USER MOD reduce.3.24.130724 H: found=0, std=0, add=1336, rem=0, adj=50 USER MOD reduce.3.24.130724 removed 1264 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 101 THR OG1 : rot -174:sc= -0.646 USER MOD Set 1.2: A 103 ASN : amide:sc= 0 X(o=-0.65,f=-0.78) USER MOD Set 2.1: A 10 TYR OH : rot 120:sc= 0.816 USER MOD Set 2.2: A 96 LYS NZ :NH3+ 132:sc= 0.315 (180deg=-1.5) USER MOD Set 2.3: A 113 SER OG : rot -140:sc= -1.73! USER MOD Set 3.1: A -3 SER OG : rot 38:sc= 0.033 USER MOD Set 3.2: A -4 SER OG : rot 180:sc= -0.0102 USER MOD Set 4.1: A 0 MET CE :methyl -162:sc= -0.816 (180deg=-1.77!) USER MOD Set 4.2: A 31 THR OG1 : rot 180:sc= -0.115 USER MOD Single : A 2 LYS NZ :NH3+ -165:sc= -0.0152 (180deg=-0.237) USER MOD Single : A 3 TYR OH : rot 3:sc= 0.0696 USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -5 HIS : no HD1:sc= -0.834 K(o=-0.83,f=0.22) USER MOD Single : A -6 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -7 HIS : no HD1:sc= 0 X(o=0,f=-0.0055) USER MOD Single : A -8 HIS : no HD1:sc= 0 X(o=0,f=-0.0081) USER MOD Single : A -9 HIS : no HD1:sc= 0 X(o=0,f=-0.004) USER MOD Single : A 14 MET CE :methyl 140:sc= -0.898 (180deg=-2.69!) USER MOD Single : A 23 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 ASN : amide:sc= -0.618 X(o=-0.62,f=-0.18) USER MOD Single : A 26 SER OG : rot 60:sc= 0.464 USER MOD Single : A 30 LYS NZ :NH3+ -169:sc= 2.24 (180deg=2.07) USER MOD Single : A 34 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00581) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 71:sc= -1.23 USER MOD Single : A 43 LYS NZ :NH3+ 166:sc= -0.0681 (180deg=-0.388) USER MOD Single : A 44 ASN : amide:sc= -3.91! K(o=-3.9!,f=-0.33) USER MOD Single : A 45 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 53 LYS NZ :NH3+ 159:sc= 0 (180deg=-0.509) USER MOD Single : A 54 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0545) USER MOD Single : A 55 LYS NZ :NH3+ -172:sc= -0.22 (180deg=-0.265) USER MOD Single : A 56 SER OG : rot 30:sc= -0.486 USER MOD Single : A 62 LYS NZ :NH3+ 167:sc= 0.676 (180deg=0.43) USER MOD Single : A 65 LYS NZ :NH3+ -151:sc= 1.45 (180deg=-0.0215) USER MOD Single : A 67 HIS : no HD1:sc= -0.537 X(o=-0.54,f=-0.18) USER MOD Single : A 69 MET CE :methyl -160:sc= -2.84! (180deg=-3.93!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ -165:sc= -0.037 (180deg=-0.25) USER MOD Single : A 82 LYS NZ :NH3+ 169:sc= 1.15 (180deg=0.899) USER MOD Single : A 87 LYS NZ :NH3+ -165:sc= -0.0237 (180deg=-0.267) USER MOD Single : A 88 SER OG : rot -78:sc= 1.13 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A -10 HIS : no HE2:sc= -0.142 K(o=-0.14,f=-0.74) USER MOD Single : A -11 SER OG : rot 180:sc= 0 USER MOD Single : A -12 SER OG : rot -150:sc= -0.171 USER MOD Single : A -14 MET CE :methyl 160:sc= -0.213 (180deg=-0.828) USER MOD Single : A -14 MET N :NH3+ -173:sc= 0 (180deg=-0.0348) USER MOD Single : A 100 TYR OH : rot -72:sc= 0.438 USER MOD Single : A 106 THR OG1 : rot -71:sc= 1.11 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 LYS NZ :NH3+ -177:sc= 1.08 (180deg=1.06) USER MOD Single : A 115 LYS NZ :NH3+ -127:sc= 0.748 (180deg=-0.134) USER MOD Single : A 119 LYS NZ :NH3+ 178:sc= 1.19 (180deg=1.17) USER MOD Single : A 121 TYR OH : rot 30:sc= -0.0315 USER MOD Single : A 122 LYS NZ :NH3+ -155:sc= -0.163 (180deg=-0.659) USER MOD Single : A 124 MET CE :methyl -144:sc= -0.373 (180deg=-2.21) USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 129 LYS NZ :NH3+ -169:sc= 0.345 (180deg=0.293) USER MOD Single : A 134 LYS NZ :NH3+ -164:sc= 1.21 (180deg=1.16) USER MOD Single : A 135 GLN : amide:sc= -0.38 K(o=-0.38,f=-2.2) USER MOD Single : A 141 LYS NZ :NH3+ 169:sc= -0.0173 (180deg=-0.172) USER MOD Single : A 145 SER OG : rot 180:sc= 0 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 168:sc= -0.0402 (180deg=-0.231) USER MOD Single : A 155 ASN : amide:sc= -1.54 K(o=-1.5,f=-0.19) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -14 8.110 30.045 9.141 1.00 23.34 N ATOM 2 CA MET A -14 6.771 29.445 8.926 1.00 23.09 C ATOM 3 C MET A -14 6.812 28.433 7.791 1.00 22.83 C ATOM 4 O MET A -14 6.356 27.300 7.947 1.00 23.06 O ATOM 5 CB MET A -14 5.727 30.522 8.614 1.00 23.32 C ATOM 6 CG MET A -14 5.410 31.434 9.788 1.00 23.49 C ATOM 7 SD MET A -14 4.208 32.714 9.363 1.00 23.59 S ATOM 8 CE MET A -14 2.821 31.719 8.817 1.00 23.42 C ATOM 0 H1 MET A -14 8.090 30.642 9.992 1.00 23.34 H new ATOM 0 H2 MET A -14 8.813 29.289 9.265 1.00 23.34 H new ATOM 0 H3 MET A -14 8.367 30.625 8.317 1.00 23.34 H new ATOM 0 HA MET A -14 6.486 28.938 9.848 1.00 23.09 H new ATOM 0 HB2 MET A -14 6.084 31.129 7.782 1.00 23.32 H new ATOM 0 HB3 MET A -14 4.808 30.038 8.285 1.00 23.32 H new ATOM 0 HG2 MET A -14 5.024 30.837 10.614 1.00 23.49 H new ATOM 0 HG3 MET A -14 6.329 31.904 10.137 1.00 23.49 H new ATOM 0 HE1 MET A -14 1.908 32.312 8.861 1.00 23.42 H new ATOM 0 HE2 MET A -14 2.991 31.390 7.792 1.00 23.42 H new ATOM 0 HE3 MET A -14 2.720 30.849 9.465 1.00 23.42 H new ATOM 20 N GLY A -13 7.351 28.839 6.651 1.00 22.47 N ATOM 21 CA GLY A -13 7.455 27.931 5.528 1.00 22.32 C ATOM 22 C GLY A -13 7.556 28.663 4.209 1.00 21.64 C ATOM 23 O GLY A -13 8.608 29.205 3.871 1.00 21.33 O ATOM 0 H GLY A -13 7.717 29.776 6.484 1.00 22.47 H new ATOM 0 HA2 GLY A -13 8.331 27.295 5.657 1.00 22.32 H new ATOM 0 HA3 GLY A -13 6.585 27.275 5.512 1.00 22.32 H new ATOM 27 N SER A -12 6.458 28.705 3.476 1.00 21.51 N ATOM 28 CA SER A -12 6.441 29.343 2.174 1.00 20.97 C ATOM 29 C SER A -12 6.151 30.833 2.317 1.00 20.41 C ATOM 30 O SER A -12 4.992 31.258 2.343 1.00 20.34 O ATOM 31 CB SER A -12 5.402 28.683 1.264 1.00 21.18 C ATOM 32 OG SER A -12 5.535 29.132 -0.076 1.00 21.36 O ATOM 0 H SER A -12 5.565 28.304 3.762 1.00 21.51 H new ATOM 0 HA SER A -12 7.424 29.221 1.719 1.00 20.97 H new ATOM 0 HB2 SER A -12 5.518 27.600 1.301 1.00 21.18 H new ATOM 0 HB3 SER A -12 4.400 28.909 1.628 1.00 21.18 H new ATOM 0 HG SER A -12 4.660 29.111 -0.516 1.00 21.36 H new ATOM 38 N SER A -11 7.208 31.615 2.434 1.00 20.15 N ATOM 39 CA SER A -11 7.096 33.062 2.493 1.00 19.73 C ATOM 40 C SER A -11 7.900 33.687 1.359 1.00 19.37 C ATOM 41 O SER A -11 8.403 34.806 1.466 1.00 19.50 O ATOM 42 CB SER A -11 7.585 33.565 3.851 1.00 20.02 C ATOM 43 OG SER A -11 8.852 33.007 4.178 1.00 20.19 O ATOM 0 H SER A -11 8.165 31.268 2.491 1.00 20.15 H new ATOM 0 HA SER A -11 6.052 33.352 2.376 1.00 19.73 H new ATOM 0 HB2 SER A -11 7.656 34.653 3.835 1.00 20.02 H new ATOM 0 HB3 SER A -11 6.860 33.304 4.622 1.00 20.02 H new ATOM 0 HG SER A -11 9.143 33.346 5.050 1.00 20.19 H new ATOM 49 N HIS A -10 8.016 32.942 0.267 1.00 19.05 N ATOM 50 CA HIS A -10 8.811 33.363 -0.872 1.00 18.80 C ATOM 51 C HIS A -10 8.023 34.351 -1.727 1.00 17.89 C ATOM 52 O HIS A -10 7.130 33.962 -2.479 1.00 17.81 O ATOM 53 CB HIS A -10 9.224 32.143 -1.700 1.00 19.29 C ATOM 54 CG HIS A -10 10.326 32.419 -2.677 1.00 20.11 C ATOM 55 ND1 HIS A -10 10.205 32.213 -4.033 1.00 20.55 N ATOM 56 CD2 HIS A -10 11.587 32.870 -2.480 1.00 20.68 C ATOM 57 CE1 HIS A -10 11.341 32.526 -4.625 1.00 21.33 C ATOM 58 NE2 HIS A -10 12.195 32.928 -3.709 1.00 21.42 N ATOM 0 H HIS A -10 7.564 32.035 0.149 1.00 19.05 H new ATOM 0 HA HIS A -10 9.712 33.861 -0.513 1.00 18.80 H new ATOM 0 HB2 HIS A -10 9.541 31.348 -1.025 1.00 19.29 H new ATOM 0 HB3 HIS A -10 8.354 31.773 -2.243 1.00 19.29 H new ATOM 0 HD1 HIS A -10 9.368 31.872 -4.506 1.00 20.55 H new ATOM 0 HD2 HIS A -10 12.032 33.135 -1.532 1.00 20.68 H new ATOM 0 HE1 HIS A -10 11.537 32.463 -5.685 1.00 21.33 H new ATOM 67 N HIS A -9 8.369 35.629 -1.594 1.00 17.33 N ATOM 68 CA HIS A -9 7.674 36.712 -2.290 1.00 16.53 C ATOM 69 C HIS A -9 7.669 36.505 -3.800 1.00 15.50 C ATOM 70 O HIS A -9 6.661 36.743 -4.458 1.00 15.25 O ATOM 71 CB HIS A -9 8.315 38.065 -1.962 1.00 16.68 C ATOM 72 CG HIS A -9 7.998 38.571 -0.588 1.00 17.20 C ATOM 73 ND1 HIS A -9 8.863 38.458 0.480 1.00 17.69 N ATOM 74 CD2 HIS A -9 6.905 39.218 -0.116 1.00 17.45 C ATOM 75 CE1 HIS A -9 8.312 39.009 1.547 1.00 18.20 C ATOM 76 NE2 HIS A -9 7.127 39.476 1.210 1.00 18.08 N ATOM 0 H HIS A -9 9.138 35.944 -1.002 1.00 17.33 H new ATOM 0 HA HIS A -9 6.641 36.704 -1.941 1.00 16.53 H new ATOM 0 HB2 HIS A -9 9.397 37.978 -2.066 1.00 16.68 H new ATOM 0 HB3 HIS A -9 7.983 38.800 -2.695 1.00 16.68 H new ATOM 0 HD2 HIS A -9 6.023 39.481 -0.681 1.00 17.45 H new ATOM 0 HE1 HIS A -9 8.758 39.067 2.529 1.00 18.20 H new ATOM 0 HE2 HIS A -9 6.479 39.953 1.837 1.00 18.08 H new ATOM 85 N HIS A -8 8.796 36.064 -4.341 1.00 15.05 N ATOM 86 CA HIS A -8 8.911 35.822 -5.774 1.00 14.17 C ATOM 87 C HIS A -8 8.209 34.527 -6.164 1.00 13.33 C ATOM 88 O HIS A -8 8.815 33.457 -6.174 1.00 13.18 O ATOM 89 CB HIS A -8 10.379 35.770 -6.199 1.00 14.48 C ATOM 90 CG HIS A -8 11.008 37.118 -6.364 1.00 15.02 C ATOM 91 ND1 HIS A -8 11.622 37.522 -7.532 1.00 15.53 N ATOM 92 CD2 HIS A -8 11.121 38.158 -5.506 1.00 15.28 C ATOM 93 CE1 HIS A -8 12.085 38.748 -7.381 1.00 16.06 C ATOM 94 