USER MOD reduce.3.24.130724 H: found=0, std=0, add=1411, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1411 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 73 HIS : no HE2:sc= -0.0353 K(o=-0.85,f=-4.3!) USER MOD Set 1.2: A 75 THR OG1 : rot 180:sc= -0.815 USER MOD Set 2.1: A 33 ASN : amide:sc= -0.894 K(o=-0.89,f=0.45) USER MOD Set 2.2: A 35 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 1 MET N :NH3+ -161:sc= 1.27 (180deg=1.01) USER MOD Set 3.2: A 4 SER OG : rot -164:sc= 0.41 USER MOD Single : A 1 MET CE :methyl 171:sc= -1.63 (180deg=-1.92) USER MOD Single : A 2 SER OG : rot -44:sc= 1.18 USER MOD Single : A 3 GLN : amide:sc= -0.54 K(o=-0.54,f=-2.6) USER MOD Single : A 5 ASN : amide:sc= -1.23! C(o=-1.2!,f=-6.4!) USER MOD Single : A 14 SER OG : rot 170:sc= -0.867 USER MOD Single : A 15 TYR OH : rot 180:sc= 0 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 94:sc= 1.19 USER MOD Single : A 19 GLN : amide:sc=-0.00573 K(o=-0.0057,f=-0.78) USER MOD Single : A 20 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0867) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 SER OG : rot 180:sc= 0 USER MOD Single : A 26 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.1) USER MOD Single : A 28 SER OG : rot 64:sc= 0.599 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 156:sc= 1.12 USER MOD Single : A 47 LYS NZ :NH3+ -130:sc= 0.407 (180deg=-0.0818) USER MOD Single : A 48 GLN : amide:sc= 1.08 K(o=1.1,f=-0.31) USER MOD Single : A 61 TYR OH : rot 180:sc= 0.936 USER MOD Single : A 66 SER OG : rot -170:sc= 0 USER MOD Single : A 69 THR OG1 : rot -90:sc= 1.05 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 71 GLN : amide:sc= -1.26! K(o=-1.3!,f=-0.018) USER MOD Single : A 78 THR OG1 : rot 76:sc= 0.558 USER MOD Single : A 80 TYR OH : rot -114:sc= 1.22 USER MOD Single : A 81 GLN : amide:sc= 0.241 X(o=0.24,f=-0.062) USER MOD Single : A 82 SER OG : rot 180:sc= 0 USER MOD Single : A 85 GLN : amide:sc= -1.71! K(o=-1.7!,f=-0.071) USER MOD Single : A 88 ASN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 96 ASN : amide:sc= -1.46! K(o=-1.5!,f=-0.092) USER MOD Single : A 105 SER OG : rot -83:sc= 0.968 USER MOD Single : A 111 CYS SG : rot 70:sc= -5.05! USER MOD Single : A 114 SER OG : rot 82:sc= -0.0341 USER MOD Single : A 117 LYS NZ :NH3+ -143:sc= 1.18 (180deg=0.899) USER MOD Single : A 119 MET CE :methyl -144:sc= -6.22! (180deg=-10.7!) USER MOD Single : A 120 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 130 MET CE :methyl 177:sc= -4.65! (180deg=-4.93!) USER MOD Single : A 132 THR OG1 : rot 80:sc= 1.23 USER MOD Single : A 133 TYR OH : rot 70:sc= 0.732 USER MOD Single : A 135 ASN : amide:sc= 0.746 K(o=0.75,f=0) USER MOD Single : A 137 HIS : no HD1:sc= 0.205 K(o=0.2,f=-3.6!) USER MOD Single : A 143 GLN : amide:sc= -1.24! K(o=-1.2!,f=-0.048) USER MOD Single : A 145 ASN : amide:sc= 0.944 K(o=0.94,f=0) USER MOD Single : A 150 THR OG1 : rot -119:sc= -0.37 USER MOD Single : A 155 TYR OH : rot 180:sc= 0 USER MOD Single : A 157 ASN : amide:sc= 0 X(o=0,f=-0.042) USER MOD Single : A 158 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 SER OG : rot 73:sc= 0.221 USER MOD Single : A 165 LYS NZ :NH3+ 169:sc= 1.03 (180deg=0.772) USER MOD Single : A 167 GLN : amide:sc= -1.06! K(o=-1.1!,f=-0.22) USER MOD Single : A 172 HIS : no HD1:sc=-0.00596 X(o=-0.006,f=-0.0062) USER MOD Single : A 173 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 174 HIS : no HD1:sc= -1.47 K(o=-1.5,f=-0.4) USER MOD Single : A 175 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 176 HIS : no HD1:sc= 0 X(o=0,f=-0.0033) USER MOD Single : A 177 HIS : no HD1:sc= -0.0981 X(o=-0.098,f=0) USER MOD Single : A 180 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 181 HIS : no HD1:sc=-0.000195 X(o=-0.0002,f=0) USER MOD Single : A 182 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 183 HIS : no HD1:sc= -0.1 X(o=-0.1,f=-0.1) USER MOD Single : A 184 HIS : no HD1:sc= 0 X(o=0,f=-0.0029) USER MOD Single : A 185 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.775 3.998 14.947 1.00 3.19 N ATOM 2 CA MET A 1 2.032 4.363 13.536 1.00 2.85 C ATOM 3 C MET A 1 3.473 4.063 13.150 1.00 2.27 C ATOM 4 O MET A 1 3.725 3.259 12.261 1.00 2.72 O ATOM 5 CB MET A 1 1.745 5.849 13.307 1.00 3.07 C ATOM 6 CG MET A 1 0.281 6.221 13.433 1.00 3.85 C ATOM 7 SD MET A 1 -0.018 7.974 13.132 1.00 4.63 S ATOM 8 CE MET A 1 0.630 8.148 11.470 1.00 5.45 C ATOM 0 H1 MET A 1 0.751 3.902 15.100 1.00 3.19 H new ATOM 0 H2 MET A 1 2.243 3.095 15.163 1.00 3.19 H new ATOM 0 H3 MET A 1 2.150 4.740 15.571 1.00 3.19 H new ATOM 0 HA MET A 1 1.368 3.765 12.912 1.00 2.85 H new ATOM 0 HB2 MET A 1 2.321 6.434 14.024 1.00 3.07 H new ATOM 0 HB3 MET A 1 2.096 6.127 12.313 1.00 3.07 H new ATOM 0 HG2 MET A 1 -0.302 5.630 12.727 1.00 3.85 H new ATOM 0 HG3 MET A 1 -0.071 5.962 14.432 1.00 3.85 H new ATOM 0 HE1 MET A 1 0.375 9.134 11.081 1.00 5.45 H new ATOM 0 HE2 MET A 1 1.714 8.035 11.488 1.00 5.45 H new ATOM 0 HE3 MET A 1 0.196 7.381 10.828 1.00 5.45 H new ATOM 20 N SER A 2 4.417 4.691 13.839 1.00 1.75 N ATOM 21 CA SER A 2 5.824 4.601 13.468 1.00 1.66 C ATOM 22 C SER A 2 6.359 3.167 13.536 1.00 1.36 C ATOM 23 O SER A 2 7.245 2.795 12.767 1.00 1.24 O ATOM 24 CB SER A 2 6.650 5.528 14.356 1.00 2.18 C ATOM 25 OG SER A 2 6.225 6.874 14.199 1.00 2.93 O ATOM 0 H SER A 2 4.234 5.269 14.659 1.00 1.75 H new ATOM 0 HA SER A 2 5.912 4.916 12.428 1.00 1.66 H new ATOM 0 HB2 SER A 2 6.549 5.228 15.399 1.00 2.18 H new ATOM 0 HB3 SER A 2 7.706 5.441 14.100 1.00 2.18 H new ATOM 0 HG SER A 2 6.099 7.068 13.247 1.00 2.93 H new ATOM 31 N GLN A 3 5.821 2.355 14.433 1.00 1.37 N ATOM 32 CA GLN A 3 6.274 0.977 14.557 1.00 1.24 C ATOM 33 C GLN A 3 5.500 0.067 13.605 1.00 0.92 C ATOM 34 O GLN A 3 6.034 -0.924 13.106 1.00 0.86 O ATOM 35 CB GLN A 3 6.143 0.473 16.002 1.00 1.49 C ATOM 36 CG GLN A 3 7.021 1.210 17.008 1.00 1.69 C ATOM 37 CD GLN A 3 6.526 2.611 17.321 1.00 2.43 C ATOM 38 OE1 GLN A 3 5.325 2.885 17.264 1.00 3.10 O ATOM 39 NE2 GLN A 3 7.440 3.509 17.653 1.00 2.97 N ATOM 0 H GLN A 3 5.078 2.621 15.079 1.00 1.37 H new ATOM 0 HA GLN A 3 7.329 0.950 14.285 1.00 1.24 H new ATOM 0 HB2 GLN A 3 5.102 0.563 16.312 1.00 1.49 H new ATOM 0 HB3 GLN A 3 6.393 -0.588 16.028 1.00 1.49 H new ATOM 0 HG2 GLN A 3 7.067 0.633 17.932 1.00 1.69 H new ATOM 0 HG3 GLN A 3 8.037 1.269 16.619 1.00 1.69 H new ATOM 0 HE21 GLN A 3 8.425 3.245 17.690 1.00 2.97 H new ATOM 0 HE22 GLN A 3 7.160 4.465 17.872 1.00 2.97 H new ATOM 48 N SER A 4 4.249 0.422 13.333 1.00 0.88 N ATOM 49 CA SER A 4 3.404 -0.373 12.451 1.00 0.77 C ATOM 50 C SER A 4 3.719 -0.100 10.979 1.00 0.62 C ATOM 51 O SER A 4 3.323 -0.869 10.104 1.00 0.64 O ATOM 52 CB SER A 4 1.922 -0.128 12.756 1.00 1.02 C ATOM 53 OG SER A 4 1.642 1.248 12.958 1.00 1.34 O ATOM 0 H SER A 4 3.798 1.255 13.711 1.00 0.88 H new ATOM 0 HA SER A 4 3.620 -1.425 12.639 1.00 0.77 H new ATOM 0 HB2 SER A 4 1.315 -0.504 11.932 1.00 1.02 H new ATOM 0 HB3 SER A 4 1.637 -0.690 13.645 1.00 1.02 H new ATOM 0 HG SER A 4 0.766 1.344 13.386 1.00 1.34 H new ATOM 59 N ASN A 5 4.424 1.001 10.716 1.00 0.59 N ATOM 60 CA ASN A 5 4.841 1.359 9.350 1.00 0.55 C ATOM 61 C ASN A 5 5.454 0.167 8.609 1.00 0.43 C ATOM 62 O ASN A 5 5.137 -0.075 7.444 1.00 0.44 O ATOM 63 CB ASN A 5 5.858 2.514 9.360 1.00 0.65 C ATOM 64 CG ASN A 5 5.238 3.867 9.684 1.00 0.94 C ATOM 65 OD1 ASN A 5 4.064 4.112 9.405 1.00 1.71 O ATOM 66 ND2 ASN A 5 6.031 4.766 10.257 1.00 0.67 N ATOM 0 H ASN A 5 4.721 1.666 11.430 1.00 0.59 H new ATOM 0 HA ASN A 5 3.938 1.674 8.827 1.00 0.55 H new ATOM 0 HB2 ASN A 5 6.637 2.296 10.091 1.00 0.65 H new ATOM 0 HB3 ASN A 5 6.342 2.569 8.385 1.00 0.65 H new ATOM 0 HD21 ASN A 5 5.672 5.694 10.480 1.00 0.67 H new ATOM 0 HD22 ASN A 5 6.999 4.528 10.474 1.00 0.67 H new ATOM 73 N ARG A 6 6.317 -0.592 9.283 1.00 0.41 N ATOM 74 CA ARG A 6 7.011 -1.696 8.631 1.00 0.41 C ATOM 75 C ARG A 6 6.054 -2.848 8.319 1.00 0.37 C ATOM 76 O ARG A 6 6.273 -3.598 7.367 1.00 0.38 O ATOM 77 CB ARG A 6 8.188 -2.190 9.479 1.00 0.54 C ATOM 78 CG ARG A 6 9.046 -3.220 8.757 1.00 0.65 C ATOM 79 CD ARG A 6 10.391 -3.438 9.436 1.00 0.83 C ATOM 80 NE ARG A 6 10.270 -4.037 10.763 1.00 1.50 N ATOM 81 CZ ARG A 6 11.271 -4.089 11.643 1.00 2.14 C ATOM 82 NH1 ARG A 6 12.442 -3.531 11.354 1.00 2.16 N ATOM 83 NH2 ARG A 6 11.097 -4.686 12.815 1.00 3.18 N ATOM 0 H ARG A 6 6.549 -0.464 10.268 1.00 0.41 H new ATOM 0 HA ARG A 6 7.406 -1.319 7.688 1.00 0.41 H new ATOM 0 HB2 ARG A 6 8.809 -1.340 9.760 1.00 0.54 H new ATOM 0 HB3 ARG A 6 7.807 -2.625 10.403 1.00 0.54 H new ATOM 0 HG2 ARG A 6 8.509 -4.167 8.710 1.00 0.65 H new ATOM 0 HG3 ARG A 6 9.210 -2.895 7.729 1.00 0.65 H new ATOM 0 HD2 ARG A 6 11.009 -4.080 8.808 1.00 0.83 H new ATOM 0 HD3 ARG A 6 10.908 -2.482 9.521 1.00 0.83 H new ATOM 0 HE ARG A 6 9.371 -4.437 11.031 1.00 1.50 H new ATOM 0 HH11 ARG A 6 12.576 -3.062 10.458 1.00 2.16 H new ATOM 0 HH12 ARG A 6 13.206 -3.572 12.028 1.00 2.16 H new ATOM 0 HH21 ARG A 6 10.196 -5.106 13.045 1.00 3.18 H new ATOM 0 HH22 ARG A 6 11.864 -4.725 13.486 1.00 3.18 H new ATOM 97 N GLU A 7 4.983 -2.971 9.101 1.00 0.36 N ATOM 98 CA GLU A 7 3.978 -4.004 8.855 1.00 0.37 C ATOM 99 C GLU A 7 3.338 -3.785 7.497 1.00 0.29 C ATOM 100 O GLU A 7 3.068 -4.731 6.759 1.00 0.29 O ATOM 101 CB GLU A 7 2.874 -3.981 9.912 1.00 0.46 C ATOM 102 CG GLU A 7 3.331 -4.283 11.324 1.00 0.60 C ATOM 103 CD GLU A 7 2.152 -4.433 12.261 1.00 1.39 C ATOM 104 OE1 GLU A 7 1.659 -3.411 12.777 1.00 2.00 O ATOM 105 OE2 GLU A 7 1.690 -5.578 12.457 1.00 1.58 O ATOM 0 H GLU A 7 4.789 -2.373 9.904 1.00 0.36 H new ATOM 0 HA GLU A 7 4.486 -4.968 8.894 1.00 0.37 H new ATOM 0 HB2 GLU A 7 2.403 -2.998 9.902 1.00 0.46 H new ATOM 0 HB3 GLU A 7 2.109 -4.705 9.632 1.00 0.46 H new ATOM 0 HG2 GLU A 7 3.922 -5.199 11.330 1.00 0.60 H new ATOM 0 HG3 GLU A 7 3.980 -3.482 11.678 1.00 0.60 H new ATOM 112 N LEU A 8 3.119 -2.519 7.179 1.00 0.27 N ATOM 113 CA LEU A 8 2.455 -2.127 5.950 1.00 0.28 C ATOM 114 C LEU A 8 3.308 -2.517 4.759 1.00 0.28 C ATOM 115 O LEU A 8 2.798 -2.899 3.711 1.00 0.39 O ATOM 116 CB LEU A 8 2.212 -0.620 5.971 1.00 0.31 C ATOM 117 CG LEU A 8 1.597 -0.105 7.267 1.00 0.33 C ATOM 118 CD1 LEU A 8 1.526 1.410 7.252 1.00 0.36 C ATOM 119 CD2 LEU A 8 0.219 -0.715 7.470 1.00 0.35 C ATOM 0 H LEU A 8 3.398 -1.734 7.768 1.00 0.27 H new ATOM 0 HA LEU A 8 1.496 -2.639 5.866 1.00 0.28 H new ATOM 0 HB2 LEU A 8 3.159 -0.108 5.803 1.00 0.31 H new ATOM 0 HB3 LEU A 8 1.556 -0.357 5.141 1.00 0.31 H new ATOM 0 HG LEU A 8 2.229 -0.404 8.103 1.00 0.33 H new ATOM 0 HD11 LEU A 8 1.085 1.763 8.184 1.00 0.36 H new ATOM 0 HD12 LEU A 8 2.530 1.820 7.148 1.00 0.36 H new ATOM 0 HD13 LEU A 8 0.912 1.737 6.413 1.00 0.36 H new ATOM 0 HD21 LEU A 8 -0.211 -0.340 8.399 1.00 0.35 H new ATOM 0 HD22 LEU A 8 -0.426 -0.442 6.635 1.00 0.35 H new ATOM 0 HD23 LEU A 8 0.306 -1.800 7.522 1.00 0.35 H new ATOM 131 N VAL A 9 4.616 -2.421 4.943 1.00 0.26 N ATOM 132 CA VAL A 9 5.566 -2.885 3.955 1.00 0.28 C ATOM 133 C VAL A 9 5.486 -4.400 3.837 1.00 0.29 C ATOM 134 O VAL A 9 5.108 -4.931 2.798 1.00 0.31 O ATOM 135 CB VAL A 9 7.001 -2.481 4.342 1.00 0.32 C ATOM 136 CG1 VAL A 9 8.005 -3.048 3.355 1.00 0.38 C ATOM 137 CG2 VAL A 9 7.122 -0.970 4.421 1.00 0.31 C ATOM 0 H VAL A 9 5.043 -2.021 5.778 1.00 0.26 H new ATOM 0 HA VAL A 9 5.317 -2.424 2.999 1.00 0.28 H new ATOM 0 HB VAL A 9 7.221 -2.897 5.325 1.00 0.32 H new ATOM 0 HG11 VAL A 9 9.012 -2.750 3.648 1.00 0.38 H new ATOM 0 HG12 VAL A 9 7.936 -4.136 3.350 1.00 0.38 H new ATOM 0 HG13 VAL A 9 7.790 -2.666 2.357 1.00 0.38 H new ATOM 0 HG21 VAL A 9 8.142 -0.701 4.696 1.00 0.31 H new ATOM 0 HG22 VAL A 9 6.880 -0.534 3.452 1.00 0.31 H new ATOM 0 HG23 VAL A 9 6.431 -0.588 5.173 1.00 0.31 H new ATOM 147 N VAL A 10 5.819 -5.077 4.932 1.00 0.30 N ATOM 148 CA VAL A 10 5.871 -6.533 4.978 1.00 0.32 C ATOM 149 C VAL A 10 4.603 -7.174 4.422 1.00 0.35 C ATOM 150 O VAL A 10 4.673 -8.009 3.518 1.00 0.36 O ATOM 151 CB VAL A 10 6.097 -7.021 6.422 1.00 0.37 C ATOM 152 CG1 VAL A 10 5.914 -8.525 6.525 1.00 0.42 C ATOM 153 CG2 VAL A 10 7.484 -6.624 6.896 1.00 0.38 C ATOM 0 H VAL A 10 6.061 -4.628 5.815 1.00 0.30 H new ATOM 0 HA VAL A 10 6.708 -6.837 4.349 1.00 0.32 H new ATOM 0 HB VAL A 10 5.354 -6.547 7.063 1.00 0.37 H new ATOM 0 HG11 VAL A 10 6.079 -8.842 7.555 1.00 0.42 H new ATOM 0 HG12 VAL A 10 4.901 -8.790 6.222 1.00 0.42 H new ATOM 0 HG13 VAL A 10 6.630 -9.024 5.872 1.00 0.42 H new ATOM 0 HG21 VAL A 10 7.633 -6.974 7.918 1.00 0.38 H new ATOM 0 HG22 VAL A 10 8.234 -7.074 6.245 1.00 0.38 H new ATOM 0 HG23 VAL A 10 7.582 -5.539 6.866 1.00 0.38 H new ATOM 163 N ASP A 11 3.453 -6.775 4.949 1.00 0.39 N ATOM 164 CA ASP A 11 2.195 -7.416 4.580 1.00 0.46 C ATOM 165 C ASP A 11 1.832 -7.118 3.130 1.00 0.44 C ATOM 166 O ASP A 11 1.125 -7.890 2.488 1.00 0.50 O ATOM 167 CB ASP A 11 1.056 -6.977 5.503 1.00 0.55 C ATOM 168 CG ASP A 11 -0.107 -7.949 5.462 1.00 0.71 C ATOM 169 OD1 ASP A 11 -0.994 -7.781 4.599 1.00 0.84 O ATOM 170 OD2 ASP A 11 -0.143 -8.882 6.290 1.00 0.92 O ATOM 0 H ASP A 11 3.363 -6.018 5.627 1.00 0.39 H new ATOM 0 HA ASP A 11 2.335 -8.491 4.691 1.00 0.46 H new ATOM 0 HB2 ASP A 11 1.427 -6.896 6.525 1.00 0.55 H new ATOM 0 HB3 ASP A 11 0.712 -5.985 5.209 1.00 0.55 H new ATOM 175 N PHE A 12 2.327 -6.006 2.606 1.00 0.41 N ATOM 176 CA PHE A 12 2.078 -5.669 1.210 1.00 0.42 C ATOM 177 C PHE A 12 2.952 -6.543 0.320 1.00 0.37 C ATOM 178 O PHE A 12 2.514 -7.022 -0.729 1.00 0.41 O ATOM 179 CB PHE A 12 2.368 -4.186 0.937 1.00 0.44 C ATOM 180 CG PHE A 12 1.683 -3.652 -0.292 1.00 0.48 C ATOM 181 CD1 PHE A 12 2.158 -3.975 -1.551 1.00 0.46 C ATOM 182 CD2 PHE A 12 0.570 -2.831 -0.191 1.00 0.62 C ATOM 183 CE1 PHE A 12 1.538 -3.491 -2.687 1.00 0.51 C ATOM 184 CE2 PHE A 12 -0.054 -2.344 -1.323 1.00 0.68 C ATOM 185 CZ PHE A 12 0.404 -2.656 -2.550 1.00 0.60 C ATOM 0 H PHE A 12 2.895 -5.330 3.116 1.00 0.41 H new ATOM 0 HA PHE A 12 1.026 -5.850 0.990 1.00 0.42 H new ATOM 0 HB2 PHE A 12 2.055 -3.599 1.800 1.00 0.44 H new ATOM 0 HB3 PHE A 12 3.444 -4.049 0.831 1.00 0.44 H new ATOM 0 HD1 PHE A 12 3.024 -4.613 -1.647 1.00 0.46 H new ATOM 0 HD2 PHE A 12 0.187 -2.569 0.784 1.00 0.62 H new ATOM 0 HE1 PHE A 12 1.914 -3.747 -3.667 1.00 0.51 H new ATOM 0 HE2 PHE A 12 -0.919 -1.706 -1.223 1.00 0.68 H new ATOM 0 HZ PHE A 12 -0.093 -2.270 -3.428 1.00 0.60 H new ATOM 195 N LEU A 13 4.186 -6.763 0.754 1.00 0.33 N ATOM 196 CA LEU A 13 5.123 -7.580 0.004 1.00 0.32 C ATOM 197 C LEU A 13 4.658 -9.028 -0.003 1.00 0.33 C ATOM 198 O LEU A 13 4.681 -9.700 -1.037 1.00 0.35 O ATOM 199 CB LEU A 13 6.524 -7.483 0.615 1.00 0.32 C ATOM 200 CG LEU A 13 7.007 -6.062 0.916 1.00 0.34 C ATOM 201 CD1 LEU A 13 8.465 -6.067 1.331 1.00 0.40 C ATOM 202 CD2 LEU A 13 6.798 -5.150 -0.280 1.00 0.38 C ATOM 0 H LEU A 13 4.560 -6.385 1.624 1.00 0.33 H new ATOM 0 HA LEU A 13 5.164 -7.213 -1.022 1.00 0.32 H new ATOM 0 HB2 LEU A 13 6.540 -8.059 1.540 1.00 0.32 H new ATOM 0 HB3 LEU A 13 7.233 -7.954 -0.066 1.00 0.32 H new ATOM 0 HG LEU A 13 6.414 -5.676 1.745 1.00 0.34 H new ATOM 0 HD11 LEU A 13 8.787 -5.047 1.540 1.00 0.40 H new ATOM 0 HD12 LEU A 13 8.586 -6.677 2.226 1.00 0.40 H new ATOM 0 HD13 LEU A 13 9.071 -6.481 0.525 1.00 0.40 H new ATOM 0 HD21 LEU A 13 7.150 -4.147 -0.039 1.00 0.38 H new ATOM 0 HD22 LEU A 13 7.357 -5.535 -1.133 1.00 0.38 H new ATOM 0 HD23 LEU A 13 5.737 -5.113 -0.528 1.00 0.38 H new ATOM 214 N SER A 14 4.213 -9.494 1.157 1.00 0.34 N ATOM 215 CA SER A 14 3.707 -10.848 1.292 1.00 0.38 C ATOM 216 C SER A 14 2.423 -11.019 0.490 1.00 0.39 C ATOM 217 O SER A 14 2.166 -12.085 -0.064 1.00 0.41 O ATOM 218 CB SER A 14 3.457 -11.168 2.765 1.00 0.45 C ATOM 219 OG SER A 14 2.511 -10.278 3.325 1.00 1.14 O ATOM 0 H SER A 14 4.194 -8.949 2.019 1.00 0.34 H new ATOM 0 HA SER A 14 4.453 -11.541 0.901 1.00 0.38 H new ATOM 0 HB2 SER A 14 3.099 -12.193 2.862 1.00 0.45 H new ATOM 0 HB3 SER A 14 4.394 -11.104 3.319 1.00 0.45 H new ATOM 0 HG SER A 14 2.247 -10.597 4.213 1.00 1.14 H new ATOM 225 N TYR A 15 1.630 -9.954 0.422 1.00 0.42 N ATOM 226 CA TYR A 15 0.367 -9.967 -0.311 1.00 0.47 C ATOM 227 C TYR A 15 0.604 -10.295 -1.781 1.00 0.45 C ATOM 228 O TYR A 15 -0.129 -11.083 -2.381 1.00 0.52 O ATOM 229 CB TYR A 15 -0.331 -8.608 -0.172 1.00 0.55 C ATOM 230 CG TYR A 15 -1.681 -8.528 -0.849 1.00 0.66 C ATOM 231 CD1 TYR A 15 -2.822 -9.033 -0.234 1.00 0.79 C ATOM 232 CD2 TYR A 15 -1.814 -7.952 -2.106 1.00 0.78 C ATOM 233 CE1 TYR A 15 -4.054 -8.964 -0.853 1.00 0.96 C ATOM 234 CE2 TYR A 15 -3.043 -7.879 -2.729 1.00 0.94 C ATOM 235 CZ TYR A 15 -4.164 -8.377 -2.088 1.00 1.02 C ATOM 236 OH TYR A 15 -5.386 -8.315 -2.718 1.00 1.20 O ATOM 0 H TYR A 15 1.842 -9.063 0.870 1.00 0.42 H new ATOM 0 HA TYR A 15 -0.276 -10.740 0.111 1.00 0.47 H new ATOM 0 HB2 TYR A 15 -0.455 -8.384 0.887 1.00 0.55 H new ATOM 0 HB3 TYR A 15 0.317 -7.836 -0.588 1.00 0.55 H new ATOM 0 HD1 TYR A 15 -2.743 -9.486 0.743 1.00 0.79 H new ATOM 0 HD2 TYR A 15 -0.942 -7.555 -2.604 1.00 0.78 H new ATOM 0 HE1 TYR A 15 -4.928 -9.371 -0.367 1.00 0.96 H new ATOM 0 HE2 TYR A 15 -3.130 -7.436 -3.710 1.00 0.94 H new ATOM 0 HH TYR A 15 -5.285 -7.866 -3.583 1.00 1.20 H new ATOM 246 N LYS A 16 1.649 -9.706 -2.349 1.00 0.40 N ATOM 247 CA LYS A 16 1.985 -9.929 -3.747 1.00 0.41 C ATOM 248 C LYS A 16 2.515 -11.343 -3.948 1.00 0.35 C ATOM 249 O LYS A 16 2.135 -12.036 -4.891 1.00 0.39 O ATOM 250 CB LYS A 16 3.022 -8.905 -4.213 1.00 0.49 C ATOM 251 CG LYS A 16 2.559 -7.461 -4.081 1.00 0.90 C ATOM 252 CD LYS A 16 1.451 -7.123 -5.069 1.00 0.83 C ATOM 253 CE LYS A 16 1.963 -7.112 -6.501 1.00 1.35 C ATOM 254 NZ LYS A 16 0.895 -6.750 -7.471 1.00 1.39 N ATOM 0 H LYS A 16 2.279 -9.069 -1.861 1.00 0.40 H new ATOM 0 HA LYS A 16 1.081 -9.809 -4.344 1.00 0.41 H new ATOM 0 HB2 LYS A 16 3.936 -9.038 -3.635 1.00 0.49 H new ATOM 0 HB3 LYS A 16 3.272 -9.103 -5.255 1.00 0.49 H new ATOM 0 HG2 LYS A 16 2.204 -7.286 -3.065 1.00 0.90 H new ATOM 0 HG3 LYS A 16 3.405 -6.793 -4.243 1.00 0.90 H new ATOM 0 HD2 LYS A 16 0.645 -7.851 -4.976 1.00 0.83 H new ATOM 0 HD3 LYS A 16 1.030 -6.148 -4.825 1.00 0.83 H new ATOM 0 HE2 LYS A 16 2.786 -6.403 -6.586 1.00 1.35 H new ATOM 0 HE3 LYS A 16 2.362 -8.095 -6.751 1.00 1.35 H new ATOM 0 HZ1 LYS A 16 1.286 -6.754 -8.435 1.00 1.39 H new ATOM 0 HZ2 LYS A 16 0.120 -7.441 -7.408 1.00 1.39 H new ATOM 0 HZ3 LYS A 16 0.531 -5.801 -7.249 1.00 1.39 H new ATOM 268 N LEU A 17 3.389 -11.770 -3.045 1.00 0.30 N ATOM 269 CA LEU A 17 3.967 -13.105 -3.111 1.00 0.27 C ATOM 270 C LEU A 17 2.909 -14.182 -2.891 1.00 0.31 C ATOM 271 O LEU A 17 2.995 -15.266 -3.467 1.00 0.32 O ATOM 272 CB LEU A 17 5.086 -13.244 -2.083 1.00 0.25 C ATOM 273 CG LEU A 17 6.293 -12.350 -2.335 1.00 0.24 C ATOM 274 CD1 LEU A 17 7.271 -12.451 -1.186 1.00 0.29 C ATOM 275 CD2 LEU A 17 6.970 -12.729 -3.640 1.00 0.25 C ATOM 0 H LEU A 17 3.713 -11.209 -2.257 1.00 0.30 H new ATOM 0 HA LEU A 17 4.380 -13.244 -4.110 1.00 0.27 H new ATOM 0 HB2 LEU A 17 4.684 -13.019 -1.095 1.00 0.25 H new ATOM 0 HB3 LEU A 17 5.417 -14.282 -2.064 1.00 0.25 H new ATOM 0 HG LEU A 17 5.950 -11.318 -2.410 1.00 0.24 H new ATOM 0 HD11 LEU A 17 8.128 -11.807 -1.380 1.00 0.29 H new ATOM 0 HD12 LEU A 17 6.782 -12.137 -0.264 1.00 0.29 H new ATOM 0 HD13 LEU A 17 7.608 -13.483 -1.085 1.00 0.29 H new ATOM 0 HD21 LEU A 17 7.830 -12.081 -3.805 1.00 0.25 H new ATOM 0 HD22 LEU A 17 7.301 -13.766 -3.590 1.00 0.25 H new ATOM 0 HD23 LEU A 17 6.265 -12.613 -4.463 1.00 0.25 H new ATOM 287 N SER A 18 1.910 -13.878 -2.073 1.00 0.37 N ATOM 288 CA SER A 18 0.811 -14.804 -1.831 1.00 0.44 C ATOM 289 C SER A 18 0.041 -15.062 -3.127 1.00 0.47 C ATOM 290 O SER A 18 -0.418 -16.178 -3.377 1.00 0.51 O ATOM 291 CB SER A 18 -0.126 -14.251 -0.750 1.00 0.54 C ATOM 292 OG SER A 18 0.562 -14.075 0.480 1.00 1.26 O ATOM 0 H SER A 18 1.838 -12.996 -1.565 1.00 0.37 H new ATOM 0 HA SER A 18 1.223 -15.750 -1.478 1.00 0.44 H new ATOM 0 HB2 SER A 18 -0.542 -13.298 -1.077 1.00 0.54 H new ATOM 0 HB3 SER A 18 -0.964 -14.933 -0.607 1.00 0.54 H new ATOM 0 HG SER A 18 0.886 -13.152 0.544 1.00 1.26 H new ATOM 298 N GLN A 19 -0.062 -14.034 -3.967 1.00 0.48 N ATOM 299 CA GLN A 19 -0.730 -14.158 -5.257 1.00 0.53 C ATOM 300 C GLN A 19 0.143 -14.960 -6.219 1.00 0.48 C ATOM 301 O GLN A 19 -0.349 -15.615 -7.139 1.00 0.55 O ATOM 302 CB GLN A 19 -1.012 -12.772 -5.837 1.00 0.59 C ATOM 303 CG GLN A 19 -1.724 -12.799 -7.179 1.00 0.71 C ATOM 304 CD GLN A 19 -3.156 -13.292 -7.075 1.00 1.06 C ATOM 305 OE1 GLN A 19 -3.831 -13.068 -6.070 1.00 1.72 O ATOM 306 NE2 GLN A 19 -3.630 -13.976 -8.106 1.00 1.65 N ATOM 0 H GLN A 19 0.310 -13.104 -3.775 1.00 0.48 H new ATOM 0 HA GLN A 19 -1.677 -14.680 -5.117 1.00 0.53 H new ATOM 0 HB2 GLN A 19 -1.617 -12.208 -5.127 1.00 0.59 H new ATOM 0 HB3 GLN A 19 -0.069 -12.237 -5.948 1.00 0.59 H new ATOM 0 HG2 GLN A 19 -1.720 -11.797 -7.608 1.00 0.71 H new ATOM 0 HG3 GLN A 19 -1.172 -13.442 -7.865 1.00 0.71 H new ATOM 0 HE21 GLN A 19 -3.041 -14.142 -8.922 1.00 1.65 H new ATOM 0 