 ARG A 158 9.464 -5.216 9.360 1.00 7.76 H new ATOM 0 HD2 ARG A 158 11.658 -4.307 9.746 1.00 8.64 H new ATOM 0 HD3 ARG A 158 11.405 -4.337 8.012 1.00 8.64 H new ATOM 0 HE ARG A 158 10.569 -1.792 9.067 1.00 8.78 H new ATOM 0 HH11 ARG A 158 13.433 -3.716 8.313 1.00 10.24 H new ATOM 0 HH12 ARG A 158 14.464 -2.301 8.079 1.00 10.24 H new ATOM 0 HH21 ARG A 158 11.899 0.018 8.773 1.00 9.80 H new ATOM 0 HH22 ARG A 158 13.598 -0.194 8.338 1.00 9.80 H new ATOM 2509 N ALA A 159 6.894 -3.689 10.406 1.00 8.79 N ATOM 2510 CA ALA A 159 5.934 -4.358 11.272 1.00 9.64 C ATOM 2511 C ALA A 159 4.616 -3.604 11.302 1.00 9.32 C ATOM 2512 O ALA A 159 3.550 -4.192 11.109 1.00 9.45 O ATOM 2513 CB ALA A 159 6.498 -4.500 12.676 1.00 10.64 C ATOM 0 H ALA A 159 7.780 -3.453 10.854 1.00 8.79 H new ATOM 0 HA ALA A 159 5.746 -5.353 10.870 1.00 9.64 H new ATOM 0 HB1 ALA A 159 5.769 -5.002 13.312 1.00 10.64 H new ATOM 0 HB2 ALA A 159 7.415 -5.088 12.642 1.00 10.64 H new ATOM 0 HB3 ALA A 159 6.715 -3.512 13.083 1.00 10.64 H new ATOM 2519 N MET A 160 4.696 -2.296 11.494 1.00 8.95 N ATOM 2520 CA MET A 160 3.503 -1.466 11.527 1.00 8.73 C ATOM 2521 C MET A 160 2.802 -1.555 10.182 1.00 7.79 C ATOM 2522 O MET A 160 1.575 -1.621 10.106 1.00 7.78 O ATOM 2523 CB MET A 160 3.867 -0.015 11.857 1.00 8.63 C ATOM 2524 CG MET A 160 2.847 0.676 12.745 1.00 9.38 C ATOM 2525 SD MET A 160 2.692 -0.109 14.361 1.00 10.41 S ATOM 2526 CE MET A 160 1.467 0.942 15.133 1.00 11.44 C ATOM 0 H MET A 160 5.571 -1.789 11.629 1.00 8.95 H new ATOM 0 HA MET A 160 2.831 -1.824 12.307 1.00 8.73 H new ATOM 0 HB2 MET A 160 4.839 0.005 12.350 1.00 8.63 H new ATOM 0 HB3 MET A 160 3.969 0.546 10.928 1.00 8.63 H new ATOM 0 HG2 MET A 160 3.133 1.719 12.878 1.00 9.38 H new ATOM 0 HG3 MET A 160 1.877 0.673 12.249 1.00 9.38 H new ATOM 0 HE1 MET A 160 1.714 1.076 16.186 1.00 11.44 H new ATOM 0 HE2 MET A 160 1.455 1.912 14.636 1.00 11.44 H new ATOM 0 HE3 MET A 160 0.484 0.479 15.047 1.00 11.44 H new ATOM 2536 N ALA A 161 3.602 -1.581 9.123 1.00 7.04 N ATOM 2537 CA ALA A 161 3.077 -1.689 7.775 1.00 6.16 C ATOM 2538 C ALA A 161 2.318 -2.998 7.609 1.00 6.64 C ATOM 2539 O ALA A 161 1.233 -3.033 7.022 1.00 6.28 O ATOM 2540 CB ALA A 161 4.217 -1.607 6.774 1.00 5.48 C ATOM 0 H ALA A 161 4.619 -1.528 9.176 1.00 7.04 H new ATOM 0 HA ALA A 161 2.386 -0.866 7.593 1.00 6.16 H new ATOM 0 HB1 ALA A 161 3.819 -1.688 5.762 1.00 5.48 H new ATOM 0 HB2 ALA A 161 4.732 -0.653 6.886 1.00 5.48 H new ATOM 0 HB3 ALA A 161 4.919 -2.421 6.955 1.00 5.48 H new ATOM 2546 N GLN A 162 2.876 -4.067 8.172 1.00 7.56 N ATOM 2547 CA GLN A 162 2.272 -5.385 8.072 1.00 8.22 C ATOM 2548 C GLN A 162 0.939 -5.413 8.798 1.00 8.56 C ATOM 2549 O GLN A 162 0.035 -6.163 8.429 1.00 8.70 O ATOM 2550 CB GLN A 162 3.214 -6.444 8.645 1.00 9.22 C ATOM 2551 CG GLN A 162 4.531 -6.550 7.892 1.00 9.05 C ATOM 2552 CD GLN A 162 5.563 -7.381 8.629 1.00 10.06 C ATOM 2553 OE1 GLN A 162 5.560 -7.445 9.859 1.00 10.94 O ATOM 2554 NE2 GLN A 162 6.453 -8.020 7.880 1.00 9.99 N ATOM 0 H GLN A 162 3.747 -4.042 8.702 1.00 7.56 H new