NE2 HIS A -8 11.793 39.156 -6.163 1.00 15.93 N ATOM 0 H HIS A -8 9.644 35.866 -3.810 1.00 15.05 H new ATOM 0 HA HIS A -8 8.426 36.650 -6.292 1.00 14.17 H new ATOM 0 HB2 HIS A -8 10.943 35.205 -5.457 1.00 14.48 H new ATOM 0 HB3 HIS A -8 10.456 35.226 -7.140 1.00 14.48 H new ATOM 0 HD2 HIS A -8 10.751 38.195 -4.492 1.00 15.28 H new ATOM 0 HE1 HIS A -8 12.614 39.320 -8.129 1.00 16.06 H new ATOM 0 HE2 HIS A -8 12.029 40.068 -5.772 1.00 15.93 H new ATOM 103 N HIS A -7 6.928 34.628 -6.478 1.00 12.97 N ATOM 104 CA HIS A -7 6.143 33.466 -6.857 1.00 12.32 C ATOM 105 C HIS A -7 6.221 33.222 -8.359 1.00 11.63 C ATOM 106 O HIS A -7 5.378 33.695 -9.122 1.00 11.60 O ATOM 107 CB HIS A -7 4.680 33.632 -6.434 1.00 12.67 C ATOM 108 CG HIS A -7 4.460 33.563 -4.954 1.00 12.79 C ATOM 109 ND1 HIS A -7 4.070 34.646 -4.198 1.00 12.93 N ATOM 110 CD2 HIS A -7 4.559 32.523 -4.092 1.00 13.01 C ATOM 111 CE1 HIS A -7 3.940 34.278 -2.939 1.00 13.22 C ATOM 112 NE2 HIS A -7 4.229 32.994 -2.846 1.00 13.27 N ATOM 0 H HIS A -7 6.409 35.506 -6.478 1.00 12.97 H new ATOM 0 HA HIS A -7 6.562 32.603 -6.339 1.00 12.32 H new ATOM 0 HB2 HIS A -7 4.313 34.591 -6.801 1.00 12.67 H new ATOM 0 HB3 HIS A -7 4.083 32.857 -6.916 1.00 12.67 H new ATOM 0 HD2 HIS A -7 4.845 31.511 -4.339 1.00 13.01 H new ATOM 0 HE1 HIS A -7 3.646 34.919 -2.121 1.00 13.22 H new ATOM 0 HE2 HIS A -7 4.210 32.442 -1.989 1.00 13.27 H new ATOM 121 N HIS A -6 7.248 32.500 -8.782 1.00 11.27 N ATOM 122 CA HIS A -6 7.370 32.088 -10.174 1.00 10.81 C ATOM 123 C HIS A -6 6.602 30.785 -10.371 1.00 10.06 C ATOM 124 O HIS A -6 7.185 29.703 -10.442 1.00 10.07 O ATOM 125 CB HIS A -6 8.850 31.923 -10.558 1.00 11.05 C ATOM 126 CG HIS A -6 9.086 31.636 -12.018 1.00 11.45 C ATOM 127 ND1 HIS A -6 9.286 32.622 -12.958 1.00 11.75 N ATOM 128 CD2 HIS A -6 9.174 30.461 -12.690 1.00 11.82 C ATOM 129 CE1 HIS A -6 9.485 32.069 -14.141 1.00 12.27 C ATOM 130 NE2 HIS A -6 9.423 30.757 -14.008 1.00 12.33 N ATOM 0 H HIS A -6 8.010 32.187 -8.181 1.00 11.27 H new ATOM 0 HA HIS A -6 6.947 32.854 -10.824 1.00 10.81 H new ATOM 0 HB2 HIS A -6 9.386 32.833 -10.288 1.00 11.05 H new ATOM 0 HB3 HIS A -6 9.278 31.113 -9.967 1.00 11.05 H new ATOM 0 HD2 HIS A -6 9.068 29.473 -12.266 1.00 11.82 H new ATOM 0 HE1 HIS A -6 9.668 32.601 -15.063 1.00 12.27 H new ATOM 0 HE2 HIS A -6 9.540 30.077 -14.759 1.00 12.33 H new ATOM 139 N HIS A -5 5.287 30.897 -10.437 1.00 9.63 N ATOM 140 CA HIS A -5 4.424 29.730 -10.514 1.00 9.11 C ATOM 141 C HIS A -5 4.275 29.266 -11.957 1.00 8.16 C ATOM 142 O HIS A -5 3.446 29.782 -12.702 1.00 8.12 O ATOM 143 CB HIS A -5 3.053 30.048 -9.906 1.00 9.69 C ATOM 144 CG HIS A -5 2.122 28.875 -9.844 1.00 10.23 C ATOM 145 ND1 HIS A -5 2.206 27.897 -8.876 1.00 10.62 N ATOM 146 CD2 HIS A -5 1.081 28.527 -10.636 1.00 10.71 C ATOM 147 CE1 HIS A -5 1.260 27.001 -9.075 1.00 11.27 C ATOM 148 NE2 HIS A -5 0.564 27.360 -10.135 1.00 11.33 N ATOM 0 H HIS A -5 4.791 31.788 -10.439 1.00 9.63 H new ATOM 0 HA HIS A -5 4.881 28.921 -9.943 1.00 9.11 H new ATOM 0 HB2 HIS A -5 3.196 30.438 -8.898 1.00 9.69 H new ATOM 0 HB3 HIS A -5 2.584 30.840 -10.490 1.00 9.69 H new ATOM 0 HD2 HIS A -5 0.724 29.067 -11.501 1.00 10.71 H new ATOM 0 HE1 HIS A -5 1.085 26.122 -8.472 1.00 11.27 H new ATOM 0 HE2 HIS A -5 -0.232 26.851 -10.521 1.00 11.33 H new ATOM 157 N SER A -4 5.084 28.294 -12.340 1.00 7.67 N ATOM 158 CA SER A -4 5.032 27.748 -13.683 1.00 6.97 C ATOM 159 C SER A -4 5.234 26.237 -13.635 1.00 6.27 C ATOM 160 O SER A -4 5.621 25.690 -12.599 1.00 6.26 O ATOM 161 CB SER A -4 6.096 28.408 -14.566 1.00 7.36 C ATOM 162 OG SER A -4 5.901 28.088 -15.935 1.00 7.95 O ATOM 0 H SER A -4 5.787 27.866 -11.737 1.00 7.67 H new ATOM 0 HA SER A -4 4.053 27.956 -14.115 1.00 6.97 H new ATOM 0 HB2 SER A -4 6.061 29.489 -14.435 1.00 7.36 H new ATOM 0 HB3 SER A -4 7.087 28.081 -14.251 1.00 7.36 H new ATOM 0 HG SER A -4 6.593 28.524 -16.475 1.00 7.95 H new ATOM 168 N SER A -3 4.971 25.580 -14.758 1.00 6.06 N ATOM 169 CA SER A -3 5.058 24.130 -14.857 1.00 5.84 C ATOM 170 C SER A -3 6.469 23.627 -14.551 1.00 5.11 C ATOM 171 O SER A -3 7.446 24.076 -15.155 1.00 5.39 O ATOM 172 CB SER A -3 4.628 23.693 -16.257 1.00 6.61 C ATOM 173 OG SER A -3 5.217 24.519 -17.246 1.00 7.36 O ATOM 0 H SER A -3 4.691 26.038 -15.625 1.00 6.06 H new ATOM 0 HA SER A -3 4.391 23.693 -14.114 1.00 5.84 H new ATOM 0 HB2 SER A -3 4.918 22.656 -16.424 1.00 6.61 H new ATOM 0 HB3 SER A -3 3.542 23.738 -16.339 1.00 6.61 H new ATOM 0 HG SER A -3 6.134 24.743 -16.982 1.00 7.36 H new ATOM 179 N GLY A -2 6.566 22.701 -13.605 1.00 4.57 N ATOM 180 CA GLY A -2 7.851 22.135 -13.248 1.00 4.26 C ATOM 181 C GLY A -2 8.215 22.392 -11.800 1.00 3.39 C ATOM 182 O GLY A -2 9.200 21.850 -11.292 1.00 3.57 O ATOM 0 H GLY A -2 5.775 22.332 -13.078 1.00 4.57 H new ATOM 0 HA2 GLY A -2 7.834 21.060 -13.430 1.00 4.26 H new ATOM 0 HA3 GLY A -2 8.622 22.556 -13.893 1.00 4.26 H new ATOM 186 N HIS A -1 7.423 23.217 -11.126 1.00 2.94 N ATOM 187 CA HIS A -1 7.700 23.570 -9.737 1.00 2.48 C ATOM 188 C HIS A -1 6.537 23.193 -8.827 1.00 1.95 C ATOM 189 O HIS A -1 6.566 23.456 -7.625 1.00 2.40 O ATOM 190 CB HIS A -1 8.004 25.068 -9.610 1.00 3.02 C ATOM 191 CG HIS A -1 9.248 25.489 -10.329 1.00 3.37 C ATOM 192 ND1 HIS A -1 10.487 25.535 -9.731 1.00 4.00 N ATOM 193 CD2 HIS A -1 9.439 25.880 -11.611 1.00 3.77 C ATOM 194 CE1 HIS A -1 11.386 25.932 -10.611 1.00 4.52 C ATOM 195 NE2 HIS A -1 10.777 26.148 -11.758 1.00 4.43 N ATOM 0 H HIS A -1 6.587 23.653 -11.516 1.00 2.94 H new ATOM 0 HA HIS A -1 8.576 23.004 -9.421 1.00 2.48 H new ATOM 0 HB2 HIS A -1 7.159 25.636 -9.999 1.00 3.02 H new ATOM 0 HB3 HIS A -1 8.100 25.323 -8.555 1.00 3.02 H new ATOM 0 HD2 HIS A -1 8.680 25.965 -12.375 1.00 3.77 H new ATOM 0 HE1 HIS A -1 12.442 26.058 -10.423 1.00 4.52 H new ATOM 0 HE2 HIS A -1 11.227 26.464 -12.617 1.00 4.43 H new ATOM 204 N MET A 0 5.520 22.576 -9.409 1.00 1.39 N ATOM 205 CA MET A 0 4.348 22.148 -8.656 1.00 1.16 C ATOM 206 C MET A 0 3.622 21.039 -9.408 1.00 1.03 C ATOM 207 O MET A 0 2.754 21.302 -10.246 1.00 1.08 O ATOM 208 CB MET A 0 3.408 23.330 -8.411 1.00 1.34 C ATOM 209 CG MET A 0 2.212 22.974 -7.546 1.00 1.63 C ATOM 210 SD MET A 0 1.510 24.406 -6.707 1.00 2.00 S ATOM 211 CE MET A 0 2.932 24.942 -5.757 1.00 1.61 C ATOM 0 H MET A 0 5.482 22.359 -10.405 1.00 1.39 H new ATOM 0 HA MET A 0 4.674 21.763 -7.690 1.00 1.16 H new ATOM 0 HB2 MET A 0 3.965 24.136 -7.935 1.00 1.34 H new ATOM 0 HB3 MET A 0 3.055 23.710 -9.370 1.00 1.34 H new ATOM 0 HG2 MET A 0 1.445 22.510 -8.166 1.00 1.63 H new ATOM 0 HG3 MET A 0 2.513 22.234 -6.804 1.00 1.63 H new ATOM 0 HE1 MET A 0 2.605 25.602 -4.953 1.00 1.61 H new ATOM 0 HE2 MET A 0 3.434 24.073 -5.332 1.00 1.61 H new ATOM 0 HE3 MET A 0 3.623 25.478 -6.408 1.00 1.61 H new ATOM 221 N PHE A 1 3.988 19.800 -9.106 1.00 1.03 N ATOM 222 CA PHE A 1 3.463 18.641 -9.819 1.00 1.07 C ATOM 223 C PHE A 1 1.964 18.477 -9.589 1.00 0.89 C ATOM 224 O PHE A 1 1.417 18.944 -8.585 1.00 0.81 O ATOM 225 CB PHE A 1 4.193 17.364 -9.376 1.00 1.39 C ATOM 226 CG PHE A 1 3.790 16.867 -8.012 1.00 0.93 C ATOM 227 CD1 PHE A 1 4.246 17.493 -6.864 1.00 1.15 C ATOM 228 CD2 PHE A 1 2.949 15.771 -7.884 1.00 1.11 C ATOM 229 CE1 PHE A 1 3.872 17.036 -5.615 1.00 1.47 C ATOM 230 CE2 PHE A 1 2.571 15.311 -6.639 1.00 1.14 C ATOM 231 CZ PHE A 1 3.034 15.945 -5.503 1.00 1.31 C ATOM 0 H PHE A 1 4.652 19.570 -8.366 1.00 1.03 H new ATOM 0 HA PHE A 1 3.632 18.806 -10.883 1.00 1.07 H new ATOM 0 HB2 PHE A 1 4.005 16.578 -10.108 1.00 1.39 H new ATOM 0 HB3 PHE A 1 5.267 17.552 -9.380 1.00 1.39 H new ATOM 0 HD1 PHE A 1 4.901 18.348 -6.946 1.00 1.15 H new ATOM 0 HD2 PHE A 1 2.586 15.272 -8.770 1.00 1.11 H new ATOM 0 HE1 PHE A 1 4.235 17.532 -4.727 1.00 1.47 H new ATOM 0 HE2 PHE A 1 1.915 14.457 -6.553 1.00 1.14 H new ATOM 0 HZ PHE A 1 2.740 15.587 -4.527 1.00 1.31 H new ATOM 241 N LYS A 2 1.313 17.796 -10.514 1.00 0.96 N ATOM 242 CA LYS A 2 -0.103 17.503 -10.399 1.00 0.98 C ATOM 243 C LYS A 2 -0.313 16.000 -10.347 1.00 1.01 C ATOM 244 O LYS A 2 0.523 15.230 -10.818 1.00 1.42 O ATOM 245 CB LYS A 2 -0.881 18.075 -11.585 1.00 1.14 C ATOM 246 CG LYS A 2 -0.874 19.589 -11.667 1.00 1.62 C ATOM 247 CD LYS A 2 -1.629 20.070 -12.896 1.00 2.02 C ATOM 248 CE LYS A 2 -1.744 21.585 -12.931 1.00 2.67 C ATOM 249 NZ LYS A 2 -2.550 22.108 -11.796 1.00 3.15 N ATOM 0 H LYS A 2 1.748 17.432 -11.362 1.00 0.96 H new ATOM 0 HA LYS A 2 -0.471 17.965 -9.483 1.00 0.98 H new ATOM 0 HB2 LYS A 2 -0.463 17.671 -12.507 1.00 1.14 H new ATOM 0 HB3 LYS A 2 -1.914 17.731 -11.526 1.00 1.14 H new ATOM 0 HG2 LYS A 2 -1.329 20.008 -10.769 1.00 1.62 H new ATOM 0 HG3 LYS A 2 0.154 19.950 -11.702 1.00 1.62 H new ATOM 0 HD2 LYS A 2 -1.119 19.723 -13.795 1.00 2.02 H new ATOM 0 HD3 LYS A 2 -2.626 19.630 -12.906 1.00 2.02 H new ATOM 0 HE2 LYS A 2 -0.747 22.025 -12.901 1.00 2.67 H new ATOM 0 HE3 LYS A 2 -2.200 21.892 -13.872 1.00 2.67 H new ATOM 0 HZ1 LYS A 2 -2.819 23.094 -11.987 1.00 3.15 H new ATOM 0 HZ2 LYS A 2 -3.408 