HE22 GLN A 19 -4.584 -14.337 -8.084 1.00 1.65 H new ATOM 315 N LYS A 20 1.446 -14.901 -5.986 1.00 0.41 N ATOM 316 CA LYS A 20 2.413 -15.625 -6.801 1.00 0.40 C ATOM 317 C LYS A 20 2.585 -17.057 -6.296 1.00 0.44 C ATOM 318 O LYS A 20 3.359 -17.833 -6.854 1.00 0.48 O ATOM 319 CB LYS A 20 3.758 -14.898 -6.784 1.00 0.36 C ATOM 320 CG LYS A 20 3.708 -13.498 -7.381 1.00 0.68 C ATOM 321 CD LYS A 20 3.511 -13.536 -8.891 1.00 0.61 C ATOM 322 CE LYS A 20 3.431 -12.137 -9.490 1.00 1.06 C ATOM 323 NZ LYS A 20 2.223 -11.397 -9.037 1.00 1.87 N ATOM 0 H LYS A 20 1.862 -14.354 -5.232 1.00 0.41 H new ATOM 0 HA LYS A 20 2.040 -15.665 -7.824 1.00 0.40 H new ATOM 0 HB2 LYS A 20 4.111 -14.832 -5.755 1.00 0.36 H new ATOM 0 HB3 LYS A 20 4.488 -15.492 -7.334 1.00 0.36 H new ATOM 0 HG2 LYS A 20 2.895 -12.936 -6.922 1.00 0.68 H new ATOM 0 HG3 LYS A 20 4.632 -12.970 -7.148 1.00 0.68 H new ATOM 0 HD2 LYS A 20 4.335 -14.081 -9.351 1.00 0.61 H new ATOM 0 HD3 LYS A 20 2.598 -14.083 -9.124 1.00 0.61 H new ATOM 0 HE2 LYS A 20 4.323 -11.575 -9.215 1.00 1.06 H new ATOM 0 HE3 LYS A 20 3.423 -12.210 -10.578 1.00 1.06 H new ATOM 0 HZ1 LYS A 20 2.121 -10.525 -9.595 1.00 1.87 H new ATOM 0 HZ2 LYS A 20 1.381 -11.993 -9.169 1.00 1.87 H new ATOM 0 HZ3 LYS A 20 2.322 -11.155 -8.030 1.00 1.87 H new ATOM 337 N GLY A 21 1.865 -17.394 -5.233 1.00 0.48 N ATOM 338 CA GLY A 21 1.900 -18.747 -4.709 1.00 0.54 C ATOM 339 C GLY A 21 3.107 -19.016 -3.829 1.00 0.53 C ATOM 340 O GLY A 21 3.544 -20.162 -3.713 1.00 0.67 O ATOM 0 H GLY A 21 1.256 -16.754 -4.723 1.00 0.48 H new ATOM 0 HA2 GLY A 21 0.992 -18.931 -4.135 1.00 0.54 H new ATOM 0 HA3 GLY A 21 1.900 -19.452 -5.540 1.00 0.54 H new ATOM 344 N TYR A 22 3.656 -17.974 -3.215 1.00 0.43 N ATOM 345 CA TYR A 22 4.785 -18.140 -2.304 1.00 0.42 C ATOM 346 C TYR A 22 4.375 -17.775 -0.884 1.00 0.43 C ATOM 347 O TYR A 22 3.525 -16.905 -0.678 1.00 0.46 O ATOM 348 CB TYR A 22 5.977 -17.274 -2.734 1.00 0.40 C ATOM 349 CG TYR A 22 6.479 -17.568 -4.132 1.00 0.48 C ATOM 350 CD1 TYR A 22 6.538 -18.874 -4.603 1.00 0.65 C ATOM 351 CD2 TYR A 22 6.888 -16.545 -4.981 1.00 0.47 C ATOM 352 CE1 TYR A 22 6.994 -19.152 -5.877 1.00 0.75 C ATOM 353 CE2 TYR A 22 7.347 -16.816 -6.255 1.00 0.57 C ATOM 354 CZ TYR A 22 7.402 -18.094 -6.701 1.00 0.69 C ATOM 355 OH TYR A 22 7.854 -18.392 -7.968 1.00 0.81 O ATOM 0 H TYR A 22 3.341 -17.011 -3.330 1.00 0.43 H new ATOM 0 HA TYR A 22 5.088 -19.186 -2.337 1.00 0.42 H new ATOM 0 HB2 TYR A 22 5.690 -16.224 -2.675 1.00 0.40 H new ATOM 0 HB3 TYR A 22 6.794 -17.421 -2.027 1.00 0.40 H new ATOM 0 HD1 TYR A 22 6.222 -19.685 -3.963 1.00 0.65 H new ATOM 0 HD2 TYR A 22 6.846 -15.522 -4.638 1.00 0.47 H new ATOM 0 HE1 TYR A 22 7.036 -20.171 -6.233 1.00 0.75 H new ATOM 0 HE2 TYR A 22 7.663 -16.007 -6.897 1.00 0.57 H new ATOM 0 HH TYR A 22 8.103 -17.564 -8.430 1.00 0.81 H new ATOM 365 N SER A 23 4.977 -18.439 0.090 1.00 0.45 N ATOM 366 CA SER A 23 4.683 -18.178 1.489 1.00 0.49 C ATOM 367 C SER A 23 5.752 -17.275 2.102 1.00 0.43 C ATOM 368 O SER A 23 6.931 -17.636 2.146 1.00 0.44 O ATOM 369 CB SER A 23 4.596 -19.497 2.256 1.00 0.59 C ATOM 370 OG SER A 23 3.605 -20.346 1.694 1.00 1.41 O ATOM 0 H SER A 23 5.675 -19.166 -0.064 1.00 0.45 H new ATOM 0 HA SER A 23 3.723 -17.665 1.557 1.00 0.49 H new ATOM 0 HB2 SER A 23 5.564 -19.998 2.236 1.00 0.59 H new ATOM 0 HB3 SER A 23 4.361 -19.299 3.302 1.00 0.59 H new ATOM 0 HG SER A 23 3.568 -21.185 2.199 1.00 1.41 H new ATOM 376 N TRP A 24 5.332 -16.107 2.574 1.00 0.43 N ATOM 377 CA TRP A 24 6.247 -15.121 3.147 1.00 0.41 C ATOM 378 C TRP A 24 6.984 -15.688 4.358 1.00 0.47 C ATOM 379 O TRP A 24 8.196 -15.516 4.490 1.00 0.53 O ATOM 380 CB TRP A 24 5.475 -13.850 3.538 1.00 0.44 C ATOM 381 CG TRP A 24 6.313 -12.812 4.231 1.00 0.46 C ATOM 382 CD1 TRP A 24 6.351 -12.555 5.573 1.00 0.55 C ATOM 383 CD2 TRP A 24 7.227 -11.886 3.623 1.00 0.43 C ATOM 384 NE1 TRP A 24 7.236 -11.542 5.836 1.00 0.57 N ATOM 385 CE2 TRP A 24 7.784 -11.111 4.658 1.00 0.50 C ATOM 386 CE3 TRP A 24 7.633 -11.640 2.309 1.00 0.39 C ATOM 387 CZ2 TRP A 24 8.720 -10.108 4.420 1.00 0.51 C ATOM 388 CZ3 TRP A 24 8.562 -10.644 2.073 1.00 0.43 C ATOM 389 CH2 TRP A 24 9.097 -9.889 3.123 1.00 0.48 C ATOM 0 H TRP A 24 4.354 -15.816 2.572 1.00 0.43 H new ATOM 0 HA TRP A 24 6.991 -14.868 2.391 1.00 0.41 H new ATOM 0 HB2 TRP A 24 5.041 -13.411 2.640 1.00 0.44 H new ATOM 0 HB3 TRP A 24 4.646 -14.127 4.190 1.00 0.44 H new ATOM 0 HD1 TRP A 24 5.768 -13.075 6.319 1.00 0.55 H new ATOM 0 HE1 TRP A 24 7.452 -11.169 6.761 1.00 0.57 H new ATOM 0 HE3 TRP A 24 7.228 -12.218 1.492 1.00 0.39 H new ATOM 0 HZ2 TRP A 24 9.133 -9.524 5.229 1.00 0.51 H new ATOM 0 HZ3 TRP A 24 8.881 -10.445 1.060 1.00 0.43 H new ATOM 0 HH2 TRP A 24 9.822 -9.118 2.905 1.00 0.48 H new ATOM 400 N SER A 25 6.255 -16.391 5.219 1.00 0.54 N ATOM 401 CA SER A 25 6.823 -16.936 6.450 1.00 0.63 C ATOM 402 C SER A 25 7.994 -17.885 6.171 1.00 0.63 C ATOM 403 O SER A 25 8.862 -18.075 7.023 1.00 0.75 O ATOM 404 CB SER A 25 5.741 -17.660 7.254 1.00 0.75 C ATOM 405 OG SER A 25 4.632 -16.806 7.495 1.00 1.20 O ATOM 0 H SER A 25 5.265 -16.598 5.087 1.00 0.54 H new ATOM 0 HA SER A 25 7.209 -16.099 7.031 1.00 0.63 H new ATOM 0 HB2 SER A 25 5.411 -18.546 6.712 1.00 0.75 H new ATOM 0 HB3 SER A 25 6.155 -18.002 8.203 1.00 0.75 H new ATOM 0 HG SER A 25 3.952 -17.290 8.009 1.00 1.20 H new ATOM 411 N GLN A 26 8.033 -18.461 4.972 1.00 0.61 N ATOM 412 CA GLN A 26 9.103 -19.380 4.606 1.00 0.73 C ATOM 413 C GLN A 26 10.425 -18.637 4.430 1.00 0.79 C ATOM 414 O GLN A 26 11.499 -19.218 4.596 1.00 0.93 O ATOM 415 CB GLN A 26 8.755 -20.137 3.318 1.00 0.80 C ATOM 416 CG GLN A 26 7.533 -21.043 3.438 1.00 1.25 C ATOM 417 CD GLN A 26 7.698 -22.115 4.504 1.00 1.53 C ATOM 418 OE1 GLN A 26 8.198 -23.202 4.225 1.00 1.91 O ATOM 419 NE2 GLN A 26 7.268 -21.830 5.725 1.00 2.26 N ATOM 0 H GLN A 26 7.338 -18.307 4.241 1.00 0.61 H new ATOM 0 HA GLN A 26 9.213 -20.099 5.418 1.00 0.73 H new ATOM 0 HB2 GLN A 26 8.581 -19.415 2.520 1.00 0.80 H new ATOM 0 HB3 GLN A 26 9.613 -20.740 3.021 1.00 0.80 H new ATOM 0 HG2 GLN A 26 6.658 -20.436 3.671 1.00 1.25 H new ATOM 0 HG3 GLN A 26 7.343 -21.519 2.476 1.00 1.25 H new ATOM 0 HE21 GLN A 26 6.858 -20.917 5.921 1.00 2.26 H new ATOM 0 HE22 GLN A 26 7.347 -22.524 6.468 1.00 2.26 H new ATOM 428 N PHE A 27 10.352 -17.347 4.120 1.00 0.76 N ATOM 429 CA PHE A 27 11.557 -16.559 3.879 1.00 0.92 C ATOM 430 C PHE A 27 11.815 -15.609 5.045 1.00 0.98 C ATOM 431 O PHE A 27 12.797 -14.865 5.051 1.00 1.18 O ATOM 432 CB PHE A 27 11.444 -15.770 2.564 1.00 0.99 C ATOM 433 CG PHE A 27 10.978 -16.604 1.400 1.00 0.97 C ATOM 434 CD1 PHE A 27 11.667 -17.748 1.034 1.00 1.07 C ATOM 435 CD2 PHE A 27 9.859 -16.238 0.667 1.00 0.93 C ATOM 436 CE1 PHE A 27 11.250 -18.512 -0.039 1.00 1.13 C ATOM 437 CE2 PHE A 27 9.437 -16.999 -0.406 1.00 0.96 C ATOM 438 CZ PHE A 27 10.099 -18.148 -0.738 1.00 1.05 C ATOM 0 H PHE A 27 9.479 -16.827 4.030 1.00 0.76 H new ATOM 0 HA PHE A 27 12.399 -17.246 3.794 1.00 0.92 H new ATOM 0 HB2 PHE A 27 10.752 -14.940 2.706 1.00 0.99 H new ATOM 0 HB3 PHE A 27 12.415 -15.337 2.325 1.00 0.99 H new ATOM 0 HD1 PHE A 27 12.541 -18.047 1.594 1.00 1.07 H new ATOM 0 HD2 PHE A 27 9.311 -15.348 0.938 1.00 0.93 H new ATOM 0 HE1 PHE A 27 11.812 -19.386 -0.335 1.00 1.13 H new ATOM 0 HE2 PHE A 27 8.581 -16.685 -0.985 1.00 0.96 H new ATOM 0 HZ PHE A 27 9.732 -18.772 -1.539 1.00 1.05 H new ATOM 448 N SER A 28 10.931 -15.638 6.031 1.00 0.93 N ATOM 449 CA SER A 28 11.073 -14.794 7.209 1.00 1.07 C ATOM 450 C SER A 28 11.910 -15.489 8.274 1.00 1.04 C ATOM 451 O SER A 28 11.732 -16.684 8.528 1.00 1.02 O ATOM 452 CB SER A 28 9.699 -14.457 7.791 1.00 1.21 C ATOM 453 OG SER A 28 8.859 -13.873 6.815 1.00 1.73 O ATOM 0 H SER A 28 10.106 -16.238 6.039 1.00 0.93 H new ATOM 0 HA SER A 28 11.575 -13.876 6.904 1.00 1.07 H new ATOM 0 HB2 SER A 28 9.234 -15.363 8.180 1.00 1.21 H new ATOM 0 HB3 SER A 28 9.815 -13.772 8.631 1.00 1.21 H new ATOM 0 HG SER A 28 8.683 -14.524 6.104 1.00 1.73 H new ATOM 459 N ASP A 29 12.822 -14.748 8.889 1.00 1.25 N ATOM 460 CA ASP A 29 13.554 -15.260 10.035 1.00 1.33 C ATOM 461 C ASP A 29 12.656 -15.179 11.258 1.00 1.40 C ATOM 462 O ASP A 29 12.504 -14.116 11.856 1.00 1.62 O ATOM 463 CB ASP A 29 14.839 -14.456 10.277 1.00 1.63 C ATOM 464 CG ASP A 29 15.798 -14.519 9.107 1.00 1.96 C ATOM 465 OD1 ASP A 29 15.668 -13.696 8.179 1.00 2.16 O ATOM 466 OD2 ASP A 29 16.691 -15.395 9.110 1.00 2.43 O ATOM 0 H ASP A 29 13.070 -13.797 8.615 1.00 1.25 H new ATOM 0 HA ASP A 29 13.841 -16.294 9.842 1.00 1.33 H new ATOM 0 HB2 ASP A 29 14.580 -13.416 10.473 1.00 1.63 H new ATOM 0 HB3 ASP A 29 15.337 -14.835 11.170 1.00 1.63 H new ATOM 471 N VAL A 30 12.039 -16.294 11.607 1.00 1.40 N ATOM 472 CA VAL A 30 11.078 -16.324 12.696 1.00 1.63 C ATOM 473 C VAL A 30 11.788 -16.360 14.042 1.00 1.66 C ATOM 474 O VAL A 30 11.807 -15.372 14.773 1.00 1.79 O ATOM 475 CB VAL A 30 10.149 -17.549 12.574 1.00 1.89 C ATOM 476 CG1 VAL A 30 9.081 -17.530 13.661 1.00 2.24 C ATOM 477 CG2 VAL A 30 9.508 -17.602 11.193 1.00 1.95 C ATOM 0 H VAL A 30 12.187 -17.194 11.150 1.00 1.40 H new ATOM 0 HA VAL A 30 10.479 -15.415 12.633 1.00 1.63 H new ATOM 0 HB VAL A 30 10.753 -18.447 12.707 1.00 1.89 H new ATOM 0 HG11 VAL A 30 8.438 -18.404 13.555 1.00 2.24 H new ATOM 0 HG12 VAL A 30 9.559 -17.548 14.641 1.00 2.24 H new ATOM 0 HG13 VAL A 30 8.482 -16.625 13.566 1.00 2.24 H new ATOM 0 HG21 VAL A 30 8.856 -18.473 11.127 1.00 1.95 H new ATOM 0 HG22 VAL A 30 8.922 -16.698 11.029 1.00 1.95 H new ATOM 0 HG23 VAL A 30 10.286 -17.673 10.433 1.00 1.95 H new ATOM 487 N GLU A 31 12.394 -17.495 14.354 1.00 1.67 N ATOM 488 CA GLU A 31 13.067 -17.672 15.633 1.00 1.83 C ATOM 489 C GLU A 31 14.410 -16.947 15.657 1.00 1.78 C ATOM 490 O GLU A 31 14.906 -16.582 16.723 1.00 1.99 O ATOM 491 CB GLU A 31 13.252 -19.160 15.931 1.00 2.07 C ATOM 492 CG GLU A 31 13.937 -19.924 14.814 1.00 2.55 C ATOM 493 CD GLU A 31 13.899 -21.417 15.033 1.00 2.93 C ATOM 494 OE1 GLU A 31 12.806 -22.013 14.902 1.00 3.27 O ATOM 495 OE2 GLU A 31 14.958 -22.008 15.325 1.00 3.42 O ATOM 0 H GLU A 31 12.434 -18.308 13.739 1.00 1.67 H new ATOM 0 HA GLU A 31 12.440 -17.234 16.410 1.00 1.83 H new ATOM 0 HB2 GLU A 31 13.836 -19.269 16.845 1.00 2.07 H new ATOM 0 HB3 GLU A 31 12.276 -19.608 16.121 1.00 2.07 H new ATOM 0 HG2 GLU A 31 13.455 -19.686 13.866 1.00 2.55 H new ATOM 0 HG3 GLU A 31 14.974 -19.597 14.736 1.00 2.55 H new ATOM 502 N GLU A 32 14.996 -16.731 14.485 1.00 1.61 N ATOM 503 CA GLU A 32 16.268 -16.019 14.393 1.00 1.65 C ATOM 504 C GLU A 32 16.065 -14.512 14.471 1.00 1.75 C ATOM 505 O GLU A 32 17.026 -13.756 14.618 1.00 2.00 O ATOM 506 CB GLU A 32 17.015 -16.389 13.109 1.00 1.54 C ATOM 507 CG GLU A 32 17.562 -17.805 13.122 1.00 1.79 C ATOM 508 CD GLU A 32 18.455 -18.060 14.319 1.00 2.33 C ATOM 509 OE1 GLU A 32 19.634 -17.660 14.280 1.00 2.57 O ATOM 510 OE2 GLU A 32 17.985 -18.674 15.302 1.00 3.01 O ATOM 0 H GLU A 32 14.615 -17.036 13.589 1.00 1.61 H new ATOM 0 HA GLU A 32 16.875 -16.325 15.245 1.00 1.65 H new ATOM 0 HB2 GLU A 32 16.342 -16.274 12.259 1.00 1.54 H new ATOM 0 HB3 GLU A 32 17.838 -15.690 12.961 1.00 1.54 H new ATOM 0 HG2 GLU A 32 16.733 -18.513 13.131 1.00 1.79 H new ATOM 0 HG3 GLU A 32 18.125 -17.984 12.206 1.00 1.79 H new ATOM 517 N ASN A 33 14.819 -14.081 14.387 1.00 1.77 N ATOM 518 CA ASN A 33 14.487 -12.668 14.503 1.00 2.01 C ATOM 519 C ASN A 33 13.081 -12.521 15.068 1.00 1.89 C ATOM 520 O ASN A 33 12.127 -12.214 14.347 1.00 2.13 O ATOM 521 CB ASN A 33 14.610 -11.955 13.148 1.00 2.35 C ATOM 522 CG ASN A 33 14.316 -10.464 13.231 1.00 3.05 C ATOM 523 OD1 ASN A 33 13.816 -9.867 12.275 1.00 3.61 O ATOM 524 ND2 ASN A 33 14.638 -9.843 14.357 1.00 3.58 N ATOM 0 H ASN A 33 14.015 -14.691 14.238 1.00 1.77 H new ATOM 0 HA ASN A 33 15.196 -12.196 15.183 1.00 2.01 H new ATOM 0 HB2 ASN A 33 15.617 -12.100 12.758 1.00 2.35 H new ATOM 0 HB3 ASN A 33 13.924 -12.416 12.438 1.00 2.35 H new ATOM 0 HD21 ASN A 33 14.474 -8.841 14.452 1.00 3.58 H new ATOM 0 HD22 ASN A 33 15.050 -10.367 15.129 1.00 3.58 H new ATOM 531 N ARG A 34 12.950 -12.774 16.361 1.00 1.88 N ATOM 532 CA ARG A 34 11.649 -12.750 17.006 1.00 1.96 C ATOM 533 C ARG A 34 11.304 -11.337 17.466 1.00 1.98 C ATOM 534 O ARG A 34 11.294 -11.032 18.661 1.00 2.34 O ATOM 535 CB ARG A 34 11.611 -13.740 18.178 1.00 2.42 C ATOM 536 CG ARG A 34 10.229 -13.924 18.787 1.00 2.86 C ATOM 537 CD ARG A 34 10.239 -14.994 19.865 1.00 3.54 C ATOM 538 NE ARG A 34 10.599 -16.304 19.327 1.00 3.97 N ATOM 539 CZ ARG A 34 11.616 -17.045 19.773 1.00 4.63 C ATOM 540 NH1 ARG A 34 12.421 -16.576 20.722 1.00 4.92 N ATOM 541 NH2 ARG A 34 11.835 -18.246 19.258 1.00 5.33 N ATOM 0 H ARG A 34 13.728 -12.998 16.982 1.00 1.88 H new ATOM 0 HA ARG A 34 10.896 -13.059 16.281 1.00 1.96 H new ATOM 0 HB2 ARG A 34 11.978 -14.708 17.835 1.00 2.42 H new ATOM 0 HB3 ARG A 34 12.296 -13.396 18.953 1.00 2.42 H new ATOM 0 HG2 ARG A 34 9.888 -12.980 19.212 1.00 2.86 H new ATOM 0 HG3 ARG A 34 9.519 -14.198 18.007 1.00 2.86 H new ATOM 0 HD2 ARG A 34 10.946 -14.716 20.647 1.00 3.54 H new ATOM 0 HD3 ARG A 34 9.255 -15.050 20.330 1.00 3.54 H new ATOM 0 HE ARG A 34 10.037 -16.676 18.561 1.00 3.97 H new ATOM 0 HH11 ARG A 34 12.263 -15.647 21.112 1.00 4.92 H new ATOM 0 HH12 ARG A 34 13.197 -17.145 21.060 1.00 4.92 H new ATOM 0 HH21 ARG A 34 11.227 -18.604 18.521 1.00 5.33 H new ATOM 0 HH22 ARG A 34 12.612 -18.813 19.598 1.00 5.33 H new ATOM 555 N THR A 35 11.073 -10.468 16.497 1.00 1.80 N ATOM 556 CA THR A 35 10.591 -9.130 16.766 1.00 1.96 C ATOM 557 C THR A 35 9.133 -9.043 16.343 1.00 1.86 C ATOM 558 O THR A 35 8.827 -8.884 15.163 1.00 2.02 O ATOM 559 CB THR A 35 11.412 -8.078 15.993 1.00 2.32 C ATOM 560 OG1 THR A 35 12.815 -8.248 16.253 1.00 2.88 O ATOM 561 CG2 THR A 35 10.987 -6.667 16.377 1.00 2.78 C ATOM 0 H THR A 35 11.214 -10.671 15.508 1.00 1.80 H new ATOM 0 HA THR A 35 10.694 -8.926 17.832 1.00 1.96 H new ATOM 0 HB THR A 35 11.224 -8.222 14.929 1.00 2.32 H new ATOM 0 HG1 THR A 35 13.324 -7.575 15.755 1.00 2.88 H new ATOM 0 HG21 THR A 35 11.581 -5.943 15.818 1.00 2.78 H new ATOM 0 HG22 THR A 35 9.932 -6.528 16.143 1.00 2.78 H new ATOM 0 HG23 THR A 35 11.144 -6.518 17.445 1.00 2.78 H new ATOM 569 N GLU A 36 8.236 -9.183 17.301 1.00 1.87 N ATOM 570 CA GLU A 36 6.815 -9.204 17.008 1.00 1.94 C ATOM 571 C GLU A 36 6.196 -7.844 17.281 1.00 1.78 C ATOM 572 O GLU A 36 6.516 -7.191 18.278 1.00 1.92 O ATOM 573 CB GLU A 36 6.114 -10.279 17.839 1.00 2.27 C ATOM 574 CG GLU A 36 6.676 -11.677 17.626 1.00 2.71 C ATOM 575 CD GLU A 36 5.895 -12.739 18.372 1.00 3.32 C ATOM 576 OE1 GLU A 36 6.005 -12.799 19.615 1.00 3.86 O ATOM 577 OE2 GLU A 36 5.159 -13.513 17.722 1.00 3.69 O ATOM 0 H GLU A 36 8.466 -9.284 18.290 1.00 1.87 H new ATOM 0 HA GLU A 36 6.686 -9.440 15.952 1.00 1.94 H new ATOM 0 HB2 GLU A 36 6.195 -10.021 18.895 1.00 2.27 H new ATOM 0 HB3 GLU A 36 5.052 -10.282 17.593 1.00 2.27 H new ATOM 0 HG2 GLU A 36 6.670 -11.908 16.561 1.00 2.71 H new ATOM 0 HG3 GLU A 36 7.716 -11.700 17.952 1.00 2.71 H new ATOM 584 N ALA A 37 5.319 -7.417 16.391 1.00 1.73 N ATOM 585 CA ALA A 37 4.647 -6.137 16.531 1.00 1.70 C ATOM 586 C ALA A 37 3.404 -6.277 17.405 1.00 1.55 C ATOM 587 O ALA A 37 2.741 -7.316 17.380 1.00 1.78 O ATOM 588 CB ALA A 37 4.277 -5.590 15.163 1.00 2.06 C ATOM 0 H ALA A 37 5.054 -7.942 15.558 1.00 1.73 H new ATOM 0 HA ALA A 37 5.327 -5.437 17.016 1.00 1.70 H new ATOM 0 HB1 ALA A 37 3.774 -4.630 15.279 1.00 2.06 H new ATOM 0 HB2 ALA A 37 5.180 -5.456 14.568 1.00 2.06 H new ATOM 0 HB3 ALA A 37 3.611 -6.290 14.659 1.00 2.06 H new ATOM 594 N PRO A 38 3.084 -5.247 18.205 1.00 1.53 N ATOM 595 CA PRO A 38 1.888 -5.238 19.052 1.00 1.68 C ATOM 596 C PRO A 38 0.612 -5.019 18.241 1.00 1.55 C ATOM 597 O PRO A 38 0.651 -4.923 17.011 1.00 1.51 O ATOM 598 CB PRO A 38 2.117 -4.059 20.012 1.00 2.02 C ATOM 599 CG PRO A 38 3.517 -3.597 19.768 1.00 2.11 C ATOM 600 CD PRO A 38 3.863 -4.014 18.369 1.00 1.77 C ATOM 0 HA PRO A 38 1.751 -6.191 19.563 1.00 1.68 H new ATOM 0 HB2 PRO A 38 1.403 -3.257 19.823 1.00 2.02 H new ATOM 0 HB3 PRO A 38 1.983 -4.368 21.049 1.00 2.02 H new ATOM 0 HG2 PRO A 38 3.594 -2.516 19.881 1.00 2.11 H new ATOM 0 HG3 PRO A 38 4.204 -4.043 20.487 1.00 2.11 H new ATOM 0 HD2 PRO A 38 3.582 -3.256 17.638 1.00 1.77 H new ATOM 0 HD3 PRO A 38 4.932 -4.190 18.250 1.00 1.77 H new ATOM 608 N GLU A 39 -0.514 -4.950 18.937 1.00 1.87 N ATOM 609 CA GLU A 39 -1.805 -4.729 18.299 1.00 1.91 C ATOM 610 C GLU A 39 -1.861 -3.328 17.694 1.00 1.53 C ATOM 611 O GLU A 39 -2.045 -2.336 18.408 1.00 1.78 O ATOM 612 CB GLU A 39 -2.929 -4.913 19.324 1.00 2.57 C ATOM 613 CG GLU A 39 -4.322 -4.979 18.717 1.00 3.24 C ATOM 614 CD GLU A 39 -4.495 -6.155 17.778 1.00 3.67 C ATOM 615 OE1 GLU A 39 -4.317 -7.309 18.224 1.00 3.88 O ATOM 616 OE2 GLU A 39 -4.823 -5.934 16.597 1.00 4.19 O ATOM 0 H GLU A 39 -0.560 -5.045 19.952 1.00 1.87 H new ATOM 0 HA GLU A 39 -1.936 -5.457 17.498 1.00 1.91 H new ATOM 0 HB2 GLU A 39 -2.746 -5.829 19.886 1.00 2.57 H new ATOM 0 HB3 GLU A 39 -2.894 -4.089 20.037 1.00 2.57 H new ATOM 0 HG2 GLU A 39 -5.060 -5.046 19.517 1.00 3.24 H new ATOM 0 HG3 GLU A 39 -4.522 -4.054 18.176 1.00 3.24 H new ATOM 623 N GLY A 40 -1.674 -3.251 16.385 1.00 1.33 N ATOM 624 CA GLY A 40 -1.671 -1.973 15.711 1.00 1.39 C ATOM 625 C GLY A 40 -3.064 -1.511 15.343 1.00 1.23 C ATOM 626 O GLY A 40 -3.731 -2.129 14.512 1.00 1.20 O ATOM 0 H GLY A 40 -1.524 -4.056 15.777 1.00 1.33 H new ATOM 0 HA2 GLY A 40 -1.202 -1.228 16.353 1.00 1.39 H new ATOM 0 HA3 GLY A 40 -1.064 -2.043 14.808 1.00 1.39 H new ATOM 630 N THR A 41 -3.504 -0.424 15.960 1.00 1.33 N ATOM 631 CA THR A 41 -4.823 0.126 15.694 1.00 1.34 C ATOM 632 C THR A 41 -4.889 0.704 14.282 1.00 1.09 C ATOM 633 O THR A 41 -5.611 0.187 13.429 1.00 1.05 O ATOM 634 CB THR A 41 -5.187 1.209 16.726 1.00 1.62 C ATOM 635 OG1 THR A 41 -5.044 0.674 18.051 1.00 1.89 O ATOM 636 CG2 THR A 41 -6.614 1.702 16.524 1.00 1.79 C ATOM 0 H THR A 41 -2.963 0.096 16.651 1.00 1.33 H new ATOM 0 HA THR A 41 -5.547 -0.685 15.776 1.00 1.34 H new ATOM 0 HB THR A 41 -4.512 2.054 16.591 1.00 1.62 H new ATOM 0 HG1 THR A 41 -5.274 1.363 18.709 1.00 1.89 H new ATOM 0 HG21 THR A 41 -6.844 2.466 17.267 1.00 1.79 H new ATOM 0 HG22 THR A 41 -6.715 2.125 15.525 1.00 1.79 H new ATOM 0 HG23 THR A 41 -7.306 0.868 16.636 1.00 1.79 H new ATOM 644 N GLU A 42 -4.128 1.767 14.033 1.00 1.02 N ATOM 645 CA GLU A 42 -4.101 2.386 12.713 1.00 0.87 C ATOM 646 C GLU A 42 -3.563 1.405 11.676 1.00 0.73 C ATOM 647 O GLU A 42 -3.928 1.472 10.505 1.00 0.63 O ATOM 648 CB GLU A 42 -3.250 3.666 12.708 1.00 1.05 C ATOM 649 CG GLU A 42 -1.741 3.434 12.684 1.00 1.53 C ATOM 650 CD GLU A 42 -1.201 2.815 13.958 1.00 2.12 C ATOM 651 OE1 GLU A 42 -0.872 3.568 14.894 1.00 2.42 O ATOM 652 OE2 GLU A 42 -1.099 1.575 14.032 1.00 2.82 O ATOM 0 H GLU A 42 -3.526 2.214 14.724 1.00 1.02 H new ATOM 0 HA GLU A 42 -5.125 2.657 12.457 1.00 0.87 H new ATOM 0 HB2 GLU A 42 -3.525 4.264 11.839 1.00 1.05 H new ATOM 0 HB3 GLU A 42 -3.499 4.254 13.592 1.00 1.05 H new ATOM 0 HG2 GLU A 42 -1.495 2.786 11.843 1.00 1.53 H new ATOM 0 HG3 GLU A 42 -1.238 4.386 12.511 1.00 1.53 H new ATOM 659 N SER A 43 -2.703 0.496 12.130 1.00 0.79 N ATOM 660 CA SER A 43 -2.068 -0.497 11.270 1.00 0.75 C ATOM 661 C SER A 43 -3.095 -1.222 10.403 1.00 0.67 C ATOM 662 O SER A 43 -2.916 -1.334 9.196 1.00 0.62 O ATOM 663 CB SER A 43 -1.283 -1.505 12.122 1.00 0.94 C ATOM 664 OG SER A 43 -0.479 -2.361 11.326 1.00 1.14 O ATOM 0 H SER A 43 -2.426 0.428 13.109 1.00 0.79 H new ATOM 0 HA SER A 43 -1.379 0.023 10.604 1.00 0.75 H new ATOM 0 HB2 SER A 43 -0.651 -0.968 12.829 1.00 0.94 H new ATOM 0 HB3 SER A 43 -1.980 -2.104 12.709 1.00 0.94 H new ATOM 0 HG SER A 43 0.261 -2.710 11.865 1.00 1.14 H new ATOM 670 N GLU A 44 -4.190 -1.672 11.009 1.00 0.72 N ATOM 671 CA GLU A 44 -5.201 -2.435 10.276 1.00 0.73 C ATOM 672 C GLU A 44 -6.016 -1.535 9.351 1.00 0.61 C ATOM 673 O GLU A 44 -6.694 -2.015 8.439 1.00 0.66 O ATOM 674 CB GLU A 44 -6.132 -3.179 11.234 1.00 0.85 C ATOM 675 CG GLU A 44 -5.419 -4.196 12.110 1.00 1.32 C ATOM 676 CD GLU A 44 -6.376 -5.134 12.815 1.00 1.96 C ATOM 677 OE1 GLU A 44 -7.216 -4.647 13.601 1.00 2.98 O ATOM 678 OE2 GLU A 44 -6.296 -6.361 12.588 1.00 1.90 O ATOM 0 H GLU A 44 -4.401 -1.525 11.996 1.00 0.72 H new ATOM 0 HA GLU A 44 -4.672 -3.166 9.665 1.00 0.73 H new ATOM 0 HB2 GLU A 44 -6.638 -2.454 11.872 1.00 0.85 H new ATOM 0 HB3 GLU A 44 -6.903 -3.688 10.656 1.00 0.85 H new ATOM 0 HG2 GLU A 44 -4.731 -4.779 11.497 1.00 1.32 H new ATOM 0 HG3 GLU A 44 -4.818 -3.672 12.853 1.00 1.32 H new ATOM 685 N ALA A 45 -5.938 -0.233 9.578 1.00 0.53 N ATOM 686 CA ALA A 45 -6.653 0.729 8.758 1.00 0.45 C ATOM 687 C ALA A 45 -5.844 1.061 7.516 1.00 0.39 C ATOM 688 O ALA A 45 -6.344 0.975 6.398 1.00 0.39 O ATOM 689 CB ALA A 45 -6.950 1.987 9.555 1.00 0.48 C ATOM 0 H ALA A 45 -5.384 0.182 10.327 1.00 0.53 H new ATOM 0 HA ALA A 45 -7.601 0.289 