ATOM 0 HA GLN A 162 2.096 -5.608 7.020 1.00 8.22 H new ATOM 0 HB2 GLN A 162 3.419 -6.211 9.690 1.00 9.22 H new ATOM 0 HB3 GLN A 162 2.714 -7.413 8.627 1.00 9.22 H new ATOM 0 HG2 GLN A 162 4.349 -6.990 6.912 1.00 9.05 H new ATOM 0 HG3 GLN A 162 4.930 -5.550 7.723 1.00 9.05 H new ATOM 0 HE21 GLN A 162 6.417 -7.938 6.864 1.00 9.99 H new ATOM 0 HE22 GLN A 162 7.173 -8.593 8.320 1.00 9.99 H new ATOM 2563 N THR A 163 0.818 -4.581 9.826 1.00 8.76 N ATOM 2564 CA THR A 163 -0.409 -4.514 10.595 1.00 9.19 C ATOM 2565 C THR A 163 -1.576 -4.154 9.685 1.00 8.39 C ATOM 2566 O THR A 163 -2.650 -4.755 9.766 1.00 8.67 O ATOM 2567 CB THR A 163 -0.303 -3.484 11.741 1.00 9.62 C ATOM 2568 OG1 THR A 163 0.666 -3.924 12.701 1.00 10.45 O ATOM 2569 CG2 THR A 163 -1.647 -3.289 12.428 1.00 10.08 C ATOM 0 H THR A 163 1.553 -3.948 10.142 1.00 8.76 H new ATOM 0 HA THR A 163 -0.579 -5.496 11.037 1.00 9.19 H new ATOM 0 HB THR A 163 0.008 -2.531 11.314 1.00 9.62 H new ATOM 0 HG1 THR A 163 1.539 -4.018 12.265 1.00 10.45 H new ATOM 0 HG21 THR A 163 -1.543 -2.559 13.231 1.00 10.08 H new ATOM 0 HG22 THR A 163 -2.377 -2.930 11.703 1.00 10.08 H new ATOM 0 HG23 THR A 163 -1.985 -4.239 12.843 1.00 10.08 H new ATOM 2577 N ALA A 164 -1.343 -3.200 8.787 1.00 7.40 N ATOM 2578 CA ALA A 164 -2.374 -2.758 7.859 1.00 6.57 C ATOM 2579 C ALA A 164 -2.875 -3.924 7.026 1.00 6.51 C ATOM 2580 O ALA A 164 -4.068 -4.033 6.738 1.00 6.33 O ATOM 2581 CB ALA A 164 -1.840 -1.661 6.952 1.00 5.56 C ATOM 0 H ALA A 164 -0.449 -2.720 8.684 1.00 7.40 H new ATOM 0 HA ALA A 164 -3.206 -2.359 8.439 1.00 6.57 H new ATOM 0 HB1 ALA A 164 -2.624 -1.343 6.265 1.00 5.56 H new ATOM 0 HB2 ALA A 164 -1.521 -0.812 7.557 1.00 5.56 H new ATOM 0 HB3 ALA A 164 -0.991 -2.040 6.383 1.00 5.56 H new ATOM 2587 N ILE A 165 -1.953 -4.803 6.657 1.00 6.81 N ATOM 2588 CA ILE A 165 -2.278 -5.962 5.846 1.00 7.06 C ATOM 2589 C ILE A 165 -3.365 -6.799 6.504 1.00 7.79 C ATOM 2590 O ILE A 165 -4.339 -7.184 5.862 1.00 7.66 O ATOM 2591 CB ILE A 165 -1.028 -6.836 5.612 1.00 7.65 C ATOM 2592 CG1 ILE A 165 0.055 -6.023 4.895 1.00 6.92 C ATOM 2593 CG2 ILE A 165 -1.385 -8.081 4.813 1.00 8.25 C ATOM 2594 CD1 ILE A 165 1.349 -6.780 4.689 1.00 7.54 C ATOM 0 H ILE A 165 -0.968 -4.732 6.910 1.00 6.81 H new ATOM 0 HA ILE A 165 -2.644 -5.598 4.886 1.00 7.06 H new ATOM 0 HB ILE A 165 -0.640 -7.156 6.579 1.00 7.65 H new ATOM 0 HG12 ILE A 165 -0.326 -5.703 3.925 1.00 6.92 H new ATOM 0 HG13 ILE A 165 0.260 -5.121 5.471 1.00 6.92 H new ATOM 0 HG21 ILE A 165 -0.490 -8.684 4.659 1.00 8.25 H new ATOM 0 HG22 ILE A 165 -2.125 -8.665 5.360 1.00 8.25 H new ATOM 0 HG23 ILE A 165 -1.796 -7.788 3.847 1.00 8.25 H new ATOM 0 HD11 ILE A 165 2.067 -6.140 4.176 1.00 7.54 H new ATOM 0 HD12 ILE A 165 1.754 -7.077 5.656 1.00 7.54 H new ATOM 0 HD13 ILE A 165 1.159 -7.668 4.087 1.00 7.54 H new ATOM 2606 N LYS A 166 -3.220 -7.038 7.800 1.00 8.61 N ATOM 2607 CA LYS A 166 -4.183 -7.851 8.527 1.00 9.40 C ATOM 2608 C LYS A 166 -5.553 -7.183 8.559 1.00 8.92 C ATOM 2609 O LYS A 166 -6.584 -7.853 8.566 1.00 9.17 O ATOM 2610 