21.531 -11.684 1.00 3.15 H new ATOM 0 HZ3 LYS A 2 -1.988 22.065 -10.922 1.00 3.15 H new ATOM 263 N TYR A 3 -1.441 15.591 -9.784 1.00 0.91 N ATOM 264 CA TYR A 3 -1.819 14.186 -9.746 1.00 0.94 C ATOM 265 C TYR A 3 -2.099 13.689 -11.162 1.00 1.01 C ATOM 266 O TYR A 3 -2.075 12.492 -11.438 1.00 0.90 O ATOM 267 CB TYR A 3 -3.051 14.010 -8.850 1.00 1.02 C ATOM 268 CG TYR A 3 -3.537 12.584 -8.723 1.00 1.12 C ATOM 269 CD1 TYR A 3 -2.711 11.597 -8.202 1.00 1.31 C ATOM 270 CD2 TYR A 3 -4.814 12.223 -9.135 1.00 1.36 C ATOM 271 CE1 TYR A 3 -3.144 10.290 -8.093 1.00 1.62 C ATOM 272 CE2 TYR A 3 -5.253 10.917 -9.028 1.00 1.78 C ATOM 273 CZ TYR A 3 -4.443 9.969 -8.472 1.00 1.87 C ATOM 274 OH TYR A 3 -4.850 8.654 -8.400 1.00 2.35 O ATOM 0 H TYR A 3 -2.115 16.218 -9.344 1.00 0.91 H new ATOM 0 HA TYR A 3 -1.002 13.596 -9.331 1.00 0.94 H new ATOM 0 HB2 TYR A 3 -2.818 14.391 -7.856 1.00 1.02 H new ATOM 0 HB3 TYR A 3 -3.862 14.623 -9.244 1.00 1.02 H new ATOM 0 HD1 TYR A 3 -1.714 11.855 -7.877 1.00 1.31 H new ATOM 0 HD2 TYR A 3 -5.473 12.974 -9.545 1.00 1.36 H new ATOM 0 HE1 TYR A 3 -2.481 9.525 -7.717 1.00 1.62 H new ATOM 0 HE2 TYR A 3 -6.236 10.646 -9.384 1.00 1.78 H new ATOM 0 HH TYR A 3 -4.125 8.107 -8.032 1.00 2.35 H new ATOM 284 N GLU A 4 -2.321 14.638 -12.063 1.00 1.38 N ATOM 285 CA GLU A 4 -2.611 14.335 -13.454 1.00 1.74 C ATOM 286 C GLU A 4 -1.322 14.123 -14.244 1.00 1.24 C ATOM 287 O GLU A 4 -1.349 13.600 -15.356 1.00 1.52 O ATOM 288 CB GLU A 4 -3.419 15.468 -14.082 1.00 2.44 C ATOM 289 CG GLU A 4 -4.735 15.743 -13.377 1.00 3.05 C ATOM 290 CD GLU A 4 -5.487 16.905 -13.989 1.00 3.65 C ATOM 291 OE1 GLU A 4 -6.259 16.686 -14.945 1.00 4.16 O ATOM 292 OE2 GLU A 4 -5.308 18.047 -13.523 1.00 3.95 O ATOM 0 H GLU A 4 -2.305 15.635 -11.849 1.00 1.38 H new ATOM 0 HA GLU A 4 -3.194 13.415 -13.486 1.00 1.74 H new ATOM 0 HB2 GLU A 4 -2.818 16.377 -14.077 1.00 2.44 H new ATOM 0 HB3 GLU A 4 -3.620 15.224 -15.125 1.00 2.44 H new ATOM 0 HG2 GLU A 4 -5.358 14.850 -13.416 1.00 3.05 H new ATOM 0 HG3 GLU A 4 -4.543 15.952 -12.325 1.00 3.05 H new ATOM 299 N ASP A 5 -0.193 14.529 -13.668 1.00 0.71 N ATOM 300 CA ASP A 5 1.091 14.406 -14.356 1.00 0.73 C ATOM 301 C ASP A 5 1.776 13.106 -13.971 1.00 0.72 C ATOM 302 O ASP A 5 2.824 12.751 -14.511 1.00 0.90 O ATOM 303 CB ASP A 5 2.004 15.595 -14.046 1.00 1.07 C ATOM 304 CG ASP A 5 1.557 16.869 -14.733 1.00 1.83 C ATOM 305 OD1 ASP A 5 0.719 17.597 -14.159 1.00 2.57 O ATOM 306 OD2 ASP A 5 2.029 17.145 -15.854 1.00 2.15 O ATOM 0 H ASP A 5 -0.140 14.942 -12.737 1.00 0.71 H new ATOM 0 HA ASP A 5 0.895 14.400 -15.428 1.00 0.73 H new ATOM 0 HB2 ASP A 5 2.029 15.758 -12.968 1.00 1.07 H new ATOM 0 HB3 ASP A 5 3.022 15.357 -14.356 1.00 1.07 H new ATOM 311 N ILE A 6 1.174 12.409 -13.024 1.00 0.58 N ATOM 312 CA ILE A 6 1.650 11.103 -12.605 1.00 0.55 C ATOM 313 C ILE A 6 1.060 10.041 -13.528 1.00 0.54 C ATOM 314 O ILE A 6 -0.124 10.115 -13.871 1.00 0.58 O ATOM 315 CB ILE A 6 1.241 10.819 -11.140 1.00 0.55 C ATOM 316 CG1 ILE A 6 1.777 11.921 -10.220 1.00 0.63 C ATOM 317 CG2 ILE A 6 1.745 9.452 -10.687 1.00 0.56 C ATOM 318 CD1 ILE A 6 1.367 11.764 -8.773 1.00 0.69 C ATOM 0 H ILE A 6 0.344 12.731 -12.525 1.00 0.58 H new ATOM 0 HA ILE A 6 2.738 11.081 -12.664 1.00 0.55 H new ATOM 0 HB ILE A 6 0.153 10.811 -11.083 1.00 0.55 H new ATOM 0 HG12 ILE A 6 2.865 11.933 -10.280 1.00 0.63 H new ATOM 0 HG13 ILE A 6 1.427 12.887 -10.584 1.00 0.63 H new ATOM 0 HG21 ILE A 6 1.444 9.277 -9.654 1.00 0.56 H new ATOM 0 HG22 ILE A 6 1.319 8.678 -11.325 1.00 0.56 H new ATOM 0 HG23 ILE A 6 2.832 9.423 -10.758 1.00 0.56 H new ATOM 0 HD11 ILE A 6 1.785 12.582 -8.186 1.00 0.69 H new ATOM 0 HD12 ILE A 6 0.280 11.783 -8.699 1.00 0.69 H new ATOM 0 HD13 ILE A 6 1.741 10.814 -8.390 1.00 0.69 H new ATOM 325 N PRO A 7 1.886 9.074 -13.983 1.00 0.53 N ATOM 326 CA PRO A 7 1.439 7.978 -14.851 1.00 0.55 C ATOM 327 C PRO A 7 0.148 7.335 -14.363 1.00 0.53 C ATOM 328 O PRO A 7 0.114 6.708 -13.299 1.00 0.52 O ATOM 329 CB PRO A 7 2.594 6.984 -14.769 1.00 0.55 C ATOM 330 CG PRO A 7 3.794 7.836 -14.557 1.00 0.60 C ATOM 331 CD PRO A 7 3.333 8.985 -13.699 1.00 0.54 C ATOM 0 HA PRO A 7 1.216 8.320 -15.861 1.00 0.55 H new ATOM 0 HB2 PRO A 7 2.456 6.280 -13.949 1.00 0.55 H new ATOM 0 HB3 PRO A 7 2.679 6.396 -15.683 1.00 0.55 H new ATOM 0 HG2 PRO A 7 4.590 7.276 -14.066 1.00 0.60 H new ATOM 0 HG3 PRO A 7 4.194 8.192 -15.506 1.00 0.60 H new ATOM 0 HD2 PRO A 7 3.523 8.797 -12.642 1.00 0.54 H new ATOM 0 HD3 PRO A 7 3.849 9.910 -13.956 1.00 0.54 H new ATOM 339 N ALA A 8 -0.909 7.486 -15.152 1.00 0.55 N ATOM 340 CA ALA A 8 -2.229 6.994 -14.781 1.00 0.54 C ATOM 341 C ALA A 8 -2.253 5.476 -14.668 1.00 0.55 C ATOM 342 O ALA A 8 -3.102 4.917 -13.973 1.00 0.56 O ATOM 343 CB ALA A 8 -3.273 7.469 -15.775 1.00 0.57 C ATOM 0 H ALA A 8 -0.876 7.949 -16.060 1.00 0.55 H new ATOM 0 HA ALA A 8 -2.467 7.401 -13.798 1.00 0.54 H new ATOM 0 HB1 ALA A 8 -4.253 7.092 -15.482 1.00 0.57 H new ATOM 0 HB2 ALA A 8 -3.293 8.559 -15.789 1.00 0.57 H new ATOM 0 HB3 ALA A 8 -3.024 7.098 -16.769 1.00 0.57 H new ATOM 349 N ASP A 9 -1.318 4.807 -15.338 1.00 0.55 N ATOM 350 CA ASP A 9 -1.251 3.351 -15.273 1.00 0.57 C ATOM 351 C ASP A 9 -0.941 2.919 -13.849 1.00 0.54 C ATOM 352 O ASP A 9 -1.451 1.919 -13.348 1.00 0.55 O ATOM 353 CB ASP A 9 -0.182 2.802 -16.224 1.00 0.61 C ATOM 354 CG ASP A 9 -0.557 2.960 -17.682 1.00 0.93 C ATOM 355 OD1 ASP A 9 -1.525 2.309 -18.124 1.00 1.33 O ATOM 356 OD2 ASP A 9 0.112 3.737 -18.392 1.00 1.37 O ATOM 0 H ASP A 9 -0.606 5.243 -15.924 1.00 0.55 H new ATOM 0 HA ASP A 9 -2.217 2.950 -15.580 1.00 0.57 H new ATOM 0 HB2 ASP A 9 0.761 3.316 -16.038 1.00 0.61 H new ATOM 0 HB3 ASP A 9 -0.018 1.746 -16.008 1.00 0.61 H new ATOM 361 N TYR A 10 -0.104 3.727 -13.207 1.00 0.52 N ATOM 362 CA TYR A 10 0.358 3.476 -11.851 1.00 0.50 C ATOM 363 C TYR A 10 -0.604 4.087 -10.833 1.00 0.49 C ATOM 364 O TYR A 10 -0.609 3.707 -9.663 1.00 0.51 O ATOM 365 CB TYR A 10 1.771 4.057 -11.688 1.00 0.52 C ATOM 366 CG TYR A 10 2.364 3.921 -10.300 1.00 0.53 C ATOM 367 CD1 TYR A 10 2.714 2.680 -9.785 1.00 0.59 C ATOM 368 CD2 TYR A 10 2.579 5.043 -9.512 1.00 0.59 C ATOM 369 CE1 TYR A 10 3.260 2.561 -8.520 1.00 0.66 C ATOM 370 CE2 TYR A 10 3.124 4.932 -8.249 1.00 0.66 C ATOM 371 CZ TYR A 10 3.462 3.691 -7.757 1.00 0.70 C ATOM 372 OH TYR A 10 4.002 3.580 -6.491 1.00 0.80 O ATOM 0 H TYR A 10 0.274 4.580 -13.618 1.00 0.52 H new ATOM 0 HA TYR A 10 0.389 2.402 -11.670 1.00 0.50 H new ATOM 0 HB2 TYR A 10 2.434 3.565 -12.400 1.00 0.52 H new ATOM 0 HB3 TYR A 10 1.746 5.114 -11.954 1.00 0.52 H new ATOM 0 HD1 TYR A 10 2.557 1.794 -10.382 1.00 0.59 H new ATOM 0 HD2 TYR A 10 2.316 6.019 -9.893 1.00 0.59 H new ATOM 0 HE1 TYR A 10 3.526 1.589 -8.132 1.00 0.66 H new ATOM 0 HE2 TYR A 10 3.285 5.815 -7.649 1.00 0.66 H new ATOM 0 HH TYR A 10 4.839 4.087 -6.447 1.00 0.80 H new ATOM 382 N ARG A 11 -1.426 5.034 -11.283 1.00 0.48 N ATOM 383 CA ARG A 11 -2.435 5.628 -10.413 1.00 0.49 C ATOM 384 C ARG A 11 -3.576 4.642 -10.209 1.00 0.50 C ATOM 385 O ARG A 11 -4.278 4.672 -9.201 1.00 0.54 O ATOM 386 CB ARG A 11 -2.952 6.944 -10.994 1.00 0.51 C ATOM 387 CG ARG A 11 -2.004 8.113 -10.793 1.00 0.48 C ATOM 388 CD ARG A 11 -2.267 9.236 -11.783 1.00 0.60 C ATOM 389 NE ARG A 11 -3.687 9.549 -11.926 1.00 0.88 N ATOM 390 CZ ARG A 11 -4.177 10.306 -12.907 1.00 1.19 C ATOM 391 NH1 ARG A 11 -3.361 10.838 -13.812 1.00 1.61 N ATOM 392 NH2 ARG A 11 -5.480 10.530 -12.983 1.00 1.73 N ATOM 0 H ARG A 11 -1.413 5.402 -12.234 1.00 0.48 H new ATOM 0 HA ARG A 11 -1.981 5.851 -9.447 1.00 0.49 H new ATOM 0 HB2 ARG A 11 -3.133 6.814 -12.061 1.00 0.51 H new ATOM 0 HB3 ARG A 11 -3.911 7.182 -10.534 1.00 0.51 H new ATOM 0 HG2 ARG A 11 -2.108 8.494 -9.777 1.00 0.48 H new ATOM 0 HG3 ARG A 11 -0.976 7.768 -10.900 1.00 0.48 H new ATOM 0 HD2 ARG A 11 -1.734 10.130 -11.460 1.00 0.60 H new ATOM 0 HD3 ARG A 11 -1.862 8.958 -12.756 1.00 0.60 H new ATOM 0 HE ARG A 11 -4.337 9.168 -11.239 1.00 0.88 H new ATOM 0 HH11 ARG A 11 -2.357 10.667 -13.756 1.00 1.61 H new ATOM 0 HH12 ARG A 11 -3.739 11.417 -14.562 1.00 1.61 H new ATOM 0 HH21 ARG A 11 -6.109 10.123 -12.291 1.00 1.73 H new ATOM 0 HH22 ARG A 11 -5.855 11.110 -13.734 1.00 1.73 H new ATOM 406 N ASP A 12 -3.732 3.755 -11.181 1.00 0.48 N ATOM 407 CA ASP A 12 -4.675 2.652 -11.089 1.00 0.50 C ATOM 408 C ASP A 12 -4.236 1.668 -10.013 1.00 0.52 C ATOM 409 O ASP A 12 -5.050 0.952 -9.439 1.00 0.62 O ATOM 410 CB ASP A 12 -4.765 1.931 -12.437 1.00 0.51 C ATOM 411 CG ASP A 12 -5.958 0.998 -12.508 1.00 0.76 C ATOM 412 OD1 ASP A 12 -7.104 1.481 -12.419 1.00 1.02 O ATOM 413 OD2 ASP A 12 -5.758 -0.226 -12.657 1.00 0.99 O ATOM 0 H ASP A 12 -3.208 3.780 -12.056 1.00 0.48 H new ATOM 0 HA ASP A 12 -5.654 3.052 -10.825 1.00 0.50 H new ATOM 0 HB2 ASP A 12 -4.834 2.668 -13.237 1.00 0.51 H new ATOM 0 HB3 ASP A 12 -3.850 1.362 -12.605 1.00 0.51 H new ATOM 418 N LEU A 13 -2.934 1.650 -9.737 1.00 0.50 N ATOM 419 CA LEU A 13 -2.366 0.764 -8.725 1.00 0.53 C ATOM 420 