8.447 1.00 0.45 H new ATOM 0 HB1 ALA A 45 -7.486 2.698 8.926 1.00 0.48 H new ATOM 0 HB2 ALA A 45 -7.563 1.733 10.420 1.00 0.48 H new ATOM 0 HB3 ALA A 45 -6.014 2.434 9.892 1.00 0.48 H new ATOM 695 N VAL A 46 -4.585 1.426 7.715 1.00 0.36 N ATOM 696 CA VAL A 46 -3.698 1.729 6.605 1.00 0.32 C ATOM 697 C VAL A 46 -3.385 0.467 5.802 1.00 0.34 C ATOM 698 O VAL A 46 -3.215 0.518 4.583 1.00 0.35 O ATOM 699 CB VAL A 46 -2.401 2.413 7.086 1.00 0.33 C ATOM 700 CG1 VAL A 46 -1.871 1.767 8.349 1.00 0.34 C ATOM 701 CG2 VAL A 46 -1.353 2.379 5.996 1.00 0.34 C ATOM 0 H VAL A 46 -4.156 1.519 8.636 1.00 0.36 H new ATOM 0 HA VAL A 46 -4.215 2.432 5.951 1.00 0.32 H new ATOM 0 HB VAL A 46 -2.637 3.452 7.317 1.00 0.33 H new ATOM 0 HG11 VAL A 46 -0.957 2.273 8.660 1.00 0.34 H new ATOM 0 HG12 VAL A 46 -2.617 1.847 9.139 1.00 0.34 H new ATOM 0 HG13 VAL A 46 -1.657 0.716 8.158 1.00 0.34 H new ATOM 0 HG21 VAL A 46 -0.444 2.865 6.350 1.00 0.34 H new ATOM 0 HG22 VAL A 46 -1.133 1.344 5.735 1.00 0.34 H new ATOM 0 HG23 VAL A 46 -1.726 2.904 5.116 1.00 0.34 H new ATOM 711 N LYS A 47 -3.336 -0.663 6.492 1.00 0.41 N ATOM 712 CA LYS A 47 -3.196 -1.963 5.843 1.00 0.50 C ATOM 713 C LYS A 47 -4.291 -2.138 4.795 1.00 0.51 C ATOM 714 O LYS A 47 -4.051 -2.651 3.703 1.00 0.59 O ATOM 715 CB LYS A 47 -3.296 -3.077 6.891 1.00 0.63 C ATOM 716 CG LYS A 47 -3.052 -4.476 6.359 1.00 0.84 C ATOM 717 CD LYS A 47 -3.339 -5.516 7.430 1.00 1.45 C ATOM 718 CE LYS A 47 -2.951 -6.916 6.983 1.00 1.93 C ATOM 719 NZ LYS A 47 -3.641 -7.324 5.731 1.00 2.14 N ATOM 0 H LYS A 47 -3.391 -0.708 7.510 1.00 0.41 H new ATOM 0 HA LYS A 47 -2.223 -2.017 5.354 1.00 0.50 H new ATOM 0 HB2 LYS A 47 -2.577 -2.875 7.685 1.00 0.63 H new ATOM 0 HB3 LYS A 47 -4.287 -3.043 7.343 1.00 0.63 H new ATOM 0 HG2 LYS A 47 -3.686 -4.656 5.491 1.00 0.84 H new ATOM 0 HG3 LYS A 47 -2.019 -4.568 6.023 1.00 0.84 H new ATOM 0 HD2 LYS A 47 -2.793 -5.261 8.338 1.00 1.45 H new ATOM 0 HD3 LYS A 47 -4.400 -5.496 7.680 1.00 1.45 H new ATOM 0 HE2 LYS A 47 -1.873 -6.960 6.831 1.00 1.93 H new ATOM 0 HE3 LYS A 47 -3.190 -7.626 7.774 1.00 1.93 H new ATOM 0 HZ1 LYS A 47 -4.072 -8.261 5.862 1.00 2.14 H new ATOM 0 HZ2 LYS A 47 -4.382 -6.631 5.501 1.00 2.14 H new ATOM 0 HZ3 LYS A 47 -2.952 -7.365 4.953 1.00 2.14 H new ATOM 733 N GLN A 48 -5.493 -1.685 5.137 1.00 0.47 N ATOM 734 CA GLN A 48 -6.623 -1.753 4.225 1.00 0.52 C ATOM 735 C GLN A 48 -6.539 -0.625 3.205 1.00 0.48 C ATOM 736 O GLN A 48 -6.879 -0.801 2.035 1.00 0.54 O ATOM 737 CB GLN A 48 -7.940 -1.651 4.996 1.00 0.55 C ATOM 738 CG GLN A 48 -9.165 -1.842 4.117 1.00 0.85 C ATOM 739 CD GLN A 48 -10.457 -1.465 4.810 1.00 1.50 C ATOM 740 OE1 GLN A 48 -10.585 -1.572 6.034 1.00 2.23 O ATOM 741 NE2 GLN A 48 -11.430 -1.022 4.030 1.00 2.02 N ATOM 0 H GLN A 48 -5.707 -1.266 6.042 1.00 0.47 H new ATOM 0 HA GLN A 48 -6.591 -2.711 3.707 1.00 0.52 H new ATOM 0 HB2 GLN A 48 -7.949 -2.400 5.788 1.00 0.55 H new ATOM 0 HB3 GLN A 48 -7.996 -0.676 5.479 1.00 0.55 H new ATOM 0 HG2 GLN A 48 -9.055 -1.241 3.215 1.00 0.85 H new ATOM 0 HG3 GLN A 48 -9.219 -2.884 3.801 1.00 0.85 H new ATOM 0 HE21 GLN A 48 -11.283 -0.949 3.023 1.00 2.02 H new ATOM 0 HE22 GLN A 48 -12.327 -0.754 4.436 1.00 2.02 H new ATOM 750 N ALA A 49 -6.075 0.532 3.665 1.00 0.42 N ATOM 751 CA ALA A 49 -5.916 1.694 2.810 1.00 0.40 C ATOM 752 C ALA A 49 -5.017 1.374 1.627 1.00 0.39 C ATOM 753 O ALA A 49 -5.389 1.600 0.481 1.00 0.42 O ATOM 754 CB ALA A 49 -5.349 2.855 3.607 1.00 0.36 C ATOM 0 H ALA A 49 -5.801 0.686 4.635 1.00 0.42 H new ATOM 0 HA ALA A 49 -6.896 1.976 2.425 1.00 0.40 H new ATOM 0 HB1 ALA A 49 -5.234 3.721 2.956 1.00 0.36 H new ATOM 0 HB2 ALA A 49 -6.028 3.102 4.423 1.00 0.36 H new ATOM 0 HB3 ALA A 49 -4.378 2.576 4.015 1.00 0.36 H new ATOM 760 N LEU A 50 -3.843 0.822 1.913 1.00 0.38 N ATOM 761 CA LEU A 50 -2.900 0.440 0.864 1.00 0.39 C ATOM 762 C LEU A 50 -3.447 -0.720 0.046 1.00 0.46 C ATOM 763 O LEU A 50 -3.185 -0.828 -1.152 1.00 0.49 O ATOM 764 CB LEU A 50 -1.532 0.063 1.451 1.00 0.39 C ATOM 765 CG LEU A 50 -0.551 1.227 1.647 1.00 0.33 C ATOM 766 CD1 LEU A 50 -0.269 1.918 0.322 1.00 0.31 C ATOM 767 CD2 LEU A 50 -1.082 2.222 2.660 1.00 0.29 C ATOM 0 H LEU A 50 -3.520 0.629 2.861 1.00 0.38 H new ATOM 0 HA LEU A 50 -2.768 1.304 0.213 1.00 0.39 H new ATOM 0 HB2 LEU A 50 -1.691 -0.421 2.415 1.00 0.39 H new ATOM 0 HB3 LEU A 50 -1.067 -0.675 0.797 1.00 0.39 H new ATOM 0 HG LEU A 50 0.383 0.818 2.031 1.00 0.33 H new ATOM 0 HD11 LEU A 50 0.428 2.740 0.482 1.00 0.31 H new ATOM 0 HD12 LEU A 50 0.167 1.203 -0.376 1.00 0.31 H new ATOM 0 HD13 LEU A 50 -1.200 2.307 -0.091 1.00 0.31 H new ATOM 0 HD21 LEU A 50 -0.367 3.036 2.779 1.00 0.29 H new ATOM 0 HD22 LEU A 50 -2.034 2.623 2.312 1.00 0.29 H new ATOM 0 HD23 LEU A 50 -1.227 1.723 3.618 1.00 0.29 H new ATOM 779 N ARG A 51 -4.220 -1.578 0.701 1.00 0.52 N ATOM 780 CA ARG A 51 -4.830 -2.722 0.042 1.00 0.61 C ATOM 781 C ARG A 51 -5.735 -2.264 -1.093 1.00 0.62 C ATOM 782 O ARG A 51 -5.561 -2.668 -2.242 1.00 0.69 O ATOM 783 CB ARG A 51 -5.634 -3.543 1.048 1.00 0.67 C ATOM 784 CG ARG A 51 -6.309 -4.764 0.450 1.00 0.98 C ATOM 785 CD ARG A 51 -7.185 -5.459 1.475 1.00 1.49 C ATOM 786 NE ARG A 51 -7.791 -6.677 0.949 1.00 2.00 N ATOM 787 CZ ARG A 51 -8.430 -7.572 1.698 1.00 2.89 C ATOM 788 NH1 ARG A 51 -8.535 -7.389 3.010 1.00 3.39 N ATOM 789 NH2 ARG A 51 -8.953 -8.653 1.137 1.00 3.74 N ATOM 0 H ARG A 51 -4.439 -1.500 1.694 1.00 0.52 H new ATOM 0 HA ARG A 51 -4.036 -3.344 -0.372 1.00 0.61 H new ATOM 0 HB2 ARG A 51 -4.971 -3.864 1.852 1.00 0.67 H new ATOM 0 HB3 ARG A 51 -6.394 -2.904 1.498 1.00 0.67 H new ATOM 0 HG2 ARG A 51 -6.913 -4.467 -0.407 1.00 0.98 H new ATOM 0 HG3 ARG A 51 -5.553 -5.458 0.082 1.00 0.98 H new ATOM 0 HD2 ARG A 51 -6.589 -5.703 2.354 1.00 1.49 H new ATOM 0 HD3 ARG A 51 -7.970 -4.777 1.801 1.00 1.49 H new ATOM 0 HE ARG A 51 -7.721 -6.853 -0.053 1.00 2.00 H new ATOM 0 HH11 ARG A 51 -8.126 -6.562 3.444 1.00 3.39 H new ATOM 0 HH12 ARG A 51 -9.025 -8.076 3.583 1.00 3.39 H new ATOM 0 HH21 ARG A 51 -8.866 -8.799 0.131 1.00 3.74 H new ATOM 0 HH22 ARG A 51 -9.443 -9.339 1.711 1.00 3.74 H new ATOM 803 N GLU A 52 -6.686 -1.396 -0.771 1.00 0.59 N ATOM 804 CA GLU A 52 -7.643 -0.925 -1.761 1.00 0.62 C ATOM 805 C GLU A 52 -7.014 0.128 -2.670 1.00 0.59 C ATOM 806 O GLU A 52 -7.463 0.339 -3.798 1.00 0.65 O ATOM 807 CB GLU A 52 -8.900 -0.384 -1.078 1.00 0.66 C ATOM 808 CG GLU A 52 -9.653 -1.445 -0.286 1.00 0.92 C ATOM 809 CD GLU A 52 -11.047 -1.011 0.111 1.00 1.23 C ATOM 810 OE1 GLU A 52 -11.909 -0.855 -0.780 1.00 1.45 O ATOM 811 OE2 GLU A 52 -11.279 -0.789 1.320 1.00 1.88 O ATOM 0 H GLU A 52 -6.814 -1.006 0.163 1.00 0.59 H new ATOM 0 HA GLU A 52 -7.934 -1.770 -2.385 1.00 0.62 H new ATOM 0 HB2 GLU A 52 -8.621 0.430 -0.409 1.00 0.66 H new ATOM 0 HB3 GLU A 52 -9.564 0.037 -1.833 1.00 0.66 H new ATOM 0 HG2 GLU A 52 -9.718 -2.356 -0.881 1.00 0.92 H new ATOM 0 HG3 GLU A 52 -9.086 -1.691 0.612 1.00 0.92 H new ATOM 818 N ALA A 53 -5.962 0.778 -2.183 1.00 0.52 N ATOM 819 CA ALA A 53 -5.204 1.720 -2.992 1.00 0.49 C ATOM 820 C ALA A 53 -4.538 1.004 -4.157 1.00 0.52 C ATOM 821 O ALA A 53 -4.403 1.559 -5.247 1.00 0.53 O ATOM 822 CB ALA A 53 -4.161 2.421 -2.141 1.00 0.43 C ATOM 0 H ALA A 53 -5.616 0.668 -1.230 1.00 0.52 H new ATOM 0 HA ALA A 53 -5.891 2.466 -3.391 1.00 0.49 H new ATOM 0 HB1 ALA A 53 -3.600 3.123 -2.758 1.00 0.43 H new ATOM 0 HB2 ALA A 53 -4.654 2.961 -1.333 1.00 0.43 H new ATOM 0 HB3 ALA A 53 -3.478 1.683 -1.720 1.00 0.43 H new ATOM 828 N GLY A 54 -4.133 -0.237 -3.912 1.00 0.57 N ATOM 829 CA GLY A 54 -3.509 -1.047 -4.944 1.00 0.64 C ATOM 830 C GLY A 54 -4.410 -1.254 -6.146 1.00 0.74 C ATOM 831 O GLY A 54 -3.929 -1.399 -7.269 1.00 0.82 O ATOM 0 H GLY A 54 -4.227 -0.701 -3.008 1.00 0.57 H new ATOM 0 HA2 GLY A 54 -2.584 -0.569 -5.266 1.00 0.64 H new ATOM 0 HA3 GLY A 54 -3.238 -2.017 -4.526 1.00 0.64 H new ATOM 835 N ASP A 55 -5.720 -1.256 -5.914 1.00 0.79 N ATOM 836 CA ASP A 55 -6.683 -1.403 -7.000 1.00 0.92 C ATOM 837 C ASP A 55 -6.783 -0.110 -7.783 1.00 0.88 C ATOM 838 O ASP A 55 -6.834 -0.115 -9.015 1.00 0.97 O ATOM 839 CB ASP A 55 -8.071 -1.790 -6.479 1.00 1.04 C ATOM 840 CG ASP A 55 -8.140 -3.224 -6.007 1.00 1.12 C ATOM 841 OD1 ASP A 55 -8.093 -4.136 -6.856 1.00 1.34 O ATOM 842 OD2 ASP A 55 -8.243 -3.449 -4.781 1.00 1.29 O ATOM 0 H ASP A 55 -6.137 -1.158 -4.988 1.00 0.79 H new ATOM 0 HA ASP A 55 -6.327 -2.204 -7.648 1.00 0.92 H new ATOM 0 HB2 ASP A 55 -8.343 -1.128 -5.657 1.00 1.04 H new ATOM 0 HB3 ASP A 55 -8.806 -1.636 -7.269 1.00 1.04 H new ATOM 847 N GLU A 56 -6.791 1.003 -7.061 1.00 0.79 N ATOM 848 CA GLU A 56 -6.904 2.307 -7.686 1.00 0.83 C ATOM 849 C GLU A 56 -5.644 2.604 -8.492 1.00 0.78 C ATOM 850 O GLU A 56 -5.718 3.084 -9.621 1.00 0.85 O ATOM 851 CB GLU A 56 -7.135 3.392 -6.629 1.00 0.83 C ATOM 852 CG GLU A 56 -7.793 4.642 -7.185 1.00 0.94 C ATOM 853 CD GLU A 56 -9.193 4.369 -7.691 1.00 1.27 C ATOM 854 OE1 GLU A 56 -9.335 3.925 -8.848 1.00 2.06 O ATOM 855 OE2 GLU A 56 -10.162 4.610 -6.944 1.00 1.38 O ATOM 0 H GLU A 56 -6.721 1.025 -6.044 1.00 0.79 H new ATOM 0 HA GLU A 56 -7.761 2.303 -8.360 1.00 0.83 H new ATOM 0 HB2 GLU A 56 -7.758 2.986 -5.832 1.00 0.83 H new ATOM 0 HB3 GLU A 56 -6.179 3.662 -6.181 1.00 0.83 H new ATOM 0 HG2 GLU A 56 -7.831 5.407 -6.410 1.00 0.94 H new ATOM 0 HG3 GLU A 56 -7.185 5.041 -7.997 1.00 0.94 H new ATOM 862 N PHE A 57 -4.488 2.284 -7.914 1.00 0.72 N ATOM 863 CA PHE A 57 -3.212 2.463 -8.596 1.00 0.76 C ATOM 864 C PHE A 57 -3.147 1.578 -9.840 1.00 0.82 C ATOM 865 O PHE A 57 -2.576 1.963 -10.861 1.00 0.90 O ATOM 866 CB PHE A 57 -2.045 2.138 -7.650 1.00 0.77 C ATOM 867 CG PHE A 57 -0.695 2.199 -8.313 1.00 0.94 C ATOM 868 CD1 PHE A 57 -0.137 3.416 -8.670 1.00 1.07 C ATOM 869 CD2 PHE A 57 0.011 1.038 -8.585 1.00 1.05 C ATOM 870 CE1 PHE A 57 1.099 3.474 -9.287 1.00 1.26 C ATOM 871 CE2 PHE A 57 1.247 1.091 -9.200 1.00 1.25 C ATOM 872 CZ PHE A 57 1.792 2.310 -9.552 1.00 1.34 C ATOM 0 H PHE A 57 -4.411 1.899 -6.973 1.00 0.72 H new ATOM 0 HA PHE A 57 -3.128 3.505 -8.903 1.00 0.76 H new ATOM 0 HB2 PHE A 57 -2.061 2.837 -6.814 1.00 0.77 H new ATOM 0 HB3 PHE A 57 -2.192 1.141 -7.235 1.00 0.77 H new ATOM 0 HD1 PHE A 57 -0.674 4.330 -8.464 1.00 1.07 H new ATOM 0 HD2 PHE A 57 -0.410 0.081 -8.313 1.00 1.05 H new ATOM 0 HE1 PHE A 57 1.522 4.429 -9.561 1.00 1.26 H new ATOM 0 HE2 PHE A 57 1.787 0.179 -9.406 1.00 1.25 H new ATOM 0 HZ PHE A 57 2.758 2.353 -10.033 1.00 1.34 H new ATOM 882 N GLU A 58 -3.767 0.406 -9.746 1.00 0.83 N ATOM 883 CA GLU A 58 -3.785 -0.562 -10.840 1.00 0.95 C ATOM 884 C GLU A 58 -4.497 0.017 -12.063 1.00 0.99 C ATOM 885 O GLU A 58 -4.105 -0.234 -13.199 1.00 1.08 O ATOM 886 CB GLU A 58 -4.485 -1.848 -10.376 1.00 1.05 C ATOM 887 CG GLU A 58 -4.506 -2.967 -11.407 1.00 1.35 C ATOM 888 CD GLU A 58 -3.120 -3.417 -11.810 1.00 1.27 C ATOM 889 OE1 GLU A 58 -2.330 -3.789 -10.922 1.00 1.45 O ATOM 890 OE2 GLU A 58 -2.818 -3.405 -13.021 1.00 1.61 O ATOM 0 H GLU A 58 -4.270 0.100 -8.913 1.00 0.83 H new ATOM 0 HA GLU A 58 -2.758 -0.792 -11.124 1.00 0.95 H new ATOM 0 HB2 GLU A 58 -3.989 -2.211 -9.476 1.00 1.05 H new ATOM 0 HB3 GLU A 58 -5.512 -1.607 -10.100 1.00 1.05 H new ATOM 0 HG2 GLU A 58 -5.056 -3.817 -11.003 1.00 1.35 H new ATOM 0 HG3 GLU A 58 -5.045 -2.630 -12.292 1.00 1.35 H new ATOM 897 N LEU A 59 -5.540 0.798 -11.822 1.00 0.98 N ATOM 898 CA LEU A 59 -6.302 1.401 -12.905 1.00 1.10 C ATOM 899 C LEU A 59 -5.698 2.745 -13.305 1.00 1.10 C ATOM 900 O LEU A 59 -5.918 3.237 -14.412 1.00 1.24 O ATOM 901 CB LEU A 59 -7.760 1.580 -12.475 1.00 1.19 C ATOM 902 CG LEU A 59 -8.700 2.116 -13.555 1.00 1.36 C ATOM 903 CD1 LEU A 59 -8.758 1.164 -14.739 1.00 1.59 C ATOM 904 CD2 LEU A 59 -10.089 2.343 -12.981 1.00 1.56 C ATOM 0 H LEU A 59 -5.877 1.029 -10.887 1.00 0.98 H new ATOM 0 HA LEU A 59 -6.264 0.740 -13.771 1.00 1.10 H new ATOM 0 HB2 LEU A 59 -8.140 0.618 -12.131 1.00 1.19 H new ATOM 0 HB3 LEU A 59 -7.789 2.258 -11.622 1.00 1.19 H new ATOM 0 HG LEU A 59 -8.311 3.071 -13.907 1.00 1.36 H new ATOM 0 HD11 LEU A 59 -9.433 1.565 -15.496 1.00 1.59 H new ATOM 0 HD12 LEU A 59 -7.761 1.052 -15.165 1.00 1.59 H new ATOM 0 HD13 LEU A 59 -9.122 0.192 -14.407 1.00 1.59 H new ATOM 0 HD21 LEU A 59 -10.747 2.725 -13.761 1.00 1.56 H new ATOM 0 HD22 LEU A 59 -10.484 1.401 -12.602 1.00 1.56 H new ATOM 0 HD23 LEU A 59 -10.033 3.067 -12.168 1.00 1.56 H new ATOM 916 N ARG A 60 -4.917 3.321 -12.404 1.00 1.00 N ATOM 917 CA ARG A 60 -4.340 4.643 -12.626 1.00 1.06 C ATOM 918 C ARG A 60 -3.038 4.565 -13.413 1.00 1.00 C ATOM 919 O ARG A 60 -2.902 5.203 -14.454 1.00 1.07 O ATOM 920 CB ARG A 60 -4.098 5.374 -11.296 1.00 1.10 C ATOM 921 CG ARG A 60 -5.319 6.107 -10.751 1.00 1.19 C ATOM 922 CD ARG A 60 -5.696 7.295 -11.626 1.00 1.31 C ATOM 923 NE ARG A 60 -4.611 8.273 -11.724 1.00 1.81 N ATOM 924 CZ ARG A 60 -4.598 9.284 -12.597 1.00 2.26 C ATOM 925 NH1 ARG A 60 -5.615 9.456 -13.431 1.00 2.15 N ATOM 926 NH2 ARG A 60 -3.568 10.122 -12.635 1.00 3.21 N ATOM 0 H ARG A 60 -4.667 2.896 -11.511 1.00 1.00 H new ATOM 0 HA ARG A 60 -5.064 5.208 -13.214 1.00 1.06 H new ATOM 0 HB2 ARG A 60 -3.762 4.651 -10.553 1.00 1.10 H new ATOM 0 HB3 ARG A 60 -3.289 6.091 -11.431 1.00 1.10 H new ATOM 0 HG2 ARG A 60 -6.161 5.417 -10.690 1.00 1.19 H new ATOM 0 HG3 ARG A 60 -5.115 6.451 -9.737 1.00 1.19 H new ATOM 0 HD2 ARG A 60 -5.956 6.942 -12.624 1.00 1.31 H new ATOM 0 HD3 ARG A 60 -6.583 7.778 -11.218 1.00 1.31 H new ATOM 0 HE ARG A 60 -3.819 8.177 -11.089 1.00 1.81 H new ATOM 0 HH11 ARG A 60 -6.409 8.816 -13.406 1.00 2.15 H new ATOM 0 HH12 ARG A 60 -5.603 10.229 -14.097 1.00 2.15 H new ATOM 0 HH21 ARG A 60 -2.783 9.995 -11.996 1.00 3.21 H new ATOM 0 HH22 ARG A 60 -3.562 10.893 -13.303 1.00 3.21 H new ATOM 940 N TYR A 61 -2.085 3.781 -12.928 1.00 0.91 N ATOM 941 CA TYR A 61 -0.757 3.754 -13.526 1.00 0.90 C ATOM 942 C TYR A 61 -0.311 2.321 -13.786 1.00 0.84 C ATOM 943 O TYR A 61 0.737 1.888 -13.306 1.00 0.83 O ATOM 944 CB TYR A 61 0.258 4.470 -12.625 1.00 0.96 C ATOM 945 CG TYR A 61 -0.079 5.922 -12.350 1.00 1.05 C ATOM 946 CD1 TYR A 61 -0.115 6.864 -13.377 1.00 1.27 C ATOM 947 CD2 TYR A 61 -0.364 6.352 -11.060 1.00 1.04 C ATOM 948 CE1 TYR A 61 -0.428 8.186 -13.120 1.00 1.38 C ATOM 949 CE2 TYR A 61 -0.675 7.672 -10.798 1.00 1.14 C ATOM 950 CZ TYR A 61 -0.707 8.584 -11.830 1.00 1.27 C ATOM 951 OH TYR A 61 -1.021 9.898 -11.570 1.00 1.41 O ATOM 0 H TYR A 61 -2.205 3.159 -12.128 1.00 0.91 H new ATOM 0 HA TYR A 61 -0.806 4.279 -14.480 1.00 0.90 H new ATOM 0 HB2 TYR A 61 0.326 3.937 -11.676 1.00 0.96 H new ATOM 0 HB3 TYR A 61 1.242 4.418 -13.091 1.00 0.96 H new ATOM 0 HD1 TYR A 61 0.105 6.557 -14.389 1.00 1.27 H new ATOM 0 HD2 TYR A 61 -0.342 5.641 -10.247 1.00 1.04 H new ATOM 0 HE1 TYR A 61 -0.454 8.904 -13.927 1.00 1.38 H new ATOM 0 HE2 TYR A 61 -0.892 7.988 -9.788 1.00 1.14 H new ATOM 0 HH TYR A 61 -1.191 10.010 -10.611 1.00 1.41 H new ATOM 961 N ARG A 62 -1.109 1.593 -14.554 1.00 0.86 N ATOM 962 CA ARG A 62 -0.807 0.205 -14.882 1.00 0.85 C ATOM 963 C ARG A 62 0.426 0.116 -15.781 1.00 0.87 C ATOM 964 O ARG A 62 1.231 -0.810 -15.666 1.00 0.85 O ATOM 965 CB ARG A 62 -2.017 -0.444 -15.563 1.00 0.95 C ATOM 966 CG ARG A 62 -1.812 -1.902 -15.945 1.00 1.04 C ATOM 967 CD ARG A 62 -3.118 -2.551 -16.376 1.00 1.23 C ATOM 968 NE ARG A 62 -4.064 -2.636 -15.268 1.00 1.73 N ATOM 969 CZ ARG A 62 -5.382 -2.487 -15.388 1.00 2.16 C ATOM 970 NH1 ARG A 62 -5.929 -2.218 -16.567 1.00 2.24 N ATOM 971 NH2 ARG A 62 -6.158 -2.601 -14.317 1.00 3.02 N ATOM 0 H ARG A 62 -1.975 1.942 -14.964 1.00 0.86 H new ATOM 0 HA ARG A 62 -0.590 -0.333 -13.959 1.00 0.85 H new ATOM 0 HB2 ARG A 62 -2.876 -0.373 -14.896 1.00 0.95 H new ATOM 0 HB3 ARG A 62 -2.262 0.124 -16.461 1.00 0.95 H new ATOM 0 HG2 ARG A 62 -1.086 -1.969 -16.755 1.00 1.04 H new ATOM 0 HG3 ARG A 62 -1.395 -2.447 -15.098 1.00 1.04 H new ATOM 0 HD2 ARG A 62 -3.560 -1.976 -17.190 1.00 1.23 H new ATOM 0 HD3 ARG A 62 -2.919 -3.550 -16.763 1.00 1.23 H new ATOM 0 HE ARG A 62 -3.690 -2.822 -14.338 1.00 1.73 H new ATOM 0 HH11 ARG A 62 -5.339 -2.123 -17.393 1.00 2.24 H new ATOM 0 HH12 ARG A 62 -6.940 -2.106 -16.647 1.00 2.24 H new ATOM 0 HH21 ARG A 62 -5.744 -2.802 -13.407 1.00 3.02 H new ATOM 0 HH22 ARG A 62 -7.168 -2.488 -14.405 1.00 3.02 H new ATOM 985 N ARG A 63 0.582 1.095 -16.660 1.00 0.94 N ATOM 986 CA ARG A 63 1.714 1.121 -17.574 1.00 1.01 C ATOM 987 C ARG A 63 2.940 1.689 -16.865 1.00 0.95 C ATOM 988 O ARG A 63 4.066 1.233 -17.077 1.00 0.99 O ATOM 989 CB ARG A 63 1.379 1.962 -18.810 1.00 1.16 C ATOM 990 CG ARG A 63 2.387 1.842 -19.948 1.00 1.70 C ATOM 991 CD ARG A 63 2.294 0.495 -20.653 1.00 2.14 C ATOM 992 NE ARG A 63 2.924 -0.585 -19.897 1.00 2.71 N ATOM 993 CZ ARG A 63 2.281 -1.671 -19.464 1.00 3.58 C ATOM 994 NH1 ARG A 63 0.962 -1.776 -19.610 1.00 3.92 N ATOM 995 NH2 ARG A 63 2.957 -2.645 -18.870 1.00 4.52 N ATOM 0 H ARG A 63 -0.060 1.881 -16.760 1.00 0.94 H new ATOM 0 HA ARG A 63 1.932 0.103 -17.896 1.00 1.01 H new ATOM 0 HB2 ARG A 63 0.397 1.667 -19.179 1.00 1.16 H new ATOM 0 HB3 ARG A 63 1.308 3.008 -18.513 1.00 1.16 H new ATOM 0 HG2 ARG A 63 2.216 2.641 -20.669 1.00 1.70 H new ATOM 0 HG3 ARG A 63 3.395 1.977 -19.555 1.00 1.70 H new ATOM 0 HD2 ARG A 63 1.245 0.250 -20.822 1.00 2.14 H new ATOM 0 HD3 ARG A 63 2.766 0.570 -21.633 1.00 2.14 H new ATOM 0 HE ARG A 63 3.919 -0.504 -19.687 1.00 2.71 H new ATOM 0 HH11 ARG A 63 0.437 -1.024 -20.055 1.00 3.92 H new ATOM 0 HH12 ARG A 63 0.477 -2.609 -19.277 1.00 3.92 H new ATOM 0 HH21 ARG A 63 3.966 -2.563 -18.745 1.00 4.52 H new ATOM 0 HH22 ARG A 63 2.468 -3.476 -18.538 1.00 4.52 H new ATOM 1009 N ALA A 64 2.704 2.677 -16.007 1.00 0.90 N ATOM 1010 CA ALA A 64 3.772 3.308 -15.247 1.00 0.89 C ATOM 1011 C ALA A 64 4.376 2.337 -14.241 1.00 0.75 C ATOM 1012 O ALA A 64 5.586 2.332 -14.024 1.00 0.73 O ATOM 1013 CB ALA A 64 3.257 4.550 -14.538 1.00 0.94 C ATOM 0 H ALA A 64 1.776 3.058 -15.822 1.00 0.90 H new ATOM 0 HA ALA A 64 4.555 3.602 -15.946 1.00 0.89 H new ATOM 0 HB1 ALA A 64 4.069 5.010 -13.974 1.00 0.94 H new ATOM 0 HB2 ALA A 64 2.880 5.259 -15.275 1.00 0.94 H new ATOM 0 HB3 ALA A 64 2.453 4.273 -13.856 1.00 0.94 H new ATOM 1019 N PHE A 65 3.525 1.512 -13.637 1.00 0.69 N ATOM 1020 CA PHE A 65 3.966 0.524 -12.655 1.00 0.61 C ATOM 1021 C PHE A 65 5.067 -0.366 -13.224 1.00 0.59 C ATOM 1022 O PHE A 65 6.149 -0.476 -12.646 1.00 0.59 O ATOM 1023 CB PHE A 65 2.786 -0.343 -12.194 1.00 0.62 C ATOM 1024 CG PHE A 65 3.183 -1.458 -11.267 1.00 0.59 C ATOM 1025 CD1 PHE A 65 3.690 -1.182 -10.009 1.00 0.60 C ATOM 1026 CD2 PHE A 65 3.055 -2.784 -11.658 1.00 0.64 C ATOM 1027 CE1 PHE A 65 4.059 -2.205 -9.157 1.00 0.64 C ATOM 1028 CE2 PHE A 65 3.425 -3.808 -10.811 1.00 0.68 C ATOM 1029 CZ PHE A 65 3.928 -3.518 -9.559 1.00 0.66 C ATOM 0 H PHE A 65 2.520 1.508 -13.811 1.00 0.69 H new ATOM 0 HA PHE A 65 4.367 1.066 -11.799 1.00 0.61 H new ATOM 0 HB2 PHE A 65 2.054 0.291 -11.693 1.00 0.62 H new ATOM 0 HB3 PHE A 65 2.294 -0.767 -13.069 1.00 0.62 H new ATOM 0 HD1 PHE A 65 3.798 -0.156 -9.690 1.00 0.60 H new ATOM 0 HD2 PHE A 65 2.661 -3.016 -12.636 1.00 0.64 H new ATOM 0 HE1 PHE A 65 4.450 -1.977 -8.176 1.00 0.64 H new ATOM 0 HE2 PHE A 65 3.321 -4.835 -11.127 1.00 0.68 H new ATOM 0 HZ PHE A 65 4.219 -4.318 -8.895 1.00 0.66 H new ATOM 1039 N SER A 66 4.789 -0.989 -14.361 1.00 0.64 N ATOM 1040 CA SER A 66 5.736 -1.899 -14.990 1.00 0.68 C ATOM 1041 C SER A 66 6.992 -1.155 -15.450 1.00 0.66 C ATOM 1042 O SER A 66 8.092 -1.710 -15.443 1.00 0.68 O ATOM 1043 CB SER A 66 5.070 -2.596 -16.172 1.00 0.83 C ATOM 1044 OG SER A 66 3.796 -3.099 -15.804 1.00 1.20 O ATOM 0 H SER A 66 3.911 -0.880 -14.869 1.00 0.64 H new ATOM 0 HA SER A 66 6.040 -2.645 -14.256 1.00 0.68 H new ATOM 0 HB2 SER A 66 4.965 -1.896 -17.001 1.00 0.83 H new ATOM 0 HB3 SER A 66 5.702 -3.412 -16.522 1.00 0.83 H new ATOM 0 HG SER A 66 3.453 -3.675 -16.519 1.00 1.20 H new ATOM 1050 N ASP A 67 6.824 0.105 -15.829 1.00 0.68 N ATOM 1051 CA ASP A 67 7.949 0.921 -16.280 1.00 0.73 C ATOM 1052 C ASP A 67 8.867 1.276 -15.116 1.00 0.65 C ATOM 1053 O ASP A 67 10.081 1.087 -15.190 1.00 0.66 O ATOM 1054 CB ASP A 67 7.461 2.201 -16.961 1.00 0.89 C ATOM 1055 CG ASP A 67 8.607 3.107 -17.361 1.00 1.36 C ATOM 1056 OD1 ASP A 67 9.221 2.868 -18.423 1.00 1.41 O ATOM 1057 OD2 ASP A 67 8.901 4.064 -16.618 1.00 2.06 O ATOM 0 H ASP A 67 5.924 0.585 -15.834 1.00 0.68 H new ATOM 0 HA ASP A 67 8.511 0.331 -17.004 1.00 0.73 H new ATOM 0 HB2 ASP A 67 6.879 1.941 -17.845 1.00 0.89 H new ATOM 0 HB3 ASP A 67 6.794 2.738 -16.287 1.00 0.89 H new ATOM 1062 N LEU A 68 8.282 1.769 -14.032 1.00 0.63 N ATOM 1063 CA LEU A 68 9.057 2.204 -12.881 1.00 0.66 C ATOM 1064 C LEU A 68 9.732 1.021 -12.191 1.00 0.57 C ATOM 1065 O LEU A 68 10.830 1.157 -11.654 1.00 0.63 O ATOM 1066 CB LEU A 68 8.169 2.977 -11.900 1.00 0.75 C ATOM 1067 CG LEU A 68 7.623 4.307 -12.435 1.00 0.81 C ATOM 1068 CD1 LEU A 68 6.724 4.978 -11.408 1.00 1.64 C ATOM 1069 CD2 LEU A 68 8.761 5.240 -12.820 1.00 1.07 C ATOM 