CB LYS A 166 -3.688 -8.113 9.951 1.00 10.41 C ATOM 2611 CG LYS A 166 -4.642 -8.944 10.796 1.00 11.21 C ATOM 2612 CD LYS A 166 -5.033 -10.238 10.100 1.00 11.56 C ATOM 2613 CE LYS A 166 -5.503 -11.285 11.097 1.00 12.63 C ATOM 2614 NZ LYS A 166 -5.895 -12.554 10.423 1.00 13.37 N ATOM 0 H LYS A 166 -2.450 -6.683 8.366 1.00 8.61 H new ATOM 0 HA LYS A 166 -4.283 -8.803 8.006 1.00 9.40 H new ATOM 0 HB2 LYS A 166 -2.725 -8.622 9.902 1.00 10.41 H new ATOM 0 HB3 LYS A 166 -3.518 -7.157 10.447 1.00 10.41 H new ATOM 0 HG2 LYS A 166 -4.174 -9.173 11.753 1.00 11.21 H new ATOM 0 HG3 LYS A 166 -5.538 -8.362 11.011 1.00 11.21 H new ATOM 0 HD2 LYS A 166 -5.825 -10.039 9.378 1.00 11.56 H new ATOM 0 HD3 LYS A 166 -4.181 -10.623 9.540 1.00 11.56 H new ATOM 0 HE2 LYS A 166 -4.708 -11.486 11.815 1.00 12.63 H new ATOM 0 HE3 LYS A 166 -6.351 -10.896 11.660 1.00 12.63 H new ATOM 0 HZ1 LYS A 166 -5.948 -13.319 11.126 1.00 13.37 H new ATOM 0 HZ2 LYS A 166 -6.824 -12.434 9.971 1.00 13.37 H new ATOM 0 HZ3 LYS A 166 -5.187 -12.796 9.700 1.00 13.37 H new ATOM 2628 N ALA A 167 -5.552 -5.858 8.584 1.00 8.28 N ATOM 2629 CA ALA A 167 -6.786 -5.086 8.628 1.00 7.90 C ATOM 2630 C ALA A 167 -7.481 -5.003 7.270 1.00 6.96 C ATOM 2631 O ALA A 167 -8.700 -4.844 7.206 1.00 6.80 O ATOM 2632 CB ALA A 167 -6.509 -3.692 9.159 1.00 7.77 C ATOM 0 H ALA A 167 -4.704 -5.292 8.574 1.00 8.28 H new ATOM 0 HA ALA A 167 -7.466 -5.609 9.301 1.00 7.90 H new ATOM 0 HB1 ALA A 167 -7.438 -3.122 9.188 1.00 7.77 H new ATOM 0 HB2 ALA A 167 -6.094 -3.761 10.165 1.00 7.77 H new ATOM 0 HB3 ALA A 167 -5.795 -3.189 8.506 1.00 7.77 H new ATOM 2638 N MET A 168 -6.713 -5.106 6.185 1.00 6.41 N ATOM 2639 CA MET A 168 -7.287 -4.976 4.844 1.00 5.59 C ATOM 2640 C MET A 168 -7.175 -6.258 4.024 1.00 6.06 C ATOM 2641 O MET A 168 -8.174 -6.769 3.520 1.00 6.21 O ATOM 2642 CB MET A 168 -6.597 -3.836 4.097 1.00 4.61 C ATOM 2643 CG MET A 168 -6.424 -2.572 4.927 1.00 4.37 C ATOM 2644 SD MET A 168 -7.903 -2.132 5.865 1.00 4.25 S ATOM 2645 CE MET A 168 -9.067 -1.805 4.546 1.00 4.06 C ATOM 0 H MET A 168 -5.708 -5.276 6.205 1.00 6.41 H new ATOM 0 HA MET A 168 -8.349 -4.765 4.972 1.00 5.59 H new ATOM 0 HB2 MET A 168 -5.617 -4.175 3.761 1.00 4.61 H new ATOM 0 HB3 MET A 168 -7.175 -3.597 3.204 1.00 4.61 H new ATOM 0 HG2 MET A 168 -5.591 -2.709 5.617 1.00 4.37 H new ATOM 0 HG3 MET A 168 -6.160 -1.745 4.268 1.00 4.37 H new ATOM 0 HE1 MET A 168 -9.968 -1.352 4.960 1.00 4.06 H new ATOM 0 HE2 MET A 168 -8.617 -1.123 3.824 1.00 4.06 H new ATOM 0 HE3 MET A 168 -9.326 -2.740 4.049 1.00 4.06 H new ATOM 2655 N HIS A 169 -5.955 -6.758 3.877 1.00 6.40 N ATOM 2656 CA HIS A 169 -5.704 -7.969 3.099 1.00 7.11 C ATOM 2657 C HIS A 169 -6.545 -9.148 3.591 1.00 8.00 C ATOM 2658 O HIS A 169 -6.588 -10.198 2.948 1.00 8.44 O ATOM 2659 CB HIS A 169 -4.219 -8.319 3.154 1.00 7.58 C ATOM 2660 CG HIS A 169 -3.817 -9.396 2.194 1.00 8.20 C ATOM 2661 ND1 HIS A 169 -3.751 -10.730 2.542 1.00 9.21 N ATOM 2662 CD2 HIS A 169 -3.458 -9.331 0.890 1.00 8.09 C ATOM 2663 CE1 HIS A 169 -3.372 -11.437 1.493 1.00 