C LEU A 13 -2.410 1.412 -7.343 1.00 0.62 C ATOM 421 O LEU A 13 -1.842 0.893 -6.383 1.00 0.93 O ATOM 422 CB LEU A 13 -0.918 0.409 -9.077 1.00 0.49 C ATOM 423 CG LEU A 13 -0.726 -0.348 -10.392 1.00 0.44 C ATOM 424 CD1 LEU A 13 0.750 -0.585 -10.663 1.00 0.78 C ATOM 425 CD2 LEU A 13 -1.471 -1.669 -10.359 1.00 0.88 C ATOM 0 H LEU A 13 -2.249 2.244 -10.204 1.00 0.50 H new ATOM 0 HA LEU A 13 -2.966 -0.146 -8.705 1.00 0.53 H new ATOM 0 HB2 LEU A 13 -0.337 1.330 -9.120 1.00 0.49 H new ATOM 0 HB3 LEU A 13 -0.503 -0.192 -8.268 1.00 0.49 H new ATOM 0 HG LEU A 13 -1.133 0.262 -11.198 1.00 0.44 H new ATOM 0 HD11 LEU A 13 0.865 -1.125 -11.603 1.00 0.78 H new ATOM 0 HD12 LEU A 13 1.266 0.373 -10.729 1.00 0.78 H new ATOM 0 HD13 LEU A 13 1.179 -1.173 -9.852 1.00 0.78 H new ATOM 0 HD21 LEU A 13 -1.323 -2.194 -11.303 1.00 0.88 H new ATOM 0 HD22 LEU A 13 -1.091 -2.280 -9.540 1.00 0.88 H new ATOM 0 HD23 LEU A 13 -2.535 -1.483 -10.210 1.00 0.88 H new ATOM 437 N MET A 14 -3.073 2.555 -7.248 1.00 0.55 N ATOM 438 CA MET A 14 -3.194 3.254 -5.979 1.00 0.64 C ATOM 439 C MET A 14 -4.487 2.855 -5.282 1.00 0.55 C ATOM 440 O MET A 14 -5.574 3.010 -5.842 1.00 0.53 O ATOM 441 CB MET A 14 -3.169 4.769 -6.186 1.00 0.82 C ATOM 442 CG MET A 14 -1.875 5.290 -6.786 1.00 0.97 C ATOM 443 SD MET A 14 -1.895 7.082 -7.009 1.00 1.15 S ATOM 444 CE MET A 14 -0.311 7.351 -7.797 1.00 1.04 C ATOM 0 H MET A 14 -3.534 3.016 -8.032 1.00 0.55 H new ATOM 0 HA MET A 14 -2.345 2.973 -5.356 1.00 0.64 H new ATOM 0 HB2 MET A 14 -3.998 5.050 -6.836 1.00 0.82 H new ATOM 0 HB3 MET A 14 -3.336 5.259 -5.227 1.00 0.82 H new ATOM 0 HG2 MET A 14 -1.041 5.016 -6.140 1.00 0.97 H new ATOM 0 HG3 MET A 14 -1.704 4.808 -7.749 1.00 0.97 H new ATOM 0 HE1 MET A 14 -0.417 8.102 -8.580 1.00 1.04 H new ATOM 0 HE2 MET A 14 0.409 7.699 -7.057 1.00 1.04 H new ATOM 0 HE3 MET A 14 0.041 6.417 -8.235 1.00 1.04 H new ATOM 454 N PRO A 15 -4.388 2.321 -4.054 1.00 0.62 N ATOM 455 CA PRO A 15 -5.562 1.946 -3.269 1.00 0.67 C ATOM 456 C PRO A 15 -6.379 3.175 -2.878 1.00 0.59 C ATOM 457 O PRO A 15 -5.813 4.259 -2.723 1.00 0.57 O ATOM 458 CB PRO A 15 -4.972 1.265 -2.028 1.00 0.88 C ATOM 459 CG PRO A 15 -3.576 1.780 -1.932 1.00 0.90 C ATOM 460 CD PRO A 15 -3.127 2.042 -3.342 1.00 0.74 C ATOM 0 HA PRO A 15 -6.245 1.300 -3.821 1.00 0.67 H new ATOM 0 HB2 PRO A 15 -5.545 1.509 -1.134 1.00 0.88 H new ATOM 0 HB3 PRO A 15 -4.986 0.180 -2.129 1.00 0.88 H new ATOM 0 HG2 PRO A 15 -3.538 2.692 -1.336 1.00 0.90 H new ATOM 0 HG3 PRO A 15 -2.926 1.053 -1.445 1.00 0.90 H new ATOM 0 HD2 PRO A 15 -2.440 2.887 -3.395 1.00 0.74 H new ATOM 0 HD3 PRO A 15 -2.608 1.182 -3.765 1.00 0.74 H new ATOM 468 N PRO A 16 -7.709 3.024 -2.718 1.00 0.65 N ATOM 469 CA PRO A 16 -8.622 4.154 -2.494 1.00 0.70 C ATOM 470 C PRO A 16 -8.112 5.142 -1.451 1.00 0.71 C ATOM 471 O PRO A 16 -8.139 6.350 -1.682 1.00 0.74 O ATOM 472 CB PRO A 16 -9.914 3.486 -2.030 1.00 0.85 C ATOM 473 CG PRO A 16 -9.880 2.131 -2.648 1.00 0.96 C ATOM 474 CD PRO A 16 -8.427 1.737 -2.729 1.00 0.76 C ATOM 0 HA PRO A 16 -8.740 4.756 -3.395 1.00 0.70 H new ATOM 0 HB2 PRO A 16 -9.960 3.425 -0.943 1.00 0.85 H new ATOM 0 HB3 PRO A 16 -10.790 4.048 -2.355 1.00 0.85 H new ATOM 0 HG2 PRO A 16 -10.443 1.416 -2.048 1.00 0.96 H new ATOM 0 HG3 PRO A 16 -10.335 2.144 -3.639 1.00 0.96 H new ATOM 0 HD2 PRO A 16 -8.136 1.110 -1.886 1.00 0.76 H new ATOM 0 HD3 PRO A 16 -8.217 1.170 -3.636 1.00 0.76 H new ATOM 482 N GLU A 17 -7.619 4.631 -0.333 1.00 0.78 N ATOM 483 CA GLU A 17 -7.109 5.481 0.739 1.00 0.89 C ATOM 484 C GLU A 17 -5.984 6.388 0.236 1.00 0.84 C ATOM 485 O GLU A 17 -6.019 7.602 0.424 1.00 1.13 O ATOM 486 CB GLU A 17 -6.596 4.623 1.900 1.00 1.09 C ATOM 487 CG GLU A 17 -7.516 3.462 2.272 1.00 1.48 C ATOM 488 CD GLU A 17 -8.953 3.884 2.521 1.00 1.36 C ATOM 489 OE1 GLU A 17 -9.725 3.989 1.550 1.00 1.65 O ATOM 490 OE2 GLU A 17 -9.310 4.131 3.692 1.00 1.83 O ATOM 0 H GLU A 17 -7.560 3.631 -0.142 1.00 0.78 H new ATOM 0 HA GLU A 17 -7.931 6.107 1.087 1.00 0.89 H new ATOM 0 HB2 GLU A 17 -5.615 4.226 1.638 1.00 1.09 H new ATOM 0 HB3 GLU A 17 -6.459 5.259 2.775 1.00 1.09 H new ATOM 0 HG2 GLU A 17 -7.496 2.722 1.472 1.00 1.48 H new ATOM 0 HG3 GLU A 17 -7.129 2.974 3.166 1.00 1.48 H new ATOM 497 N ALA A 18 -5.006 5.792 -0.432 1.00 0.72 N ATOM 498 CA ALA A 18 -3.822 6.521 -0.870 1.00 0.73 C ATOM 499 C ALA A 18 -4.135 7.473 -2.019 1.00 0.62 C ATOM 500 O ALA A 18 -3.585 8.574 -2.090 1.00 0.72 O ATOM 501 CB ALA A 18 -2.728 5.546 -1.276 1.00 0.82 C ATOM 0 H ALA A 18 -5.009 4.803 -0.683 1.00 0.72 H new ATOM 0 HA ALA A 18 -3.475 7.123 -0.031 1.00 0.73 H new ATOM 0 HB1 ALA A 18 -1.848 6.101 -1.601 1.00 0.82 H new ATOM 0 HB2 ALA A 18 -2.466 4.918 -0.425 1.00 0.82 H new ATOM 0 HB3 ALA A 18 -3.084 4.919 -2.093 1.00 0.82 H new ATOM 507 N ARG A 19 -5.017 7.053 -2.917 1.00 0.52 N ATOM 508 CA ARG A 19 -5.347 7.865 -4.084 1.00 0.49 C ATOM 509 C ARG A 19 -6.283 9.009 -3.709 1.00 0.50 C ATOM 510 O ARG A 19 -6.260 10.057 -4.347 1.00 0.52 O ATOM 511 CB ARG A 19 -5.949 7.007 -5.200 1.00 0.52 C ATOM 512 CG ARG A 19 -7.210 6.260 -4.803 1.00 0.64 C ATOM 513 CD ARG A 19 -7.649 5.289 -5.889 1.00 0.72 C ATOM 514 NE ARG A 19 -7.971 5.966 -7.140 1.00 1.01 N ATOM 515 CZ ARG A 19 -7.788 5.430 -8.346 1.00 1.43 C ATOM 516 NH1 ARG A 19 -7.247 4.222 -8.467 1.00 1.46 N ATOM 517 NH2 ARG A 19 -8.136 6.109 -9.431 1.00 2.16 N ATOM 0 H ARG A 19 -5.513 6.164 -2.862 1.00 0.52 H new ATOM 0 HA ARG A 19 -4.421 8.300 -4.460 1.00 0.49 H new ATOM 0 HB2 ARG A 19 -6.173 7.647 -6.053 1.00 0.52 H new ATOM 0 HB3 ARG A 19 -5.202 6.285 -5.530 1.00 0.52 H new ATOM 0 HG2 ARG A 19 -7.034 5.715 -3.876 1.00 0.64 H new ATOM 0 HG3 ARG A 19 -8.010 6.974 -4.607 1.00 0.64 H new ATOM 0 HD2 ARG A 19 -6.856 4.562 -6.066 1.00 0.72 H new ATOM 0 HD3 ARG A 19 -8.521 4.732 -5.545 1.00 0.72 H new ATOM 0 HE ARG A 19 -8.360 6.907 -7.089 1.00 1.01 H new ATOM 0 HH11 ARG A 19 -6.970 3.701 -7.635 1.00 1.46 H new ATOM 0 HH12 ARG A 19 -7.109 3.815 -9.392 1.00 1.46 H new ATOM 0 HH21 ARG A 19 -8.543 7.040 -9.341 1.00 2.16 H new ATOM 0 HH22 ARG A 19 -7.997 5.700 -10.355 1.00 2.16 H new ATOM 531 N ASP A 20 -7.103 8.801 -2.680 1.00 0.53 N ATOM 532 CA ASP A 20 -7.969 9.861 -2.156 1.00 0.57 C ATOM 533 C ASP A 20 -7.143 11.078 -1.756 1.00 0.56 C ATOM 534 O ASP A 20 -7.485 12.205 -2.094 1.00 0.57 O ATOM 535 CB ASP A 20 -8.772 9.361 -0.955 1.00 0.63 C ATOM 536 CG ASP A 20 -9.672 10.429 -0.361 1.00 0.80 C ATOM 537 OD1 ASP A 20 -10.754 10.688 -0.929 1.00 1.06 O ATOM 538 OD2 ASP A 20 -9.315 10.993 0.697 1.00 0.98 O ATOM 0 H ASP A 20 -7.187 7.910 -2.192 1.00 0.53 H new ATOM 0 HA ASP A 20 -8.663 10.149 -2.945 1.00 0.57 H new ATOM 0 HB2 ASP A 20 -9.380 8.509 -1.260 1.00 0.63 H new ATOM 0 HB3 ASP A 20 -8.085 9.004 -0.188 1.00 0.63 H new ATOM 543 N PHE A 21 -6.044 10.832 -1.059 1.00 0.57 N ATOM 544 CA PHE A 21 -5.125 11.892 -0.655 1.00 0.57 C ATOM 545 C PHE A 21 -4.635 12.709 -1.855 1.00 0.55 C ATOM 546 O PHE A 21 -4.888 13.908 -1.904 1.00 0.64 O ATOM 547 CB PHE A 21 -3.953 11.307 0.131 1.00 0.60 C ATOM 548 CG PHE A 21 -3.081 12.344 0.776 1.00 0.59 C ATOM 549 CD1 PHE A 21 -3.568 13.121 1.814 1.00 0.62 C ATOM 550 CD2 PHE A 21 -1.781 12.542 0.345 1.00 0.64 C ATOM 551 CE1 PHE A 21 -2.771 14.078 2.411 1.00 0.65 C ATOM 552 CE2 PHE A 21 -0.980 13.499 0.939 1.00 0.65 C ATOM 553 CZ PHE A 21 -1.476 14.268 1.972 1.00 0.63 C ATOM 0 H PHE A 21 -5.763 9.899 -0.758 1.00 0.57 H new ATOM 0 HA PHE A 21 -5.670 12.577 -0.006 1.00 0.57 H new ATOM 0 HB2 PHE A 21 -4.341 10.641 0.902 1.00 0.60 H new ATOM 0 HB3 PHE A 21 -3.345 10.700 -0.539 1.00 0.60 H new ATOM 0 HD1 PHE A 21 -4.581 12.977 2.160 1.00 0.62 H new ATOM 0 HD2 PHE A 21 -1.389 11.943 -0.463 1.00 0.64 H new ATOM 0 HE1 PHE A 21 -3.161 14.677 3.221 1.00 0.65 H new ATOM 0 HE2 PHE A 21 0.033 13.645 0.595 1.00 0.65 H new ATOM 0 HZ PHE A 21 -0.852 15.017 2.436 1.00 0.63 H new ATOM 563 N LEU A 22 -3.969 12.113 -2.826 1.00 0.56 N ATOM 564 CA LEU A 22 -3.505 12.898 -3.977 1.00 0.55 C ATOM 565 C LEU A 22 -4.655 13.283 -4.911 1.00 0.54 C ATOM 566 O LEU A 22 -4.463 14.069 -5.839 1.00 0.57 O ATOM 567 CB LEU A 22 -2.389 12.190 -4.745 1.00 0.56 C ATOM 568 CG LEU A 22 -0.988 12.341 -4.154 1.00 0.65 C ATOM 569 CD1 LEU A 22 0.011 11.506 -4.937 1.00 1.04 C ATOM 570 CD2 LEU A 22 -0.569 13.805 -4.151 1.00 1.13 C ATOM 0 H LEU A 22 -3.738 11.120 -2.853 1.00 0.56 H new ATOM 0 HA LEU A 22 -3.089 13.820 -3.571 1.00 0.55 H new ATOM 0 HB2 LEU A 22 -2.628 11.128 -4.803 1.00 0.56 H new ATOM 0 HB3 LEU A 22 -2.377 12.570 -5.767 1.00 0.56 H new ATOM 0 HG LEU A 22 -1.006 11.983 -3.125 1.00 0.65 H new ATOM 0 HD11 LEU A 22 1.004 11.625 -4.503 1.00 1.04 H new ATOM 0 HD12 LEU A 22 -0.280 10.456 -4.895 1.00 1.04 H new ATOM 0 HD13 LEU A 22 0.027 11.837 -5.975 1.00 1.04 H new ATOM 0 HD21 LEU A 22 0.431 13.896 -3.727 1.00 1.13 H new ATOM 0 HD22 LEU A 22 -0.566 14.185 -5.173 1.00 1.13 H new ATOM 0 HD23 LEU A 22 -1.272 14.383 -3.551 1.00 1.13 H new ATOM 582 N GLN A 23 -5.837 12.746 -4.674 1.00 0.52 N ATOM 583 CA