0 H LEU A 68 7.273 1.877 -13.927 1.00 0.63 H new ATOM 0 HA LEU A 68 9.843 2.872 -13.233 1.00 0.66 H new ATOM 0 HB2 LEU A 68 7.329 2.344 -11.616 1.00 0.75 H new ATOM 0 HB3 LEU A 68 8.740 3.174 -10.993 1.00 0.75 H new ATOM 0 HG LEU A 68 7.031 4.091 -13.324 1.00 0.81 H new ATOM 0 HD11 LEU A 68 6.350 5.919 -11.811 1.00 1.64 H new ATOM 0 HD12 LEU A 68 5.884 4.323 -11.176 1.00 1.64 H new ATOM 0 HD13 LEU A 68 7.293 5.174 -10.499 1.00 1.64 H new ATOM 0 HD21 LEU A 68 8.351 6.177 -13.197 1.00 1.07 H new ATOM 0 HD22 LEU A 68 9.379 5.440 -11.945 1.00 1.07 H new ATOM 0 HD23 LEU A 68 9.369 4.772 -13.594 1.00 1.07 H new ATOM 1081 N THR A 69 9.093 -0.146 -12.233 1.00 0.49 N ATOM 1082 CA THR A 69 9.693 -1.351 -11.672 1.00 0.49 C ATOM 1083 C THR A 69 10.806 -1.879 -12.573 1.00 0.46 C ATOM 1084 O THR A 69 11.665 -2.639 -12.133 1.00 0.51 O ATOM 1085 CB THR A 69 8.652 -2.459 -11.430 1.00 0.51 C ATOM 1086 OG1 THR A 69 7.777 -2.571 -12.560 1.00 0.71 O ATOM 1087 CG2 THR A 69 7.840 -2.171 -10.179 1.00 0.63 C ATOM 0 H THR A 69 8.170 -0.281 -12.645 1.00 0.49 H new ATOM 0 HA THR A 69 10.116 -1.069 -10.708 1.00 0.49 H new ATOM 0 HB THR A 69 9.183 -3.401 -11.292 1.00 0.51 H new ATOM 0 HG1 THR A 69 7.007 -1.977 -12.438 1.00 0.71 H new ATOM 0 HG21 THR A 69 7.111 -2.967 -10.027 1.00 0.63 H new ATOM 0 HG22 THR A 69 8.505 -2.120 -9.317 1.00 0.63 H new ATOM 0 HG23 THR A 69 7.320 -1.220 -10.293 1.00 0.63 H new ATOM 1095 N SER A 70 10.796 -1.458 -13.832 1.00 0.46 N ATOM 1096 CA SER A 70 11.863 -1.814 -14.753 1.00 0.49 C ATOM 1097 C SER A 70 13.121 -1.035 -14.393 1.00 0.48 C ATOM 1098 O SER A 70 14.231 -1.560 -14.458 1.00 0.53 O ATOM 1099 CB SER A 70 11.451 -1.539 -16.207 1.00 0.57 C ATOM 1100 OG SER A 70 12.491 -1.875 -17.112 1.00 1.31 O ATOM 0 H SER A 70 10.064 -0.873 -14.235 1.00 0.46 H new ATOM 0 HA SER A 70 12.064 -2.882 -14.666 1.00 0.49 H new ATOM 0 HB2 SER A 70 10.557 -2.114 -16.448 1.00 0.57 H new ATOM 0 HB3 SER A 70 11.194 -0.486 -16.321 1.00 0.57 H new ATOM 0 HG SER A 70 12.199 -1.691 -18.029 1.00 1.31 H new ATOM 1106 N GLN A 71 12.938 0.214 -13.982 1.00 0.49 N ATOM 1107 CA GLN A 71 14.051 1.040 -13.536 1.00 0.53 C ATOM 1108 C GLN A 71 14.522 0.580 -12.161 1.00 0.46 C ATOM 1109 O GLN A 71 15.715 0.563 -11.868 1.00 0.53 O ATOM 1110 CB GLN A 71 13.631 2.513 -13.478 1.00 0.63 C ATOM 1111 CG GLN A 71 14.712 3.439 -12.941 1.00 0.69 C ATOM 1112 CD GLN A 71 14.226 4.862 -12.722 1.00 0.83 C ATOM 1113 OE1 GLN A 71 14.995 5.815 -12.842 1.00 1.22 O ATOM 1114 NE2 GLN A 71 12.952 5.018 -12.388 1.00 0.82 N ATOM 0 H GLN A 71 12.029 0.676 -13.949 1.00 0.49 H new ATOM 0 HA GLN A 71 14.870 0.937 -14.247 1.00 0.53 H new ATOM 0 HB2 GLN A 71 13.349 2.841 -14.479 1.00 0.63 H new ATOM 0 HB3 GLN A 71 12.744 2.604 -12.851 1.00 0.63 H new ATOM 0 HG2 GLN A 71 15.087 3.041 -11.998 1.00 0.69 H new ATOM 0 HG3 GLN A 71 15.550 3.451 -13.638 1.00 0.69 H new ATOM 0 HE21 GLN A 71 12.345 4.203 -12.298 1.00 0.82 H new ATOM 0 HE22 GLN A 71 12.579 5.953 -12.221 1.00 0.82 H new ATOM 1123 N LEU A 72 13.569 0.177 -11.336 1.00 0.39 N ATOM 1124 CA LEU A 72 13.849 -0.207 -9.957 1.00 0.33 C ATOM 1125 C LEU A 72 14.123 -1.710 -9.853 1.00 0.34 C ATOM 1126 O LEU A 72 14.037 -2.286 -8.773 1.00 0.37 O ATOM 1127 CB LEU A 72 12.659 0.189 -9.065 1.00 0.37 C ATOM 1128 CG LEU A 72 12.889 0.077 -7.556 1.00 0.46 C ATOM 1129 CD1 LEU A 72 14.066 0.933 -7.127 1.00 0.96 C ATOM 1130 CD2 LEU A 72 11.633 0.482 -6.801 1.00 0.92 C ATOM 0 H LEU A 72 12.586 0.106 -11.598 1.00 0.39 H new ATOM 0 HA LEU A 72 14.743 0.317 -9.618 1.00 0.33 H new ATOM 0 HB2 LEU A 72 12.383 1.218 -9.296 1.00 0.37 H new ATOM 0 HB3 LEU A 72 11.807 -0.436 -9.331 1.00 0.37 H new ATOM 0 HG LEU A 72 13.120 -0.962 -7.319 1.00 0.46 H new ATOM 0 HD11 LEU A 72 14.212 0.838 -6.051 1.00 0.96 H new ATOM 0 HD12 LEU A 72 14.965 0.601 -7.645 1.00 0.96 H new ATOM 0 HD13 LEU A 72 13.868 1.975 -7.376 1.00 0.96 H new ATOM 0 HD21 LEU A 72 11.810 0.398 -5.729 1.00 0.92 H new ATOM 0 HD22 LEU A 72 11.377 1.513 -7.047 1.00 0.92 H new ATOM 0 HD23 LEU A 72 10.810 -0.174 -7.085 1.00 0.92 H new ATOM 1142 N HIS A 73 14.467 -2.334 -10.982 1.00 0.41 N ATOM 1143 CA HIS A 73 14.740 -3.773 -11.010 1.00 0.46 C ATOM 1144 C HIS A 73 15.814 -4.132 -9.981 1.00 0.41 C ATOM 1145 O HIS A 73 16.872 -3.500 -9.927 1.00 0.45 O ATOM 1146 CB HIS A 73 15.158 -4.235 -12.423 1.00 0.60 C ATOM 1147 CG HIS A 73 16.474 -3.690 -12.911 1.00 1.34 C ATOM 1148 ND1 HIS A 73 16.582 -2.574 -13.711 1.00 2.07 N ATOM 1149 CD2 HIS A 73 17.742 -4.128 -12.717 1.00 2.33 C ATOM 1150 CE1 HIS A 73 17.853 -2.350 -13.985 1.00 2.86 C ATOM 1151 NE2 HIS A 73 18.579 -3.276 -13.393 1.00 3.01 N ATOM 0 H HIS A 73 14.563 -1.868 -11.884 1.00 0.41 H new ATOM 0 HA HIS A 73 13.821 -4.297 -10.749 1.00 0.46 H new ATOM 0 HB2 HIS A 73 15.208 -5.324 -12.432 1.00 0.60 H new ATOM 0 HB3 HIS A 73 14.379 -3.946 -13.128 1.00 0.60 H new ATOM 0 HD1 HIS A 73 15.800 -2.008 -14.041 1.00 2.07 H new ATOM 0 HD2 HIS A 73 18.039 -4.989 -12.137 1.00 2.33 H new ATOM 0 HE1 HIS A 73 18.234 -1.543 -14.593 1.00 2.86 H new ATOM 1160 N ILE A 74 15.540 -5.132 -9.158 1.00 0.37 N ATOM 1161 CA ILE A 74 16.441 -5.468 -8.071 1.00 0.36 C ATOM 1162 C ILE A 74 17.450 -6.546 -8.489 1.00 0.45 C ATOM 1163 O ILE A 74 17.142 -7.735 -8.558 1.00 0.61 O ATOM 1164 CB ILE A 74 15.655 -5.897 -6.803 1.00 0.31 C ATOM 1165 CG1 ILE A 74 16.621 -6.170 -5.650 1.00 0.31 C ATOM 1166 CG2 ILE A 74 14.774 -7.114 -7.068 1.00 0.35 C ATOM 1167 CD1 ILE A 74 15.933 -6.410 -4.328 1.00 0.34 C ATOM 0 H ILE A 74 14.709 -5.719 -9.222 1.00 0.37 H new ATOM 0 HA ILE A 74 17.006 -4.569 -7.825 1.00 0.36 H new ATOM 0 HB ILE A 74 14.996 -5.074 -6.525 1.00 0.31 H new ATOM 0 HG12 ILE A 74 17.230 -7.040 -5.896 1.00 0.31 H new ATOM 0 HG13 ILE A 74 17.300 -5.324 -5.548 1.00 0.31 H new ATOM 0 HG21 ILE A 74 14.241 -7.383 -6.156 1.00 0.35 H new ATOM 0 HG22 ILE A 74 14.055 -6.879 -7.853 1.00 0.35 H new ATOM 0 HG23 ILE A 74 15.396 -7.951 -7.385 1.00 0.35 H new ATOM 0 HD11 ILE A 74 16.681 -6.597 -3.557 1.00 0.34 H new ATOM 0 HD12 ILE A 74 15.346 -5.532 -4.059 1.00 0.34 H new ATOM 0 HD13 ILE A 74 15.275 -7.275 -4.412 1.00 0.34 H new ATOM 1179 N THR A 75 18.647 -6.107 -8.828 1.00 0.61 N ATOM 1180 CA THR A 75 19.740 -7.009 -9.144 1.00 0.73 C ATOM 1181 C THR A 75 20.656 -7.130 -7.926 1.00 0.58 C ATOM 1182 O THR A 75 20.799 -6.166 -7.177 1.00 0.57 O ATOM 1183 CB THR A 75 20.526 -6.468 -10.359 1.00 1.02 C ATOM 1184 OG1 THR A 75 19.608 -6.141 -11.409 1.00 1.38 O ATOM 1185 CG2 THR A 75 21.535 -7.480 -10.879 1.00 1.56 C ATOM 0 H THR A 75 18.890 -5.118 -8.892 1.00 0.61 H new ATOM 0 HA THR A 75 19.348 -7.994 -9.396 1.00 0.73 H new ATOM 0 HB THR A 75 21.073 -5.583 -10.035 1.00 1.02 H new ATOM 0 HG1 THR A 75 20.103 -5.796 -12.181 1.00 1.38 H new ATOM 0 HG21 THR A 75 22.065 -7.059 -11.733 1.00 1.56 H new ATOM 0 HG22 THR A 75 22.249 -7.720 -10.091 1.00 1.56 H new ATOM 0 HG23 THR A 75 21.015 -8.387 -11.186 1.00 1.56 H new ATOM 1193 N PRO A 76 21.250 -8.313 -7.667 1.00 0.66 N ATOM 1194 CA PRO A 76 22.194 -8.486 -6.560 1.00 0.73 C ATOM 1195 C PRO A 76 23.281 -7.420 -6.579 1.00 0.72 C ATOM 1196 O PRO A 76 24.154 -7.422 -7.447 1.00 0.81 O ATOM 1197 CB PRO A 76 22.791 -9.870 -6.807 1.00 0.93 C ATOM 1198 CG PRO A 76 21.743 -10.601 -7.567 1.00 1.06 C ATOM 1199 CD PRO A 76 21.041 -9.568 -8.410 1.00 0.90 C ATOM 0 HA PRO A 76 21.712 -8.394 -5.587 1.00 0.73 H new ATOM 0 HB2 PRO A 76 23.720 -9.806 -7.374 1.00 0.93 H new ATOM 0 HB3 PRO A 76 23.025 -10.374 -5.869 1.00 0.93 H new ATOM 0 HG2 PRO A 76 22.185 -11.378 -8.191 1.00 1.06 H new ATOM 0 HG3 PRO A 76 21.044 -11.093 -6.891 1.00 1.06 H new ATOM 0 HD2 PRO A 76 21.464 -9.515 -9.413 1.00 0.90 H new ATOM 0 HD3 PRO A 76 19.981 -9.795 -8.522 1.00 0.90 H new ATOM 1207 N GLY A 77 23.204 -6.493 -5.638 1.00 0.86 N ATOM 1208 CA GLY A 77 24.144 -5.397 -5.602 1.00 1.10 C ATOM 1209 C GLY A 77 23.454 -4.054 -5.712 1.00 1.00 C ATOM 1210 O GLY A 77 24.061 -3.012 -5.449 1.00 1.32 O ATOM 0 H GLY A 77 22.504 -6.481 -4.896 1.00 0.86 H new ATOM 0 HA2 GLY A 77 24.713 -5.437 -4.673 1.00 1.10 H new ATOM 0 HA3 GLY A 77 24.859 -5.505 -6.418 1.00 1.10 H new ATOM 1214 N THR A 78 22.188 -4.074 -6.114 1.00 0.85 N ATOM 1215 CA THR A 78 21.358 -2.883 -6.087 1.00 0.82 C ATOM 1216 C THR A 78 20.986 -2.574 -4.640 1.00 0.85 C ATOM 1217 O THR A 78 19.942 -2.998 -4.145 1.00 1.52 O ATOM 1218 CB THR A 78 20.075 -3.065 -6.931 1.00 0.90 C ATOM 1219 OG1 THR A 78 20.412 -3.516 -8.254 1.00 1.52 O ATOM 1220 CG2 THR A 78 19.296 -1.763 -7.033 1.00 1.15 C ATOM 0 H THR A 78 21.716 -4.908 -6.463 1.00 0.85 H new ATOM 0 HA THR A 78 21.922 -2.056 -6.519 1.00 0.82 H new ATOM 0 HB THR A 78 19.453 -3.809 -6.433 1.00 0.90 H new ATOM 0 HG1 THR A 78 20.650 -4.466 -8.225 1.00 1.52 H new ATOM 0 HG21 THR A 78 18.399 -1.922 -7.632 1.00 1.15 H new ATOM 0 HG22 THR A 78 19.011 -1.430 -6.035 1.00 1.15 H new ATOM 0 HG23 THR A 78 19.918 -1.003 -7.505 1.00 1.15 H new ATOM 1228 N ALA A 79 21.895 -1.905 -3.951 1.00 0.68 N ATOM 1229 CA ALA A 79 21.734 -1.607 -2.534 1.00 0.73 C ATOM 1230 C ALA A 79 20.745 -0.467 -2.316 1.00 0.62 C ATOM 1231 O ALA A 79 20.225 0.106 -3.279 1.00 0.56 O ATOM 1232 CB ALA A 79 23.089 -1.266 -1.937 1.00 0.85 C ATOM 0 H ALA A 79 22.763 -1.553 -4.354 1.00 0.68 H new ATOM 0 HA ALA A 79 21.329 -2.486 -2.034 1.00 0.73 H new ATOM 0 HB1 ALA A 79 22.973 -1.042 -0.877 1.00 0.85 H new ATOM 0 HB2 ALA A 79 23.763 -2.114 -2.058 1.00 0.85 H new ATOM 0 HB3 ALA A 79 23.504 -0.397 -2.448 1.00 0.85 H new ATOM 1238 N TYR A 80 20.495 -0.124 -1.052 1.00 0.63 N ATOM 1239 CA TYR A 80 19.592 0.977 -0.728 1.00 0.58 C ATOM 1240 C TYR A 80 20.122 2.285 -1.306 1.00 0.50 C ATOM 1241 O TYR A 80 19.360 3.209 -1.552 1.00 0.46 O ATOM 1242 CB TYR A 80 19.385 1.117 0.789 1.00 0.67 C ATOM 1243 CG TYR A 80 18.372 2.186 1.160 1.00 0.80 C ATOM 1244 CD1 TYR A 80 17.009 1.986 0.969 1.00 0.89 C ATOM 1245 CD2 TYR A 80 18.783 3.393 1.713 1.00 1.14 C ATOM 1246 CE1 TYR A 80 16.089 2.959 1.318 1.00 1.24 C ATOM 1247 CE2 TYR A 80 17.869 4.367 2.065 1.00 1.55 C ATOM 1248 CZ TYR A 80 16.506 4.146 1.817 1.00 1.58 C ATOM 1249 OH TYR A 80 15.612 5.111 2.229 1.00 2.03 O ATOM 0 H TYR A 80 20.903 -0.590 -0.242 1.00 0.63 H new ATOM 0 HA TYR A 80 18.625 0.750 -1.177 1.00 0.58 H new ATOM 0 HB2 TYR A 80 19.058 0.160 1.194 1.00 0.67 H new ATOM 0 HB3 TYR A 80 20.340 1.352 1.259 1.00 0.67 H new ATOM 0 HD1 TYR A 80 16.663 1.057 0.541 1.00 0.89 H new ATOM 0 HD2 TYR A 80 19.836 3.573 1.870 1.00 1.14 H new ATOM 0 HE1 TYR A 80 15.033 2.770 1.192 1.00 1.24 H new ATOM 0 HE2 TYR A 80 18.199 5.287 2.525 1.00 1.55 H new ATOM 0 HH TYR A 80 15.685 5.895 1.645 1.00 2.03 H new ATOM 1259 N GLN A 81 21.430 2.354 -1.527 1.00 0.56 N ATOM 1260 CA GLN A 81 22.036 3.513 -2.169 1.00 0.59 C ATOM 1261 C GLN A 81 21.400 3.752 -3.539 1.00 0.54 C ATOM 1262 O GLN A 81 21.096 4.888 -3.904 1.00 0.63 O ATOM 1263 CB GLN A 81 23.551 3.313 -2.314 1.00 0.72 C ATOM 1264 CG GLN A 81 24.273 4.513 -2.911 1.00 0.84 C ATOM 1265 CD GLN A 81 24.083 5.771 -2.089 1.00 1.40 C ATOM 1266 OE1 GLN A 81 24.867 6.064 -1.187 1.00 2.01 O ATOM 1267 NE2 GLN A 81 23.040 6.527 -2.394 1.00 2.18 N ATOM 0 H GLN A 81 22.091 1.620 -1.271 1.00 0.56 H new ATOM 0 HA GLN A 81 21.860 4.388 -1.544 1.00 0.59 H new ATOM 0 HB2 GLN A 81 23.975 3.096 -1.334 1.00 0.72 H new ATOM 0 HB3 GLN A 81 23.735 2.441 -2.941 1.00 0.72 H new ATOM 0 HG2 GLN A 81 25.337 4.291 -2.989 1.00 0.84 H new ATOM 0 HG3 GLN A 81 23.908 4.686 -3.924 1.00 0.84 H new ATOM 0 HE21 GLN A 81 22.413 6.250 -3.149 1.00 2.18 H new ATOM 0 HE22 GLN A 81 22.864 7.387 -1.874 1.00 2.18 H new ATOM 1276 N SER A 82 21.182 2.673 -4.278 1.00 0.48 N ATOM 1277 CA SER A 82 20.543 2.752 -5.582 1.00 0.47 C ATOM 1278 C SER A 82 19.033 2.897 -5.416 1.00 0.40 C ATOM 1279 O SER A 82 18.399 3.711 -6.086 1.00 0.42 O ATOM 1280 CB SER A 82 20.863 1.494 -6.388 1.00 0.55 C ATOM 1281 OG SER A 82 22.242 1.182 -6.303 1.00 1.17 O ATOM 0 H SER A 82 21.440 1.728 -3.994 1.00 0.48 H new ATOM 0 HA SER A 82 20.923 3.624 -6.115 1.00 0.47 H new ATOM 0 HB2 SER A 82 20.272 0.657 -6.015 1.00 0.55 H new ATOM 0 HB3 SER A 82 20.582 1.643 -7.431 1.00 0.55 H new ATOM 0 HG SER A 82 22.427 0.373 -6.824 1.00 1.17 H new ATOM 1287 N PHE A 83 18.480 2.109 -4.497 1.00 0.36 N ATOM 1288 CA PHE A 83 17.046 2.114 -4.217 1.00 0.33 C ATOM 1289 C PHE A 83 16.580 3.518 -3.831 1.00 0.31 C ATOM 1290 O PHE A 83 15.557 3.998 -4.319 1.00 0.32 O ATOM 1291 CB PHE A 83 16.744 1.108 -3.093 1.00 0.35 C ATOM 1292 CG PHE A 83 15.281 0.826 -2.874 1.00 0.33 C ATOM 1293 CD1 PHE A 83 14.615 -0.107 -3.654 1.00 0.38 C ATOM 1294 CD2 PHE A 83 14.577 1.480 -1.875 1.00 0.32 C ATOM 1295 CE1 PHE A 83 13.278 -0.380 -3.442 1.00 0.41 C ATOM 1296 CE2 PHE A 83 13.239 1.212 -1.661 1.00 0.34 C ATOM 1297 CZ PHE A 83 12.588 0.282 -2.445 1.00 0.38 C ATOM 0 H PHE A 83 19.011 1.451 -3.927 1.00 0.36 H new ATOM 0 HA PHE A 83 16.502 1.818 -5.114 1.00 0.33 H new ATOM 0 HB2 PHE A 83 17.251 0.170 -3.319 1.00 0.35 H new ATOM 0 HB3 PHE A 83 17.170 1.485 -2.163 1.00 0.35 H new ATOM 0 HD1 PHE A 83 15.148 -0.626 -4.437 1.00 0.38 H new ATOM 0 HD2 PHE A 83 15.081 2.208 -1.256 1.00 0.32 H new ATOM 0 HE1 PHE A 83 12.772 -1.111 -4.055 1.00 0.41 H new ATOM 0 HE2 PHE A 83 12.703 1.730 -0.880 1.00 0.34 H new ATOM 0 HZ PHE A 83 11.542 0.072 -2.280 1.00 0.38 H new ATOM 1307 N GLU A 84 17.365 4.179 -2.982 1.00 0.34 N ATOM 1308 CA GLU A 84 17.060 5.528 -2.508 1.00 0.39 C ATOM 1309 C GLU A 84 16.953 6.499 -3.677 1.00 0.37 C ATOM 1310 O GLU A 84 15.988 7.247 -3.782 1.00 0.40 O ATOM 1311 CB GLU A 84 18.164 6.008 -1.549 1.00 0.51 C ATOM 1312 CG GLU A 84 17.938 7.403 -0.988 1.00 0.64 C ATOM 1313 CD GLU A 84 17.179 7.396 0.322 1.00 0.90 C ATOM 1314 OE1 GLU A 84 15.985 7.047 0.329 1.00 1.58 O ATOM 1315 OE2 GLU A 84 17.784 7.743 1.362 1.00 0.95 O ATOM 0 H GLU A 84 18.231 3.794 -2.603 1.00 0.34 H new ATOM 0 HA GLU A 84 16.104 5.498 -1.985 1.00 0.39 H new ATOM 0 HB2 GLU A 84 18.242 5.304 -0.721 1.00 0.51 H new ATOM 0 HB3 GLU A 84 19.119 5.990 -2.074 1.00 0.51 H new ATOM 0 HG2 GLU A 84 18.902 7.890 -0.841 1.00 0.64 H new ATOM 0 HG3 GLU A 84 17.388 7.998 -1.717 1.00 0.64 H new ATOM 1322 N GLN A 85 17.934 6.453 -4.571 1.00 0.37 N ATOM 1323 CA GLN A 85 18.019 7.406 -5.673 1.00 0.42 C ATOM 1324 C GLN A 85 16.796 7.319 -6.579 1.00 0.38 C ATOM 1325 O GLN A 85 16.375 8.318 -7.163 1.00 0.46 O ATOM 1326 CB GLN A 85 19.295 7.160 -6.480 1.00 0.50 C ATOM 1327 CG GLN A 85 20.573 7.461 -5.706 1.00 0.61 C ATOM 1328 CD GLN A 85 21.824 6.968 -6.410 1.00 1.44 C ATOM 1329 OE1 GLN A 85 22.895 7.559 -6.276 1.00 1.90 O ATOM 1330 NE2 GLN A 85 21.701 5.881 -7.157 1.00 2.16 N ATOM 0 H GLN A 85 18.685 5.763 -4.554 1.00 0.37 H new ATOM 0 HA GLN A 85 18.049 8.410 -5.250 1.00 0.42 H new ATOM 0 HB2 GLN A 85 19.314 6.120 -6.806 1.00 0.50 H new ATOM 0 HB3 GLN A 85 19.271 7.776 -7.379 1.00 0.50 H new ATOM 0 HG2 GLN A 85 20.651 8.537 -5.549 1.00 0.61 H new ATOM 0 HG3 GLN A 85 20.512 6.999 -4.721 1.00 0.61 H new ATOM 0 HE21 GLN A 85 20.795 5.420 -7.242 1.00 2.16 H new ATOM 0 HE22 GLN A 85 22.512 5.505 -7.647 1.00 2.16 H new ATOM 1339 N VAL A 86 16.222 6.131 -6.675 1.00 0.31 N ATOM 1340 CA VAL A 86 15.037 5.918 -7.486 1.00 0.31 C ATOM 1341 C VAL A 86 13.797 6.404 -6.749 1.00 0.29 C ATOM 1342 O VAL A 86 13.067 7.269 -7.231 1.00 0.32 O ATOM 1343 CB VAL A 86 14.852 4.426 -7.824 1.00 0.33 C ATOM 1344 CG1 VAL A 86 13.612 4.220 -8.681 1.00 0.38 C ATOM 1345 CG2 VAL A 86 16.086 3.871 -8.516 1.00 0.36 C ATOM 0 H VAL A 86 16.561 5.296 -6.198 1.00 0.31 H new ATOM 0 HA VAL A 86 15.170 6.481 -8.410 1.00 0.31 H new ATOM 0 HB VAL A 86 14.715 3.880 -6.891 1.00 0.33 H new ATOM 0 HG11 VAL A 86 13.499 3.160 -8.909 1.00 0.38 H new ATOM 0 HG12 VAL A 86 12.733 4.570 -8.140 1.00 0.38 H new ATOM 0 HG13 VAL A 86 13.714 4.782 -9.610 1.00 0.38 H new ATOM 0 HG21 VAL A 86 15.932 2.816 -8.745 1.00 0.36 H new ATOM 0 HG22 VAL A 86 16.263 4.421 -9.441 1.00 0.36 H new ATOM 0 HG23 VAL A 86 16.950 3.977 -7.860 1.00 0.36 H new ATOM 1355 N VAL A 87 13.575 5.845 -5.570 1.00 0.28 N ATOM 1356 CA VAL A 87 12.355 6.092 -4.820 1.00 0.32 C ATOM 1357 C VAL A 87 12.314 7.500 -4.223 1.00 0.35 C ATOM 1358 O VAL A 87 11.257 7.983 -3.823 1.00 0.37 O ATOM 1359 CB VAL A 87 12.166 5.043 -3.715 1.00 0.38 C ATOM 1360 CG1 VAL A 87 12.221 3.651 -4.318 1.00 0.38 C ATOM 1361 CG2 VAL A 87 13.207 5.200 -2.620 1.00 0.41 C ATOM 0 H VAL A 87 14.230 5.213 -5.110 1.00 0.28 H new ATOM 0 HA VAL A 87 11.531 6.012 -5.529 1.00 0.32 H new ATOM 0 HB VAL A 87 11.189 5.194 -3.257 1.00 0.38 H new ATOM 0 HG11 VAL A 87 12.087 2.908 -3.532 1.00 0.38 H new ATOM 0 HG12 VAL A 87 11.428 3.543 -5.058 1.00 0.38 H new ATOM 0 HG13 VAL A 87 13.188 3.500 -4.798 1.00 0.38 H new ATOM 0 HG21 VAL A 87 13.045 4.442 -1.853 1.00 0.41 H new ATOM 0 HG22 VAL A 87 14.203 5.079 -3.045 1.00 0.41 H new ATOM 0 HG23 VAL A 87 13.120 6.191 -2.175 1.00 0.41 H new ATOM 1371 N ASN A 88 13.459 8.164 -4.179 1.00 0.38 N ATOM 1372 CA ASN A 88 13.510 9.555 -3.725 1.00 0.47 C ATOM 1373 C ASN A 88 12.857 10.458 -4.767 1.00 0.44 C ATOM 1374 O ASN A 88 12.395 11.556 -4.460 1.00 0.45 O ATOM 1375 CB ASN A 88 14.956 10.005 -3.472 1.00 0.61 C ATOM 1376 CG ASN A 88 15.039 11.351 -2.767 1.00 0.78 C ATOM 1377 OD1 ASN A 88 14.170 11.704 -1.969 1.00 0.87 O ATOM 1378 ND2 ASN A 88 16.088 12.110 -3.056 1.00 0.97 N ATOM 0 H ASN A 88 14.361 7.771 -4.449 1.00 0.38 H new ATOM 0 HA ASN A 88 12.966 9.629 -2.784 1.00 0.47 H new ATOM 0 HB2 ASN A 88 15.466 9.253 -2.870 1.00 0.61 H new ATOM 0 HB3 ASN A 88 15.485 10.065 -4.423 1.00 0.61 H new ATOM 0 HD21 ASN A 88 16.196 13.022 -2.611 1.00 0.97 H new ATOM 0 HD22 ASN A 88 16.787 11.782 -3.723 1.00 0.97 H new ATOM 1385 N GLU A 89 12.790 9.970 -6.003 1.00 0.42 N ATOM 1386 CA GLU A 89 12.159 10.719 -7.082 1.00 0.45 C ATOM 1387 C GLU A 89 10.647 10.716 -6.921 1.00 0.38 C ATOM 1388 O GLU A 89 9.948 11.469 -7.588 1.00 0.43 O ATOM 1389 CB GLU A 89 12.548 10.155 -8.450 1.00 0.54 C ATOM 1390 CG GLU A 89 14.012 10.356 -8.785 1.00 0.65 C ATOM 1391 CD GLU A 89 14.361 9.888 -10.177 1.00 1.23 C ATOM 1392 OE1 GLU A 89 14.196 10.672 -11.133 1.00 1.28 O ATOM 1393 OE2 GLU A 89 14.802 8.734 -10.325 1.00 2.04 O ATOM 0 H GLU A 89 13.164 9.062 -6.280 1.00 0.42 H new ATOM 0 HA GLU A 89 12.516 11.747 -7.026 1.00 0.45 H new ATOM 0 HB2 GLU A 89 12.319 9.090 -8.475 1.00 0.54 H new ATOM 0 HB3 GLU A 89 11.938 10.630 -9.218 1.00 0.54 H new ATOM 0 HG2 GLU A 89 14.261 11.413 -8.688 1.00 0.65 H new ATOM 0 HG3 GLU A 89 14.623 9.817 -8.061 1.00 0.65 H new ATOM 1400 N LEU A 90 10.149 9.858 -6.039 1.00 0.31 N ATOM 1401 CA LEU A 90 8.739 9.867 -5.682 1.00 0.27 C ATOM 1402 C LEU A 90 8.452 11.070 -4.796 1.00 0.25 C ATOM 1403 O LEU A 90 7.430 11.739 -4.937 1.00 0.26 O ATOM 1404 CB LEU A 90 8.363 8.581 -4.943 1.00 0.26 C ATOM 1405 CG LEU A 90 8.625 7.286 -5.704 1.00 0.30 C ATOM 1406 CD1 LEU A 90 8.436 6.093 -4.785 1.00 0.31 C ATOM 1407 CD2 LEU A 90 7.705 7.177 -6.909 1.00 0.37 C ATOM 0 H LEU A 90 10.702 9.148 -5.559 1.00 0.31 H new ATOM 0 HA LEU A 90 8.144 9.929 -6.593 1.00 0.27 H new ATOM 0 HB2 LEU A 90 8.915 8.548 -4.004 1.00 0.26 H new ATOM 0 HB3 LEU A 90 7.304 8.625 -4.689 1.00 0.26 H new ATOM 0 HG LEU A 90 9.655 7.296 -6.060 1.00 0.30 H new ATOM 0 HD11 LEU A 90 8.626 5.173 -5.339 1.00 0.31 H new ATOM 0 HD12 LEU A 90 9.132 6.163 -3.949 1.00 0.31 H new ATOM 0 HD13 LEU A 90 7.414 6.084 -4.406 1.00 0.31 H new ATOM 0 HD21 LEU A 90 7.908 6.246 -7.439 1.00 0.37 H new ATOM 0 HD22 LEU A 90 6.667 7.187 -6.576 1.00 0.37 H new ATOM 0 HD23 LEU A 90 7.880 8.020 -7.577 1.00 0.37 H new ATOM 1419 N PHE A 91 9.389 11.348 -3.897 1.00 0.27 N ATOM 1420 CA PHE A 91 9.264 12.465 -2.972 1.00 0.29 C ATOM 1421 C PHE A 91 9.513 13.775 -3.710 1.00 0.33 C ATOM 1422 O PHE A 91 8.794 14.755 -3.520 1.00 0.33 O ATOM 1423 CB PHE A 91 10.262 12.311 -1.814 1.00 0.35 C ATOM 1424 CG PHE A 91 9.902 13.100 -0.582 1.00 0.37 C ATOM 1425 CD1 PHE A 91 10.161 14.461 -0.501 1.00 0.46 C ATOM 1426 CD2 PHE A 91 9.307 12.471 0.500 1.00 0.37 C ATOM 1427 CE1 PHE A 91 9.830 15.176 0.636 1.00 0.53 C ATOM 1428 CE2 PHE A 91 8.976 13.180 1.638 1.00 0.43 C ATOM 1429 CZ PHE A 91 9.237 14.534 1.706 1.00 0.50 C ATOM 0 H PHE A 91 10.249 10.810 -3.790 1.00 0.27 H new ATOM 0 HA PHE A 91 8.255 12.474 -2.561 1.00 0.29 H new ATOM 0 HB2 PHE A 91 10.334 11.256 -1.549 1.00 0.35 H new ATOM 0 HB3 PHE A 91 11.249 12.622 -2.156 1.00 0.35 H new ATOM 0 HD1 PHE A 91 10.626 14.967 -1.334 1.00 0.46 H new ATOM 0 HD2 PHE A 91 9.099 11.412 0.453 1.00 0.37 H new ATOM 0 HE1 PHE A 91 10.035 16.235 0.687 1.00 0.53 H new ATOM 0 HE2 PHE A 91 8.514 12.676 2.474 1.00 0.43 H new ATOM 0 HZ PHE A 91 8.978 15.091 2.595 1.00 0.50 H new ATOM 1439 N ARG A 92 10.514 13.767 -4.587 1.00 0.39 N ATOM 1440 CA ARG A 92 10.905 14.966 -5.319 1.00 0.49 C ATOM 1441 C ARG A 92 9.930 15.279 -6.453 1.00 0.51 C ATOM 1442 O ARG A 92 10.035 16.315 -7.110 1.00 0.62 O ATOM 1443 CB ARG A 92 12.319 14.813 -5.881 1.00 0.56 C ATOM 1444 CG ARG A 92 13.406 14.731 -4.816 1.00 1.24 C ATOM 1445 CD ARG A 92 14.795 14.922 -5.414 1.00 