9.66 C ATOM 2664 NE2 HIS A 169 -3.187 -10.613 0.479 1.00 9.05 N ATOM 0 H HIS A 169 -5.119 -6.343 4.288 1.00 6.40 H new ATOM 0 HA HIS A 169 -5.995 -7.771 2.067 1.00 7.11 H new ATOM 0 HB2 HIS A 169 -3.636 -7.422 2.945 1.00 7.58 H new ATOM 0 HB3 HIS A 169 -3.967 -8.635 4.166 1.00 7.58 H new ATOM 0 HD2 HIS A 169 -3.396 -8.438 0.286 1.00 8.09 H new ATOM 0 HE1 HIS A 169 -3.236 -12.508 1.469 1.00 9.66 H new ATOM 0 HE2 HIS A 169 -2.891 -10.884 -0.458 1.00 9.05 H new ATOM 2673 N GLN A 170 -7.208 -8.976 4.731 1.00 8.38 N ATOM 2674 CA GLN A 170 -8.050 -10.028 5.287 1.00 9.26 C ATOM 2675 C GLN A 170 -9.527 -9.708 5.073 1.00 8.98 C ATOM 2676 O GLN A 170 -10.374 -10.601 5.074 1.00 9.60 O ATOM 2677 CB GLN A 170 -7.757 -10.215 6.777 1.00 10.15 C ATOM 2678 CG GLN A 170 -6.710 -11.283 7.060 1.00 10.35 C ATOM 2679 CD GLN A 170 -5.395 -11.032 6.345 1.00 10.22 C ATOM 2680 OE1 GLN A 170 -4.685 -11.971 5.983 1.00 10.51 O ATOM 2681 NE2 GLN A 170 -5.057 -9.765 6.144 1.00 10.01 N ATOM 0 H GLN A 170 -7.178 -8.120 5.286 1.00 8.38 H new ATOM 0 HA GLN A 170 -7.822 -10.958 4.767 1.00 9.26 H new ATOM 0 HB2 GLN A 170 -7.419 -9.267 7.195 1.00 10.15 H new ATOM 0 HB3 GLN A 170 -8.681 -10.478 7.291 1.00 10.15 H new ATOM 0 HG2 GLN A 170 -6.529 -11.331 8.134 1.00 10.35 H new ATOM 0 HG3 GLN A 170 -7.101 -12.255 6.759 1.00 10.35 H new ATOM 0 HE21 GLN A 170 -5.674 -9.016 6.460 1.00 10.01 H new ATOM 0 HE22 GLN A 170 -4.180 -9.539 5.674 1.00 10.01 H new ATOM 2690 N ALA A 171 -9.826 -8.424 4.888 1.00 8.13 N ATOM 2691 CA ALA A 171 -11.197 -7.978 4.661 1.00 7.83 C ATOM 2692 C ALA A 171 -11.675 -8.380 3.269 1.00 7.35 C ATOM 2693 O ALA A 171 -12.855 -8.250 2.944 1.00 7.32 O ATOM 2694 CB ALA A 171 -11.299 -6.471 4.843 1.00 7.29 C ATOM 0 H ALA A 171 -9.135 -7.674 4.891 1.00 8.13 H new ATOM 0 HA ALA A 171 -11.841 -8.463 5.395 1.00 7.83 H new ATOM 0 HB1 ALA A 171 -12.327 -6.152 4.671 1.00 7.29 H new ATOM 0 HB2 ALA A 171 -11.002 -6.206 5.858 1.00 7.29 H new ATOM 0 HB3 ALA A 171 -10.641 -5.973 4.131 1.00 7.29 H new ATOM 2700 N GLN A 172 -10.740 -8.860 2.450 1.00 7.13 N ATOM 2701 CA GLN A 172 -11.042 -9.299 1.089 1.00 6.86 C ATOM 2702 C GLN A 172 -12.259 -10.215 1.061 1.00 7.25 C ATOM 2703 O GLN A 172 -12.658 -10.777 2.082 1.00 7.95 O ATOM 2704 CB GLN A 172 -9.842 -10.046 0.501 1.00 7.25 C ATOM 2705 CG GLN A 172 -8.511 -9.359 0.743 1.00 7.68 C ATOM 2706 CD GLN A 172 -7.364 -10.027 0.008 1.00 8.46 C ATOM 2707 OE1 GLN A 172 -6.404 -9.370 -0.394 1.00 8.78 O ATOM 2708 NE2 GLN A 172 -7.455 -11.341 -0.164 1.00 8.94 N ATOM 0 H GLN A 172 -9.758 -8.955 2.709 1.00 7.13 H new ATOM 0 HA GLN A 172 -11.258 -8.411 0.494 1.00 6.86 H new ATOM 0 HB2 GLN A 172 -9.805 -11.048 0.928 1.00 7.25 H new ATOM 0 HB3 GLN A 172 -9.990 -10.163 -0.573 1.00 7.25 H new ATOM 0 HG2 GLN A 172 -8.582 -8.318 0.428 1.00 7.68 H new ATOM 0 HG3 GLN A 172 -8.298 -9.355 1.812 1.00 7.68 H new ATOM 0 HE21 GLN A 172 -8.269 -11.846 0.186 1.00 8.94 H new ATOM 0 HE22 GLN A 172 -6.711 -11.845 -0.646 1.00 8.94 H new ATOM 2717 N THR A 173 -12.833 -10.365 -0.123 1.00 6.89 N ATOM 2718 CA THR