GLN A 23 -7.052 13.301 -5.259 1.00 0.52 C ATOM 584 C GLN A 23 -7.357 14.667 -4.630 1.00 0.53 C ATOM 585 O GLN A 23 -7.787 15.599 -5.311 1.00 0.54 O ATOM 586 CB GLN A 23 -8.224 12.343 -5.029 1.00 0.53 C ATOM 587 CG GLN A 23 -9.510 12.760 -5.716 1.00 0.78 C ATOM 588 CD GLN A 23 -10.648 11.800 -5.435 1.00 1.38 C ATOM 589 OE1 GLN A 23 -10.844 10.821 -6.156 1.00 2.05 O ATOM 590 NE2 GLN A 23 -11.404 12.070 -4.385 1.00 2.06 N ATOM 0 H GLN A 23 -5.986 11.928 -4.083 1.00 0.52 H new ATOM 0 HA GLN A 23 -6.906 13.430 -6.331 1.00 0.52 H new ATOM 0 HB2 GLN A 23 -7.942 11.351 -5.381 1.00 0.53 H new ATOM 0 HB3 GLN A 23 -8.407 12.261 -3.958 1.00 0.53 H new ATOM 0 HG2 GLN A 23 -9.790 13.759 -5.383 1.00 0.78 H new ATOM 0 HG3 GLN A 23 -9.343 12.817 -6.792 1.00 0.78 H new ATOM 0 HE21 GLN A 23 -11.208 12.892 -3.813 1.00 2.06 H new ATOM 0 HE22 GLN A 23 -12.183 11.457 -4.147 1.00 2.06 H new ATOM 599 N ASN A 24 -7.119 14.770 -3.321 1.00 0.58 N ATOM 600 CA ASN A 24 -7.383 16.002 -2.573 1.00 0.65 C ATOM 601 C ASN A 24 -6.360 17.068 -2.932 1.00 0.60 C ATOM 602 O ASN A 24 -6.713 18.185 -3.313 1.00 0.63 O ATOM 603 CB ASN A 24 -7.319 15.769 -1.055 1.00 0.85 C ATOM 604 CG ASN A 24 -8.213 14.648 -0.552 1.00 1.10 C ATOM 605 OD1 ASN A 24 -7.898 14.010 0.455 1.00 1.84 O ATOM 606 ND2 ASN A 24 -9.325 14.401 -1.224 1.00 1.21 N ATOM 0 H ASN A 24 -6.742 14.011 -2.754 1.00 0.58 H new ATOM 0 HA ASN A 24 -8.387 16.329 -2.843 1.00 0.65 H new ATOM 0 HB2 ASN A 24 -6.289 15.547 -0.777 1.00 0.85 H new ATOM 0 HB3 ASN A 24 -7.595 16.693 -0.546 1.00 0.85 H new ATOM 0 HD21 ASN A 24 -9.955 13.662 -0.913 1.00 1.21 H new ATOM 0 HD22 ASN A 24 -9.553 14.950 -2.053 1.00 1.21 H new ATOM 613 N LEU A 25 -5.091 16.705 -2.790 1.00 0.60 N ATOM 614 CA LEU A 25 -3.982 17.601 -3.061 1.00 0.65 C ATOM 615 C LEU A 25 -4.079 18.185 -4.463 1.00 0.64 C ATOM 616 O LEU A 25 -4.248 17.462 -5.443 1.00 0.64 O ATOM 617 CB LEU A 25 -2.657 16.855 -2.893 1.00 0.76 C ATOM 618 CG LEU A 25 -2.189 16.607 -1.456 1.00 0.59 C ATOM 619 CD1 LEU A 25 -1.795 17.905 -0.809 1.00 0.81 C ATOM 620 CD2 LEU A 25 -3.239 15.932 -0.609 1.00 1.05 C ATOM 0 H LEU A 25 -4.805 15.776 -2.482 1.00 0.60 H new ATOM 0 HA LEU A 25 -4.026 18.424 -2.348 1.00 0.65 H new ATOM 0 HB2 LEU A 25 -2.742 15.891 -3.395 1.00 0.76 H new ATOM 0 HB3 LEU A 25 -1.881 17.417 -3.412 1.00 0.76 H new ATOM 0 HG LEU A 25 -1.332 15.937 -1.518 1.00 0.59 H new ATOM 0 HD11 LEU A 25 -1.464 17.717 0.212 1.00 0.81 H new ATOM 0 HD12 LEU A 25 -0.983 18.362 -1.375 1.00 0.81 H new ATOM 0 HD13 LEU A 25 -2.652 18.579 -0.794 1.00 0.81 H new ATOM 0 HD21 LEU A 25 -2.852 15.781 0.399 1.00 1.05 H new ATOM 0 HD22 LEU A 25 -4.130 16.559 -0.566 1.00 1.05 H new ATOM 0 HD23 LEU A 25 -3.495 14.967 -1.047 1.00 1.05 H new ATOM 632 N SER A 26 -3.942 19.502 -4.544 1.00 0.73 N ATOM 633 CA SER A 26 -4.142 20.207 -5.801 1.00 0.83 C ATOM 634 C SER A 26 -2.969 21.143 -6.097 1.00 1.02 C ATOM 635 O SER A 26 -2.045 20.778 -6.828 1.00 1.78 O ATOM 636 CB SER A 26 -5.464 20.981 -5.768 1.00 0.93 C ATOM 637 OG SER A 26 -6.556 20.115 -5.490 1.00 1.72 O ATOM 0 H SER A 26 -3.694 20.101 -3.757 1.00 0.73 H new ATOM 0 HA SER A 26 -4.190 19.472 -6.605 1.00 0.83 H new ATOM 0 HB2 SER A 26 -5.413 21.762 -5.010 1.00 0.93 H new ATOM 0 HB3 SER A 26 -5.623 21.476 -6.726 1.00 0.93 H new ATOM 0 HG SER A 26 -6.420 19.686 -4.620 1.00 1.72 H new ATOM 643 N ASP A 27 -2.986 22.329 -5.507 1.00 0.96 N ATOM 644 CA ASP A 27 -1.914 23.298 -5.701 1.00 1.11 C ATOM 645 C ASP A 27 -1.683 24.066 -4.410 1.00 1.13 C ATOM 646 O ASP A 27 -2.581 24.180 -3.582 1.00 1.95 O ATOM 647 CB ASP A 27 -2.241 24.271 -6.839 1.00 1.42 C ATOM 648 CG ASP A 27 -3.394 25.194 -6.507 1.00 1.84 C ATOM 649 OD1 ASP A 27 -4.553 24.826 -6.777 1.00 2.19 O ATOM 650 OD2 ASP A 27 -3.146 26.296 -5.970 1.00 2.39 O ATOM 0 H ASP A 27 -3.732 22.646 -4.888 1.00 0.96 H new ATOM 0 HA ASP A 27 -1.008 22.757 -5.974 1.00 1.11 H new ATOM 0 HB2 ASP A 27 -1.358 24.868 -7.066 1.00 1.42 H new ATOM 0 HB3 ASP A 27 -2.482 23.704 -7.738 1.00 1.42 H new ATOM 655 N GLY A 28 -0.478 24.580 -4.233 1.00 0.93 N ATOM 656 CA GLY A 28 -0.140 25.255 -2.991 1.00 0.87 C ATOM 657 C GLY A 28 0.283 24.274 -1.918 1.00 0.75 C ATOM 658 O GLY A 28 1.285 24.477 -1.235 1.00 0.73 O ATOM 0 H GLY A 28 0.273 24.544 -4.922 1.00 0.93 H new ATOM 0 HA2 GLY A 28 0.665 25.967 -3.171 1.00 0.87 H new ATOM 0 HA3 GLY A 28 -0.999 25.828 -2.642 1.00 0.87 H new ATOM 662 N ASP A 29 -0.481 23.199 -1.778 1.00 0.70 N ATOM 663 CA ASP A 29 -0.142 22.127 -0.847 1.00 0.67 C ATOM 664 C ASP A 29 1.111 21.416 -1.326 1.00 0.59 C ATOM 665 O ASP A 29 1.889 20.899 -0.535 1.00 0.60 O ATOM 666 CB ASP A 29 -1.276 21.107 -0.751 1.00 0.80 C ATOM 667 CG ASP A 29 -2.652 21.729 -0.719 1.00 1.47 C ATOM 668 OD1 ASP A 29 -3.068 22.192 0.364 1.00 1.74 O ATOM 669 OD2 ASP A 29 -3.319 21.773 -1.774 1.00 2.25 O ATOM 0 H ASP A 29 -1.344 23.044 -2.299 1.00 0.70 H new ATOM 0 HA ASP A 29 0.022 22.570 0.135 1.00 0.67 H new ATOM 0 HB2 ASP A 29 -1.214 20.427 -1.601 1.00 0.80 H new ATOM 0 HB3 ASP A 29 -1.137 20.507 0.148 1.00 0.80 H new ATOM 674 N LYS A 30 1.306 21.402 -2.636 1.00 0.63 N ATOM 675 CA LYS A 30 2.501 20.812 -3.222 1.00 0.65 C ATOM 676 C LYS A 30 3.744 21.559 -2.756 1.00 0.61 C ATOM 677 O LYS A 30 4.857 21.051 -2.842 1.00 0.65 O ATOM 678 CB LYS A 30 2.410 20.820 -4.750 1.00 0.78 C ATOM 679 CG LYS A 30 1.658 19.632 -5.337 1.00 0.92 C ATOM 680 CD LYS A 30 0.222 19.551 -4.844 1.00 0.89 C ATOM 681 CE LYS A 30 -0.510 18.360 -5.445 1.00 0.96 C ATOM 682 NZ LYS A 30 -0.618 18.462 -6.926 1.00 1.31 N ATOM 0 H LYS A 30 0.652 21.793 -3.314 1.00 0.63 H new ATOM 0 HA LYS A 30 2.575 19.777 -2.889 1.00 0.65 H new ATOM 0 HB2 LYS A 30 1.919 21.740 -5.069 1.00 0.78 H new ATOM 0 HB3 LYS A 30 3.419 20.837 -5.163 1.00 0.78 H new ATOM 0 HG2 LYS A 30 1.662 19.705 -6.425 1.00 0.92 H new ATOM 0 HG3 LYS A 30 2.180 18.711 -5.078 1.00 0.92 H new ATOM 0 HD2 LYS A 30 0.214 19.473 -3.757 1.00 0.89 H new ATOM 0 HD3 LYS A 30 -0.304 20.470 -5.102 1.00 0.89 H new ATOM 0 HE2 LYS A 30 0.015 17.442 -5.182 1.00 0.96 H new ATOM 0 HE3 LYS A 30 -1.508 18.292 -5.012 1.00 0.96 H new ATOM 0 HZ1 LYS A 30 -1.277 17.738 -7.277 1.00 1.31 H new ATOM 0 HZ2 LYS A 30 -0.971 19.406 -7.184 1.00 1.31 H new ATOM 0 HZ3 LYS A 30 0.319 18.314 -7.353 1.00 1.31 H new ATOM 696 N THR A 31 3.535 22.768 -2.253 1.00 0.60 N ATOM 697 CA THR A 31 4.606 23.550 -1.671 1.00 0.61 C ATOM 698 C THR A 31 4.984 22.994 -0.301 1.00 0.52 C ATOM 699 O THR A 31 6.167 22.818 -0.002 1.00 0.54 O ATOM 700 CB THR A 31 4.197 25.026 -1.522 1.00 0.68 C ATOM 701 OG1 THR A 31 3.745 25.545 -2.778 1.00 0.80 O ATOM 702 CG2 THR A 31 5.352 25.864 -1.012 1.00 0.76 C ATOM 0 H THR A 31 2.624 23.227 -2.239 1.00 0.60 H new ATOM 0 HA THR A 31 5.463 23.488 -2.342 1.00 0.61 H new ATOM 0 HB THR A 31 3.385 25.076 -0.796 1.00 0.68 H new ATOM 0 HG1 THR A 31 3.486 26.484 -2.670 1.00 0.80 H new ATOM 0 HG21 THR A 31 5.034 26.902 -0.917 1.00 0.76 H new ATOM 0 HG22 THR A 31 5.670 25.491 -0.038 1.00 0.76 H new ATOM 0 HG23 THR A 31 6.184 25.802 -1.714 1.00 0.76 H new ATOM 710 N VAL A 32 3.980 22.691 0.527 1.00 0.50 N ATOM 711 CA VAL A 32 4.257 22.214 1.869 1.00 0.50 C ATOM 712 C VAL A 32 4.775 20.781 1.841 1.00 0.47 C ATOM 713 O VAL A 32 5.713 20.440 2.558 1.00 0.48 O ATOM 714 CB VAL A 32 3.048 22.337 2.836 1.00 0.57 C ATOM 715 CG1 VAL A 32 1.762 21.822 2.252 1.00 0.60 C ATOM 716 CG2 VAL A 32 3.337 21.601 4.127 1.00 0.85 C ATOM 0 H VAL A 32 2.991 22.768 0.291 1.00 0.50 H new ATOM 0 HA VAL A 32 5.033 22.870 2.264 1.00 0.50 H new ATOM 0 HB VAL A 32 2.914 23.403 3.022 1.00 0.57 H new ATOM 0 HG11 VAL A 32 0.959 21.938 2.980 1.00 0.60 H new ATOM 0 HG12 VAL A 32 1.520 22.386 1.352 1.00 0.60 H new ATOM 0 HG13 VAL A 32 1.873 20.767 2.000 1.00 0.60 H new ATOM 0 HG21 VAL A 32 2.483 21.694 4.798 1.00 0.85 H new ATOM 0 HG22 VAL A 32 3.517 20.548 3.913 1.00 0.85 H new ATOM 0 HG23 VAL A 32 4.219 22.031 4.601 1.00 0.85 H new ATOM 720 N LEU A 33 4.173 19.939 1.005 1.00 0.48 N ATOM 721 CA LEU A 33 4.649 18.575 0.835 1.00 0.49 C ATOM 722 C LEU A 33 6.122 18.560 0.429 1.00 0.50 C ATOM 723 O LEU A 33 6.881 17.701 0.864 1.00 0.54 O ATOM 724 CB LEU A 33 3.812 17.840 -0.225 1.00 0.53 C ATOM 725 CG LEU A 33 2.517 17.159 0.259 1.00 0.58 C ATOM 726 CD1 LEU A 33 2.797 16.210 1.408 1.00 0.98 C ATOM 727 CD2 LEU A 33 1.451 18.166 0.652 1.00 0.74 C ATOM 0 H LEU A 33 3.359 20.178 0.439 1.00 0.48 H new ATOM 0 HA LEU A 33 4.544 18.062 1.791 1.00 0.49 H new ATOM 0 HB2 LEU A 33 3.549 18.555 -1.005 1.00 0.53 H new ATOM 0 HB3 LEU A 33 4.442 17.081 -0.688 1.00 0.53 H new ATOM 0 HG LEU A 33 2.130 16.585 -0.583 1.00 0.58 H new ATOM 0 HD11 LEU A 33 1.866 15.743 1.730 1.00 0.98 H new ATOM 0 HD12 LEU A 33 3.495 15.439 1.081 1.00 0.98 H new ATOM 0 HD13 LEU A 33 3.231 16.764 2.240 1.00 0.98 H new ATOM 0 HD21 LEU A 33 0.558 17.638 0.986 1.00 0.74 H new ATOM 0 HD22 LEU A 33 1.825 18.795 1.460 1.00 0.74 H new ATOM 0 HD23 LEU A 33 1.204 18.789 -0.208 1.00 0.74 H new ATOM 739 N LYS A 34 6.524 19.541 -0.372 1.00 