1.54 C ATOM 1446 NE ARG A 92 15.137 13.881 -6.383 1.00 2.30 N ATOM 1447 CZ ARG A 92 15.331 14.105 -7.683 1.00 2.99 C ATOM 1448 NH1 ARG A 92 15.141 15.316 -8.192 1.00 3.13 N ATOM 1449 NH2 ARG A 92 15.704 13.108 -8.472 1.00 3.95 N ATOM 0 H ARG A 92 11.070 12.940 -4.807 1.00 0.39 H new ATOM 0 HA ARG A 92 10.884 15.798 -4.615 1.00 0.49 H new ATOM 0 HB2 ARG A 92 12.359 13.914 -6.496 1.00 0.56 H new ATOM 0 HB3 ARG A 92 12.531 15.657 -6.537 1.00 0.56 H new ATOM 0 HG2 ARG A 92 13.229 15.492 -4.056 1.00 1.24 H new ATOM 0 HG3 ARG A 92 13.354 13.763 -4.317 1.00 1.24 H new ATOM 0 HD2 ARG A 92 14.847 15.897 -5.899 1.00 1.54 H new ATOM 0 HD3 ARG A 92 15.534 14.925 -4.613 1.00 1.54 H new ATOM 0 HE ARG A 92 15.233 12.924 -6.043 1.00 2.30 H new ATOM 0 HH11 ARG A 92 14.845 16.082 -7.588 1.00 3.13 H new ATOM 0 HH12 ARG A 92 15.291 15.480 -9.187 1.00 3.13 H new ATOM 0 HH21 ARG A 92 15.841 12.175 -8.084 1.00 3.95 H new ATOM 0 HH22 ARG A 92 15.854 13.274 -9.467 1.00 3.95 H new ATOM 1463 N ASP A 93 8.975 14.388 -6.670 1.00 0.46 N ATOM 1464 CA ASP A 93 7.991 14.556 -7.738 1.00 0.53 C ATOM 1465 C ASP A 93 6.716 15.195 -7.189 1.00 0.50 C ATOM 1466 O ASP A 93 5.670 15.189 -7.837 1.00 0.60 O ATOM 1467 CB ASP A 93 7.682 13.191 -8.376 1.00 0.62 C ATOM 1468 CG ASP A 93 6.811 13.283 -9.612 1.00 0.90 C ATOM 1469 OD1 ASP A 93 7.268 13.856 -10.620 1.00 1.14 O ATOM 1470 OD2 ASP A 93 5.656 12.810 -9.573 1.00 1.11 O ATOM 0 H ASP A 93 8.857 13.537 -6.121 1.00 0.46 H new ATOM 0 HA ASP A 93 8.401 15.217 -8.502 1.00 0.53 H new ATOM 0 HB2 ASP A 93 8.620 12.701 -8.638 1.00 0.62 H new ATOM 0 HB3 ASP A 93 7.187 12.558 -7.639 1.00 0.62 H new ATOM 1475 N GLY A 94 6.808 15.776 -5.999 1.00 0.45 N ATOM 1476 CA GLY A 94 5.627 16.353 -5.388 1.00 0.47 C ATOM 1477 C GLY A 94 4.851 15.329 -4.591 1.00 0.39 C ATOM 1478 O GLY A 94 3.623 15.366 -4.580 1.00 0.42 O ATOM 0 H GLY A 94 7.666 15.857 -5.453 1.00 0.45 H new ATOM 0 HA2 GLY A 94 5.920 17.176 -4.736 1.00 0.47 H new ATOM 0 HA3 GLY A 94 4.985 16.773 -6.162 1.00 0.47 H new ATOM 1482 N VAL A 95 5.592 14.404 -3.965 1.00 0.32 N ATOM 1483 CA VAL A 95 5.041 13.244 -3.247 1.00 0.26 C ATOM 1484 C VAL A 95 3.630 13.466 -2.702 1.00 0.25 C ATOM 1485 O VAL A 95 3.400 14.271 -1.803 1.00 0.29 O ATOM 1486 CB VAL A 95 5.971 12.808 -2.088 1.00 0.31 C ATOM 1487 CG1 VAL A 95 6.281 13.970 -1.158 1.00 0.40 C ATOM 1488 CG2 VAL A 95 5.360 11.647 -1.315 1.00 0.33 C ATOM 0 H VAL A 95 6.611 14.441 -3.943 1.00 0.32 H new ATOM 0 HA VAL A 95 4.978 12.454 -3.995 1.00 0.26 H new ATOM 0 HB VAL A 95 6.912 12.474 -2.525 1.00 0.31 H new ATOM 0 HG11 VAL A 95 6.936 13.629 -0.356 1.00 0.40 H new ATOM 0 HG12 VAL A 95 6.776 14.763 -1.719 1.00 0.40 H new ATOM 0 HG13 VAL A 95 5.354 14.352 -0.732 1.00 0.40 H new ATOM 0 HG21 VAL A 95 6.030 11.356 -0.505 1.00 0.33 H new ATOM 0 HG22 VAL A 95 4.399 11.952 -0.900 1.00 0.33 H new ATOM 0 HG23 VAL A 95 5.213 10.800 -1.986 1.00 0.33 H new ATOM 1498 N ASN A 96 2.686 12.773 -3.309 1.00 0.24 N ATOM 1499 CA ASN A 96 1.315 12.730 -2.819 1.00 0.29 C ATOM 1500 C ASN A 96 1.029 11.330 -2.286 1.00 0.23 C ATOM 1501 O ASN A 96 1.904 10.464 -2.337 1.00 0.21 O ATOM 1502 CB ASN A 96 0.319 13.113 -3.922 1.00 0.41 C ATOM 1503 CG ASN A 96 0.387 14.585 -4.304 1.00 1.33 C ATOM 1504 OD1 ASN A 96 0.135 14.951 -5.453 1.00 2.13 O ATOM 1505 ND2 ASN A 96 0.718 15.438 -3.346 1.00 2.00 N ATOM 0 H ASN A 96 2.844 12.224 -4.154 1.00 0.24 H new ATOM 0 HA ASN A 96 1.196 13.457 -2.016 1.00 0.29 H new ATOM 0 HB2 ASN A 96 0.513 12.505 -4.806 1.00 0.41 H new ATOM 0 HB3 ASN A 96 -0.692 12.877 -3.589 1.00 0.41 H new ATOM 0 HD21 ASN A 96 0.771 16.436 -3.548 1.00 2.00 H new ATOM 0 HD22 ASN A 96 0.920 15.096 -2.406 1.00 2.00 H new ATOM 1512 N TRP A 97 -0.185 11.094 -1.794 1.00 0.25 N ATOM 1513 CA TRP A 97 -0.521 9.810 -1.171 1.00 0.24 C ATOM 1514 C TRP A 97 -0.381 8.643 -2.153 1.00 0.25 C ATOM 1515 O TRP A 97 -0.117 7.511 -1.745 1.00 0.25 O ATOM 1516 CB TRP A 97 -1.938 9.841 -0.589 1.00 0.27 C ATOM 1517 CG TRP A 97 -2.106 10.835 0.525 1.00 0.28 C ATOM 1518 CD1 TRP A 97 -2.828 11.991 0.485 1.00 0.32 C ATOM 1519 CD2 TRP A 97 -1.538 10.762 1.842 1.00 0.27 C ATOM 1520 NE1 TRP A 97 -2.743 12.642 1.690 1.00 0.34 N ATOM 1521 CE2 TRP A 97 -1.958 11.910 2.538 1.00 0.30 C ATOM 1522 CE3 TRP A 97 -0.716 9.842 2.502 1.00 0.26 C ATOM 1523 CZ2 TRP A 97 -1.587 12.163 3.856 1.00 0.32 C ATOM 1524 CZ3 TRP A 97 -0.348 10.095 3.811 1.00 0.27 C ATOM 1525 CH2 TRP A 97 -0.784 11.248 4.475 1.00 0.30 C ATOM 0 H TRP A 97 -0.950 11.768 -1.813 1.00 0.25 H new ATOM 0 HA TRP A 97 0.192 9.652 -0.362 1.00 0.24 H new ATOM 0 HB2 TRP A 97 -2.644 10.076 -1.385 1.00 0.27 H new ATOM 0 HB3 TRP A 97 -2.193 8.847 -0.220 1.00 0.27 H new ATOM 0 HD1 TRP A 97 -3.386 12.343 -0.370 1.00 0.32 H new ATOM 0 HE1 TRP A 97 -3.193 13.529 1.917 1.00 0.34 H new ATOM 0 HE3 TRP A 97 -0.375 8.950 1.998 1.00 0.26 H new ATOM 0 HZ2 TRP A 97 -1.922 13.051 4.371 1.00 0.32 H new ATOM 0 HZ3 TRP A 97 0.286 9.391 4.330 1.00 0.27 H new ATOM 0 HH2 TRP A 97 -0.479 11.417 5.497 1.00 0.30 H new ATOM 1536 N GLY A 98 -0.526 8.925 -3.445 1.00 0.27 N ATOM 1537 CA GLY A 98 -0.417 7.885 -4.451 1.00 0.29 C ATOM 1538 C GLY A 98 1.010 7.397 -4.618 1.00 0.26 C ATOM 1539 O GLY A 98 1.239 6.275 -5.066 1.00 0.27 O ATOM 0 H GLY A 98 -0.717 9.857 -3.813 1.00 0.27 H new ATOM 0 HA2 GLY A 98 -1.056 7.046 -4.175 1.00 0.29 H new ATOM 0 HA3 GLY A 98 -0.783 8.265 -5.405 1.00 0.29 H new ATOM 1543 N ARG A 99 1.971 8.241 -4.247 1.00 0.26 N ATOM 1544 CA ARG A 99 3.382 7.868 -4.308 1.00 0.25 C ATOM 1545 C ARG A 99 3.675 6.800 -3.272 1.00 0.21 C ATOM 1546 O ARG A 99 4.508 5.926 -3.490 1.00 0.20 O ATOM 1547 CB ARG A 99 4.297 9.077 -4.071 1.00 0.30 C ATOM 1548 CG ARG A 99 4.606 9.902 -5.319 1.00 0.70 C ATOM 1549 CD ARG A 99 3.378 10.607 -5.869 1.00 1.40 C ATOM 1550 NE ARG A 99 3.717 11.482 -6.989 1.00 1.74 N ATOM 1551 CZ ARG A 99 2.927 12.451 -7.447 1.00 2.46 C ATOM 1552 NH1 ARG A 99 1.700 12.598 -6.968 1.00 3.06 N ATOM 1553 NH2 ARG A 99 3.348 13.251 -8.415 1.00 2.98 N ATOM 0 H ARG A 99 1.799 9.185 -3.902 1.00 0.26 H new ATOM 0 HA ARG A 99 3.583 7.483 -5.308 1.00 0.25 H new ATOM 0 HB2 ARG A 99 3.832 9.727 -3.329 1.00 0.30 H new ATOM 0 HB3 ARG A 99 5.236 8.726 -3.643 1.00 0.30 H new ATOM 0 HG2 ARG A 99 5.370 10.642 -5.081 1.00 0.70 H new ATOM 0 HG3 ARG A 99 5.022 9.250 -6.088 1.00 0.70 H new ATOM 0 HD2 ARG A 99 2.647 9.866 -6.193 1.00 1.40 H new ATOM 0 HD3 ARG A 99 2.909 11.192 -5.078 1.00 1.40 H new ATOM 0 HE ARG A 99 4.616 11.342 -7.449 1.00 1.74 H new ATOM 0 HH11 ARG A 99 1.356 11.967 -6.244 1.00 3.06 H new ATOM 0 HH12 ARG A 99 1.100 13.342 -7.323 1.00 3.06 H new ATOM 0 HH21 ARG A 99 4.279 13.126 -8.811 1.00 2.98 H new ATOM 0 HH22 ARG A 99 2.741 13.993 -8.764 1.00 2.98 H new ATOM 1567 N ILE A 100 2.971 6.874 -2.151 1.00 0.22 N ATOM 1568 CA ILE A 100 3.096 5.878 -1.106 1.00 0.21 C ATOM 1569 C ILE A 100 2.571 4.544 -1.614 1.00 0.20 C ATOM 1570 O ILE A 100 3.219 3.510 -1.467 1.00 0.19 O ATOM 1571 CB ILE A 100 2.323 6.300 0.162 1.00 0.24 C ATOM 1572 CG1 ILE A 100 2.889 7.612 0.714 1.00 0.26 C ATOM 1573 CG2 ILE A 100 2.380 5.203 1.214 1.00 0.24 C ATOM 1574 CD1 ILE A 100 2.309 8.015 2.050 1.00 0.30 C ATOM 0 H ILE A 100 2.305 7.619 -1.945 1.00 0.22 H new ATOM 0 HA ILE A 100 4.149 5.784 -0.842 1.00 0.21 H new ATOM 0 HB ILE A 100 1.278 6.459 -0.104 1.00 0.24 H new ATOM 0 HG12 ILE A 100 3.970 7.517 0.812 1.00 0.26 H new ATOM 0 HG13 ILE A 100 2.703 8.408 -0.007 1.00 0.26 H new ATOM 0 HG21 ILE A 100 1.829 5.520 2.100 1.00 0.24 H new ATOM 0 HG22 ILE A 100 1.933 4.293 0.815 1.00 0.24 H new ATOM 0 HG23 ILE A 100 3.419 5.010 1.482 1.00 0.24 H new ATOM 0 HD11 ILE A 100 2.759 8.953 2.374 1.00 0.30 H new ATOM 0 HD12 ILE A 100 1.231 8.144 1.955 1.00 0.30 H new ATOM 0 HD13 ILE A 100 2.518 7.239 2.786 1.00 0.30 H new ATOM 1586 N VAL A 101 1.400 4.589 -2.236 1.00 0.21 N ATOM 1587 CA VAL A 101 0.802 3.409 -2.837 1.00 0.21 C ATOM 1588 C VAL A 101 1.753 2.803 -3.857 1.00 0.20 C ATOM 1589 O VAL A 101 2.036 1.604 -3.829 1.00 0.21 O ATOM 1590 CB VAL A 101 -0.517 3.757 -3.542 1.00 0.25 C ATOM 1591 CG1 VAL A 101 -1.199 2.500 -4.044 1.00 0.29 C ATOM 1592 CG2 VAL A 101 -1.428 4.533 -2.614 1.00 0.26 C ATOM 0 H VAL A 101 0.844 5.438 -2.337 1.00 0.21 H new ATOM 0 HA VAL A 101 0.603 2.695 -2.038 1.00 0.21 H new ATOM 0 HB VAL A 101 -0.293 4.388 -4.402 1.00 0.25 H new ATOM 0 HG11 VAL A 101 -2.132 2.766 -4.541 1.00 0.29 H new ATOM 0 HG12 VAL A 101 -0.545 1.988 -4.750 1.00 0.29 H new ATOM 0 HG13 VAL A 101 -1.411 1.840 -3.203 1.00 0.29 H new ATOM 0 HG21 VAL A 101 -2.358 4.771 -3.131 1.00 0.26 H new ATOM 0 HG22 VAL A 101 -1.647 3.931 -1.732 1.00 0.26 H new ATOM 0 HG23 VAL A 101 -0.936 5.457 -2.310 1.00 0.26 H new ATOM 1602 N ALA A 102 2.239 3.650 -4.753 1.00 0.19 N ATOM 1603 CA ALA A 102 3.173 3.232 -5.782 1.00 0.19 C ATOM 1604 C ALA A 102 4.415 2.606 -5.165 1.00 0.17 C ATOM 1605 O ALA A 102 4.839 1.527 -5.573 1.00 0.19 O ATOM 1606 CB ALA A 102 3.547 4.418 -6.655 1.00 0.21 C ATOM 0 H ALA A 102 1.997 4.640 -4.785 1.00 0.19 H new ATOM 0 HA ALA A 102 2.692 2.476 -6.403 1.00 0.19 H new ATOM 0 HB1 ALA A 102 4.248 4.096 -7.425 1.00 0.21 H new ATOM 0 HB2 ALA A 102 2.650 4.820 -7.126 1.00 0.21 H new ATOM 0 HB3 ALA A 102 4.011 5.190 -6.041 1.00 0.21 H new ATOM 1612 N PHE A 103 4.970 3.278 -4.162 1.00 0.16 N ATOM 1613 CA PHE A 103 6.177 2.813 -3.482 1.00 0.17 C ATOM 1614 C PHE A 103 5.977 1.412 -2.915 1.00 0.17 C ATOM 1615 O PHE A 103 6.842 0.544 -3.050 1.00 0.21 O ATOM 1616 CB PHE A 103 6.561 3.786 -2.359 1.00 0.17 C ATOM 1617 CG PHE A 103 7.767 3.358 -1.568 1.00 0.19 C ATOM 1618 CD1 PHE A 103 9.016 3.272 -2.166 1.00 0.29 C ATOM 1619 CD2 PHE A 103 7.650 3.041 -0.228 1.00 0.17 C ATOM 1620 CE1 PHE A 103 10.121 2.878 -1.439 1.00 0.32 C ATOM 1621 CE2 PHE A 103 8.751 2.647 0.505 1.00 0.20 C ATOM 1622 CZ PHE A 103 9.998 2.569 -0.115 1.00 0.26 C ATOM 0 H PHE A 103 4.600 4.156 -3.798 1.00 0.16 H new ATOM 0 HA PHE A 103 6.986 2.775 -4.212 1.00 0.17 H new ATOM 0 HB2 PHE A 103 6.752 4.768 -2.792 1.00 0.17 H new ATOM 0 HB3 PHE A 103 5.714 3.896 -1.681 1.00 0.17 H new ATOM 0 HD1 PHE A 103 9.125 3.516 -3.212 1.00 0.29 H new ATOM 0 HD2 PHE A 103 6.684 3.102 0.252 1.00 0.17 H new ATOM 0 HE1 PHE A 103 11.086 2.814 -1.919 1.00 0.32 H new ATOM 0 HE2 PHE A 103 8.648 2.401 1.551 1.00 0.20 H new ATOM 0 HZ PHE A 103 10.865 2.264 0.452 1.00 0.26 H new ATOM 1632 N PHE A 104 4.827 1.195 -2.299 1.00 0.16 N ATOM 1633 CA PHE A 104 4.520 -0.093 -1.699 1.00 0.18 C ATOM 1634 C PHE A 104 4.277 -1.145 -2.777 1.00 0.19 C ATOM 1635 O PHE A 104 4.709 -2.291 -2.647 1.00 0.23 O ATOM 1636 CB PHE A 104 3.304 0.022 -0.773 1.00 0.19 C ATOM 1637 CG PHE A 104 3.609 0.630 0.575 1.00 0.21 C ATOM 1638 CD1 PHE A 104 4.353 1.799 0.691 1.00 0.24 C ATOM 1639 CD2 PHE A 104 3.152 0.023 1.733 1.00 0.29 C ATOM 1640 CE1 PHE A 104 4.628 2.343 1.930 1.00 0.27 C ATOM 1641 CE2 PHE A 104 3.426 0.565 2.973 1.00 0.33 C ATOM 1642 CZ PHE A 104 4.164 1.727 3.071 1.00 0.30 C ATOM 0 H PHE A 104 4.090 1.894 -2.201 1.00 0.16 H new ATOM 0 HA PHE A 104 5.377 -0.407 -1.103 1.00 0.18 H new ATOM 0 HB2 PHE A 104 2.541 0.624 -1.267 1.00 0.19 H new ATOM 0 HB3 PHE A 104 2.880 -0.971 -0.624 1.00 0.19 H new ATOM 0 HD1 PHE A 104 4.720 2.288 -0.199 1.00 0.24 H new ATOM 0 HD2 PHE A 104 2.574 -0.886 1.665 1.00 0.29 H new ATOM 0 HE1 PHE A 104 5.207 3.252 2.004 1.00 0.27 H new ATOM 0 HE2 PHE A 104 3.063 0.079 3.867 1.00 0.33 H new ATOM 0 HZ PHE A 104 4.377 2.152 4.041 1.00 0.30 H new ATOM 1652 N SER A 105 3.609 -0.742 -3.850 1.00 0.18 N ATOM 1653 CA SER A 105 3.312 -1.647 -4.949 1.00 0.21 C ATOM 1654 C SER A 105 4.602 -2.098 -5.642 1.00 0.21 C ATOM 1655 O SER A 105 4.703 -3.239 -6.101 1.00 0.23 O ATOM 1656 CB SER A 105 2.366 -0.970 -5.948 1.00 0.25 C ATOM 1657 OG SER A 105 1.826 -1.904 -6.871 1.00 1.04 O ATOM 0 H SER A 105 3.262 0.208 -3.981 1.00 0.18 H new ATOM 0 HA SER A 105 2.818 -2.532 -4.548 1.00 0.21 H new ATOM 0 HB2 SER A 105 1.555 -0.481 -5.408 1.00 0.25 H new ATOM 0 HB3 SER A 105 2.904 -0.192 -6.489 1.00 0.25 H new ATOM 0 HG SER A 105 2.461 -2.044 -7.604 1.00 1.04 H new ATOM 1663 N PHE A 106 5.593 -1.206 -5.699 1.00 0.20 N ATOM 1664 CA PHE A 106 6.873 -1.534 -6.323 1.00 0.21 C ATOM 1665 C PHE A 106 7.569 -2.632 -5.537 1.00 0.22 C ATOM 1666 O PHE A 106 8.013 -3.624 -6.111 1.00 0.24 O ATOM 1667 CB PHE A 106 7.795 -0.309 -6.403 1.00 0.23 C ATOM 1668 CG PHE A 106 7.265 0.827 -7.233 1.00 0.24 C ATOM 1669 CD1 PHE A 106 6.368 0.605 -8.267 1.00 0.30 C ATOM 1670 CD2 PHE A 106 7.677 2.126 -6.978 1.00 0.27 C ATOM 1671 CE1 PHE A 106 5.890 1.657 -9.026 1.00 0.35 C ATOM 1672 CE2 PHE A 106 7.204 3.179 -7.733 1.00 0.30 C ATOM 1673 CZ PHE A 106 6.309 2.944 -8.757 1.00 0.33 C ATOM 0 H PHE A 106 5.534 -0.259 -5.324 1.00 0.20 H new ATOM 0 HA PHE A 106 6.665 -1.875 -7.337 1.00 0.21 H new ATOM 0 HB2 PHE A 106 7.981 0.054 -5.392 1.00 0.23 H new ATOM 0 HB3 PHE A 106 8.756 -0.621 -6.812 1.00 0.23 H new ATOM 0 HD1 PHE A 106 6.039 -0.401 -8.482 1.00 0.30 H new ATOM 0 HD2 PHE A 106 8.377 2.316 -6.178 1.00 0.27 H new ATOM 0 HE1 PHE A 106 5.190 1.472 -9.828 1.00 0.35 H new ATOM 0 HE2 PHE A 106 7.534 4.186 -7.523 1.00 0.30 H new ATOM 0 HZ PHE A 106 5.936 3.768 -9.348 1.00 0.33 H new ATOM 1683 N GLY A 107 7.639 -2.454 -4.221 1.00 0.23 N ATOM 1684 CA GLY A 107 8.310 -3.417 -3.371 1.00 0.27 C ATOM 1685 C GLY A 107 7.727 -4.807 -3.496 1.00 0.32 C ATOM 1686 O GLY A 107 8.457 -5.796 -3.463 1.00 0.37 O ATOM 0 H GLY A 107 7.240 -1.655 -3.728 1.00 0.23 H new ATOM 0 HA2 GLY A 107 9.369 -3.447 -3.627 1.00 0.27 H new ATOM 0 HA3 GLY A 107 8.242 -3.090 -2.333 1.00 0.27 H new ATOM 1690 N GLY A 108 6.410 -4.880 -3.639 1.00 0.33 N ATOM 1691 CA GLY A 108 5.751 -6.157 -3.827 1.00 0.41 C ATOM 1692 C GLY A 108 6.232 -6.864 -5.077 1.00 0.42 C ATOM 1693 O GLY A 108 6.537 -8.058 -5.047 1.00 0.63 O ATOM 0 H GLY A 108 5.785 -4.074 -3.628 1.00 0.33 H new ATOM 0 HA2 GLY A 108 5.933 -6.791 -2.959 1.00 0.41 H new ATOM 0 HA3 GLY A 108 4.674 -6.004 -3.889 1.00 0.41 H new ATOM 1697 N ALA A 109 6.323 -6.117 -6.170 1.00 0.27 N ATOM 1698 CA ALA A 109 6.804 -6.658 -7.432 1.00 0.26 C ATOM 1699 C ALA A 109 8.276 -7.026 -7.325 1.00 0.23 C ATOM 1700 O ALA A 109 8.723 -8.029 -7.886 1.00 0.24 O ATOM 1701 CB ALA A 109 6.593 -5.648 -8.544 1.00 0.29 C ATOM 0 H ALA A 109 6.068 -5.130 -6.206 1.00 0.27 H new ATOM 0 HA ALA A 109 6.239 -7.561 -7.664 1.00 0.26 H new ATOM 0 HB1 ALA A 109 6.956 -6.062 -9.485 1.00 0.29 H new ATOM 0 HB2 ALA A 109 5.531 -5.422 -8.633 1.00 0.29 H new ATOM 0 HB3 ALA A 109 7.141 -4.734 -8.314 1.00 0.29 H new ATOM 1707 N LEU A 110 9.015 -6.209 -6.588 1.00 0.22 N ATOM 1708 CA LEU A 110 10.426 -6.444 -6.347 1.00 0.23 C ATOM 1709 C LEU A 110 10.627 -7.756 -5.616 1.00 0.21 C ATOM 1710 O LEU A 110 11.501 -8.545 -5.962 1.00 0.21 O ATOM 1711 CB LEU A 110 11.013 -5.299 -5.529 1.00 0.25 C ATOM 1712 CG LEU A 110 10.981 -3.942 -6.217 1.00 0.28 C ATOM 1713 CD1 LEU A 110 11.550 -2.877 -5.302 1.00 0.32 C ATOM 1714 CD2 LEU A 110 11.748 -3.999 -7.526 1.00 0.36 C ATOM 0 H LEU A 110 8.651 -5.367 -6.142 1.00 0.22 H new ATOM 0 HA LEU A 110 10.939 -6.497 -7.308 1.00 0.23 H new ATOM 0 HB2 LEU A 110 10.468 -5.227 -4.588 1.00 0.25 H new ATOM 0 HB3 LEU A 110 12.047 -5.541 -5.281 1.00 0.25 H new ATOM 0 HG LEU A 110 9.946 -3.682 -6.440 1.00 0.28 H new ATOM 0 HD11 LEU A 110 11.521 -1.911 -5.806 1.00 0.32 H new ATOM 0 HD12 LEU A 110 10.957 -2.827 -4.389 1.00 0.32 H new ATOM 0 HD13 LEU A 110 12.581 -3.125 -5.052 1.00 0.32 H new ATOM 0 HD21 LEU A 110 11.718 -3.022 -8.008 1.00 0.36 H new ATOM 0 HD22 LEU A 110 12.784 -4.274 -7.329 1.00 0.36 H new ATOM 0 HD23 LEU A 110 11.294 -4.742 -8.182 1.00 0.36 H new ATOM 1726 N CYS A 111 9.808 -7.982 -4.599 1.00 0.21 N ATOM 1727 CA CYS A 111 9.870 -9.213 -3.830 1.00 0.21 C ATOM 1728 C CYS A 111 9.635 -10.423 -4.721 1.00 0.21 C ATOM 1729 O CYS A 111 10.305 -11.449 -4.586 1.00 0.25 O ATOM 1730 CB CYS A 111 8.843 -9.181 -2.704 1.00 0.22 C ATOM 1731 SG CYS A 111 9.162 -7.907 -1.468 1.00 1.34 S ATOM 0 H CYS A 111 9.091 -7.326 -4.288 1.00 0.21 H new ATOM 0 HA CYS A 111 10.868 -9.296 -3.399 1.00 0.21 H new ATOM 0 HB2 CYS A 111 7.853 -9.020 -3.131 1.00 0.22 H new ATOM 0 HB3 CYS A 111 8.824 -10.154 -2.213 1.00 0.22 H new ATOM 0 HG CYS A 111 8.952 -6.735 -1.989 1.00 1.34 H new ATOM 1737 N VAL A 112 8.702 -10.287 -5.651 1.00 0.19 N ATOM 1738 CA VAL A 112 8.385 -11.361 -6.571 1.00 0.20 C ATOM 1739 C VAL A 112 9.580 -11.672 -7.457 1.00 0.22 C ATOM 1740 O VAL A 112 10.064 -12.803 -7.477 1.00 0.25 O ATOM 1741 CB VAL A 112 7.178 -11.004 -7.452 1.00 0.23 C ATOM 1742 CG1 VAL A 112 6.936 -12.092 -8.484 1.00 0.27 C ATOM 1743 CG2 VAL A 112 5.941 -10.798 -6.595 1.00 0.25 C ATOM 0 H VAL A 112 8.151 -9.439 -5.786 1.00 0.19 H new ATOM 0 HA VAL A 112 8.134 -12.239 -5.975 1.00 0.20 H new ATOM 0 HB VAL A 112 7.393 -10.073 -7.977 1.00 0.23 H new ATOM 0 HG11 VAL A 112 6.078 -11.824 -9.100 1.00 0.27 H new ATOM 0 HG12 VAL A 112 7.818 -12.197 -9.116 1.00 0.27 H new ATOM 0 HG13 VAL A 112 6.738 -13.037 -7.977 1.00 0.27 H new ATOM 0 HG21 VAL A 112 5.094 -10.546 -7.233 1.00 0.25 H new ATOM 0 HG22 VAL A 112 5.722 -11.714 -6.046 1.00 0.25 H new ATOM 0 HG23 VAL A 112 6.118 -9.986 -5.890 1.00 0.25 H new ATOM 1753 N GLU A 113 10.059 -10.663 -8.176 1.00 0.22 N ATOM 1754 CA GLU A 113 11.193 -10.844 -9.078 1.00 0.25 C ATOM 1755 C GLU A 113 12.436 -11.286 -8.309 1.00 0.25 C ATOM 1756 O GLU A 113 13.306 -11.957 -8.862 1.00 0.30 O ATOM 1757 CB GLU A 113 11.478 -9.572 -9.882 1.00 0.29 C ATOM 1758 CG GLU A 113 11.832 -8.359 -9.042 1.00 0.30 C ATOM 1759 CD GLU A 113 12.169 -7.153 -9.894 1.00 0.39 C ATOM 1760 OE1 GLU A 113 11.246 -6.586 -10.511 1.00 0.51 O ATOM 1761 OE2 GLU A 113 13.361 -6.787 -9.971 1.00 0.50 O ATOM 0 H GLU A 113 9.683 -9.715 -8.153 1.00 0.22 H new ATOM 0 HA GLU A 113 10.928 -11.631 -9.784 1.00 0.25 H new ATOM 0 HB2 GLU A 113 12.297 -9.771 -10.573 1.00 0.29 H new ATOM 0 HB3 GLU A 113 10.602 -9.336 -10.486 1.00 0.29 H new ATOM 0 HG2 GLU A 113 10.996 -8.116 -8.386 1.00 0.30 H new ATOM 0 HG3 GLU A 113 12.681 -8.598 -8.401 1.00 0.30 H new ATOM 1768 N SER A 114 12.504 -10.932 -7.031 1.00 0.23 N ATOM 1769 CA SER A 114 13.590 -11.386 -6.181 1.00 0.28 C ATOM 1770 C SER A 114 13.536 -12.896 -6.026 1.00 0.27 C ATOM 1771 O SER A 114 14.508 -13.589 -6.312 1.00 0.31 O ATOM 1772 CB SER A 114 13.545 -10.707 -4.811 1.00 0.33 C ATOM 1773 OG SER A 114 13.818 -9.326 -4.924 1.00 0.99 O ATOM 0 H SER A 114 11.821 -10.334 -6.565 1.00 0.23 H new ATOM 0 HA SER A 114 14.531 -11.111 -6.658 1.00 0.28 H new ATOM 0 HB2 SER A 114 12.563 -10.852 -4.361 1.00 0.33 H new ATOM 0 HB3 SER A 114 14.272 -11.172 -4.146 1.00 0.33 H new ATOM 0 HG SER A 114 13.001 -8.851 -5.184 1.00 0.99 H new ATOM 1779 N VAL A 115 12.386 -13.409 -5.617 1.00 0.28 N ATOM 1780 CA VAL A 115 12.224 -14.837 -5.417 1.00 0.33 C ATOM 1781 C VAL A 115 12.290 -15.565 -6.756 1.00 0.37 C ATOM 1782 O VAL A 115 12.833 -16.665 -6.857 1.00 0.42 O ATOM 1783 CB VAL A 115 10.892 -15.150 -4.712 1.00 0.40 C ATOM 1784 CG1 VAL A 115 10.753 -16.643 -4.462 1.00 0.45 C ATOM 1785 CG2 VAL A 115 10.795 -14.382 -3.405 1.00 0.41 C ATOM 0 H VAL A 115 11.552 -12.856 -5.418 1.00 0.28 H new ATOM 0 HA VAL A 115 13.037 -15.184 -4.779 1.00 0.33 H new ATOM 0 HB VAL A 115 10.076 -14.836 -5.363 1.00 0.40 H new ATOM 0 HG11 VAL A 115 9.805 -16.842 -3.963 1.00 0.45 H new ATOM 0 HG12 VAL A 115 10.781 -17.175 -5.413 1.00 0.45 H new ATOM 0 HG13 VAL A 115 11.574 -16.984 -3.831 1.00 0.45 H new ATOM 0 HG21 VAL A 115 9.848 -14.613 -2.917 1.00 0.41 H new ATOM 0 HG22 VAL A 115 11.619 -14.669 -2.752 1.00 0.41 H new ATOM 0 HG23 VAL A 115 10.848 -13.312 -3.607 1.00 0.41 H new ATOM 1795 N ASP A 116 11.741 -14.932 -7.782 1.00 0.38 N ATOM 1796 CA ASP A 116 11.796 -15.459 -9.143 1.00 0.46 C ATOM 1797 C ASP A 116 13.239 -15.672 -9.594 1.00 0.47 C ATOM 1798 O ASP A 116 13.571 -16.702 -10.184 1.00 0.56 O ATOM 1799 CB ASP A 116 11.072 -14.508 -10.104 1.00 0.49 C ATOM 1800 CG ASP A 116 11.299 -14.857 -11.559 1.00 1.08 C ATOM 1801 OD1 ASP A 116 10.717 -15.851 -12.036 1.00 1.23 O ATOM 1802 OD2 ASP A 116 12.051 -14.128 -12.240 1.00 1.89 O ATOM 0 H ASP A 116 11.247 -14.044 -7.699 1.00 0.38 H new ATOM 0 HA ASP A 116 11.295 -16.427 -9.154 1.00 0.46 H new ATOM 0 HB2 ASP A 116 10.003 -14.530 -9.893 1.00 0.49 H new ATOM 0 HB3 ASP A 116 11.412 -13.488 -9.923 1.00 0.49 H new ATOM 1807 N LYS A 117 14.101 -14.711 -9.289 1.00 0.43 N ATOM 1808 CA LYS A 117 15.508 -14.800 -9.667 1.00 0.49 C ATOM 1809 C LYS A 117 16.325 -15.519 -8.593 1.00 0.47 C ATOM 1810 O LYS A 117 17.555 -15.471 -8.611 1.00 0.52 O ATOM 1811 CB LYS A 117 16.091 -13.406 -9.920 1.00 0.53 C ATOM 1812 CG LYS A 117 15.457 -12.671 -11.094 1.00 0.61 C ATOM 1813 CD LYS A 117 15.564 -13.474 -12.385 1.00 1.20 C ATOM 1814 CE LYS A 117 14.980 -12.718 -13.574 1.00 1.32 C ATOM 1815 NZ LYS A 117 13.583 -12.278 -13.322 1.00 1.90 N ATOM 0 H LYS A 117 13.853 -13.862 -8.782 1.00 0.43 H new ATOM 0 HA LYS A 117 15.565 -15.379 -10.589 1.00 0.49 H new ATOM 0 HB2 LYS A 117 15.969 -12.804 -9.020 1.00 0.53 H new ATOM 0 HB3 LYS A 117 17.162 -13.499 -10.099 1.00 0.53 H new ATOM 0 HG2 LYS A 117 14.408 -12.472 -10.875 1.00 0.61 H new ATOM 0 HG3 LYS A 117 15.944 -11.705 -11.225 1.00 0.61 H new ATOM 0 HD2 LYS A 117 16.610 -13.708 -12.582 1.00 1.20 H new ATOM 0 HD3 LYS A 117 15.042 -14.424 -12.266 1.00 1.20 H new ATOM 0 HE2 LYS A 117 15.600 -11.848 -13.791 1.00 1.32 H new ATOM 0 HE3 LYS A 117 15.005 -13.356 -14.457 1.00 1.32 H new ATOM 0 HZ1 LYS A 117 13.030 -12.358 -14.199 1.00 1.90 H new ATOM 0 HZ2 LYS A 117 13.157 -12.879 -12.588 1.00 1.90 H new ATOM 0 HZ3 LYS A 117 13.583 -11.288 -13.002 1.00 1.90 H new ATOM 1829 N GLU A 118 15.626 -16.174 -7.662 1.00 0.45 N ATOM 1830 CA GLU A 118 16.261 -16.977 -6.614 1.00 0.49 C ATOM 1831 C GLU A 118 17.101 -16.094 -5.684 1.00 0.45 C ATOM 1832 O GLU A 118 18.094 -16.527 -5.098 1.00 0.55 O ATOM 1833 CB GLU A 118 17.102 -18.089 -7.253 1.00 0.59 C ATOM 1834 CG GLU A 118 17.532 -19.177 -6.287 1.00 1.07 C ATOM 1835 CD GLU A 118 18.078 -20.390 -7.002 1.00 1.72 C ATOM 1836 OE1 GLU A 118 19.252 -20.350 -7.429 1.00 1.89 O ATOM 1837 OE2 GLU A 118 17.347 -21.394 -7.127 1.00 2.54 O ATOM 0 H GLU A 118 14.607 -16.163 -7.614 1.00 0.45 H new ATOM 0 HA GLU A 118 15.488 -17.442 -6.002 1.00 0.49 H new ATOM 0 HB2 GLU A 118 16.530 -18.543 -8.062 1.00 0.59 H new ATOM 0 HB3 GLU A 118 17.991 -17.645 -7.701 1.00 0.59 H new ATOM 0 HG2 GLU A 118 18.292 -18.782 -5.612 1.00 1.07 H new ATOM 0 HG3 GLU A 118 16.682 -19.472 -5.672 1.00 1.07 H new ATOM 1844 N MET A 119 16.659 -14.858 -5.528 1.00 0.35 N ATOM 1845 CA MET A 119 17.328 -13.897 -4.669 1.00 0.33 C ATOM 1846 C MET A 119 16.528 -13.723 -3.384 1.00 0.31 C ATOM 1847 O MET A 119 15.979 -12.654 -3.111 1.00 0.27 O ATOM 1848 CB MET A 119 17.472 -12.551 -5.385 1.00 0.34 C ATOM 1849 CG MET A 119 18.102 -12.657 -6.764 1.00 0.41 C ATOM 1850 SD MET A 119 18.193 -11.069 -7.614 1.00 0.47 S ATOM 1851 CE MET A 119 16.494 -10.518 -7.500 1.00 0.44 C ATOM 0 H MET A 119 15.828 -14.493 -5.993 1.00 0.35 H new ATOM 0 HA MET A 119 18.324 -14.267 -4.428 1.00 0.33 H new ATOM 0 HB2 MET A 119 16.488 -12.092 -5.479 1.00 0.34 H new ATOM 0 HB3 MET A 119 18.076 -11.885 -4.769 1.00 0.34 H new ATOM 0 HG2 MET A 119 19.106 -13.071 -6.669 1.00 0.41 H new ATOM 0 HG3 MET A 119 17.525 -13.356 -7.370 1.00 0.41 H new ATOM 0 HE1 MET A 119 16.223 -9.984 -8.411 1.00 0.44 H new ATOM 0 HE2 MET A 119 15.839 -11.381 -7.377 1.00 0.44 H new ATOM 0 HE3 MET A 119 16.384 -9.853 -6.643 1.00 0.44 H new ATOM 1861 N GLN A 120 16.456 -14.789 -2.605 1.00 0.36 N ATOM 1862 CA GLN A 120 15.662 -14.805 -1.383 1.00 0.39 C ATOM 1863 C GLN A 120 16.311 -13.963 -0.288 1.00 0.41 C ATOM 1864 O GLN A 120 15.661 -13.583 0.680 1.00 0.47 O ATOM 1865 CB GLN A 120 15.466 -16.243 -0.903 1.00 0.49 C ATOM 1866 CG GLN A 120 14.657 -17.104 -1.869 1.00 0.53 C ATOM 1867 CD GLN A 120 14.592 -18.558 -1.443 1.00 0.65 C ATOM 1868 OE1 GLN A 120 14.667 -18.874 -0.256 1.00 0.71 O ATOM 1869 NE2 GLN A 120 14.444 -19.457 -2.406 1.00 0.70 N ATOM 0 H GLN A 120 16.943 -15.664 -2.798 1.00 0.36 H new ATOM 0 HA GLN A 120 14.689 -14.368 -1.606 1.00 0.39 H new ATOM 0 HB2 GLN A 120 16.442 -16.703 -0.750 1.00 0.49 H new ATOM 0 HB3 GLN A 120 14.965 -16.229 0.065 1.00 0.49 H new ATOM 0 HG2 GLN A 120 13.645 -16.706 -1.944 1.00 0.53 H new ATOM 0 HG3 GLN A 120 15.099 -17.040 -2.863 1.00 0.53 H new ATOM 0 HE21 GLN A 120 14.386 -19.157 -3.379 1.00 0.70 H new ATOM 0 HE22 GLN A 120 14.389 -20.449 -2.174 1.00 0.70 H new ATOM 1878 N VAL A 121 17.592 -13.671 -0.441 1.00 0.39 N ATOM 1879 CA VAL A 121 18.277 -12.790 0.491 1.00 0.44 C ATOM 1880 C VAL A 121 17.898 -11.335 0.236 1.00 0.38 C ATOM 1881 O VAL A 121 17.986 -10.491 1.126 1.00 0.47 O ATOM 1882 CB VAL A 121 19.807 -12.941 0.407 1.00 0.52 C ATOM 1883 CG1 VAL A 121 20.231 -14.326 0.859 1.00 0.98 C ATOM 1884 CG2 VAL A 121 20.301 -12.667 -1.003 1.00 0.92 C ATOM 0 H VAL A 121 18.176 -14.029 -1.197 1.00 0.39 H new ATOM 0 HA VAL A 121 17.959 -13.080 1.492 1.00 0.44 H new ATOM 0 HB VAL A 121 20.258 -12.206 1.074 1.00 0.52 H new ATOM 0 HG11 VAL A 121 21.315 -14.414 0.793 1.00 0.98 H new ATOM 0 HG12 VAL A 121 19.916 -14.484 1.891 1.00 0.98 H new ATOM 0 HG13 VAL A 121 19.766 -15.076 0.219 1.00 0.98 H new ATOM 0 HG21 VAL A 121 21.385 -12.780 -1.037 1.00 0.92 H new ATOM 0 HG22 VAL A 121 19.841 -13.374 -1.694 1.00 0.92 H new ATOM 0 HG23 VAL A 121 20.033 -11.651 -1.291 1.00 0.92 H new ATOM 1894 N LEU A 122 17.454 -11.054 -0.982 1.00 0.30 N ATOM 1895 CA LEU A 122 17.098 -9.700 -1.373 1.00 0.27 C ATOM 1896 C LEU A 122 15.691 -9.333 -0.922 1.00 0.23 C ATOM 1897 O LEU A 122 15.443 -8.197 -0.527 1.00 0.23 O ATOM 1898 CB LEU A 122 17.237 -9.516 -2.884 1.00 0.28 C ATOM 1899 CG LEU A 122 18.595 -8.981 -3.348 1.00 0.37 C ATOM 1900 CD1 LEU A 122 19.729 -9.846 -2.830 1.00 0.39 C ATOM 1901 CD2 LEU A 122 18.640 -8.905 -4.860 1.00 0.41 C ATOM 0 H LEU A 122 17.332 -11.750 -1.718 1.00 0.30 H new ATOM 0 HA LEU A 122 17.793 -9.026 -0.873 1.00 0.27 H new ATOM 0 HB2 LEU A 122 17.056 -10.475 -3.370 1.00 0.28 H new ATOM 0 HB3 LEU A 122 16.459 -8.833 -3.225 1.00 0.28 H new ATOM 0 HG LEU A 122 18.721 -7.978 -2.940 1.00 0.37 H new ATOM 0 HD11 LEU A 122 20.681 -9.443 -3.175 1.00 0.39 H new ATOM 0 HD12 LEU A 122 19.712 -9.854 -1.740 1.00 0.39 H new ATOM 0 HD13 LEU A 122 19.610 -10.863 -3.202 1.00 0.39 H new ATOM 0 HD21 LEU A 122 19.611 -8.523 -5.176 1.00 0.41 H new ATOM 0 HD22 LEU A 122 18.487 -9.900 -5.279 1.00 0.41 H new ATOM 0 HD23 LEU A 122 17.855 -8.237 -5.214 1.00 0.41 H new ATOM 1913 N VAL A 123 14.778 -10.301 -0.953 1.00 0.23 N ATOM 1914 CA VAL A 123 13.385 -10.046 -0.594 1.00 0.25 C ATOM 1915 C VAL A 123 13.268 -9.557 0.852 1.00 0.27 C ATOM 1916 O VAL A 123 12.461 -8.678 1.162 1.00 0.31 O ATOM 1917 CB VAL A 123 12.498 -11.296 -0.810 1.00 0.28 C ATOM 1918 CG1 VAL A 123 12.951 -12.464 0.053 1.00 0.31 C ATOM 1919 CG2 VAL A 123 11.042 -10.970 -0.538 1.00 0.31 C ATOM 0 H VAL A 123 14.976 -11.265 -1.222 1.00 0.23 H new ATOM 0 HA VAL A 123 13.024 -9.260 -1.257 1.00 0.25 H new ATOM 0 HB VAL A 123 12.603 -11.596 -1.853 1.00 0.28 H new ATOM 0 HG11 VAL A 123 12.304 -13.322 -0.127 1.00 0.31 H new ATOM 0 HG12 VAL A 123 13.979 -12.726 -0.199 1.00 0.31 H new ATOM 0 HG13 VAL A 123 12.896 -12.182 1.105 1.00 0.31 H new ATOM 0 HG21 VAL A 123 10.434 -11.861 -0.695 1.00 0.31 H new ATOM 0 HG22 VAL A 123 10.931 -10.632 0.492 1.00 0.31 H new ATOM 0 HG23 VAL A 123 10.713 -10.182 -1.216 1.00 0.31 H new ATOM 1929 N SER A 124 14.106 -10.106 1.719 1.00 0.29 N ATOM 1930 CA SER A 124 14.115 -9.727 3.124 1.00 0.35 C ATOM 1931 C SER A 124 14.589 -8.286 3.291 1.00 0.34 C ATOM 1932 O SER A 124 14.158 -7.575 4.200 1.00 0.44 O ATOM 1933 CB SER A 124 15.035 -10.668 3.903 1.00 0.43 C ATOM 1934 OG SER A 124 14.730 -12.020 3.612 1.00 1.32 O ATOM 0 H SER A 124 14.792 -10.819 1.472 1.00 0.29 H new ATOM 0 HA SER A 124 13.100 -9.804 3.513 1.00 0.35 H new ATOM 0 HB2 SER A 124 16.075 -10.462 3.648 1.00 0.43 H new ATOM 0 HB3 SER A 124 14.927 -10.488 4.973 1.00 0.43 H new ATOM 0 HG SER A 124 15.330 -12.607 4.118 1.00 1.32 H new ATOM 1940 N ARG A 125 15.461 -7.855 2.392 1.00 0.28 N ATOM 1941 CA ARG A 125 16.045 -6.527 2.477 1.00 0.31 C ATOM 1942 C ARG A 125 15.151 -5.504 1.799 1.00 0.24 C ATOM 1943 O ARG A 125 15.209 -4.323 2.111 1.00 0.24 O ATOM 1944 CB ARG A 125 17.443 -6.525 1.857 1.00 0.41 C ATOM 1945 CG ARG A 125 18.382 -7.516 2.532 1.00 0.91 C ATOM 1946 CD ARG A 125 19.725 -7.631 1.830 1.00 0.74 C ATOM 1947 NE ARG A 125 20.517 -8.717 2.397 1.00 1.01 N ATOM 1948 CZ ARG A 125 21.341 -9.484 1.694 1.00 1.24 C ATOM 1949 NH1 ARG A 125 21.543 -9.237 0.405 1.00 1.28 N ATOM 1950 NH2 ARG A 125 21.975 -10.485 2.288 1.00 1.84 N ATOM 0 H ARG A 125 15.779 -8.407 1.595 1.00 0.28 H new ATOM 0 HA ARG A 125 16.133 -6.251 3.528 1.00 0.31 H new ATOM 0 HB2 ARG A 125 17.367 -6.766 0.797 1.00 0.41 H new ATOM 0 HB3 ARG A 125 17.866 -5.523 1.927 1.00 0.41 H new ATOM 0 HG2 ARG A 125 18.543 -7.210 3.566 1.00 0.91 H new ATOM 0 HG3 ARG A 125 17.907 -8.497 2.560 1.00 0.91 H new ATOM 0 HD2 ARG A 125 19.570 -7.806 0.765 1.00 0.74 H new ATOM 0 HD3 ARG A 125 20.270 -6.691 1.922 1.00 0.74 H new ATOM 0 HE ARG A 125 20.432 -8.898 3.397 1.00 1.01 H new ATOM 0 HH11 ARG A 125 21.065 -8.457 -0.046 1.00 1.28 H new ATOM 0 HH12 ARG A 125 22.177 -9.827 -0.134 1.00 1.28 H new ATOM 0 HH21 ARG A 125 21.829 -10.663 3.282 1.00 1.84 H new ATOM 0 HH22 ARG A 125 22.609 -11.077 1.752 1.00 1.84 H new ATOM 1964 N ILE A 126 14.314 -5.965 0.880 1.00 0.21 N ATOM 1965 CA ILE A 126 13.334 -5.100 0.242 1.00 0.19 C ATOM 1966 C ILE A 126 12.424 -4.477 1.291 1.00 0.19 C ATOM 1967 O ILE A 126 12.254 -3.256 1.339 1.00 0.19 O ATOM 1968 CB ILE A 126 12.498 -5.889 -0.783 1.00 0.19 C ATOM 1969 CG1 ILE A 126 13.382 -6.296 -1.957 1.00 0.20 C ATOM 1970 CG2 ILE A 126 11.309 -5.074 -1.261 1.00 0.20 C ATOM 1971 CD1 ILE A 126 12.683 -7.150 -2.982 1.00 0.23 C ATOM 0 H ILE A 126 14.295 -6.933 0.560 1.00 0.21 H new ATOM 0 HA ILE A 126 13.865 -4.307 -0.284 1.00 0.19 H new ATOM 0 HB ILE A 126 12.108 -6.786 -0.302 1.00 0.19 H new ATOM 0 HG12 ILE A 126 13.759 -5.397 -2.444 1.00 0.20 H new ATOM 0 HG13 ILE A 126 14.247 -6.838 -1.576 1.00 0.20 H new ATOM 0 HG21 ILE A 126 10.736 -5.655 -1.984 1.00 0.20 H new ATOM 0 HG22 ILE A 126 10.674 -4.824 -0.411 1.00 0.20 H new ATOM 0 HG23 ILE A 126 11.662 -4.157 -1.732 1.00 0.20 H new ATOM 0 HD11 ILE A 126 13.378 -7.397 -3.784 1.00 0.23 H new ATOM 0 HD12 ILE A 126 12.330 -8.068 -2.511 1.00 0.23 H new ATOM 0 HD13 ILE A 126 11.834 -6.604 -3.393 1.00 0.23 H new ATOM 1983 N ALA A 127 11.858 -5.325 2.144 1.00 0.22 N ATOM 1984 CA ALA A 127 11.038 -4.865 3.253 1.00 0.25 C ATOM 1985 C ALA A 127 11.814 -3.897 4.134 1.00 0.24 C ATOM 1986 O ALA A 127 11.277 -2.887 4.586 1.00 0.26 O ATOM 1987 CB ALA A 127 10.551 -6.047 4.075 1.00 0.30 C ATOM 0 H ALA A 127 11.955 -6.339 2.085 1.00 0.22 H new ATOM 0 HA ALA A 127 10.175 -4.340 2.844 1.00 0.25 H new ATOM 0 HB1 ALA A 127 9.938 -5.687 4.902 1.00 0.30 H new ATOM 0 HB2 ALA A 127 9.957 -6.709 3.444 1.00 0.30 H new ATOM 0 HB3 ALA A 127 11.408 -6.594 4.469 1.00 0.30 H new ATOM 1993 N ALA A 128 13.085 -4.206 4.352 1.00 0.22 N ATOM 1994 CA ALA A 128 13.946 -3.376 5.176 1.00 0.23 C ATOM 1995 C ALA A 128 14.159 -2.005 4.541 1.00 0.19 C ATOM 1996 O ALA A 128 14.012 -0.977 5.201 1.00 0.19 O ATOM 1997 CB ALA A 128 15.278 -4.068 5.407 1.00 0.27 C ATOM 0 H ALA A 128 13.543 -5.032 3.966 1.00 0.22 H new ATOM 0 HA ALA A 128 13.456 -3.227 6.138 1.00 0.23 H new ATOM 0 HB1 ALA A 128 15.914 -3.435 6.026 1.00 0.27 H new ATOM 0 HB2 ALA A 128 15.111 -5.019 5.912 1.00 0.27 H new ATOM 0 HB3 ALA A 128 15.766 -4.247 4.449 1.00 0.27 H new ATOM 2003 N TRP A 129 14.488 -1.996 3.254 1.00 0.17 N ATOM 2004 CA TRP A 129 14.747 -0.749 2.537 1.00 0.17 C ATOM 2005 C TRP A 129 13.487 0.099 2.454 1.00 0.15 C ATOM 2006 O TRP A 129 13.538 1.315 2.641 1.00 0.18 O ATOM 2007 CB TRP A 129 15.290 -1.018 1.128 1.00 0.20 C ATOM 2008 CG TRP A 129 16.593 -1.755 1.121 1.00 0.24 C ATOM 2009 CD1 TRP A 129 17.538 -1.761 2.106 1.00 0.27 C ATOM 2010 CD2 TRP A 129 17.101 -2.586 0.071 1.00 0.31 C ATOM 2011 NE1 TRP A 129 18.596 -2.554 1.739 1.00 0.33 N ATOM 2012 CE2 TRP A 129 18.354 -3.070 0.492 1.00 0.36 C ATOM 2013 CE3 TRP A 129 16.617 -2.970 -1.182 1.00 0.37 C ATOM 2014 CZ2 TRP A 129 19.129 -3.919 -0.295 1.00 0.45 C ATOM 2015 CZ3 TRP A 129 17.385 -3.812 -1.964 1.00 0.47 C ATOM 2016 CH2 TRP A 129 18.630 -4.279 -1.517 1.00 0.50 C ATOM 0 H TRP A 129 14.582 -2.837 2.684 1.00 0.17 H new ATOM 0 HA TRP A 129 15.504 -0.201 3.098 1.00 0.17 H new ATOM 0 HB2 TRP A 129 14.553 -1.593 0.567 1.00 0.20 H new ATOM 0 HB3 TRP A 129 15.416 -0.068 0.608 1.00 0.20 H new ATOM 0 HD1 TRP A 129 17.464 -1.221 3.038 1.00 0.27 H new ATOM 0 HE1 TRP A 129 19.428 -2.731 2.303 1.00 0.33 H new ATOM 0 HE3 TRP A 129 15.659 -2.615 -1.533 1.00 0.37 H new ATOM 0 HZ2 TRP A 129 20.088 -4.280 0.047 1.00 0.45 H new ATOM 0 HZ3 TRP A 129 17.021 -4.115 -2.935 1.00 0.47 H new ATOM 0 HH2 TRP A 129 19.207 -4.936 -2.151 1.00 0.50 H new ATOM 2027 N MET A 130 12.352 -0.543 2.193 1.00 0.16 N ATOM 2028 CA MET A 130 11.084 0.172 2.117 1.00 0.21 C ATOM 2029 C MET A 130 10.734 0.771 3.467 1.00 0.19 C ATOM 2030 O MET A 130 10.312 1.923 3.552 1.00 0.21 O ATOM 2031 CB MET A 130 9.953 -0.744 1.658 1.00 0.29 C ATOM 2032 CG MET A 130 10.019 -1.140 0.194 1.00 0.33 C ATOM 2033 SD MET A 130 8.616 -2.157 -0.292 1.00 0.71 S ATOM 2034 CE MET A 130 7.262 -1.097 0.211 1.00 0.29 C ATOM 0 H MET A 130 12.285 -1.548 2.032 1.00 0.16 H new ATOM 0 HA MET A 130 11.201 0.969 1.383 1.00 0.21 H new ATOM 0 HB2 MET A 130 9.965 -1.648 2.267 1.00 0.29 H new ATOM 0 HB3 MET A 130 9.001 -0.247 1.844 1.00 0.29 H new ATOM 0 HG2 MET A 130 10.048 -0.242 -0.424 1.00 0.33 H new ATOM 0 HG3 MET A 130 10.944 -1.685 0.007 1.00 0.33 H new ATOM 0 HE1 MET A 130 6.315 -1.558 -0.069 1.00 0.29 H new ATOM 0 HE2 MET A 130 7.292 -0.957 1.292 1.00 0.29 H new ATOM 0 HE3 MET A 130 7.354 -0.130 -0.283 1.00 0.29 H new ATOM 2044 N ALA A 131 10.926 -0.014 4.519 1.00 0.18 N ATOM 2045 CA ALA A 131 10.664 0.444 5.873 1.00 0.20 C ATOM 2046 C ALA A 131 11.572 1.611 6.223 1.00 0.21 C ATOM 2047 O ALA A 131 11.151 2.556 6.875 1.00 0.23 O ATOM 2048 CB ALA A 131 10.854 -0.695 6.859 1.00 0.23 C ATOM 0 H ALA A 131 11.264 -0.975 4.458 1.00 0.18 H new ATOM 0 HA ALA A 131 9.630 0.784 5.933 1.00 0.20 H new ATOM 0 HB1 ALA A 131 10.655 -0.338 7.870 1.00 0.23 H new ATOM 0 HB2 ALA A 131 10.165 -1.504 6.617 1.00 0.23 H new ATOM 0 HB3 ALA A 131 11.879 -1.061 6.799 1.00 0.23 H new ATOM 2054 N THR A 132 12.815 1.536 5.770 1.00 0.22 N ATOM 2055 CA THR A 132 13.778 2.608 5.983 1.00 0.25 C ATOM 2056 C THR A 132 13.291 3.904 5.330 1.00 0.24 C ATOM 2057 O THR A 132 13.181 4.938 5.992 1.00 0.25 O ATOM 2058 CB THR A 132 15.162 2.229 5.415 1.00 0.31 C ATOM 2059 OG1 THR A 132 15.585 0.971 5.962 1.00 0.33 O ATOM 2060 CG2 THR A 132 16.193 3.297 5.745 1.00 0.37 C ATOM 0 H THR A 132 13.182 0.739 5.250 1.00 0.22 H new ATOM 0 HA THR A 132 13.872 2.762 7.058 1.00 0.25 H new ATOM 0 HB THR A 132 15.077 2.149 4.331 1.00 0.31 H new ATOM 0 HG1 THR A 132 15.139 0.240 5.485 1.00 0.33 H new ATOM 0 HG21 THR A 132 17.160 3.008 5.335 1.00 0.37 H new ATOM 0 HG22 THR A 132 15.884 4.248 5.311 1.00 0.37 H new ATOM 0 HG23 THR A 132 16.275 3.402 6.827 1.00 0.37 H new ATOM 2068 N TYR A 133 12.981 3.834 4.038 1.00 0.23 N ATOM 2069 CA TYR A 133 12.492 4.996 3.301 1.00 0.24 C ATOM 2070 C TYR A 133 11.208 5.531 3.931 1.00 0.21 C ATOM 2071 O TYR A 133 11.049 6.739 4.112 1.00 0.23 O ATOM 2072 CB TYR A 133 12.250 4.630 1.833 1.00 0.27 C ATOM 2073 CG TYR A 133 11.724 5.772 0.989 1.00 0.33 C ATOM 2074 CD1 TYR A 133 12.589 6.697 0.419 1.00 0.42 C ATOM 2075 CD2 TYR A 133 10.361 5.917 0.754 1.00 0.36 C ATOM 2076 CE1 TYR A 133 12.110 7.734 -0.359 1.00 0.50 C ATOM 2077 CE2 TYR A 133 9.877 6.947 -0.026 1.00 0.45 C ATOM 2078 CZ TYR A 133 10.754 7.854 -0.579 1.00 0.51 C ATOM 2079 OH TYR A 133 10.279 8.874 -1.368 1.00 0.61 O ATOM 0 H TYR A 133 13.060 2.984 3.479 1.00 0.23 H new ATOM 0 HA TYR A 133 13.250 5.778 3.348 1.00 0.24 H new ATOM 0 HB2 TYR A 133 13.184 4.273 1.400 1.00 0.27 H new ATOM 0 HB3 TYR A 133 11.541 3.803 1.788 1.00 0.27 H new ATOM 0 HD1 TYR A 133 13.652 6.605 0.586 1.00 0.42 H new ATOM 0 HD2 TYR A 133 9.669 5.211 1.190 1.00 0.36 H new ATOM 0 HE1 TYR A 133 12.795 8.447 -0.793 1.00 0.50 H new ATOM 0 HE2 TYR A 133 8.816 7.042 -0.202 1.00 0.45 H new ATOM 0 HH TYR A 133 10.528 8.709 -2.301 1.00 0.61 H new ATOM 2089 N LEU A 134 10.305 4.623 4.275 1.00 0.20 N ATOM 2090 CA LEU A 134 9.039 4.983 4.895 1.00 0.20 C ATOM 2091 C LEU A 134 9.270 5.642 6.257 1.00 0.21 C ATOM 2092 O LEU A 134 8.695 6.683 6.552 1.00 0.24 O ATOM 2093 CB LEU A 134 8.164 3.731 5.019 1.00 0.20 C ATOM 2094 CG LEU A 134 6.924 3.840 5.910 1.00 0.22 C ATOM 2095 CD1 LEU A 134 6.038 4.993 5.479 1.00 0.26 C ATOM 2096 CD2 LEU A 134 6.145 2.537 5.872 1.00 0.26 C ATOM 0 H LEU A 134 10.429 3.621 4.133 1.00 0.20 H new ATOM 0 HA LEU A 134 8.522 5.711 4.270 1.00 0.20 H new ATOM 0 HB2 LEU A 134 7.839 3.443 4.019 1.00 0.20 H new ATOM 0 HB3 LEU A 134 8.785 2.919 5.399 1.00 0.20 H new ATOM 0 HG LEU A 134 7.253 4.034 6.931 1.00 0.22 H new ATOM 0 HD11 LEU A 134 5.166 5.045 6.130 1.00 0.26 H new ATOM 0 HD12 LEU A 134 6.597 5.926 5.546 1.00 0.26 H new ATOM 0 HD13 LEU A 134 5.714 4.838 4.450 1.00 0.26 H new ATOM 0 HD21 LEU A 134 5.264 2.621 6.508 1.00 0.26 H new ATOM 0 HD22 LEU A 134 5.835 2.328 4.848 1.00 0.26 H new ATOM 0 HD23 LEU A 134 6.776 1.725 6.232 1.00 0.26 H new ATOM 2108 N ASN A 135 10.141 5.052 7.055 1.00 0.24 N ATOM 2109 CA ASN A 135 10.424 5.546 8.399 1.00 0.29 C ATOM 2110 C ASN A 135 11.133 6.900 8.375 1.00 0.30 C ATOM 2111 O ASN A 135 10.767 7.816 9.110 1.00 0.33 O ATOM 2112 CB ASN A 135 11.276 4.517 9.156 1.00 0.37 C ATOM 2113 CG ASN A 135 11.810 5.032 10.482 1.00 0.92 C ATOM 2114 OD1 ASN A 135 11.123 4.977 11.503 1.00 1.17 O ATOM 2115 ND2 ASN A 135 13.050 5.500 10.486 1.00 1.46 N ATOM 0 H ASN A 135 10.672 4.221 6.796 1.00 0.24 H new ATOM 0 HA ASN A 135 9.472 5.688 8.911 1.00 0.29 H new ATOM 0 HB2 ASN A 135 10.678 3.624 9.336 1.00 0.37 H new ATOM 0 HB3 ASN A 135 12.114 4.218 8.527 1.00 0.37 H new ATOM 0 HD21 ASN A 135 13.467 5.831 11.356 1.00 1.46 H new ATOM 0 HD22 ASN A 135 13.587 5.529 9.619 1.00 1.46 H new ATOM 2122 N ASP A 136 12.148 7.025 7.534 1.00 0.32 N ATOM 2123 CA ASP A 136 12.997 8.212 7.552 1.00 0.37 C ATOM 2124 C ASP A 136 12.508 9.307 6.609 1.00 0.34 C ATOM 2125 O ASP A 136 12.446 10.474 6.991 1.00 0.36 O ATOM 2126 CB ASP A 136 14.444 7.837 7.230 1.00 0.46 C ATOM 2127 CG ASP A 136 15.128 7.147 8.394 1.00 1.19 C ATOM 2128 OD1 ASP A 136 15.724 7.849 9.240 1.00 1.27 O ATOM 2129 OD2 ASP A 136 15.070 5.902 8.481 1.00 2.07 O ATOM 0 H ASP A 136 12.405 6.328 6.835 1.00 0.32 H new ATOM 0 HA ASP A 136 12.944 8.621 8.561 1.00 0.37 H new ATOM 0 HB2 ASP A 136 14.463 7.182 6.359 1.00 0.46 H new ATOM 0 HB3 ASP A 136 15.000 8.736 6.965 1.00 0.46 H new ATOM 2134 N HIS A 137 12.161 8.946 5.382 1.00 0.33 N ATOM 2135 CA HIS A 137 11.789 9.947 4.378 1.00 0.35 C ATOM 2136 C HIS A 137 10.294 10.227 4.384 1.00 0.29 C ATOM 2137 O HIS A 137 9.865 11.380 4.395 1.00 0.32 O ATOM 2138 CB HIS A 137 12.193 9.512 2.962 1.00 0.45 C ATOM 2139 CG HIS A 137 13.665 9.499 2.710 1.00 0.63 C ATOM 2140 ND1 HIS A 137 14.295 10.431 1.925 1.00 1.07 N ATOM 2141 CD2 HIS A 137 14.626 8.638 3.112 1.00 1.53 C ATOM 2142 CE1 HIS A 137 15.576 10.147 1.851 1.00 0.95 C ATOM 2143 NE2 HIS A 137 15.812 9.059 2.562 1.00 1.34 N ATOM 0 H HIS A 137 12.128 7.980 5.055 1.00 0.33 H new ATOM 0 HA HIS A 137 12.329 10.854 4.649 1.00 0.35 H new ATOM 0 HB2 HIS A 137 11.797 8.513 2.777 1.00 0.45 H new ATOM 0 HB3 HIS A 137 11.721 10.181 2.242 1.00 0.45 H new ATOM 0 HD2 HIS A 137 14.487 7.777 3.749 1.00 1.53 H new ATOM 0 HE1 HIS A 137 16.314 10.710 1.300 1.00 0.95 H new ATOM 0 HE2 HIS A 137 16.719 8.609 2.682 1.00 1.34 H new ATOM 2152 N LEU A 138 9.510 9.163 4.393 1.00 0.26 N ATOM 2153 CA LEU A 138 8.083 9.255 4.126 1.00 0.25 C ATOM 2154 C LEU A 138 7.298 9.683 5.368 1.00 0.24 C ATOM 2155 O LEU A 138 6.392 10.510 5.275 1.00 0.25 O ATOM 2156 CB LEU A 138 7.596 7.904 3.607 1.00 0.23 C ATOM 2157 CG LEU A 138 6.239 7.906 2.911 1.00 0.23 C ATOM 2158 CD1 LEU A 138 6.240 8.884 1.747 1.00 0.26 C ATOM 2159 CD2 LEU A 138 5.906 6.503 2.430 1.00 0.22 C ATOM 0 H LEU A 138 9.840 8.217 4.584 1.00 0.26 H new ATOM 0 HA LEU A 138 7.912 10.024 3.372 1.00 0.25 H new ATOM 0 HB2 LEU A 138 8.339 7.515 2.911 1.00 0.23 H new ATOM 0 HB3 LEU A 138 7.551 7.209 4.446 1.00 0.23 H new ATOM 0 HG LEU A 138 5.477 8.225 3.622 1.00 0.23 H new ATOM 0 HD11 LEU A 138 5.264 8.873 1.262 1.00 0.26 H new ATOM 0 HD12 LEU A 138 6.450 9.888 2.116 1.00 0.26 H new ATOM 0 HD13 LEU A 138 7.006 8.593 1.028 1.00 0.26 H new ATOM 0 HD21 LEU A 138 4.936 6.509 1.933 1.00 0.22 H new ATOM 0 HD22 LEU A 138 6.670 6.168 1.729 1.00 0.22 H new ATOM 0 HD23 LEU A 138 5.873 5.824 3.282 1.00 0.22 H new ATOM 2171 N GLU A 139 7.660 9.121 6.520 1.00 0.26 N ATOM 2172 CA GLU A 139 7.024 9.451 7.805 1.00 0.29 C ATOM 2173 C GLU A 139 6.872 10.969 8.013 1.00 0.30 C ATOM 2174 O GLU A 139 5.768 11.435 8.305 1.00 0.30 O ATOM 2175 CB GLU A 139 7.824 8.831 8.963 1.00 0.36 C ATOM 2176 CG GLU A 139 7.309 9.188 10.352 1.00 0.52 C ATOM 2177 CD GLU A 139 6.092 8.386 10.762 1.00 1.00 C ATOM 2178 OE1 GLU A 139 4.967 8.743 10.353 1.00 1.74 O ATOM 2179 OE2 GLU A 139 6.256 7.400 11.514 1.00 1.46 O ATOM 0 H GLU A 139 8.401 8.424 6.594 1.00 0.26 H new ATOM 0 HA GLU A 139 6.019 9.029 7.788 1.00 0.29 H new ATOM 0 HB2 GLU A 139 7.815 7.747 8.854 1.00 0.36 H new ATOM 0 HB3 GLU A 139 8.863 9.151 8.882 1.00 0.36 H new ATOM 0 HG2 GLU A 139 8.104 9.027 11.080 1.00 0.52 H new ATOM 0 HG3 GLU A 139 7.063 10.249 10.379 1.00 0.52 H new ATOM 2186 N PRO A 140 7.958 11.776 7.865 1.00 0.33 N ATOM 2187 CA PRO A 140 7.876 13.233 8.029 1.00 0.36 C ATOM 2188 C PRO A 140 6.791 13.870 7.165 1.00 0.31 C ATOM 2189 O PRO A 140 6.142 14.829 7.582 