A 173 -14.002 -11.217 -0.309 1.00 7.27 C ATOM 2719 C THR A 173 -13.605 -12.692 -0.320 1.00 8.12 C ATOM 2720 O THR A 173 -14.238 -13.517 0.340 1.00 8.79 O ATOM 2721 CB THR A 173 -14.748 -10.880 -1.618 1.00 6.67 C ATOM 2722 OG1 THR A 173 -15.964 -11.633 -1.698 1.00 7.09 O ATOM 2723 CG2 THR A 173 -13.886 -11.176 -2.838 1.00 6.49 C ATOM 0 H THR A 173 -12.508 -9.906 -0.974 1.00 6.89 H new ATOM 0 HA THR A 173 -14.670 -11.029 0.531 1.00 7.27 H new ATOM 0 HB THR A 173 -14.976 -9.814 -1.608 1.00 6.67 H new ATOM 0 HG1 THR A 173 -16.431 -11.412 -2.530 1.00 7.09 H new ATOM 0 HG21 THR A 173 -14.440 -10.928 -3.744 1.00 6.49 H new ATOM 0 HG22 THR A 173 -12.976 -10.578 -2.794 1.00 6.49 H new ATOM 0 HG23 THR A 173 -13.625 -12.234 -2.851 1.00 6.49 H new ATOM 2731 N MET A 174 -12.547 -13.010 -1.067 1.00 8.29 N ATOM 2732 CA MET A 174 -12.051 -14.381 -1.176 1.00 9.27 C ATOM 2733 C MET A 174 -13.092 -15.306 -1.800 1.00 9.76 C ATOM 2734 O MET A 174 -14.285 -15.182 -1.535 1.00 10.07 O ATOM 2735 CB MET A 174 -11.627 -14.910 0.197 1.00 9.97 C ATOM 2736 CG MET A 174 -10.541 -14.077 0.860 1.00 9.62 C ATOM 2737 SD MET A 174 -9.918 -14.823 2.378 1.00 10.64 S ATOM 2738 CE MET A 174 -11.382 -14.780 3.409 1.00 11.58 C ATOM 0 H MET A 174 -12.014 -12.330 -1.609 1.00 8.29 H new ATOM 0 HA MET A 174 -11.181 -14.365 -1.833 1.00 9.27 H new ATOM 0 HB2 MET A 174 -12.499 -14.942 0.850 1.00 9.97 H new ATOM 0 HB3 MET A 174 -11.272 -15.935 0.089 1.00 9.97 H new ATOM 0 HG2 MET A 174 -9.715 -13.942 0.161 1.00 9.62 H new ATOM 0 HG3 MET A 174 -10.935 -13.085 1.083 1.00 9.62 H new ATOM 0 HE1 MET A 174 -11.103 -14.972 4.445 1.00 11.58 H new ATOM 0 HE2 MET A 174 -11.851 -13.799 3.335 1.00 11.58 H new ATOM 0 HE3 MET A 174 -12.085 -15.544 3.075 1.00 11.58 H new ATOM 2748 N GLU A 175 -12.612 -16.245 -2.622 1.00 9.99 N ATOM 2749 CA GLU A 175 -13.467 -17.219 -3.305 1.00 10.53 C ATOM 2750 C GLU A 175 -14.380 -16.543 -4.314 1.00 10.39 C ATOM 2751 O GLU A 175 -14.214 -16.705 -5.525 1.00 11.07 O ATOM 2752 CB GLU A 175 -14.319 -18.010 -2.309 1.00 10.50 C ATOM 2753 CG GLU A 175 -13.703 -18.138 -0.933 1.00 9.82 C ATOM 2754 CD GLU A 175 -13.382 -19.572 -0.560 1.00 10.17 C ATOM 2755 OE1 GLU A 175 -12.257 -20.025 -0.859 1.00 10.48 O ATOM 2756 OE2 GLU A 175 -14.256 -20.243 0.029 1.00 10.29 O ATOM 0 H GLU A 175 -11.619 -16.350 -2.832 1.00 9.99 H new ATOM 0 HA GLU A 175 -12.803 -17.906 -3.829 1.00 10.53 H new ATOM 0 HB2 GLU A 175 -15.292 -17.527 -2.216 1.00 10.50 H new ATOM 0 HB3 GLU A 175 -14.495 -19.008 -2.711 1.00 10.50 H new ATOM 0 HG2 GLU A 175 -12.790 -17.545 -0.893 1.00 9.82 H new ATOM 0 HG3 GLU A 175 -14.387 -17.720 -0.194 1.00 9.82 H new ATOM 2763 N GLY A 176 -15.346 -15.791 -3.805 1.00 9.65 N ATOM 2764 CA GLY A 176 -16.289 -15.113 -4.664 1.00 9.66 C ATOM 2765 C GLY A 176 -15.629 -14.317 -5.775 1.00 8.99 C ATOM 2766 O GLY A 176 -16.030 -14.416 -6.935 1.00 9.20 O ATOM 0 H GLY A 176 -15.492 -15.639 -2.807 1.00 9.65 H new ATOM 0 HA2 GLY A 176 -16.962 -15.849 -5.105 1.00 9.66 H new ATOM 0 HA3 GLY A 176 -16.901 -14.442 -4.061 1.00 9.66 H new