0.51 N ATOM 740 CA LYS A 34 7.886 19.600 -0.901 1.00 0.56 C ATOM 741 C LYS A 34 8.895 19.931 0.201 1.00 0.53 C ATOM 742 O LYS A 34 10.051 19.525 0.132 1.00 0.59 O ATOM 743 CB LYS A 34 7.948 20.633 -2.033 1.00 0.65 C ATOM 744 CG LYS A 34 9.248 20.652 -2.819 1.00 0.93 C ATOM 745 CD LYS A 34 9.171 21.656 -3.960 1.00 0.89 C ATOM 746 CE LYS A 34 10.370 21.560 -4.889 1.00 1.70 C ATOM 747 NZ LYS A 34 11.644 21.894 -4.205 1.00 2.41 N ATOM 0 H LYS A 34 5.925 20.310 -0.671 1.00 0.51 H new ATOM 0 HA LYS A 34 8.153 18.620 -1.297 1.00 0.56 H new ATOM 0 HB2 LYS A 34 7.127 20.441 -2.724 1.00 0.65 H new ATOM 0 HB3 LYS A 34 7.784 21.624 -1.609 1.00 0.65 H new ATOM 0 HG2 LYS A 34 10.075 20.908 -2.157 1.00 0.93 H new ATOM 0 HG3 LYS A 34 9.454 19.658 -3.216 1.00 0.93 H new ATOM 0 HD2 LYS A 34 8.257 21.487 -4.530 1.00 0.89 H new ATOM 0 HD3 LYS A 34 9.110 22.665 -3.551 1.00 0.89 H new ATOM 0 HE2 LYS A 34 10.432 20.550 -5.294 1.00 1.70 H new ATOM 0 HE3 LYS A 34 10.227 22.234 -5.734 1.00 1.70 H new ATOM 0 HZ1 LYS A 34 12.427 21.847 -4.888 1.00 2.41 H new ATOM 0 HZ2 LYS A 34 11.585 22.855 -3.811 1.00 2.41 H new ATOM 0 HZ3 LYS A 34 11.814 21.214 -3.436 1.00 2.41 H new ATOM 761 N GLU A 35 8.445 20.635 1.228 1.00 0.47 N ATOM 762 CA GLU A 35 9.312 21.002 2.340 1.00 0.47 C ATOM 763 C GLU A 35 9.199 20.009 3.495 1.00 0.46 C ATOM 764 O GLU A 35 10.155 19.805 4.242 1.00 0.57 O ATOM 765 CB GLU A 35 9.012 22.420 2.822 1.00 0.47 C ATOM 766 CG GLU A 35 7.549 22.728 3.048 1.00 0.61 C ATOM 767 CD GLU A 35 7.351 24.114 3.610 1.00 1.26 C ATOM 768 OE1 GLU A 35 7.513 24.287 4.835 1.00 1.47 O ATOM 769 OE2 GLU A 35 7.040 25.040 2.832 1.00 1.96 O ATOM 0 H GLU A 35 7.484 20.965 1.316 1.00 0.47 H new ATOM 0 HA GLU A 35 10.338 20.971 1.974 1.00 0.47 H new ATOM 0 HB2 GLU A 35 9.551 22.591 3.754 1.00 0.47 H new ATOM 0 HB3 GLU A 35 9.407 23.126 2.091 1.00 0.47 H new ATOM 0 HG2 GLU A 35 7.008 22.637 2.106 1.00 0.61 H new ATOM 0 HG3 GLU A 35 7.124 21.994 3.732 1.00 0.61 H new ATOM 776 N VAL A 36 8.042 19.381 3.626 1.00 0.41 N ATOM 777 CA VAL A 36 7.809 18.405 4.691 1.00 0.42 C ATOM 778 C VAL A 36 8.330 17.025 4.289 1.00 0.50 C ATOM 779 O VAL A 36 8.676 16.209 5.132 1.00 0.62 O ATOM 780 CB VAL A 36 6.304 18.348 5.065 1.00 0.43 C ATOM 781 CG1 VAL A 36 6.017 17.222 6.045 1.00 0.98 C ATOM 782 CG2 VAL A 36 5.853 19.686 5.648 1.00 0.74 C ATOM 0 H VAL A 36 7.244 19.527 3.008 1.00 0.41 H new ATOM 0 HA VAL A 36 8.362 18.726 5.574 1.00 0.42 H new ATOM 0 HB VAL A 36 5.740 18.149 4.154 1.00 0.43 H new ATOM 0 HG11 VAL A 36 4.954 17.211 6.285 1.00 0.98 H new ATOM 0 HG12 VAL A 36 6.298 16.269 5.597 1.00 0.98 H new ATOM 0 HG13 VAL A 36 6.594 17.378 6.957 1.00 0.98 H new ATOM 0 HG21 VAL A 36 4.795 19.632 5.906 1.00 0.74 H new ATOM 0 HG22 VAL A 36 6.434 19.907 6.543 1.00 0.74 H new ATOM 0 HG23 VAL A 36 6.007 20.474 4.911 1.00 0.74 H new ATOM 786 N PHE A 37 8.353 16.744 3.007 1.00 0.49 N ATOM 787 CA PHE A 37 9.101 15.613 2.485 1.00 0.54 C ATOM 788 C PHE A 37 10.610 15.830 2.458 1.00 0.59 C ATOM 789 O PHE A 37 11.364 14.856 2.487 1.00 0.66 O ATOM 790 CB PHE A 37 8.559 15.255 1.113 1.00 0.57 C ATOM 791 CG PHE A 37 7.427 14.281 1.274 1.00 0.57 C ATOM 792 CD1 PHE A 37 6.169 14.724 1.634 1.00 0.74 C ATOM 793 CD2 PHE A 37 7.603 12.933 1.002 1.00 0.66 C ATOM 794 CE1 PHE A 37 5.108 13.842 1.733 1.00 0.83 C ATOM 795 CE2 PHE A 37 6.544 12.050 1.089 1.00 0.68 C ATOM 796 CZ PHE A 37 5.373 12.454 1.691 1.00 0.71 C ATOM 0 H PHE A 37 7.859 17.285 2.297 1.00 0.49 H new ATOM 0 HA PHE A 37 8.957 14.778 3.171 1.00 0.54 H new ATOM 0 HB2 PHE A 37 8.214 16.152 0.599 1.00 0.57 H new ATOM 0 HB3 PHE A 37 9.347 14.819 0.499 1.00 0.57 H new ATOM 0 HD1 PHE A 37 6.012 15.772 1.841 1.00 0.74 H new ATOM 0 HD2 PHE A 37 8.580 12.569 0.719 1.00 0.66 H new ATOM 0 HE1 PHE A 37 4.097 14.207 1.840 1.00 0.83 H new ATOM 0 HE2 PHE A 37 6.634 11.051 0.688 1.00 0.68 H new ATOM 0 HZ PHE A 37 4.684 11.738 2.115 1.00 0.71 H new ATOM 806 N LYS A 38 11.076 17.080 2.400 1.00 0.60 N ATOM 807 CA LYS A 38 12.488 17.327 2.702 1.00 0.69 C ATOM 808 C LYS A 38 12.638 17.234 4.217 1.00 0.78 C ATOM 809 O LYS A 38 13.732 17.071 4.763 1.00 1.02 O ATOM 810 CB LYS A 38 12.983 18.665 2.152 1.00 0.75 C ATOM 811 CG LYS A 38 12.879 18.784 0.651 1.00 0.76 C ATOM 812 CD LYS A 38 13.896 17.914 -0.052 1.00 0.91 C ATOM 813 CE LYS A 38 13.963 18.282 -1.514 1.00 1.37 C ATOM 814 NZ LYS A 38 15.015 17.524 -2.243 1.00 2.18 N ATOM 0 H LYS A 38 10.525 17.904 2.158 1.00 0.60 H new ATOM 0 HA LYS A 38 13.113 16.582 2.209 1.00 0.69 H new ATOM 0 HB2 LYS A 38 12.410 19.470 2.611 1.00 0.75 H new ATOM 0 HB3 LYS A 38 14.023 18.806 2.447 1.00 0.75 H new ATOM 0 HG2 LYS A 38 11.876 18.501 0.332 1.00 0.76 H new ATOM 0 HG3 LYS A 38 13.025 19.824 0.358 1.00 0.76 H new ATOM 0 HD2 LYS A 38 14.876 18.040 0.409 1.00 0.91 H new ATOM 0 HD3 LYS A 38 13.625 16.864 0.056 1.00 0.91 H new ATOM 0 HE2 LYS A 38 12.995 18.092 -1.978 1.00 1.37 H new ATOM 0 HE3 LYS A 38 14.158 19.350 -1.608 1.00 1.37 H new ATOM 0 HZ1 LYS A 38 15.021 17.812 -3.242 1.00 2.18 H new ATOM 0 HZ2 LYS A 38 15.944 17.724 -1.819 1.00 2.18 H new ATOM 0 HZ3 LYS A 38 14.817 16.505 -2.178 1.00 2.18 H new ATOM 828 N ALA A 39 11.482 17.342 4.856 1.00 0.71 N ATOM 829 CA ALA A 39 11.217 16.797 6.169 1.00 0.87 C ATOM 830 C ALA A 39 11.913 17.459 7.340 1.00 0.82 C ATOM 831 O ALA A 39 11.316 18.277 8.043 1.00 1.56 O ATOM 832 CB ALA A 39 11.517 15.320 6.142 1.00 1.06 C ATOM 0 H ALA A 39 10.679 17.829 4.457 1.00 0.71 H new ATOM 0 HA ALA A 39 10.164 17.004 6.360 1.00 0.87 H new ATOM 0 HB1 ALA A 39 11.323 14.891 7.125 1.00 1.06 H new ATOM 0 HB2 ALA A 39 10.882 14.833 5.402 1.00 1.06 H new ATOM 0 HB3 ALA A 39 12.564 15.166 5.879 1.00 1.06 H new ATOM 838 N GLY A 40 13.172 17.137 7.540 1.00 0.78 N ATOM 839 CA GLY A 40 13.729 17.314 8.857 1.00 1.03 C ATOM 840 C GLY A 40 15.157 16.866 8.984 1.00 1.29 C ATOM 841 O GLY A 40 16.060 17.697 9.069 1.00 1.54 O ATOM 0 H GLY A 40 13.808 16.765 6.835 1.00 0.78 H new ATOM 0 HA2 GLY A 40 13.664 18.368 9.129 1.00 1.03 H new ATOM 0 HA3 GLY A 40 13.121 16.762 9.574 1.00 1.03 H new ATOM 845 N PRO A 41 15.416 15.554 8.979 1.00 1.37 N ATOM 846 CA PRO A 41 14.423 14.521 8.696 1.00 1.22 C ATOM 847 C PRO A 41 13.640 14.023 9.913 1.00 1.09 C ATOM 848 O PRO A 41 13.922 14.380 11.058 1.00 1.18 O ATOM 849 CB PRO A 41 15.279 13.377 8.139 1.00 1.37 C ATOM 850 CG PRO A 41 16.692 13.641 8.567 1.00 1.60 C ATOM 851 CD PRO A 41 16.716 14.961 9.291 1.00 1.68 C ATOM 0 HA PRO A 41 13.651 14.908 8.031 1.00 1.22 H new ATOM 0 HB2 PRO A 41 14.934 12.416 8.520 1.00 1.37 H new ATOM 0 HB3 PRO A 41 15.206 13.334 7.052 1.00 1.37 H new ATOM 0 HG2 PRO A 41 17.049 12.842 9.217 1.00 1.60 H new ATOM 0 HG3 PRO A 41 17.354 13.668 7.702 1.00 1.60 H new ATOM 0 HD2 PRO A 41 16.847 14.826 10.365 1.00 1.68 H new ATOM 0 HD3 PRO A 41 17.536 15.591 8.947 1.00 1.68 H new ATOM 859 N TYR A 42 12.630 13.202 9.617 1.00 0.99 N ATOM 860 CA TYR A 42 11.760 12.591 10.626 1.00 0.92 C ATOM 861 C TYR A 42 12.175 11.148 10.888 1.00 0.97 C ATOM 862 O TYR A 42 12.771 10.496 10.031 1.00 1.08 O ATOM 863 CB TYR A 42 10.304 12.580 10.147 1.00 0.85 C ATOM 864 CG TYR A 42 9.804 13.896 9.600 1.00 0.87 C ATOM 865 CD1 TYR A 42 9.933 15.060 10.346 1.00 0.90 C ATOM 866 CD2 TYR A 42 9.204 13.978 8.352 1.00 0.99 C ATOM 867 CE1 TYR A 42 9.478 16.269 9.864 1.00 1.02 C ATOM 868 CE2 TYR A 42 8.746 15.183 7.861 1.00 1.10 C ATOM 869 CZ TYR A 42 8.886 16.309 8.574 1.00 1.12 C ATOM 870 OH TYR A 42 8.420 17.526 8.137 1.00 1.28 O ATOM 0 H TYR A 42 12.390 12.940 8.661 1.00 0.99 H new ATOM 0 HA TYR A 42 11.852 13.182 11.538 1.00 0.92 H new ATOM 0 HB2 TYR A 42 10.197 11.818 9.375 1.00 0.85 H new ATOM 0 HB3 TYR A 42 9.665 12.283 10.979 1.00 0.85 H new ATOM 0 HD1 TYR A 42 10.398 15.018 11.320 1.00 0.90 H new ATOM 0 HD2 TYR A 42 9.094 13.084 7.755 1.00 0.99 H new ATOM 0 HE1 TYR A 42 9.570 17.168 10.456 1.00 1.02 H new ATOM 0 HE2 TYR A 42 8.270 15.219 6.892 1.00 1.10 H new ATOM 0 HH TYR A 42 9.178 18.117 7.946 1.00 1.28 H new ATOM 880 N LYS A 43 11.834 10.658 12.068 1.00 0.96 N ATOM 881 CA LYS A 43 12.058 9.265 12.440 1.00 1.01 C ATOM 882 C LYS A 43 10.763 8.460 12.326 1.00 0.98 C ATOM 883 O LYS A 43 10.779 7.225 12.355 1.00 1.06 O ATOM 884 CB LYS A 43 12.602 9.190 13.872 1.00 1.10 C ATOM 885 CG LYS A 43 12.828 7.769 14.361 1.00 1.72 C ATOM 886 CD LYS A 43 13.390 7.729 15.770 1.00 2.26 C ATOM 887 CE LYS A 43 13.535 6.295 16.254 1.00 2.94 C ATOM 888 NZ LYS A 43 14.323 5.466 15.302 1.00 3.51 N ATOM 0 H LYS A 43 11.392 11.214 12.800 1.00 0.96 H new ATOM 0 HA LYS A 43 12.789 8.835 11.756 1.00 1.01 H new ATOM 0 HB2 LYS A 43 13.543 9.738 13.924 1.00 1.10 H new ATOM 0 HB3 LYS A 43 11.905 9.690 14.544 1.00 1.10 H new ATOM 0 HG2 LYS A 43 11.885 7.223 14.332 1.00 1.72 H new ATOM 0 HG3 LYS A 43 13.513 7.258 13.684 1.00 1.72 H new ATOM 0 HD2 LYS A 43 14.360 8.225 15.793 1.00 2.26 H new ATOM 0 HD3 LYS A 43 12.734 8.280 16.444 1.00 2.26 H new ATOM 0 HE2 LYS A 43 14.021 6.288 17.230 1.00 2.94 H new ATOM 0 HE3 LYS A 43 