1.00 0.36 O ATOM 2190 CB PRO A 140 9.255 13.729 7.594 1.00 0.42 C ATOM 2191 CG PRO A 140 10.160 12.578 7.837 1.00 0.42 C ATOM 2192 CD PRO A 140 9.341 11.346 7.561 1.00 0.35 C ATOM 0 HA PRO A 140 7.613 13.499 9.053 1.00 0.36 H new ATOM 0 HB2 PRO A 140 9.258 14.021 6.544 1.00 0.42 H new ATOM 0 HB3 PRO A 140 9.562 14.603 8.169 1.00 0.42 H new ATOM 0 HG2 PRO A 140 11.032 12.622 7.185 1.00 0.42 H new ATOM 0 HG3 PRO A 140 10.529 12.581 8.863 1.00 0.42 H new ATOM 0 HD2 PRO A 140 9.442 11.021 6.526 1.00 0.35 H new ATOM 0 HD3 PRO A 140 9.649 10.510 8.189 1.00 0.35 H new ATOM 2200 N TRP A 141 6.588 13.338 5.966 1.00 0.28 N ATOM 2201 CA TRP A 141 5.564 13.864 5.077 1.00 0.25 C ATOM 2202 C TRP A 141 4.189 13.355 5.502 1.00 0.22 C ATOM 2203 O TRP A 141 3.222 14.120 5.560 1.00 0.22 O ATOM 2204 CB TRP A 141 5.849 13.478 3.618 1.00 0.29 C ATOM 2205 CG TRP A 141 4.910 14.137 2.659 1.00 0.29 C ATOM 2206 CD1 TRP A 141 5.075 15.349 2.055 1.00 0.32 C ATOM 2207 CD2 TRP A 141 3.649 13.632 2.210 1.00 0.30 C ATOM 2208 NE1 TRP A 141 3.989 15.629 1.264 1.00 0.35 N ATOM 2209 CE2 TRP A 141 3.102 14.590 1.341 1.00 0.33 C ATOM 2210 CE3 TRP A 141 2.930 12.461 2.459 1.00 0.31 C ATOM 2211 CZ2 TRP A 141 1.869 14.415 0.721 1.00 0.36 C ATOM 2212 CZ3 TRP A 141 1.708 12.287 1.842 1.00 0.35 C ATOM 2213 CH2 TRP A 141 1.187 13.259 0.984 1.00 0.36 C ATOM 0 H TRP A 141 7.115 12.549 5.591 1.00 0.28 H new ATOM 0 HA TRP A 141 5.577 14.952 5.146 1.00 0.25 H new ATOM 0 HB2 TRP A 141 6.873 13.753 3.366 1.00 0.29 H new ATOM 0 HB3 TRP A 141 5.774 12.396 3.510 1.00 0.29 H new ATOM 0 HD1 TRP A 141 5.933 15.993 2.181 1.00 0.32 H new ATOM 0 HE1 TRP A 141 3.863 16.475 0.708 1.00 0.35 H new ATOM 0 HE3 TRP A 141 3.323 11.705 3.123 1.00 0.31 H new ATOM 0 HZ2 TRP A 141 1.465 15.164 0.056 1.00 0.36 H new ATOM 0 HZ3 TRP A 141 1.145 11.384 2.025 1.00 0.35 H new ATOM 0 HH2 TRP A 141 0.226 13.094 0.519 1.00 0.36 H new ATOM 2224 N ILE A 142 4.120 12.065 5.814 1.00 0.20 N ATOM 2225 CA ILE A 142 2.877 11.425 6.228 1.00 0.19 C ATOM 2226 C ILE A 142 2.300 12.109 7.465 1.00 0.20 C ATOM 2227 O ILE A 142 1.194 12.651 7.423 1.00 0.20 O ATOM 2228 CB ILE A 142 3.112 9.927 6.524 1.00 0.21 C ATOM 2229 CG1 ILE A 142 3.479 9.180 5.242 1.00 0.21 C ATOM 2230 CG2 ILE A 142 1.887 9.293 7.166 1.00 0.25 C ATOM 2231 CD1 ILE A 142 3.864 7.742 5.484 1.00 0.23 C ATOM 0 H ILE A 142 4.922 11.435 5.787 1.00 0.20 H new ATOM 0 HA ILE A 142 2.163 11.519 5.410 1.00 0.19 H new ATOM 0 HB ILE A 142 3.941 9.853 7.227 1.00 0.21 H new ATOM 0 HG12 ILE A 142 2.633 9.213 4.555 1.00 0.21 H new ATOM 0 HG13 ILE A 142 4.307 9.694 4.753 1.00 0.21 H new ATOM 0 HG21 ILE A 142 2.083 8.239 7.362 1.00 0.25 H new ATOM 0 HG22 ILE A 142 1.664 9.801 8.104 1.00 0.25 H new ATOM 0 HG23 ILE A 142 1.035 9.384 6.492 1.00 0.25 H new ATOM 0 HD11 ILE A 142 4.113 7.267 4.535 1.00 0.23 H new ATOM 0 HD12 ILE A 142 4.728 7.703 6.147 1.00 0.23 H new ATOM 0 HD13 ILE A 142 3.029 7.215 5.945 1.00 0.23 H new ATOM 2243 N GLN A 143 3.070 12.095 8.549 1.00 0.25 N ATOM 2244 CA GLN A 143 2.638 12.651 9.827 1.00 0.30 C ATOM 2245 C GLN A 143 2.237 14.117 9.685 1.00 0.29 C ATOM 2246 O GLN A 143 1.278 14.572 10.309 1.00 0.31 O ATOM 2247 CB GLN A 143 3.770 12.516 10.850 1.00 0.40 C ATOM 2248 CG GLN A 143 3.396 12.948 12.261 1.00 0.51 C ATOM 2249 CD GLN A 143 4.594 13.009 13.193 1.00 0.95 C ATOM 2250 OE1 GLN A 143 4.477 12.741 14.388 1.00 1.51 O ATOM 2251 NE2 GLN A 143 5.747 13.387 12.664 1.00 1.60 N ATOM 0 H GLN A 143 4.010 11.699 8.566 1.00 0.25 H new ATOM 0 HA GLN A 143 1.764 12.095 10.168 1.00 0.30 H new ATOM 0 HB2 GLN A 143 4.098 11.477 10.876 1.00 0.40 H new ATOM 0 HB3 GLN A 143 4.620 13.110 10.514 1.00 0.40 H new ATOM 0 HG2 GLN A 143 2.921 13.928 12.222 1.00 0.51 H new ATOM 0 HG3 GLN A 143 2.661 12.253 12.666 1.00 0.51 H new ATOM 0 HE21 GLN A 143 5.806 13.601 11.668 1.00 1.60 H new ATOM 0 HE22 GLN A 143 6.577 13.464 13.252 1.00 1.60 H new ATOM 2260 N GLU A 144 2.966 14.840 8.845 1.00 0.29 N ATOM 2261 CA GLU A 144 2.725 16.265 8.641 1.00 0.33 C ATOM 2262 C GLU A 144 1.336 16.512 8.052 1.00 0.29 C ATOM 2263 O GLU A 144 0.618 17.411 8.487 1.00 0.35 O ATOM 2264 CB GLU A 144 3.800 16.855 7.724 1.00 0.41 C ATOM 2265 CG GLU A 144 3.697 18.358 7.533 1.00 0.64 C ATOM 2266 CD GLU A 144 4.691 18.871 6.514 1.00 1.09 C ATOM 2267 OE1 GLU A 144 5.900 18.924 6.828 1.00 1.25 O ATOM 2268 OE2 GLU A 144 4.272 19.198 5.381 1.00 1.75 O ATOM 0 H GLU A 144 3.734 14.462 8.290 1.00 0.29 H new ATOM 0 HA GLU A 144 2.773 16.759 9.612 1.00 0.33 H new ATOM 0 HB2 GLU A 144 4.782 16.618 8.134 1.00 0.41 H new ATOM 0 HB3 GLU A 144 3.737 16.371 6.750 1.00 0.41 H new ATOM 0 HG2 GLU A 144 2.687 18.614 7.214 1.00 0.64 H new ATOM 0 HG3 GLU A 144 3.866 18.857 8.487 1.00 0.64 H new ATOM 2275 N ASN A 145 0.945 15.684 7.089 1.00 0.24 N ATOM 2276 CA ASN A 145 -0.335 15.858 6.400 1.00 0.28 C ATOM 2277 C ASN A 145 -1.474 15.176 7.153 1.00 0.30 C ATOM 2278 O ASN A 145 -2.556 14.963 6.599 1.00 0.42 O ATOM 2279 CB ASN A 145 -0.260 15.321 4.964 1.00 0.32 C ATOM 2280 CG ASN A 145 0.532 16.231 4.036 1.00 0.34 C ATOM 2281 OD1 ASN A 145 -0.030 17.123 3.398 1.00 0.40 O ATOM 2282 ND2 ASN A 145 1.836 16.010 3.939 1.00 0.33 N ATOM 0 H ASN A 145 1.493 14.886 6.766 1.00 0.24 H new ATOM 0 HA ASN A 145 -0.542 16.928 6.367 1.00 0.28 H new ATOM 0 HB2 ASN A 145 0.198 14.332 4.974 1.00 0.32 H new ATOM 0 HB3 ASN A 145 -1.270 15.200 4.573 1.00 0.32 H new ATOM 0 HD21 ASN A 145 2.407 16.587 3.321 1.00 0.33 H new ATOM 0 HD22 ASN A 145 2.268 15.263 4.482 1.00 0.33 H new ATOM 2289 N GLY A 146 -1.234 14.840 8.414 1.00 0.25 N ATOM 2290 CA GLY A 146 -2.283 14.272 9.241 1.00 0.30 C ATOM 2291 C GLY A 146 -2.012 12.834 9.626 1.00 0.30 C ATOM 2292 O GLY A 146 -2.622 12.304 10.554 1.00 0.41 O ATOM 0 H GLY A 146 -0.333 14.950 8.879 1.00 0.25 H new ATOM 0 HA2 GLY A 146 -2.391 14.871 10.145 1.00 0.30 H new ATOM 0 HA3 GLY A 146 -3.231 14.328 8.706 1.00 0.30 H new ATOM 2296 N GLY A 147 -1.098 12.200 8.912 1.00 0.24 N ATOM 2297 CA GLY A 147 -0.762 10.825 9.193 1.00 0.22 C ATOM 2298 C GLY A 147 -1.528 9.863 8.314 1.00 0.19 C ATOM 2299 O GLY A 147 -2.169 10.275 7.342 1.00 0.20 O ATOM 0 H GLY A 147 -0.580 12.617 8.138 1.00 0.24 H new ATOM 0 HA2 GLY A 147 0.308 10.676 9.047 1.00 0.22 H new ATOM 0 HA3 GLY A 147 -0.974 10.607 10.240 1.00 0.22 H new ATOM 2303 N TRP A 148 -1.468 8.583 8.653 1.00 0.20 N ATOM 2304 CA TRP A 148 -2.170 7.557 7.898 1.00 0.21 C ATOM 2305 C TRP A 148 -3.676 7.782 7.916 1.00 0.23 C ATOM 2306 O TRP A 148 -4.356 7.450 6.952 1.00 0.25 O ATOM 2307 CB TRP A 148 -1.850 6.164 8.443 1.00 0.23 C ATOM 2308 CG TRP A 148 -0.458 5.702 8.131 1.00 0.23 C ATOM 2309 CD1 TRP A 148 0.531 5.390 9.022 1.00 0.28 C ATOM 2310 CD2 TRP A 148 0.102 5.501 6.827 1.00 0.22 C ATOM 2311 NE1 TRP A 148 1.660 4.992 8.352 1.00 0.29 N ATOM 2312 CE2 TRP A 148 1.424 5.055 7.006 1.00 0.25 C ATOM 2313 CE3 TRP A 148 -0.387 5.650 5.525 1.00 0.22 C ATOM 2314 CZ2 TRP A 148 2.260 4.756 5.938 1.00 0.26 C ATOM 2315 CZ3 TRP A 148 0.448 5.352 4.463 1.00 0.23 C ATOM 2316 CH2 TRP A 148 1.759 4.909 4.678 1.00 0.24 C ATOM 0 H TRP A 148 -0.938 8.230 9.450 1.00 0.20 H new ATOM 0 HA TRP A 148 -1.825 7.624 6.866 1.00 0.21 H new ATOM 0 HB2 TRP A 148 -1.990 6.165 9.524 1.00 0.23 H new ATOM 0 HB3 TRP A 148 -2.562 5.449 8.030 1.00 0.23 H new ATOM 0 HD1 TRP A 148 0.437 5.448 10.096 1.00 0.28 H new ATOM 0 HE1 TRP A 148 2.534 4.697 8.787 1.00 0.29 H new ATOM 0 HE3 TRP A 148 -1.397 5.991 5.352 1.00 0.22 H new ATOM 0 HZ2 TRP A 148 3.272 4.414 6.099 1.00 0.26 H new ATOM 0 HZ3 TRP A 148 0.083 5.463 3.453 1.00 0.23 H new ATOM 0 HH2 TRP A 148 2.387 4.684 3.829 1.00 0.24 H new ATOM 2327 N ASP A 149 -4.192 8.364 9.002 1.00 0.26 N ATOM 2328 CA ASP A 149 -5.636 8.603 9.134 1.00 0.31 C ATOM 2329 C ASP A 149 -6.164 9.441 7.974 1.00 0.30 C ATOM 2330 O ASP A 149 -7.331 9.337 7.598 1.00 0.37 O ATOM 2331 CB ASP A 149 -5.975 9.295 10.461 1.00 0.40 C ATOM 2332 CG ASP A 149 -5.825 8.382 11.661 1.00 1.24 C ATOM 2333 OD1 ASP A 149 -6.735 7.566 11.909 1.00 1.96 O ATOM 2334 OD2 ASP A 149 -4.790 8.465 12.356 1.00 1.94 O ATOM 0 H ASP A 149 -3.638 8.677 9.799 1.00 0.26 H new ATOM 0 HA ASP A 149 -6.120 7.627 9.117 1.00 0.31 H new ATOM 0 HB2 ASP A 149 -5.327 10.162 10.588 1.00 0.40 H new ATOM 0 HB3 ASP A 149 -6.999 9.666 10.420 1.00 0.40 H new ATOM 2339 N THR A 150 -5.305 10.276 7.411 1.00 0.27 N ATOM 2340 CA THR A 150 -5.670 11.083 6.260 1.00 0.29 C ATOM 2341 C THR A 150 -5.814 10.203 5.020 1.00 0.28 C ATOM 2342 O THR A 150 -6.815 10.272 4.305 1.00 0.33 O ATOM 2343 CB THR A 150 -4.609 12.168 5.996 1.00 0.33 C ATOM 2344 OG1 THR A 150 -4.401 12.948 7.183 1.00 0.38 O ATOM 2345 CG2 THR A 150 -5.031 13.079 4.855 1.00 0.37 C ATOM 0 H THR A 150 -4.347 10.412 7.735 1.00 0.27 H new ATOM 0 HA THR A 150 -6.624 11.565 6.475 1.00 0.29 H new ATOM 0 HB THR A 150 -3.680 11.672 5.716 1.00 0.33 H new ATOM 0 HG1 THR A 150 -4.628 13.884 7.003 1.00 0.38 H new ATOM 0 HG21 THR A 150 -4.264 13.835 4.690 1.00 0.37 H new ATOM 0 HG22 THR A 150 -5.160 12.489 3.947 1.00 0.37 H new ATOM 0 HG23 THR A 150 -5.973 13.566 5.108 1.00 0.37 H new ATOM 2353 N PHE A 151 -4.814 9.363 4.789 1.00 0.24 N ATOM 2354 CA PHE A 151 -4.788 8.496 3.618 1.00 0.25 C ATOM 2355 C PHE A 151 -5.848 7.400 3.721 1.00 0.26 C ATOM 2356 O PHE A 151 -6.495 7.057 2.730 1.00 0.30 O ATOM 2357 CB PHE A 151 -3.399 7.871 3.454 1.00 0.25 C ATOM 2358 CG PHE A 151 -3.304 6.923 2.293 1.00 0.27 C ATOM 2359 CD1 PHE A 151 -3.515 7.367 1.001 1.00 0.39 C ATOM 2360 CD2 PHE A 151 -2.991 5.590 2.498 1.00 0.26 C ATOM 2361 CE1 PHE A 151 -3.415 6.499 -0.067 1.00 0.43 C ATOM 2362 CE2 PHE A 151 -2.891 4.718 1.435 1.00 0.28 C ATOM 2363 CZ PHE A 151 -3.154 5.170 0.148 1.00 0.34 C ATOM 0 H PHE A 151 -4.005 9.263 5.402 1.00 0.24 H new ATOM 0 HA PHE A 151 -5.012 9.104 2.742 1.00 0.25 H new ATOM 0 HB2 PHE A 151 -2.664 8.666 3.325 1.00 0.25 H new ATOM 0 HB3 PHE A 151 -3.137 7.340 4.369 1.00 0.25 H new ATOM 0 HD1 PHE A 151 -3.761 8.404 0.826 1.00 0.39 H new ATOM 0 HD2 PHE A 151 -2.823 5.229 3.502 1.00 0.26 H new ATOM 0 HE1 PHE A 151 -3.543 6.867 -1.074 1.00 0.43 H new ATOM 0 HE2 PHE A 151 -2.610 3.689 1.602 1.00 0.28 H new ATOM 0 HZ PHE A 151 -3.153 4.477 -0.680 1.00 0.34 H new ATOM 2373 N VAL A 152 -6.030 6.863 4.920 1.00 0.25 N ATOM 2374 CA VAL A 152 -7.001 5.803 5.141 1.00 0.29 C ATOM 2375 C VAL A 152 -8.417 6.299 4.873 1.00 0.35 C ATOM 2376 O VAL A 152 -9.266 5.544 4.425 1.00 0.45 O ATOM 2377 CB VAL A 152 -6.897 5.227 6.569 1.00 0.29 C ATOM 2378 CG1 VAL A 152 -7.949 4.156 6.802 1.00 0.35 C ATOM 2379 CG2 VAL A 152 -5.509 4.657 6.804 1.00 0.28 C ATOM 0 H VAL A 152 -5.516 7.145 5.755 1.00 0.25 H new ATOM 0 HA VAL A 152 -6.773 5.002 4.438 1.00 0.29 H new ATOM 0 HB VAL A 152 -7.074 6.037 7.276 1.00 0.29 H new ATOM 0 HG11 VAL A 152 -7.854 3.767 7.816 1.00 0.35 H new ATOM 0 HG12 VAL A 152 -8.942 4.586 6.670 1.00 0.35 H new ATOM 0 HG13 VAL A 152 -7.807 3.345 6.087 1.00 0.35 H new ATOM 0 HG21 VAL A 152 -5.448 4.254 7.815 1.00 0.28 H new ATOM 0 HG22 VAL A 152 -5.315 3.862 6.084 1.00 0.28 H new ATOM 0 HG23 VAL A 152 -4.766 5.446 6.682 1.00 0.28 H new ATOM 2389 N GLU A 153 -8.660 7.580 5.115 1.00 0.37 N ATOM 2390 CA GLU A 153 -9.957 8.178 4.810 1.00 0.46 C ATOM 2391 C GLU A 153 -10.266 8.079 3.313 1.00 0.51 C ATOM 2392 O GLU A 153 -11.423 7.944 2.911 1.00 0.62 O ATOM 2393 CB GLU A 153 -9.986 9.645 5.256 1.00 0.52 C ATOM 2394 CG GLU A 153 -11.256 10.378 4.849 1.00 0.70 C ATOM 2395 CD GLU A 153 -11.271 11.822 5.299 1.00 1.35 C ATOM 2396 OE1 GLU A 153 -10.328 12.563 4.962 1.00 2.17 O ATOM 2397 OE2 GLU A 153 -12.225 12.227 5.988 1.00 1.42 O ATOM 0 H GLU A 153 -7.981 8.224 5.520 1.00 0.37 H new ATOM 0 HA GLU A 153 -10.721 7.626 5.357 1.00 0.46 H new ATOM 0 HB2 GLU A 153 -9.882 9.689 6.340 1.00 0.52 H new ATOM 0 HB3 GLU A 153 -9.125 10.163 4.832 1.00 0.52 H new ATOM 0 HG2 GLU A 153 -11.360 10.339 3.765 1.00 0.70 H new ATOM 0 HG3 GLU A 153 -12.119 9.862 5.271 1.00 0.70 H new ATOM 2404 N LEU A 154 -9.223 8.126 2.492 1.00 0.50 N ATOM 2405 CA LEU A 154 -9.385 8.108 1.041 1.00 0.59 C ATOM 2406 C LEU A 154 -9.833 6.733 0.545 1.00 0.68 C ATOM 2407 O LEU A 154 -10.712 6.635 -0.310 1.00 0.74 O ATOM 2408 CB LEU A 154 -8.078 8.516 0.351 1.00 0.65 C ATOM 2409 CG LEU A 154 -7.617 9.949 0.626 1.00 0.64 C ATOM 2410 CD1 LEU A 154 -6.211 10.172 0.089 1.00 0.75 C ATOM 2411 CD2 LEU A 154 -8.582 10.945 0.004 1.00 0.67 C ATOM 0 H LEU A 154 -8.254 8.177 2.806 1.00 0.50 H new ATOM 0 HA LEU A 154 -10.163 8.828 0.787 1.00 0.59 H new ATOM 0 HB2 LEU A 154 -7.290 7.831 0.665 1.00 0.65 H new ATOM 0 HB3 LEU A 154 -8.199 8.390 -0.725 1.00 0.65 H new ATOM 0 HG LEU A 154 -7.603 10.103 1.705 1.00 0.64 H new ATOM 0 HD11 LEU A 154 -5.901 11.197 0.294 1.00 0.75 H new ATOM 0 HD12 LEU A 154 -5.522 9.481 0.574 1.00 0.75 H new ATOM 0 HD13 LEU A 154 -6.201 9.999 -0.987 1.00 0.75 H new ATOM 0 HD21 LEU A 154 -8.240 11.959 0.209 1.00 0.67 H new ATOM 0 HD22 LEU A 154 -8.624 10.787 -1.074 1.00 0.67 H new ATOM 0 HD23 LEU A 154 -9.575 10.804 0.430 1.00 0.67 H new ATOM 2423 N TYR A 155 -9.241 5.673 1.088 1.00 0.75 N ATOM 2424 CA TYR A 155 -9.525 4.320 0.609 1.00 0.90 C ATOM 2425 C TYR A 155 -10.085 3.431 1.720 1.00 0.97 C ATOM 2426 O TYR A 155 -9.995 2.206 1.646 1.00 1.15 O ATOM 2427 CB TYR A 155 -8.259 3.683 0.014 1.00 0.98 C ATOM 2428 CG TYR A 155 -7.719 4.420 -1.195 1.00 0.98 C ATOM 2429 CD1 TYR A 155 -8.397 4.396 -2.406 1.00 1.05 C ATOM 2430 CD2 TYR A 155 -6.529 5.131 -1.126 1.00 0.98 C ATOM 2431 CE1 TYR A 155 -7.904 5.060 -3.513 1.00 1.10 C ATOM 2432 CE2 TYR A 155 -6.031 5.799 -2.227 1.00 1.03 C ATOM 2433 CZ TYR A 155 -6.733 5.783 -3.410 1.00 1.08 C ATOM 2434 OH TYR A 155 -6.226 6.423 -4.520 1.00 1.17 O ATOM 0 H TYR A 155 -8.568 5.721 1.853 1.00 0.75 H new ATOM 0 HA TYR A 155 -10.285 4.403 -0.168 1.00 0.90 H new ATOM 0 HB2 TYR A 155 -7.486 3.646 0.782 1.00 0.98 H new ATOM 0 HB3 TYR A 155 -8.479 2.653 -0.267 1.00 0.98 H new ATOM 0 HD1 TYR A 155 -9.325 3.849 -2.484 1.00 1.05 H new ATOM 0 HD2 TYR A 155 -5.983 5.162 -0.195 1.00 0.98 H new ATOM 0 HE1 TYR A 155 -8.432 5.013 -4.454 1.00 1.10 H new ATOM 0 HE2 TYR A 155 -5.094 6.332 -2.160 1.00 1.03 H new ATOM 0 HH TYR A 155 -5.398 6.888 -4.279 1.00 1.17 H new ATOM 2444 N GLY A 156 -10.670 4.048 2.734 1.00 0.89 N ATOM 2445 CA GLY A 156 -11.229 3.295 3.844 1.00 1.02 C ATOM 2446 C GLY A 156 -12.228 4.111 4.640 1.00 1.11 C ATOM 2447 O GLY A 156 -11.942 4.535 5.762 1.00 1.68 O ATOM 0 H GLY A 156 -10.770 5.060 2.811 1.00 0.89 H new ATOM 0 HA2 GLY A 156 -11.716 2.397 3.464 1.00 1.02 H new ATOM 0 HA3 GLY A 156 -10.424 2.967 4.501 1.00 1.02 H new ATOM 2451 N ASN A 157 -13.405 4.328 4.059 1.00 1.62 N ATOM 2452 CA ASN A 157 -14.442 5.150 4.683 1.00 2.05 C ATOM 2453 C ASN A 157 -14.848 4.616 6.056 1.00 2.33 C ATOM 2454 O ASN A 157 -15.107 5.393 6.971 1.00 2.52 O ATOM 2455 CB ASN A 157 -15.674 5.235 3.775 1.00 3.21 C ATOM 2456 CG ASN A 157 -16.815 6.011 4.413 1.00 3.90 C ATOM 2457 OD1 ASN A 157 -17.702 5.434 5.043 1.00 4.30 O ATOM 2458 ND2 ASN A 157 -16.804 7.324 4.249 1.00 4.60 N ATOM 0 H ASN A 157 -13.667 3.944 3.151 1.00 1.62 H new ATOM 0 HA ASN A 157 -14.022 6.146 4.823 1.00 2.05 H new ATOM 0 HB2 ASN A 157 -15.396 5.711 2.835 1.00 3.21 H new ATOM 0 HB3 ASN A 157 -16.014 4.228 3.534 1.00 3.21 H new ATOM 0 HD21 ASN A 157 -17.548 7.894 4.651 1.00 4.60 H new ATOM 0 HD22 ASN A 157 -16.052 7.766 3.720 1.00 4.60 H new ATOM 2465 N ASN A 158 -14.891 3.295 6.200 1.00 2.99 N ATOM 2466 CA ASN A 158 -15.326 2.682 7.456 1.00 4.03 C ATOM 2467 C ASN A 158 -14.399 3.076 8.603 1.00 4.18 C ATOM 2468 O ASN A 158 -14.858 3.482 9.671 1.00 4.81 O ATOM 2469 CB ASN A 158 -15.385 1.156 7.321 1.00 5.08 C ATOM 2470 CG ASN A 158 -15.994 0.483 8.539 1.00 5.98 C ATOM 2471 OD1 ASN A 158 -17.214 0.346 8.639 1.00 6.22 O ATOM 2472 ND2 ASN A 158 -15.157 0.040 9.463 1.00 6.76 N ATOM 0 H ASN A 158 -14.633 2.631 5.470 1.00 2.99 H new ATOM 0 HA ASN A 158 -16.327 3.050 7.681 1.00 4.03 H new ATOM 0 HB2 ASN A 158 -15.968 0.896 6.438 1.00 5.08 H new ATOM 0 HB3 ASN A 158 -14.378 0.770 7.163 1.00 5.08 H new ATOM 0 HD21 ASN A 158 -15.516 -0.433 10.292 1.00 6.76 H new ATOM 0 HD22 ASN A 158 -14.152 0.171 9.346 1.00 6.76 H new ATOM 2479 N ALA A 159 -13.093 2.970 8.370 1.00 3.95 N ATOM 2480 CA ALA A 159 -12.101 3.356 9.367 1.00 4.72 C ATOM 2481 C ALA A 159 -12.207 4.841 9.682 1.00 4.66 C ATOM 2482 O ALA A 159 -12.238 5.239 10.848 1.00 5.63 O ATOM 2483 CB ALA A 159 -10.703 3.019 8.878 1.00 4.78 C ATOM 0 H ALA A 159 -12.698 2.619 7.498 1.00 3.95 H new ATOM 0 HA ALA A 159 -12.296 2.796 10.281 1.00 4.72 H new ATOM 0 HB1 ALA A 159 -9.973 3.313 9.632 1.00 4.78 H new ATOM 0 HB2 ALA A 159 -10.629 1.946 8.699 1.00 4.78 H new ATOM 0 HB3 ALA A 159 -10.503 3.556 7.951 1.00 4.78 H new ATOM 2489 N ALA A 160 -12.274 5.654 8.631 1.00 3.75 N ATOM 2490 CA ALA A 160 -12.421 7.098 8.774 1.00 4.08 C ATOM 2491 C ALA A 160 -13.651 7.445 9.606 1.00 4.33 C ATOM 2492 O ALA A 160 -13.601 8.309 10.481 1.00 5.11 O ATOM 2493 CB ALA A 160 -12.514 7.749 7.404 1.00 3.59 C ATOM 0 H ALA A 160 -12.228 5.333 7.664 1.00 3.75 H new ATOM 0 HA ALA A 160 -11.543 7.481 9.294 1.00 4.08 H new ATOM 0 HB1 ALA A 160 -12.624 8.827 7.520 1.00 3.59 H new ATOM 0 HB2 ALA A 160 -11.608 7.535 6.837 1.00 3.59 H new ATOM 0 HB3 ALA A 160 -13.378 7.352 6.870 1.00 3.59 H new ATOM 2499 N ALA A 161 -14.749 6.753 9.330 1.00 3.93 N ATOM 2500 CA ALA A 161 -16.002 6.974 10.035 1.00 4.43 C ATOM 2501 C ALA A 161 -15.851 6.708 11.530 1.00 5.54 C ATOM 2502 O ALA A 161 -16.403 7.434 12.354 1.00 6.11 O ATOM 2503 CB ALA A 161 -17.093 6.093 9.447 1.00 4.39 C ATOM 0 H ALA A 161 -14.795 6.027 8.615 1.00 3.93 H new ATOM 0 HA ALA A 161 -16.282 8.020 9.910 1.00 4.43 H new ATOM 0 HB1 ALA A 161 -18.027 6.265 9.981 1.00 4.39 H new ATOM 0 HB2 ALA A 161 -17.228 6.335 8.393 1.00 4.39 H new ATOM 0 HB3 ALA A 161 -16.807 5.046 9.545 1.00 4.39 H new ATOM 2509 N GLU A 162 -15.092 5.676 11.878 1.00 5.98 N ATOM 2510 CA GLU A 162 -14.888 5.320 13.277 1.00 7.23 C ATOM 2511 C GLU A 162 -14.020 6.359 13.977 1.00 7.80 C ATOM 2512 O GLU A 162 -14.209 6.646 15.161 1.00 8.75 O ATOM 2513 CB GLU A 162 -14.262 3.931 13.392 1.00 7.72 C ATOM 2514 CG GLU A 162 -15.159 2.827 12.858 1.00 7.99 C ATOM 2515 CD GLU A 162 -16.525 2.825 13.514 1.00 8.68 C ATOM 2516 OE1 GLU A 162 -17.432 3.524 13.012 1.00 9.09 O ATOM 2517 OE2 GLU A 162 -16.703 2.124 14.528 1.00 9.03 O ATOM 0 H GLU A 162 -14.609 5.072 11.213 1.00 5.98 H new ATOM 0 HA GLU A 162 -15.860 5.301 13.769 1.00 7.23 H new ATOM 0 HB2 GLU A 162 -13.317 3.919 12.848 1.00 7.72 H new ATOM 0 HB3 GLU A 162 -14.030 3.729 14.438 1.00 7.72 H new ATOM 0 HG2 GLU A 162 -15.276 2.947 11.781 1.00 7.99 H new ATOM 0 HG3 GLU A 162 -14.679 1.862 13.021 1.00 7.99 H new ATOM 2524 N SER A 163 -13.069 6.921 13.243 1.00 7.39 N ATOM 2525 CA SER A 163 -12.254 8.009 13.756 1.00 8.21 C ATOM 2526 C SER A 163 -13.113 9.255 13.971 1.00 8.28 C ATOM 2527 O SER A 163 -12.929 9.991 14.940 1.00 9.15 O ATOM 2528 CB SER A 163 -11.114 8.308 12.780 1.00 8.03 C ATOM 2529 OG SER A 163 -10.387 7.129 12.481 1.00 7.86 O ATOM 0 H SER A 163 -12.844 6.639 12.289 1.00 7.39 H new ATOM 0 HA SER A 163 -11.828 7.714 14.715 1.00 8.21 H new ATOM 0 HB2 SER A 163 -11.518 8.735 11.862 1.00 8.03 H new ATOM 0 HB3 SER A 163 -10.446 9.053 13.211 1.00 8.03 H new ATOM 0 HG SER A 163 -10.925 6.552 11.900 1.00 7.86 H new ATOM 2535 N ARG A 164 -14.069 9.468 13.071 1.00 7.47 N ATOM 2536 CA ARG A 164 -14.983 10.603 13.166 1.00 7.60 C ATOM 2537 C ARG A 164 -15.899 10.468 14.378 1.00 8.33 C ATOM 2538 O ARG A 164 -16.236 11.457 15.027 1.00 8.87 O ATOM 2539 CB ARG A 164 -15.821 10.726 11.893 1.00 6.69 C ATOM 2540 CG ARG A 164 -15.011 11.080 10.660 1.00 6.19 C ATOM 2541 CD ARG A 164 -15.894 11.190 9.431 1.00 5.74 C ATOM 2542 NE ARG A 164 -15.132 11.567 8.243 1.00 5.66 N ATOM 2543 CZ ARG A 164 -15.678 12.068 7.136 1.00 5.62 C ATOM 2544 NH1 ARG A 164 -16.995 12.235 7.059 1.00 5.62 N ATOM 2545 NH2 ARG A 164 -14.909 12.402 6.107 1.00 6.02 N ATOM 0 H ARG A 164 -14.231 8.866 12.264 1.00 7.47 H new ATOM 0 HA ARG A 164 -14.383 11.505 13.284 1.00 7.60 H new ATOM 0 HB2 ARG A 164 -16.339 9.783 11.718 1.00 6.69 H new ATOM 0 HB3 ARG A 164 -16.586 11.487 12.045 1.00 6.69 H new ATOM 0 HG2 ARG A 164 -14.492 12.024 10.823 1.00 6.19 H new ATOM 0 HG3 ARG A 164 -14.247 10.321 10.494 1.00 6.19 H new ATOM 0 HD2 ARG A 164 -16.392 10.236 9.255 1.00 5.74 H new ATOM 0 HD3 ARG A 164 -16.675 11.929 9.610 1.00 5.74 H new ATOM 0 HE ARG A 164 -14.120 11.439 8.262 1.00 5.66 H new ATOM 0 HH11 ARG A 164 -17.588 11.979 7.848 1.00 5.62 H new ATOM 0 HH12 ARG A 164 -17.412 12.619 6.211 1.00 5.62 H new ATOM 0 HH21 ARG A 164 -13.898 12.275 6.163 1.00 6.02 H new ATOM 0 HH22 ARG A 164 -15.329 12.785 5.260 1.00 6.02 H new ATOM 2559 N LYS A 165 -16.289 9.234 14.686 1.00 8.52 N ATOM 2560 CA LYS A 165 -17.128 8.964 15.852 1.00 9.41 C ATOM 2561 C LYS A 165 -16.323 9.123 17.137 1.00 10.47 C ATOM 2562 O LYS A 165 -16.881 9.108 18.237 1.00 11.24 O ATOM 2563 CB LYS A 165 -17.709 7.546 15.793 1.00 9.61 C ATOM 2564 CG LYS A 165 -18.564 7.268 14.569 1.00 9.69 C ATOM 2565 CD LYS A 165 -19.201 5.889 14.644 1.00 10.12 C ATOM 2566 CE LYS A 165 -19.980 5.551 13.381 1.00 10.34 C ATOM 2567 NZ LYS A 165 -19.090 5.429 12.197 1.00 10.42 N ATOM 0 H LYS A 165 -16.038 8.406 14.146 1.00 8.52 H new ATOM 0 HA LYS A 165 -17.947 9.684 15.845 1.00 9.41 H new ATOM 0 HB2 LYS A 165 -16.888 6.829 15.818 1.00 9.61 H new ATOM 0 HB3 LYS A 165 -18.309 7.375 16.687 1.00 9.61 H new ATOM 0 HG2 LYS A 165 -19.342 8.027 14.486 1.00 9.69 H new ATOM 0 HG3 LYS A 165 -17.951 7.340 13.670 1.00 9.69 H new ATOM 0 HD2 LYS A 165 -18.426 5.140 14.803 1.00 10.12 H new ATOM 0 HD3 LYS A 165 -19.869 5.844 15.504 1.00 10.12 H new ATOM 0 HE2 LYS A 165 -20.520 4.616 13.527 1.00 10.34 H new ATOM 0 HE3 LYS A 165 -20.726 6.324 13.197 1.00 10.34 H new ATOM 0 HZ1 LYS A 165 -19.623 5.020 11.403 1.00 10.42 H new ATOM 0 HZ2 LYS A 165 -18.738 6.370 11.929 1.00 10.42 H new ATOM 0 HZ3 LYS A 165 -18.286 4.812 12.429 1.00 10.42 H new ATOM 2581 N GLY A 166 -15.011 9.282 16.982 1.00 10.61 N ATOM 2582 CA GLY A 166 -14.117 9.371 18.118 1.00 11.72 C ATOM 2583 C GLY A 166 -14.482 10.486 19.072 1.00 12.02 C ATOM 2584 O GLY A 166 -14.561 10.264 20.277 1.00 13.02 O ATOM 0 H GLY A 166 -14.549 9.351 16.075 1.00 10.61 H new ATOM 0 HA2 GLY A 166 -14.126 8.423 18.656 1.00 11.72 H new ATOM 0 HA3 GLY A 166 -13.099 9.525 17.761 1.00 11.72 H new ATOM 2588 N GLN A 167 -14.725 11.678 18.537 1.00 11.25 N ATOM 2589 CA GLN A 167 -15.038 12.841 19.370 1.00 11.64 C ATOM 2590 C GLN A 167 -16.254 12.569 20.260 1.00 12.01 C ATOM 2591 O GLN A 167 -16.234 12.869 21.456 1.00 12.84 O ATOM 2592 CB GLN A 167 -15.269 14.089 18.506 1.00 10.86 C ATOM 2593 CG GLN A 167 -15.507 15.358 19.315 1.00 11.50 C ATOM 2594 CD GLN A 167 -14.382 15.651 20.289 1.00 11.89 C ATOM 2595 OE1 GLN A 167 -13.417 16.338 19.959 1.00 11.87 O ATOM 2596 NE2 GLN A 167 -14.503 15.137 21.500 1.00 12.41 N ATOM 0 H GLN A 167 -14.712 11.867 17.535 1.00 11.25 H new ATOM 0 HA GLN A 167 -14.180 13.028 20.016 1.00 11.64 H new ATOM 0 HB2 GLN A 167 -14.404 14.238 17.859 1.00 10.86 H new ATOM 0 HB3 GLN A 167 -16.127 13.917 17.856 1.00 10.86 H new ATOM 0 HG2 GLN A 167 -15.622 16.202 18.634 1.00 11.50 H new ATOM 0 HG3 GLN A 167 -16.443 15.263 19.865 1.00 11.50 H new ATOM 0 HE21 GLN A 167 -15.319 14.572 21.735 1.00 12.41 H new ATOM 0 HE22 GLN A 167 -13.780 15.305 22.200 1.00 12.41 H new ATOM 2605 N GLU A 168 -17.301 11.984 19.684 1.00 11.51 N ATOM 2606 CA GLU A 168 -18.486 11.619 20.457 1.00 11.94 C ATOM 2607 C GLU A 168 -18.129 10.596 21.532 1.00 13.03 C ATOM 2608 O GLU A 168 -18.542 10.722 22.683 1.00 13.73 O ATOM 2609 CB GLU A 168 -19.588 11.059 19.552 1.00 11.38 C ATOM 2610 CG GLU A 168 -20.198 12.089 18.616 1.00 10.85 C ATOM 2611 CD GLU A 168 -21.361 11.536 17.819 1.00 10.80 C ATOM 2612 OE1 GLU A 168 -22.498 11.530 18.338 1.00 10.98 O ATOM 2613 OE2 GLU A 168 -21.151 11.108 16.667 1.00 10.74 O ATOM 0 H GLU A 168 -17.354 11.754 18.692 1.00 11.51 H new ATOM 0 HA GLU A 168 -18.861 12.524 20.935 1.00 11.94 H new ATOM 0 HB2 GLU A 168 -19.177 10.242 18.959 1.00 11.38 H new ATOM 0 HB3 GLU A 168 -20.376 10.636 20.175 1.00 11.38 H new ATOM 0 HG2 GLU A 168 -20.536 12.947 19.197 1.00 10.85 H new ATOM 0 HG3 GLU A 168 -19.432 12.450 17.930 1.00 10.85 H new ATOM 2620 N ARG A 169 -17.341 9.597 21.153 1.00 13.26 N ATOM 2621 CA ARG A 169 -16.940 8.537 22.072 1.00 14.38 C ATOM 2622 C ARG A 169 -16.062 9.084 23.199 1.00 15.16 C ATOM 2623 O ARG A 169 -16.084 8.573 24.318 1.00 16.19 O ATOM 2624 CB ARG A 169 -16.203 7.428 21.311 1.00 14.52 C ATOM 2625 CG ARG A 169 -17.074 6.712 20.290 1.00 14.72 C ATOM 2626 CD ARG A 169 -16.273 5.723 19.453 1.00 14.96 C ATOM 2627 NE ARG A 169 -17.117 5.011 18.492 1.00 14.97 N ATOM 2628 CZ ARG A 169 -16.652 4.264 17.487 1.00 15.22 C ATOM 2629 NH1 ARG A 169 -15.348 4.186 17.254 1.00 15.46 N ATOM 2630 NH2 ARG A 169 -17.500 3.616 16.695 1.00 15.37 N ATOM 0 H ARG A 169 -16.965 9.498 20.210 1.00 13.26 H new ATOM 0 HA ARG A 169 -17.841 8.120 22.522 1.00 14.38 H new ATOM 0 HB2 ARG A 169 -15.340 7.858 20.803 1.00 14.52 H new ATOM 0 HB3 ARG A 169 -15.821 6.699 22.026 1.00 14.52 H new ATOM 0 HG2 ARG A 169 -17.877 6.185 20.804 1.00 14.72 H new ATOM 0 HG3 ARG A 169 -17.543 7.446 19.635 1.00 14.72 H new ATOM 0 HD2 ARG A 169 -15.484 6.254 18.920 1.00 14.96 H new ATOM 0 HD3 ARG A 169 -15.785 5.003 20.110 1.00 14.96 H new ATOM 0 HE ARG A 169 -18.128 5.091 18.597 1.00 14.97 H new ATOM 0 HH11 ARG A 169 -14.693 4.699 17.844 1.00 15.46 H new ATOM 0 HH12 ARG A 169 -15.001 3.613 16.485 1.00 15.46 H new ATOM 0 HH21 ARG A 169 -18.505 3.689 16.855 1.00 15.37 H new ATOM 0 HH22 ARG A 169 -17.146 3.045 15.927 1.00 15.37 H new ATOM 2644 N LEU A 170 -15.301 10.130 22.897 1.00 14.77 N ATOM 2645 CA LEU A 170 -14.424 10.760 23.881 1.00 15.59 C ATOM 2646 C LEU A 170 -15.220 11.547 24.917 1.00 16.06 C ATOM 2647 O LEU A 170 -14.868 11.568 26.097 1.00 17.05 O ATOM 2648 CB LEU A 170 -13.426 11.698 23.192 1.00 15.16 C ATOM 2649 CG LEU A 170 -12.445 11.025 22.232 1.00 15.47 C ATOM 2650 CD1 LEU A 170 -11.551 12.062 21.574 1.00 16.05 C ATOM 2651 CD2 LEU A 170 -11.605 9.990 22.962 1.00 15.45 C ATOM 0 H LEU A 170 -15.273 10.563 21.974 1.00 14.77 H new ATOM 0 HA LEU A 170 -13.884 9.962 24.390 1.00 15.59 H new ATOM 0 HB2 LEU A 170 -13.985 12.454 22.641 1.00 15.16 H new ATOM 0 HB3 LEU A 170 -12.855 12.220 23.960 1.00 15.16 H new ATOM 0 HG LEU A 170 -13.019 10.517 21.457 1.00 15.47 H new ATOM 0 HD11 LEU A 170 -10.859 11.566 20.894 1.00 16.05 H new ATOM 0 HD12 LEU A 170 -12.164 12.769 21.016 1.00 16.05 H new ATOM 0 HD13 LEU A 170 -10.988 12.595 22.340 1.00 16.05 H new ATOM 0 HD21 LEU A 170 -10.913 9.523 22.261 1.00 15.45 H new ATOM 0 HD22 LEU A 170 -11.041 10.475 23.759 1.00 15.45 H new ATOM 0 HD23 LEU A 170 -12.257 9.229 23.390 1.00 15.45 H new ATOM 2663 N GLU A 171 -16.285 12.200 24.472 1.00 15.42 N ATOM 2664 CA GLU A 171 -17.094 13.028 25.360 1.00 15.90 C ATOM 2665 C GLU A 171 -18.143 12.195 26.090 1.00 16.52 C ATOM 2666 O GLU A 171 -18.668 12.608 27.126 1.00 17.29 O ATOM 2667 CB GLU A 171 -17.762 14.158 24.577 1.00 15.17 C ATOM 2668 CG GLU A 171 -16.767 15.142 23.986 1.00 15.22 C ATOM 2669 CD GLU A 171 -17.434 16.292 23.264 1.00 14.93 C ATOM 2670 OE1 GLU A 171 -17.779 17.290 23.920 1.00 15.07 O ATOM 2671 OE2 GLU A 171 -17.629 16.197 22.032 1.00 14.68 O ATOM 0 H GLU A 171 -16.609 12.174 23.505 1.00 15.42 H new ATOM 0 HA GLU A 171 -16.431 13.463 26.107 1.00 15.90 H new ATOM 0 HB2 GLU A 171 -18.362 13.730 23.774 1.00 15.17 H new ATOM 0 HB3 GLU A 171 -18.446 14.693 25.235 1.00 15.17 H new ATOM 0 HG2 GLU A 171 -16.137 15.537 24.783 1.00 15.22 H new ATOM 0 HG3 GLU A 171 -16.111 14.616 23.292 1.00 15.22 H new ATOM 2678 N HIS A 172 -18.446 11.027 25.551 1.00 16.27 N ATOM 2679 CA HIS A 172 -19.374 10.111 26.197 1.00 16.96 C ATOM 2680 C HIS A 172 -18.615 9.182 27.134 1.00 17.80 C ATOM 2681 O HIS A 172 -17.447 9.420 27.440 1.00 18.06 O ATOM 2682 CB HIS A 172 -20.147 9.291 25.161 1.00 16.71 C ATOM 2683 CG HIS A 172 -21.082 10.104 24.320 1.00 16.63 C ATOM 2684 ND1 HIS A 172 -21.445 9.743 23.040 1.00 16.51 N ATOM 2685 CD2 HIS A 172 -21.737 11.259 24.582 1.00 16.83 C ATOM 2686 CE1 HIS A 172 -22.278 10.643 22.552 1.00 16.61 C ATOM 2687 NE2 HIS A 172 -22.471 11.571 23.467 1.00 16.80 N ATOM 0 H HIS A 172 -18.064 10.689 24.668 1.00 16.27 H new ATOM 0 HA HIS A 172 -20.091 10.698 26.771 1.00 16.96 H new ATOM 0 HB2 HIS A 172 -19.436 8.783 24.509 1.00 16.71 H new ATOM 0 HB3 HIS A 172 -20.716 8.517 25.676 1.00 16.71 H new ATOM 0 HD2 HIS A 172 -21.690 11.829 25.498 1.00 16.83 H new ATOM 0 HE1 HIS A 172 -22.725 10.622 21.569 1.00 16.61 H new ATOM 0 HE2 HIS A 172 -23.070 12.390 23.363 1.00 16.80 H new ATOM 2696 N HIS A 173 -19.272 8.129 27.590 1.00 18.31 N ATOM 2697 CA HIS A 173 -18.633 7.177 28.483 1.00 19.22 C ATOM 2698 C HIS A 173 -17.964 6.072 27.677 1.00 19.76 C ATOM 2699 O HIS A 173 -18.586 5.463 26.804 1.00 19.79 O ATOM 2700 CB HIS A 173 -19.658 6.577 29.451 1.00 19.61 C ATOM 2701 CG HIS A 173 -19.051 5.720 30.521 1.00 20.05 C ATOM 2702 ND1 HIS A 173 -19.074 4.342 30.487 1.00 20.25 N ATOM 2703 CD2 HIS A 173 -18.413 6.055 31.667 1.00 20.44 C ATOM 2704 CE1 HIS A 173 -18.477 3.868 31.563 1.00 20.74 C ATOM 2705 NE2 HIS A 173 -18.067 4.886 32.294 1.00 20.87 N ATOM 0 H HIS A 173 -20.241 7.912 27.359 1.00 18.31 H new ATOM 0 HA HIS A 173 -17.874 7.701 29.064 1.00 19.22 H new ATOM 0 HB2 HIS A 173 -20.217 7.386 29.920 1.00 19.61 H new ATOM 0 HB3 HIS A 173 -20.374 5.982 28.884 1.00 19.61 H new ATOM 0 HD2 HIS A 173 -18.214 7.056 32.021 1.00 20.44 H new ATOM 0 HE1 HIS A 173 -18.346 2.824 31.805 1.00 20.74 H new ATOM 0 HE2 HIS A 173 -17.572 4.815 33.183 1.00 20.87 H new ATOM 2714 N HIS A 174 -16.696 5.825 27.966 1.00 20.30 N ATOM 2715 CA HIS A 174 -15.958 4.758 27.310 1.00 20.96 C ATOM 2716 C HIS A 174 -16.354 3.417 27.901 1.00 21.59 C ATOM 2717 O HIS A 174 -16.246 3.202 29.109 1.00 21.97 O ATOM 2718 CB HIS A 174 -14.449 4.968 27.454 1.00 21.33 C ATOM 2719 CG HIS A 174 -13.869 5.928 26.463 1.00 21.43 C ATOM 2720 ND1 HIS A 174 -13.763 7.281 26.690 1.00 21.76 N ATOM 2721 CD2 HIS A 174 -13.335 5.714 25.240 1.00 21.37 C ATOM 2722 CE1 HIS A 174 -13.191 7.855 25.651 1.00 21.89 C ATOM 2723 NE2 HIS A 174 -12.917 6.928 24.754 1.00 21.66 N ATOM 0 H HIS A 174 -16.155 6.351 28.653 1.00 20.30 H new ATOM 0 HA HIS A 174 -16.205 4.772 26.248 1.00 20.96 H new ATOM 0 HB2 HIS A 174 -14.238 5.329 28.460 1.00 21.33 H new ATOM 0 HB3 HIS A 174 -13.947 4.006 27.349 1.00 21.33 H new ATOM 0 HD2 HIS A 174 -13.252 4.762 24.737 1.00 21.37 H new ATOM 0 HE1 HIS A 174 -12.981 8.910 25.551 1.00 21.89 H new ATOM 0 HE2 HIS A 174 -12.470 7.086 23.851 1.00 21.66 H new ATOM 2732 N HIS A 175 -16.821 2.522 27.052 1.00 21.78 N ATOM 2733 CA HIS A 175 -17.289 1.224 27.503 1.00 22.46 C ATOM 2734 C HIS A 175 -16.118 0.258 27.636 1.00 23.08 C ATOM 2735 O HIS A 175 -15.682 -0.348 26.658 1.00 23.17 O ATOM 2736 CB HIS A 175 -18.345 0.676 26.538 1.00 22.43 C ATOM 2737 CG HIS A 175 -19.025 -0.570 27.022 1.00 22.30 C ATOM 2738 ND1 HIS A 175 -19.082 -1.728 26.283 1.00 22.32 N ATOM 2739 CD2 HIS A 175 -19.695 -0.826 28.170 1.00 22.27 C ATOM 2740 CE1 HIS A 175 -19.755 -2.643 26.953 1.00 22.31 C ATOM 2741 NE2 HIS A 175 -20.137 -2.122 28.101 1.00 22.28 N ATOM 0 H HIS A 175 -16.887 2.669 26.045 1.00 21.78 H new ATOM 0 HA HIS A 175 -17.751 1.336 28.484 1.00 22.46 H new ATOM 0 HB2 HIS A 175 -19.098 1.445 26.365 1.00 22.43 H new ATOM 0 HB3 HIS A 175 -17.873 0.470 25.577 1.00 22.43 H new ATOM 0 HD2 HIS A 175 -19.852 -0.138 28.988 1.00 22.27 H new ATOM 0 HE1 HIS A 175 -19.959 -3.649 26.617 1.00 22.31 H new ATOM 0 HE2 HIS A 175 -20.674 -2.604 28.821 1.00 22.28 H new ATOM 2750 N HIS A 176 -15.609 0.132 28.853 1.00 23.60 N ATOM 2751 CA HIS A 176 -14.475 -0.744 29.140 1.00 24.32 C ATOM 2752 C HIS A 176 -14.965 -2.086 29.664 1.00 24.96 C ATOM 2753 O HIS A 176 -14.290 -2.723 30.474 1.00 25.33 O ATOM 2754 CB HIS A 176 -13.550 -0.102 30.181 1.00 24.63 C ATOM 2755 CG HIS A 176 -12.859 1.145 29.716 1.00 24.68 C ATOM 2756 ND1 HIS A 176 -13.088 2.382 30.276 1.00 24.97 N ATOM 2757 CD2 HIS A 176 -11.919 1.336 28.760 1.00 24.59 C ATOM 2758 CE1 HIS A 176 -12.320 3.278 29.689 1.00 25.05 C ATOM 2759 NE2 HIS A 176 -11.600 2.671 28.766 1.00 24.83 N ATOM 0 H HIS A 176 -15.966 0.630 29.668 1.00 23.60 H new ATOM 0 HA HIS A 176 -13.921 -0.897 28.214 1.00 24.32 H new ATOM 0 HB2 HIS A 176 -14.134 0.132 31.071 1.00 24.63 H new ATOM 0 HB3 HIS A 176 -12.796 -0.831 30.477 1.00 24.63 H new ATOM 0 HD2 HIS A 176 -11.499 0.579 28.114 1.00 24.59 H new ATOM 0 HE1 HIS A 176 -12.286 4.332 29.924 1.00 25.05 H new ATOM 0 HE2 HIS A 176 -10.917 3.120 28.156 1.00 24.83 H new ATOM 2768 N HIS A 177 -16.130 -2.509 29.171 1.00 25.19 N ATOM 2769 CA HIS A 177 -16.802 -3.727 29.632 1.00 25.89 C ATOM 2770 C HIS A 177 -17.361 -3.520 31.041 1.00 26.38 C ATOM 2771 O HIS A 177 -16.615 -3.322 32.000 1.00 26.64 O ATOM 2772 CB HIS A 177 -15.857 -4.941 29.589 1.00 26.07 C ATOM 2773 CG HIS A 177 -16.542 -6.262 29.780 1.00 26.41 C ATOM 2774 ND1 HIS A 177 -16.661 -7.202 28.777 1.00 26.57 N ATOM 2775 CD2 HIS A 177 -17.134 -6.807 30.871 1.00 26.71 C ATOM 2776 CE1 HIS A 177 -17.297 -8.261 29.241 1.00 26.95 C ATOM 2777 NE2 HIS A 177 -17.593 -8.047 30.508 1.00 27.04 N ATOM 0 H HIS A 177 -16.637 -2.015 28.437 1.00 25.19 H new ATOM 0 HA HIS A 177 -17.630 -3.935 28.955 1.00 25.89 H new ATOM 0 HB2 HIS A 177 -15.338 -4.949 28.631 1.00 26.07 H new ATOM 0 HB3 HIS A 177 -15.098 -4.823 30.362 1.00 26.07 H new ATOM 0 HD2 HIS A 177 -17.227 -6.350 31.845 1.00 26.71 H new ATOM 0 HE1 HIS A 177 -17.535 -9.152 28.679 1.00 26.95 H new ATOM 0 HE2 HIS A 177 -18.084 -8.699 31.120 1.00 27.04 H new ATOM 2786 N LEU A 178 -18.679 -3.560 31.148 1.00 26.60 N ATOM 2787 CA LEU A 178 -19.360 -3.328 32.417 1.00 27.15 C ATOM 2788 C LEU A 178 -20.152 -4.567 32.819 1.00 27.42 C ATOM 2789 O LEU A 178 -19.997 -5.633 32.216 1.00 27.57 O ATOM 2790 CB LEU A 178 -20.298 -2.122 32.301 1.00 27.23 C ATOM 2791 CG LEU A 178 -19.615 -0.783 32.013 1.00 27.46 C ATOM 2792 CD1 LEU A 178 -20.651 0.306 31.782 1.00 27.88 C ATOM 2793 CD2 LEU A 178 -18.695 -0.398 33.159 1.00 27.61 C ATOM 0 H LEU A 178 -19.305 -3.752 30.366 1.00 26.60 H new ATOM 0 HA LEU A 178 -18.613 -3.120 33.183 1.00 27.15 H new ATOM 0 HB2 LEU A 178 -21.020 -2.320 31.509 1.00 27.23 H new ATOM 0 HB3 LEU A 178 -20.861 -2.031 33.230 1.00 27.23 H new ATOM 0 HG LEU A 178 -19.017 -0.891 31.108 1.00 27.46 H new ATOM 0 HD11 LEU A 178 -20.147 1.251 31.579 1.00 27.88 H new ATOM 0 HD12 LEU A 178 -21.277 0.038 30.931 1.00 27.88 H new ATOM 0 HD13 LEU A 178 -21.273 0.411 32.671 1.00 27.88 H new ATOM 0 HD21 LEU A 178 -18.218 0.557 32.937 1.00 27.61 H new ATOM 0 HD22 LEU A 178 -19.275 -0.309 34.077 1.00 27.61 H new ATOM 0 HD23 LEU A 178 -17.931 -1.165 33.286 1.00 27.61 H new ATOM 2805 N GLU A 179 -20.982 -4.432 33.845 1.00 27.58 N ATOM 2806 CA GLU A 179 -21.834 -5.528 34.289 1.00 27.93 C ATOM 2807 C GLU A 179 -22.947 -5.779 33.276 1.00 28.01 C ATOM 2808 O GLU A 179 -23.426 -4.848 32.627 1.00 27.88 O ATOM 2809 CB GLU A 179 -22.433 -5.215 35.661 1.00 28.15 C ATOM 2810 CG GLU A 179 -21.394 -5.018 36.752 1.00 28.46 C ATOM 2811 CD GLU A 179 -20.547 -6.252 36.980 1.00 28.92 C ATOM 2812 OE1 GLU A 179 -19.515 -6.411 36.296 1.00 29.07 O ATOM 2813 OE2 GLU A 179 -20.906 -7.071 37.850 1.00 29.20 O ATOM 0 H GLU A 179 -21.084 -3.573 34.386 1.00 27.58 H new ATOM 0 HA GLU A 179 -21.224 -6.428 34.370 1.00 27.93 H new ATOM 0 HB2 GLU A 179 -23.042 -4.314 35.585 1.00 28.15 H new ATOM 0 HB3 GLU A 179 -23.100 -6.027 35.950 1.00 28.15 H new ATOM 0 HG2 GLU A 179 -20.747 -4.182 36.486 1.00 28.46 H new ATOM 0 HG3 GLU A 179 -21.895 -4.749 37.682 1.00 28.46 H new ATOM 2820 N HIS A 180 -23.352 -7.034 33.147 1.00 28.32 N ATOM 2821 CA HIS A 180 -24.375 -7.417 32.180 1.00 28.53 C ATOM 2822 C HIS A 180 -25.760 -7.023 32.672 1.00 28.95 C ATOM 2823 O HIS A 180 -26.096 -7.227 33.839 1.00 29.23 O ATOM 2824 CB HIS A 180 -24.335 -8.925 31.912 1.00 28.74 C ATOM 2825 CG HIS A 180 -23.120 -9.379 31.166 1.00 28.72 C ATOM 2826 ND1 HIS A 180 -23.171 -9.879 29.884 1.00 28.77 N ATOM 2827 CD2 HIS A 180 -21.817 -9.422 31.531 1.00 28.77 C ATOM 2828 CE1 HIS A 180 -21.954 -10.210 29.496 1.00 28.84 C ATOM 2829 NE2 HIS A 180 -21.113 -9.942 30.474 1.00 28.84 N ATOM 0 H HIS A 180 -22.987 -7.809 33.701 1.00 28.32 H new ATOM 0 HA HIS A 180 -24.166 -6.887 31.251 1.00 28.53 H new ATOM 0 HB2 HIS A 180 -24.383 -9.454 32.864 1.00 28.74 H new ATOM 0 HB3 HIS A 180 -25.223 -9.207 31.346 1.00 28.74 H new ATOM 0 HD2 HIS A 180 -21.407 -9.106 32.479 1.00 28.77 H new ATOM 0 HE1 HIS A 180 -21.691 -10.631 28.537 1.00 28.84 H new ATOM 0 HE2 HIS A 180 -20.105 -10.096 30.450 1.00 28.84 H new ATOM 2838 N HIS A 181 -26.558 -6.454 31.779 1.00 29.09 N ATOM 2839 CA HIS A 181 -27.917 -6.046 32.115 1.00 29.57 C ATOM 2840 C HIS A 181 -28.932 -6.853 31.322 1.00 29.91 C ATOM 2841 O HIS A 181 -30.132 -6.781 31.575 1.00 30.13 O ATOM 2842 CB HIS A 181 -28.126 -4.552 31.854 1.00 29.72 C ATOM 2843 CG HIS A 181 -27.307 -3.667 32.737 1.00 29.81 C ATOM 2844 ND1 HIS A 181 -26.882 -2.414 32.360 1.00 29.72 N ATOM 2845 CD2 HIS A 181 -26.838 -3.859 33.991 1.00 30.08 C ATOM 2846 CE1 HIS A 181 -26.184 -1.876 33.341 1.00 29.92 C ATOM 2847 NE2 HIS A 181 -26.144 -2.732 34.341 1.00 30.14 N ATOM 0 H HIS A 181 -26.288 -6.264 30.814 1.00 29.09 H new ATOM 0 HA HIS A 181 -28.064 -6.236 33.178 1.00 29.57 H new ATOM 0 HB2 HIS A 181 -27.883 -4.337 30.813 1.00 29.72 H new ATOM 0 HB3 HIS A 181 -29.180 -4.312 31.992 1.00 29.72 H new ATOM 0 HD2 HIS A 181 -26.984 -4.737 34.602 1.00 30.08 H new ATOM 0 HE1 HIS A 181 -25.723 -0.899 33.327 1.00 29.92 H new ATOM 0 HE2 HIS A 181 -25.672 -2.580 35.232 1.00 30.14 H new ATOM 2856 N HIS A 182 -28.443 -7.613 30.350 1.00 30.03 N ATOM 2857 CA HIS A 182 -29.299 -8.496 29.571 1.00 30.43 C ATOM 2858 C HIS A 182 -29.243 -9.905 30.139 1.00 30.87 C ATOM 2859 O HIS A 182 -28.247 -10.610 29.970 1.00 31.02 O ATOM 2860 CB HIS A 182 -28.886 -8.512 28.096 1.00 30.52 C ATOM 2861 CG HIS A 182 -29.129 -7.218 27.384 1.00 30.37 C ATOM 2862 ND1 HIS A 182 -30.344 -6.886 26.824 1.00 30.34 N ATOM 2863 CD2 HIS A 182 -28.306 -6.171 27.142 1.00 30.33 C ATOM 2864 CE1 HIS A 182 -30.257 -5.693 26.265 1.00 30.28 C ATOM 2865 NE2 HIS A 182 -29.032 -5.239 26.446 1.00 30.28 N ATOM 0 H HIS A 182 -27.459 -7.635 30.083 1.00 30.03 H new ATOM 0 HA HIS A 182 -30.320 -8.119 29.633 1.00 30.43 H new ATOM 0 HB2 HIS A 182 -27.827 -8.759 28.028 1.00 30.52 H new ATOM 0 HB3 HIS A 182 -29.432 -9.305 27.585 1.00 30.52 H new ATOM 0 HD2 HIS A 182 -27.272 -6.086 27.441 1.00 30.33 H new ATOM 0 HE1 HIS A 182 -31.053 -5.177 25.748 1.00 30.28 H new ATOM 0 HE2 HIS A 182 -28.681 -4.338 26.120 1.00 30.28 H new ATOM 2874 N HIS A 183 -30.304 -10.305 30.825 1.00 31.15 N ATOM 2875 CA HIS A 183 -30.347 -11.624 31.445 1.00 31.67 C ATOM 2876 C HIS A 183 -30.535 -12.704 30.387 1.00 32.06 C ATOM 2877 O HIS A 183 -31.442 -12.626 29.559 1.00 32.12 O ATOM 2878 CB HIS A 183 -31.457 -11.710 32.511 1.00 31.92 C ATOM 2879 CG HIS A 183 -32.858 -11.729 31.971 1.00 31.89 C ATOM 2880 ND1 HIS A 183 -33.647 -12.859 31.973 1.00 31.92 N ATOM 2881 CD2 HIS A 183 -33.613 -10.750 31.419 1.00 31.92 C ATOM 2882 CE1 HIS A 183 -34.822 -12.574 31.445 1.00 31.97 C ATOM 2883 NE2 HIS A 183 -34.826 -11.302 31.102 1.00 31.97 N ATOM 0 H HIS A 183 -31.142 -9.741 30.967 1.00 31.15 H new ATOM 0 HA HIS A 183 -29.393 -11.788 31.947 1.00 31.67 H new ATOM 0 HB2 HIS A 183 -31.301 -12.611 33.104 1.00 31.92 H new ATOM 0 HB3 HIS A 183 -31.356 -10.861 33.187 1.00 31.92 H new ATOM 0 HD2 HIS A 183 -33.314 -9.725 31.258 1.00 31.92 H new ATOM 0 HE1 HIS A 183 -35.641 -13.266 31.316 1.00 31.97 H new ATOM 0 HE2 HIS A 183 -35.607 -10.808 30.670 1.00 31.97 H new ATOM 2892 N HIS A 184 -29.658 -13.689 30.401 1.00 32.40 N ATOM 2893 CA HIS A 184 -29.747 -14.806 29.472 1.00 32.88 C ATOM 2894 C HIS A 184 -29.780 -16.119 30.244 1.00 33.44 C ATOM 2895 O HIS A 184 -30.369 -17.104 29.799 1.00 33.70 O ATOM 2896 CB HIS A 184 -28.566 -14.788 28.496 1.00 33.08 C ATOM 2897 CG HIS A 184 -28.723 -15.735 27.346 1.00 32.98 C ATOM 2898 ND1 HIS A 184 -27.722 -16.580 26.922 1.00 33.08 N ATOM 2899 CD2 HIS A 184 -29.768 -15.950 26.512 1.00 32.87 C ATOM 2900 CE1 HIS A 184 -28.143 -17.272 25.880 1.00 33.03 C ATOM 2901 NE2 HIS A 184 -29.381 -16.909 25.613 1.00 32.91 N ATOM 0 H HIS A 184 -28.871 -13.741 31.048 1.00 32.40 H new ATOM 0 HA HIS A 184 -30.667 -14.712 28.895 1.00 32.88 H new ATOM 0 HB2 HIS A 184 -28.441 -13.777 28.109 1.00 33.08 H new ATOM 0 HB3 HIS A 184 -27.654 -15.036 29.038 1.00 33.08 H new ATOM 0 HD2 HIS A 184 -30.728 -15.457 26.549 1.00 32.87 H new ATOM 0 HE1 HIS A 184 -27.570 -18.010 25.338 1.00 33.03 H new ATOM 0 HE2 HIS A 184 -29.958 -17.282 24.859 1.00 32.91 H new ATOM 2910 N HIS A 185 -29.150 -16.116 31.408 1.00 33.68 N ATOM 2911 CA HIS A 185 -29.149 -17.279 32.278 1.00 34.28 C ATOM 2912 C HIS A 185 -30.428 -17.303 33.095 1.00 34.40 C ATOM 2913 O HIS A 185 -31.314 -18.125 32.794 1.00 34.51 O ATOM 2914 CB HIS A 185 -27.931 -17.265 33.208 1.00 34.66 C ATOM 2915 CG HIS A 185 -26.624 -17.421 32.495 1.00 35.20 C ATOM 2916 ND1 HIS A 185 -25.962 -18.623 32.399 1.00 35.58 N ATOM 2917 CD2 HIS A 185 -25.851 -16.517 31.847 1.00 35.50 C ATOM 2918 CE1 HIS A 185 -24.841 -18.456 31.724 1.00 36.07 C ATOM 2919 NE2 HIS A 185 -24.750 -17.187 31.378 1.00 36.03 N ATOM 2920 OXT HIS A 185 -30.562 -16.461 34.004 1.00 34.44 O ATOM 0 H HIS A 185 -28.631 -15.317 31.772 1.00 33.68 H new ATOM 0 HA HIS A 185 -29.094 -18.176 31.661 1.00 34.28 H new ATOM 0 HB2 HIS A 185 -27.921 -16.328 33.764 1.00 34.66 H new ATOM 0 HB3 HIS A 185 -28.034 -18.068 33.938 1.00 34.66 H new ATOM 0 HD2 HIS A 185 -26.062 -15.465 31.723 1.00 35.50 H new ATOM 0 HE1 HIS A 185 -24.121 -19.227 31.494 1.00 36.07 H new ATOM 0 HE2 HIS A 185 -23.985 -16.771 30.847 1.00 36.03 H new TER 2929 HIS A 185