ATOM 2770 N CYS A 177 -14.619 -13.530 -5.424 1.00 8.35 N ATOM 2771 CA CYS A 177 -13.911 -12.715 -6.409 1.00 7.87 C ATOM 2772 C CYS A 177 -12.426 -12.626 -6.072 1.00 7.48 C ATOM 2773 O CYS A 177 -11.975 -13.173 -5.066 1.00 7.40 O ATOM 2774 CB CYS A 177 -14.523 -11.312 -6.471 1.00 7.33 C ATOM 2775 SG CYS A 177 -14.069 -10.364 -7.941 1.00 7.86 S ATOM 0 H CYS A 177 -14.271 -13.438 -4.469 1.00 8.35 H new ATOM 0 HA CYS A 177 -14.013 -13.190 -7.384 1.00 7.87 H new ATOM 0 HB2 CYS A 177 -15.609 -11.400 -6.432 1.00 7.33 H new ATOM 0 HB3 CYS A 177 -14.216 -10.755 -5.585 1.00 7.33 H new ATOM 0 HG CYS A 177 -12.912 -9.802 -7.754 1.00 7.86 H new ATOM 2781 N SER A 178 -11.670 -11.934 -6.922 1.00 7.49 N ATOM 2782 CA SER A 178 -10.233 -11.775 -6.718 1.00 7.32 C ATOM 2783 C SER A 178 -9.940 -10.646 -5.735 1.00 6.67 C ATOM 2784 O SER A 178 -9.099 -9.787 -5.995 1.00 6.52 O ATOM 2785 CB SER A 178 -9.536 -11.504 -8.054 1.00 7.64 C ATOM 2786 OG SER A 178 -10.027 -10.318 -8.656 1.00 7.57 O ATOM 0 H SER A 178 -12.030 -11.475 -7.759 1.00 7.49 H new ATOM 0 HA SER A 178 -9.846 -12.703 -6.296 1.00 7.32 H new ATOM 0 HB2 SER A 178 -8.461 -11.417 -7.895 1.00 7.64 H new ATOM 0 HB3 SER A 178 -9.692 -12.348 -8.726 1.00 7.64 H new ATOM 0 HG SER A 178 -9.564 -10.167 -9.507 1.00 7.57 H new ATOM 2792 N SER A 179 -10.644 -10.674 -4.607 1.00 6.58 N ATOM 2793 CA SER A 179 -10.497 -9.678 -3.547 1.00 6.32 C ATOM 2794 C SER A 179 -10.759 -8.261 -4.031 1.00 6.17 C ATOM 2795 O SER A 179 -10.121 -7.785 -4.968 1.00 6.12 O ATOM 2796 CB SER A 179 -9.105 -9.711 -2.920 1.00 6.36 C ATOM 2797 OG SER A 179 -8.130 -9.174 -3.796 1.00 6.70 O ATOM 0 H SER A 179 -11.338 -11.393 -4.400 1.00 6.58 H new ATOM 0 HA SER A 179 -11.247 -9.947 -2.804 1.00 6.32 H new ATOM 0 HB2 SER A 179 -9.110 -9.145 -1.989 1.00 6.36 H new ATOM 0 HB3 SER A 179 -8.843 -10.738 -2.667 1.00 6.36 H new ATOM 0 HG SER A 179 -8.554 -8.924 -4.643 1.00 6.70 H new ATOM 2803 N PRO A 180 -11.700 -7.560 -3.390 1.00 6.43 N ATOM 2804 CA PRO A 180 -11.995 -6.173 -3.723 1.00 6.66 C ATOM 2805 C PRO A 180 -10.877 -5.282 -3.230 1.00 5.98 C ATOM 2806 O PRO A 180 -10.770 -4.115 -3.606 1.00 5.75 O ATOM 2807 CB PRO A 180 -13.278 -5.895 -2.941 1.00 7.45 C ATOM 2808 CG PRO A 180 -13.154 -6.793 -1.761 1.00 7.34 C ATOM 2809 CD PRO A 180 -12.553 -8.051 -2.298 1.00 6.88 C ATOM 0 HA PRO A 180 -12.098 -5.991 -4.793 1.00 6.66 H new ATOM 0 HB2 PRO A 180 -13.351 -4.848 -2.645 1.00 7.45 H new ATOM 0 HB3 PRO A 180 -14.167 -6.123 -3.530 1.00 7.45 H new ATOM 0 HG2 PRO A 180 -12.522 -6.350 -0.992 1.00 7.34 H new ATOM 0 HG3 PRO A 180 -14.126 -6.983 -1.305 1.00 7.34 H new ATOM 0 HD2 PRO A 180 -11.976 -8.580 -1.540 1.00 6.88 H new ATOM 0 HD3 PRO A 180 -13.315 -8.742 -2.659 1.00 6.88 H new ATOM 2817 N MET A 181 -10.057 -5.857 -2.358 1.00 5.81 N ATOM 2818 CA MET A 181 -8.929 -5.152 -1.776 1.00 5.16 C ATOM 2819 C MET A 181 -7.727 -6.067 -1.589 1.00 5.72 C ATOM 2820 O MET A 181 -7.869 -7.218 -1.184 1.00 6.38 O ATOM 2821 CB MET A 181 -9.320 -4.566 -0.426 1.00 4.42 C ATOM 2822 CG MET A 181 -9.137 -3.069 -0.366 1.00 