12.547 5.855 16.387 1.00 2.94 H new ATOM 0 HZ1 LYS A 43 14.602 4.577 15.764 1.00 3.51 H new ATOM 0 HZ2 LYS A 43 13.744 5.254 14.465 1.00 3.51 H new ATOM 0 HZ3 LYS A 43 15.175 5.987 15.011 1.00 3.51 H new ATOM 902 N ASN A 44 9.648 9.152 12.168 1.00 0.88 N ATOM 903 CA ASN A 44 8.346 8.492 12.106 1.00 0.85 C ATOM 904 C ASN A 44 7.315 9.363 11.397 1.00 0.80 C ATOM 905 O ASN A 44 7.502 10.577 11.282 1.00 0.85 O ATOM 906 CB ASN A 44 7.860 8.131 13.519 1.00 0.89 C ATOM 907 CG ASN A 44 8.084 9.236 14.543 1.00 0.95 C ATOM 908 OD1 ASN A 44 8.284 8.963 15.727 1.00 1.52 O ATOM 909 ND2 ASN A 44 8.075 10.486 14.104 1.00 1.10 N ATOM 0 H ASN A 44 9.613 10.168 12.080 1.00 0.88 H new ATOM 0 HA ASN A 44 8.464 7.575 11.528 1.00 0.85 H new ATOM 0 HB2 ASN A 44 6.797 7.895 13.479 1.00 0.89 H new ATOM 0 HB3 ASN A 44 8.374 7.229 13.852 1.00 0.89 H new ATOM 0 HD21 ASN A 44 8.237 11.256 14.753 1.00 1.10 H new ATOM 0 HD22 ASN A 44 7.906 10.679 13.117 1.00 1.10 H new ATOM 916 N THR A 45 6.223 8.748 10.950 1.00 0.77 N ATOM 917 CA THR A 45 5.171 9.459 10.227 1.00 0.76 C ATOM 918 C THR A 45 4.565 10.579 11.084 1.00 0.74 C ATOM 919 O THR A 45 4.205 11.640 10.570 1.00 0.92 O ATOM 920 CB THR A 45 4.052 8.492 9.794 1.00 0.84 C ATOM 921 OG1 THR A 45 4.618 7.319 9.193 1.00 1.05 O ATOM 922 CG2 THR A 45 3.108 9.159 8.803 1.00 1.18 C ATOM 0 H THR A 45 6.043 7.752 11.077 1.00 0.77 H new ATOM 0 HA THR A 45 5.630 9.900 9.342 1.00 0.76 H new ATOM 0 HB THR A 45 3.487 8.213 10.684 1.00 0.84 H new ATOM 0 HG1 THR A 45 3.899 6.710 8.923 1.00 1.05 H new ATOM 0 HG21 THR A 45 2.328 8.455 8.514 1.00 1.18 H new ATOM 0 HG22 THR A 45 2.653 10.034 9.266 1.00 1.18 H new ATOM 0 HG23 THR A 45 3.666 9.466 7.919 1.00 1.18 H new ATOM 930 N GLU A 46 4.472 10.330 12.390 1.00 0.72 N ATOM 931 CA GLU A 46 3.933 11.302 13.348 1.00 0.71 C ATOM 932 C GLU A 46 4.569 12.683 13.187 1.00 0.66 C ATOM 933 O GLU A 46 3.885 13.698 13.290 1.00 0.65 O ATOM 934 CB GLU A 46 4.152 10.805 14.777 1.00 0.79 C ATOM 935 CG GLU A 46 3.436 9.500 15.084 1.00 1.41 C ATOM 936 CD GLU A 46 3.615 9.061 16.520 1.00 1.82 C ATOM 937 OE1 GLU A 46 2.908 9.594 17.401 1.00 2.12 O ATOM 938 OE2 GLU A 46 4.459 8.178 16.779 1.00 2.24 O ATOM 0 H GLU A 46 4.767 9.451 12.816 1.00 0.72 H new ATOM 0 HA GLU A 46 2.867 11.399 13.145 1.00 0.71 H new ATOM 0 HB2 GLU A 46 5.220 10.672 14.947 1.00 0.79 H new ATOM 0 HB3 GLU A 46 3.811 11.570 15.475 1.00 0.79 H new ATOM 0 HG2 GLU A 46 2.373 9.615 14.873 1.00 1.41 H new ATOM 0 HG3 GLU A 46 3.810 8.720 14.420 1.00 1.41 H new ATOM 945 N GLU A 47 5.868 12.714 12.917 1.00 0.67 N ATOM 946 CA GLU A 47 6.591 13.977 12.772 1.00 0.67 C ATOM 947 C GLU A 47 6.190 14.704 11.497 1.00 0.60 C ATOM 948 O GLU A 47 6.210 15.930 11.447 1.00 0.58 O ATOM 949 CB GLU A 47 8.095 13.744 12.768 1.00 0.73 C ATOM 950 CG GLU A 47 8.713 13.642 14.145 1.00 0.98 C ATOM 951 CD GLU A 47 10.209 13.434 14.081 1.00 1.64 C ATOM 952 OE1 GLU A 47 10.645 12.268 14.008 1.00 2.26 O ATOM 953 OE2 GLU A 47 10.957 14.437 14.109 1.00 2.03 O ATOM 0 H GLU A 47 6.444 11.882 12.794 1.00 0.67 H new ATOM 0 HA GLU A 47 6.325 14.598 13.627 1.00 0.67 H new ATOM 0 HB2 GLU A 47 8.307 12.827 12.218 1.00 0.73 H new ATOM 0 HB3 GLU A 47 8.576 14.559 12.226 1.00 0.73 H new ATOM 0 HG2 GLU A 47 8.497 14.550 14.707 1.00 0.98 H new ATOM 0 HG3 GLU A 47 8.255 12.815 14.687 1.00 0.98 H new ATOM 960 N SER A 48 5.836 13.947 10.472 1.00 0.58 N ATOM 961 CA SER A 48 5.408 14.531 9.210 1.00 0.54 C ATOM 962 C SER A 48 4.018 15.133 9.372 1.00 0.51 C ATOM 963 O SER A 48 3.748 16.235 8.902 1.00 0.49 O ATOM 964 CB SER A 48 5.417 13.472 8.103 1.00 0.57 C ATOM 965 OG SER A 48 5.205 14.053 6.827 1.00 1.19 O ATOM 0 H SER A 48 5.836 12.927 10.488 1.00 0.58 H new ATOM 0 HA SER A 48 6.102 15.322 8.925 1.00 0.54 H new ATOM 0 HB2 SER A 48 6.371 12.945 8.110 1.00 0.57 H new ATOM 0 HB3 SER A 48 4.642 12.731 8.300 1.00 0.57 H new ATOM 0 HG SER A 48 5.218 13.352 6.142 1.00 1.19 H new ATOM 971 N ILE A 49 3.145 14.401 10.053 1.00 0.51 N ATOM 972 CA ILE A 49 1.801 14.881 10.348 1.00 0.49 C ATOM 973 C ILE A 49 1.877 16.099 11.261 1.00 0.49 C ATOM 974 O ILE A 49 1.182 17.092 11.055 1.00 0.47 O ATOM 975 CB ILE A 49 0.949 13.772 11.006 1.00 0.51 C ATOM 976 CG1 ILE A 49 0.818 12.580 10.053 1.00 0.52 C ATOM 977 CG2 ILE A 49 -0.425 14.302 11.397 1.00 0.50 C ATOM 978 CD1 ILE A 49 0.096 11.391 10.650 1.00 0.55 C ATOM 0 H ILE A 49 3.345 13.468 10.413 1.00 0.51 H new ATOM 0 HA ILE A 49 1.321 15.163 9.411 1.00 0.49 H new ATOM 0 HB ILE A 49 1.450 13.442 11.916 1.00 0.51 H new ATOM 0 HG12 ILE A 49 0.288 12.901 9.156 1.00 0.52 H new ATOM 0 HG13 ILE A 49 1.814 12.267 9.740 1.00 0.52 H new ATOM 0 HG21 ILE A 49 -1.006 13.503 11.858 1.00 0.50 H new ATOM 0 HG22 ILE A 49 -0.310 15.122 12.106 1.00 0.50 H new ATOM 0 HG23 ILE A 49 -0.943 14.660 10.508 1.00 0.50 H new ATOM 0 HD11 ILE A 49 0.044 10.589 9.913 1.00 0.55 H new ATOM 0 HD12 ILE A 49 0.636 11.041 11.530 1.00 0.55 H new ATOM 0 HD13 ILE A 49 -0.913 11.685 10.937 1.00 0.55 H new ATOM 985 N ALA A 50 2.745 16.009 12.258 1.00 0.52 N ATOM 986 CA ALA A 50 3.047 17.130 13.141 1.00 0.53 C ATOM 987 C ALA A 50 3.534 18.333 12.352 1.00 0.50 C ATOM 988 O ALA A 50 3.073 19.455 12.564 1.00 0.50 O ATOM 989 CB ALA A 50 4.108 16.718 14.133 1.00 0.57 C ATOM 0 H ALA A 50 3.261 15.157 12.479 1.00 0.52 H new ATOM 0 HA ALA A 50 2.133 17.409 13.665 1.00 0.53 H new ATOM 0 HB1 ALA A 50 4.334 17.556 14.793 1.00 0.57 H new ATOM 0 HB2 ALA A 50 3.746 15.877 14.725 1.00 0.57 H new ATOM 0 HB3 ALA A 50 5.011 16.423 13.598 1.00 0.57 H new ATOM 995 N ALA A 51 4.481 18.090 11.454 1.00 0.49 N ATOM 996 CA ALA A 51 5.028 19.136 10.607 1.00 0.48 C ATOM 997 C ALA A 51 3.926 19.796 9.801 1.00 0.45 C ATOM 998 O ALA A 51 3.853 21.020 9.695 1.00 0.47 O ATOM 999 CB ALA A 51 6.066 18.553 9.670 1.00 0.50 C ATOM 0 H ALA A 51 4.887 17.168 11.295 1.00 0.49 H new ATOM 0 HA ALA A 51 5.497 19.887 11.243 1.00 0.48 H new ATOM 0 HB1 ALA A 51 6.471 19.344 9.038 1.00 0.50 H new ATOM 0 HB2 ALA A 51 6.871 18.105 10.252 1.00 0.50 H new ATOM 0 HB3 ALA A 51 5.603 17.790 9.044 1.00 0.50 H new ATOM 1005 N LEU A 52 3.065 18.960 9.243 1.00 0.42 N ATOM 1006 CA LEU A 52 1.963 19.421 8.420 1.00 0.40 C ATOM 1007 C LEU A 52 0.927 20.157 9.251 1.00 0.39 C ATOM 1008 O LEU A 52 0.412 21.169 8.815 1.00 0.40 O ATOM 1009 CB LEU A 52 1.325 18.245 7.683 1.00 0.40 C ATOM 1010 CG LEU A 52 2.132 17.704 6.506 1.00 0.41 C ATOM 1011 CD1 LEU A 52 1.695 16.293 6.170 1.00 0.45 C ATOM 1012 CD2 LEU A 52 1.962 18.601 5.293 1.00 0.41 C ATOM 0 H LEU A 52 3.112 17.947 9.348 1.00 0.42 H new ATOM 0 HA LEU A 52 2.359 20.122 7.685 1.00 0.40 H new ATOM 0 HB2 LEU A 52 1.162 17.436 8.395 1.00 0.40 H new ATOM 0 HB3 LEU A 52 0.344 18.553 7.320 1.00 0.40 H new ATOM 0 HG LEU A 52 3.185 17.688 6.789 1.00 0.41 H new ATOM 0 HD11 LEU A 52 2.280 15.922 5.329 1.00 0.45 H new ATOM 0 HD12 LEU A 52 1.852 15.648 7.034 1.00 0.45 H new ATOM 0 HD13 LEU A 52 0.638 16.293 5.905 1.00 0.45 H new ATOM 0 HD21 LEU A 52 2.543 18.203 4.461 1.00 0.41 H new ATOM 0 HD22 LEU A 52 0.909 18.640 5.014 1.00 0.41 H new ATOM 0 HD23 LEU A 52 2.311 19.606 5.532 1.00 0.41 H new ATOM 1024 N LYS A 53 0.633 19.670 10.447 1.00 0.39 N ATOM 1025 CA LYS A 53 -0.309 20.364 11.320 1.00 0.39 C ATOM 1026 C LYS A 53 0.247 21.713 11.772 1.00 0.40 C ATOM 1027 O LYS A 53 -0.502 22.609 12.161 1.00 0.45 O ATOM 1028 CB LYS A 53 -0.663 19.510 12.534 1.00 0.41 C ATOM 1029 CG LYS A 53 -1.525 18.307 12.194 1.00 0.42 C ATOM 1030 CD LYS A 53 -2.028 17.616 13.449 1.00 0.52 C ATOM 1031 CE LYS A 53 -2.987 16.488 13.113 1.00 0.52 C ATOM 1032 NZ LYS A 53 -3.622 15.929 14.332 1.00 1.22 N ATOM 0 H LYS A 53 1.024 18.811 10.833 1.00 0.39 H new ATOM 0 HA LYS A 53 -1.217 20.541 10.744 1.00 0.39 H new ATOM 0 HB2 LYS A 53 0.257 19.167 13.008 1.00 0.41 H new ATOM 0 HB3 LYS A 53 -1.186 20.128 13.264 1.00 0.41 H new ATOM 0 HG2 LYS A 53 -2.373 18.624 11.587 1.00 0.42 H new ATOM 0 HG3 LYS A 53 -0.949 17.602 11.594 1.00 0.42 H new ATOM 0 HD2 LYS A 53 -1.183 17.221 14.013 1.00 0.52 H new ATOM 0 HD3 LYS A 53 -2.528 18.342 14.090 1.00 0.52 H new ATOM 0 HE2 LYS A 53 -3.758 16.855 12.436 1.00 0.52 H new ATOM 0 HE3 LYS A 53 -2.451 15.698 12.587 1.00 0.52 H new ATOM 0 HZ1 LYS A 53 -4.499 15.435 14.071 1.00 1.22 H new ATOM 0 HZ2 LYS A 53 -2.970 15.259 14.787 1.00 1.22 H new ATOM 0 HZ3 LYS A 53 -3.843 16.701 14.994 1.00 1.22 H new ATOM 1046 N LYS A 54 1.567 21.844 11.722 1.00 0.39 N ATOM 1047 CA LYS A 54 2.233 23.091 12.080 1.00 0.41 C ATOM 1048 C LYS A 54 2.262 24.051 10.890 1.00 0.41 C ATOM 1049 O LYS A 54 2.169 25.267 11.052 1.00 0.47 O ATOM 1050 CB LYS A 54 3.653 22.795 12.572 1.00 0.44 C ATOM 1051 CG LYS A 54 4.434 24.025 13.014 1.00 1.24 C ATOM 1052 CD LYS A 54 5.717 23.642 13.743 1.00 1.63 C ATOM 1053 CE LYS A 54 6.671 22.859 12.852 1.00 2.24 C ATOM 1054 NZ LYS A 54 7.190 23.682 11.728 1.00 3.05 N ATOM 0 H LYS A 54 2.201 21.098 11.435 1.00 0.39 H new ATOM 0 HA LYS A 54 1.674 23.572 12.883 1.00 0.41 H new ATOM 0 HB2 LYS A 54 3.597 22.096 