3.57 C ATOM 2823 SD MET A 181 -9.209 -2.422 1.314 1.00 3.07 S ATOM 2824 CE MET A 181 -8.953 -0.674 1.015 1.00 3.26 C ATOM 0 H MET A 181 -10.157 -6.820 -2.038 1.00 5.81 H new ATOM 0 HA MET A 181 -8.652 -4.355 -2.467 1.00 5.16 H new ATOM 0 HB2 MET A 181 -10.362 -4.809 -0.217 1.00 4.42 H new ATOM 0 HB3 MET A 181 -8.721 -5.033 0.356 1.00 4.42 H new ATOM 0 HG2 MET A 181 -8.177 -2.807 -0.810 1.00 3.57 H new ATOM 0 HG3 MET A 181 -9.908 -2.589 -0.968 1.00 3.57 H new ATOM 0 HE1 MET A 181 -9.346 -0.100 1.854 1.00 3.26 H new ATOM 0 HE2 MET A 181 -7.887 -0.476 0.907 1.00 3.26 H new ATOM 0 HE3 MET A 181 -9.470 -0.382 0.101 1.00 3.26 H new ATOM 2834 N VAL A 182 -6.546 -5.554 -1.899 1.00 5.55 N ATOM 2835 CA VAL A 182 -5.319 -6.312 -1.713 1.00 6.08 C ATOM 2836 C VAL A 182 -4.192 -5.389 -1.267 1.00 5.39 C ATOM 2837 O VAL A 182 -3.887 -4.398 -1.931 1.00 4.91 O ATOM 2838 CB VAL A 182 -4.901 -7.078 -2.985 1.00 6.97 C ATOM 2839 CG1 VAL A 182 -4.668 -6.129 -4.148 1.00 6.80 C ATOM 2840 CG2 VAL A 182 -3.661 -7.918 -2.717 1.00 7.45 C ATOM 0 H VAL A 182 -6.412 -4.617 -2.280 1.00 5.55 H new ATOM 0 HA VAL A 182 -5.515 -7.053 -0.938 1.00 6.08 H new ATOM 0 HB VAL A 182 -5.718 -7.745 -3.260 1.00 6.97 H new ATOM 0 HG11 VAL A 182 -4.375 -6.699 -5.030 1.00 6.80 H new ATOM 0 HG12 VAL A 182 -5.586 -5.580 -4.359 1.00 6.80 H new ATOM 0 HG13 VAL A 182 -3.876 -5.426 -3.891 1.00 6.80 H new ATOM 0 HG21 VAL A 182 -3.380 -8.452 -3.625 1.00 7.45 H new ATOM 0 HG22 VAL A 182 -2.841 -7.269 -2.409 1.00 7.45 H new ATOM 0 HG23 VAL A 182 -3.872 -8.636 -1.925 1.00 7.45 H new ATOM 2850 N VAL A 183 -3.586 -5.711 -0.132 1.00 5.50 N ATOM 2851 CA VAL A 183 -2.494 -4.909 0.400 1.00 4.93 C ATOM 2852 C VAL A 183 -1.422 -5.808 1.001 1.00 5.68 C ATOM 2853 O VAL A 183 -1.699 -6.596 1.905 1.00 6.34 O ATOM 2854 CB VAL A 183 -2.995 -3.930 1.481 1.00 4.22 C ATOM 2855 CG1 VAL A 183 -1.876 -3.001 1.925 1.00 3.70 C ATOM 2856 CG2 VAL A 183 -4.193 -3.132 0.976 1.00 3.54 C ATOM 0 H VAL A 183 -3.832 -6.521 0.437 1.00 5.50 H new ATOM 0 HA VAL A 183 -2.074 -4.336 -0.426 1.00 4.93 H new ATOM 0 HB VAL A 183 -3.316 -4.512 2.344 1.00 4.22 H new ATOM 0 HG11 VAL A 183 -2.251 -2.319 2.688 1.00 3.70 H new ATOM 0 HG12 VAL A 183 -1.056 -3.590 2.336 1.00 3.70 H new ATOM 0 HG13 VAL A 183 -1.518 -2.428 1.070 1.00 3.70 H new ATOM 0 HG21 VAL A 183 -4.529 -2.448 1.755 1.00 3.54 H new ATOM 0 HG22 VAL A 183 -3.904 -2.562 0.093 1.00 3.54 H new ATOM 0 HG23 VAL A 183 -5.003 -3.815 0.718 1.00 3.54 H new ATOM 2866 N LYS A 184 -0.197 -5.689 0.499 1.00 5.70 N ATOM 2867 CA LYS A 184 0.902 -6.505 0.996 1.00 6.41 C ATOM 2868 C LYS A 184 2.233 -5.765 0.930 1.00 5.98 C ATOM 2869 O LYS A 184 2.481 -4.980 0.016 1.00 5.49 O ATOM 2870 CB LYS A 184 0.992 -7.810 0.202 1.00 7.46 C ATOM 2871 CG LYS A 184 2.000 -8.799 0.764 1.00 7.98 C ATOM 2872 CD LYS A 184 2.169 -10.008 -0.145 1.00 8.81 C ATOM 2873 CE LYS A 184 2.882 -9.641 -1.437 1.00 8.99 C ATOM 2874 NZ LYS A 184 3.039 -10.816 -2.337 1.00 9.80 N ATOM 0 H LYS A 184 0.057 -5.040 -0.246 1.00 5.70 H new ATOM 0 HA LYS A 184 0.697 -6.729 2.043 1.00 6.41 H new ATOM 0 HB2 LYS A 184 0.009 -8.280 0.180 1.00 7.46 H new ATOM 0 HB3 LYS A 184 1.259 -7.580 -0.830 1.00 7.46 H new ATOM 0 HG2 LYS A 184 2.962 -8.304 0.894 1.00 7.98 H new ATOM 0 HG3 LYS A 184 1.675 -9.128 1.751 1.00 7.98 H new ATOM 0 HD2 LYS A 184 2.734 -10.780 0.377 1.00 8.81 H new ATOM 0 HD3 LYS A 184 1.191 -10.430 -0.376 1.00 8.81 H new ATOM 0 HE2 LYS A 184 2.321 -8.861 -1.952 1.00 8.99 H new ATOM 0 HE3 LYS A 184 3.864 -9.227 -1.205 1.00 8.99 H new ATOM 0 HZ1 LYS A 184 3.529 -10.524 -3.206 1.00 9.80 H new ATOM 0 HZ2 LYS A 184 3.596 -11.550 -1.855 1.00 9.80 H new ATOM 0 HZ3 LYS A 184 2.101 -11.196 -2.579 1.00 9.80 H new ATOM 2888 N PHE A 185 3.078 -6.031 1.917 1.00 6.30 N ATOM 2889 CA PHE A 185 4.400 -5.427 1.994 1.00 5.99 C ATOM 2890 C PHE A 185 5.216 -5.750 0.744 1.00 6.35 C ATOM 2891 O PHE A 185 5.295 -6.906 0.329 1.00 7.24 O ATOM 2892 CB PHE A 185 5.125 -5.942 3.235 1.00 6.57 C ATOM 2893 CG PHE A 185 6.266 -5.077 3.674 1.00 6.08 C ATOM 2894 CD1 PHE A 185 7.533 -5.286 3.161 1.00 5.74 C ATOM 2895 CD2 PHE A 185 6.074 -4.058 4.592 1.00 6.14 C ATOM 2896 CE1 PHE A 185 8.590 -4.494 3.556 1.00 5.34 C ATOM 2897 CE2 PHE A 185 7.129 -3.262 4.990 1.00 5.81 C ATOM 2898 CZ PHE A 185 8.371 -3.471 4.499 1.00 5.34 C ATOM 0 H PHE A 185 2.867 -6.669 2.684 1.00 6.30 H new ATOM 0 HA PHE A 185 4.287 -4.345 2.060 1.00 5.99 H new ATOM 0 HB2 PHE A 185 4.410 -6.026 4.053 1.00 6.57 H new ATOM 0 HB3 PHE A 185 5.499 -6.946 3.035 1.00 6.57 H new ATOM 0 HD1 PHE A 185 7.696 -6.077 2.444 1.00 5.74 H new ATOM 0 HD2 PHE A 185 5.089 -3.885 5.000 1.00 6.14 H new ATOM 0 HE1 PHE A 185 9.576 -4.656 3.146 1.00 5.34 H new ATOM 0 HE2 PHE A 185 6.961 -2.465 5.700 1.00 5.81 H new ATOM 0 HZ PHE A 185 9.194 -2.855 4.829 1.00 5.34 H new ATOM 2908 N ALA A 186 5.823 -4.727 0.150 1.00 5.78 N ATOM 2909 CA ALA A 186 6.630 -4.912 -1.051 1.00 6.30 C ATOM 2910 C ALA A 186 7.974 -5.549 -0.720 1.00 6.85 C ATOM 2911 O ALA A 186 8.618 -5.186 0.265 1.00 6.41 O ATOM 2912 CB ALA A 186 6.836 -3.582 -1.761 1.00 5.74 C ATOM 0 H ALA A 186 5.771 -3.763 0.480 1.00 5.78 H new ATOM 0 HA ALA A 186 6.092 -5.587 -1.716 1.00 6.30 H new ATOM 0 HB1 ALA A 186 7.440 -3.737 -2.655 1.00 5.74 H new ATOM 0 HB2 ALA A 186 5.869 -3.167 -2.044 1.00 5.74 H new ATOM 0 HB3 ALA A 186 7.347 -2.888 -1.093 1.00 5.74 H new ATOM 2918 N ASP A 187 8.393 -6.500 -1.550 1.00 7.87 N ATOM 2919 CA ASP A 187 9.663 -7.188 -1.345 1.00 8.52 C ATOM 2920 C ASP A 187 10.414 -7.352 -2.664 1.00 8.61 C ATOM 2921 O ASP A 187 10.082 -8.284 -3.426 1.00 8.64 O ATOM 2922 CB ASP A 187 9.427 -8.553 -0.694 1.00 9.14 C ATOM 2923 CG ASP A 187 8.428 -9.401 -1.457 1.00 9.76 C ATOM 2924 OD1 ASP A 187 7.214 -9.132 -1.346 1.00 10.02 O ATOM 2925 OD2 ASP A 187 8.860 -10.333 -2.168 1.00 10.14 O ATOM 2926 OXT ASP A 187 11.330 -6.543 -2.925 1.00 8.89 O ATOM 0 H ASP A 187 7.872 -6.811 -2.370 1.00 7.87 H new ATOM 0 HA ASP A 187 10.276 -6.581 -0.679 1.00 8.52 H new ATOM 0 HB2 ASP A 187 10.375 -9.088 -0.627 1.00 9.14 H new ATOM 0 HB3 ASP A 187 9.070 -8.408 0.326 1.00 9.14 H new TER 2931 ASP A 187