13.406 1.00 0.44 H new ATOM 0 HB3 LYS A 54 4.204 22.297 11.775 1.00 0.44 H new ATOM 0 HG2 LYS A 54 4.677 24.635 12.144 1.00 1.24 H new ATOM 0 HG3 LYS A 54 3.812 24.636 13.668 1.00 1.24 H new ATOM 0 HD2 LYS A 54 6.214 24.544 14.100 1.00 1.63 H new ATOM 0 HD3 LYS A 54 5.470 23.045 14.621 1.00 1.63 H new ATOM 0 HE2 LYS A 54 7.507 22.494 13.449 1.00 2.24 H new ATOM 0 HE3 LYS A 54 6.158 21.984 12.453 1.00 2.24 H new ATOM 0 HZ1 LYS A 54 7.935 23.156 11.228 1.00 3.05 H new ATOM 0 HZ2 LYS A 54 6.415 23.896 11.068 1.00 3.05 H new ATOM 0 HZ3 LYS A 54 7.583 24.570 12.100 1.00 3.05 H new ATOM 1068 N LYS A 55 2.362 23.488 9.695 1.00 0.42 N ATOM 1069 CA LYS A 55 2.442 24.264 8.468 1.00 0.48 C ATOM 1070 C LYS A 55 1.050 24.517 7.896 1.00 0.47 C ATOM 1071 O LYS A 55 0.613 25.660 7.776 1.00 0.58 O ATOM 1072 CB LYS A 55 3.295 23.499 7.463 1.00 0.55 C ATOM 1073 CG LYS A 55 3.291 24.076 6.064 1.00 1.23 C ATOM 1074 CD LYS A 55 4.287 25.196 5.895 1.00 1.16 C ATOM 1075 CE LYS A 55 4.509 25.499 4.426 1.00 1.03 C ATOM 1076 NZ LYS A 55 3.264 25.946 3.752 1.00 1.48 N ATOM 0 H LYS A 55 2.390 22.479 9.549 1.00 0.42 H new ATOM 0 HA LYS A 55 2.896 25.232 8.680 1.00 0.48 H new ATOM 0 HB2 LYS A 55 4.322 23.469 7.827 1.00 0.55 H new ATOM 0 HB3 LYS A 55 2.943 22.468 7.418 1.00 0.55 H new ATOM 0 HG2 LYS A 55 3.515 23.285 5.348 1.00 1.23 H new ATOM 0 HG3 LYS A 55 2.292 24.445 5.830 1.00 1.23 H new ATOM 0 HD2 LYS A 55 3.927 26.089 6.405 1.00 1.16 H new ATOM 0 HD3 LYS A 55 5.233 24.922 6.362 1.00 1.16 H new ATOM 0 HE2 LYS A 55 5.271 26.272 4.327 1.00 1.03 H new ATOM 0 HE3 LYS A 55 4.891 24.609 3.927 1.00 1.03 H new ATOM 0 HZ1 LYS A 55 3.428 26.011 2.727 1.00 1.48 H new ATOM 0 HZ2 LYS A 55 2.504 25.261 3.938 1.00 1.48 H new ATOM 0 HZ3 LYS A 55 2.987 26.879 4.118 1.00 1.48 H new ATOM 1090 N SER A 56 0.358 23.444 7.572 1.00 0.39 N ATOM 1091 CA SER A 56 -0.961 23.520 6.979 1.00 0.39 C ATOM 1092 C SER A 56 -1.934 22.652 7.774 1.00 0.38 C ATOM 1093 O SER A 56 -2.137 21.477 7.456 1.00 0.38 O ATOM 1094 CB SER A 56 -0.892 23.076 5.518 1.00 0.40 C ATOM 1095 OG SER A 56 -0.167 21.863 5.394 1.00 1.16 O ATOM 0 H SER A 56 0.696 22.492 7.713 1.00 0.39 H new ATOM 0 HA SER A 56 -1.321 24.548 7.008 1.00 0.39 H new ATOM 0 HB2 SER A 56 -1.900 22.944 5.125 1.00 0.40 H new ATOM 0 HB3 SER A 56 -0.416 23.852 4.919 1.00 0.40 H new ATOM 0 HG SER A 56 -0.273 21.333 6.212 1.00 1.16 H new ATOM 1101 N PRO A 57 -2.511 23.232 8.842 1.00 0.41 N ATOM 1102 CA PRO A 57 -3.277 22.500 9.864 1.00 0.43 C ATOM 1103 C PRO A 57 -4.246 21.477 9.288 1.00 0.44 C ATOM 1104 O PRO A 57 -4.146 20.274 9.556 1.00 0.45 O ATOM 1105 CB PRO A 57 -4.055 23.616 10.558 1.00 0.48 C ATOM 1106 CG PRO A 57 -3.164 24.801 10.458 1.00 0.58 C ATOM 1107 CD PRO A 57 -2.463 24.679 9.133 1.00 0.45 C ATOM 0 HA PRO A 57 -2.622 21.918 10.512 1.00 0.43 H new ATOM 0 HB2 PRO A 57 -5.013 23.796 10.070 1.00 0.48 H new ATOM 0 HB3 PRO A 57 -4.269 23.365 11.597 1.00 0.48 H new ATOM 0 HG2 PRO A 57 -3.737 25.726 10.513 1.00 0.58 H new ATOM 0 HG3 PRO A 57 -2.447 24.821 11.279 1.00 0.58 H new ATOM 0 HD2 PRO A 57 -2.966 25.260 8.359 1.00 0.45 H new ATOM 0 HD3 PRO A 57 -1.437 25.042 9.188 1.00 0.45 H new ATOM 1115 N GLU A 58 -5.171 21.983 8.484 1.00 0.47 N ATOM 1116 CA GLU A 58 -6.237 21.188 7.900 1.00 0.51 C ATOM 1117 C GLU A 58 -5.688 20.124 6.942 1.00 0.47 C ATOM 1118 O GLU A 58 -6.307 19.076 6.750 1.00 0.47 O ATOM 1119 CB GLU A 58 -7.221 22.135 7.199 1.00 0.65 C ATOM 1120 CG GLU A 58 -8.527 21.498 6.746 1.00 1.44 C ATOM 1121 CD GLU A 58 -8.469 20.991 5.324 1.00 1.92 C ATOM 1122 OE1 GLU A 58 -8.225 21.805 4.407 1.00 2.45 O ATOM 1123 OE2 GLU A 58 -8.671 19.779 5.108 1.00 2.42 O ATOM 0 H GLU A 58 -5.201 22.967 8.218 1.00 0.47 H new ATOM 0 HA GLU A 58 -6.759 20.643 8.687 1.00 0.51 H new ATOM 0 HB2 GLU A 58 -7.453 22.957 7.876 1.00 0.65 H new ATOM 0 HB3 GLU A 58 -6.726 22.568 6.329 1.00 0.65 H new ATOM 0 HG2 GLU A 58 -8.773 20.671 7.412 1.00 1.44 H new ATOM 0 HG3 GLU A 58 -9.332 22.228 6.834 1.00 1.44 H new ATOM 1130 N LEU A 59 -4.515 20.369 6.362 1.00 0.46 N ATOM 1131 CA LEU A 59 -3.927 19.402 5.444 1.00 0.48 C ATOM 1132 C LEU A 59 -3.359 18.235 6.231 1.00 0.43 C ATOM 1133 O LEU A 59 -3.456 17.078 5.829 1.00 0.47 O ATOM 1134 CB LEU A 59 -2.822 20.038 4.598 1.00 0.56 C ATOM 1135 CG LEU A 59 -2.086 19.074 3.662 1.00 0.67 C ATOM 1136 CD1 LEU A 59 -3.057 18.388 2.716 1.00 1.15 C ATOM 1137 CD2 LEU A 59 -1.014 19.808 2.879 1.00 1.42 C ATOM 0 H LEU A 59 -3.963 21.214 6.509 1.00 0.46 H new ATOM 0 HA LEU A 59 -4.710 19.051 4.771 1.00 0.48 H new ATOM 0 HB2 LEU A 59 -3.258 20.839 4.000 1.00 0.56 H new ATOM 0 HB3 LEU A 59 -2.094 20.499 5.266 1.00 0.56 H new ATOM 0 HG LEU A 59 -1.608 18.308 4.273 1.00 0.67 H new ATOM 0 HD11 LEU A 59 -2.510 17.709 2.062 1.00 1.15 H new ATOM 0 HD12 LEU A 59 -3.790 17.824 3.293 1.00 1.15 H new ATOM 0 HD13 LEU A 59 -3.569 19.138 2.113 1.00 1.15 H new ATOM 0 HD21 LEU A 59 -0.501 19.108 2.219 1.00 1.42 H new ATOM 0 HD22 LEU A 59 -1.474 20.597 2.284 1.00 1.42 H new ATOM 0 HD23 LEU A 59 -0.295 20.248 3.570 1.00 1.42 H new ATOM 1149 N GLY A 60 -2.750 18.568 7.366 1.00 0.37 N ATOM 1150 CA GLY A 60 -2.211 17.561 8.252 1.00 0.36 C ATOM 1151 C GLY A 60 -3.297 16.655 8.777 1.00 0.35 C ATOM 1152 O GLY A 60 -3.064 15.477 9.030 1.00 0.36 O ATOM 0 H GLY A 60 -2.622 19.528 7.686 1.00 0.37 H new ATOM 0 HA2 GLY A 60 -1.465 16.969 7.722 1.00 0.36 H new ATOM 0 HA3 GLY A 60 -1.701 18.043 9.086 1.00 0.36 H new ATOM 1156 N ALA A 61 -4.487 17.219 8.943 1.00 0.37 N ATOM 1157 CA ALA A 61 -5.658 16.444 9.321 1.00 0.42 C ATOM 1158 C ALA A 61 -6.003 15.427 8.235 1.00 0.44 C ATOM 1159 O ALA A 61 -6.446 14.320 8.534 1.00 0.48 O ATOM 1160 CB ALA A 61 -6.836 17.365 9.592 1.00 0.45 C ATOM 0 H ALA A 61 -4.665 18.216 8.821 1.00 0.37 H new ATOM 0 HA ALA A 61 -5.432 15.898 10.237 1.00 0.42 H new ATOM 0 HB1 ALA A 61 -7.705 16.771 9.874 1.00 0.45 H new ATOM 0 HB2 ALA A 61 -6.585 18.048 10.404 1.00 0.45 H new ATOM 0 HB3 ALA A 61 -7.064 17.938 8.693 1.00 0.45 H new ATOM 1166 N LYS A 62 -5.780 15.803 6.973 1.00 0.45 N ATOM 1167 CA LYS A 62 -5.983 14.894 5.857 1.00 0.50 C ATOM 1168 C LYS A 62 -5.054 13.691 5.986 1.00 0.54 C ATOM 1169 O LYS A 62 -5.468 12.547 5.807 1.00 0.69 O ATOM 1170 CB LYS A 62 -5.719 15.596 4.519 1.00 0.53 C ATOM 1171 CG LYS A 62 -6.738 16.657 4.138 1.00 0.90 C ATOM 1172 CD LYS A 62 -6.563 17.070 2.682 1.00 1.25 C ATOM 1173 CE LYS A 62 -7.566 18.128 2.253 1.00 1.51 C ATOM 1174 NZ LYS A 62 -7.303 19.444 2.885 1.00 2.17 N ATOM 0 H LYS A 62 -5.459 16.733 6.705 1.00 0.45 H new ATOM 0 HA LYS A 62 -7.021 14.562 5.880 1.00 0.50 H new ATOM 0 HB2 LYS A 62 -4.733 16.058 4.557 1.00 0.53 H new ATOM 0 HB3 LYS A 62 -5.688 14.844 3.731 1.00 0.53 H new ATOM 0 HG2 LYS A 62 -7.746 16.273 4.294 1.00 0.90 H new ATOM 0 HG3 LYS A 62 -6.624 17.527 4.785 1.00 0.90 H new ATOM 0 HD2 LYS A 62 -5.552 17.451 2.535 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -6.669 16.193 2.044 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -7.535 18.236 1.169 1.00 1.51 H new ATOM 0 HE3 LYS A 62 -8.572 17.798 2.512 1.00 1.51 H new ATOM 0 HZ1 LYS A 62 -7.862 20.178 2.405 1.00 2.17 H new ATOM 0 HZ2 LYS A 62 -7.570 19.406 3.889 1.00 2.17 H new ATOM 0 HZ3 LYS A 62 -6.291 19.672 2.804 1.00 2.17 H new ATOM 1188 N VAL A 63 -3.797 13.963 6.308 1.00 0.45 N ATOM 1189 CA VAL A 63 -2.804 12.909 6.462 1.00 0.48 C ATOM 1190 C VAL A 63 -3.064 12.103 7.728 1.00 0.46 C ATOM 1191 O VAL A 63 -2.907 10.884 7.743 1.00 0.53 O ATOM 1192 CB VAL A 63 -1.375 13.484 6.518 1.00 0.48 C ATOM 1193 CG1 VAL A 63 -0.337 12.372 6.469 1.00 1.12 C ATOM 1194 CG2 VAL A 63 -1.155 14.477 5.389 1.00 1.12 C ATOM 0 H VAL A 63 -3.441 14.905 6.468 1.00 0.45 H new ATOM 0 HA VAL A 63 -2.889 12.260 5.591 1.00 0.48 H new ATOM 0 HB VAL A 63 -1.258 14.010 7.466 1.00 0.48 H new ATOM 0 HG11 VAL A 63 0.662 12.805 6.510 1.00 1.12 H new ATOM 0 HG12 VAL A 63 -0.478 11.705 7.319 1.00 1.12 H new ATOM 0 HG13 VAL A 63 -0.451 11.809 5.543 1.00 1.12 H new ATOM 0 HG21 VAL A 63 -0.141 14.872 5.445 1.00 1.12 H new ATOM 0 HG22 VAL A 63 -1.297 13.976 4.431 1.00 1.12 H new ATOM 0 HG23 VAL A 63 -1.869 15.296 5.480 1.00 1.12 H new ATOM 1198 N GLU A 64 -3.471 12.792 8.786 1.00 0.41 N ATOM 1199 CA GLU A 64 -3.724 12.152 10.068 1.00 0.42 C ATOM 1200 C GLU A 64 -4.895 11.179 9.978 1.00 0.50 C ATOM 1201 O GLU A 64 -4.819 10.061 10.494 1.00 0.55 O ATOM 1202 CB GLU A 64 -3.984 13.206 11.148 1.00 0.42 C ATOM 1203 CG GLU A 64 -4.179 12.628 12.542 1.00 0.53 C ATOM 1204 CD GLU A 64 -2.975 11.853 13.043 1.00 1.11 C ATOM 1205 OE1 GLU A 64 -2.783 10.696 12.621 1.00 1.66 O ATOM 1206 OE2 GLU A 64 -2.228 12.389 13.885 1.00 1.70 O ATOM 0 H GLU A 64 -3.633 13.799 8.780 1.00 0.41 H new ATOM 0 HA GLU A 64 -2.836 11.582 10.341 1.00 0.42 H new ATOM 0 HB2 GLU A 64 -3.147 13.904 11.169 1.00 0.42 H new ATOM 0 HB3 GLU A 64 -4.870 13.779 10.876 1.00 0.42 H new ATOM 0 HG2 GLU A 64 -4.396 13.439 13.237 1.00 0.53 H new ATOM 0 HG3 GLU A 64 -5.049 11.971 12.537 1.00 0.53 H new ATOM 1213 N LYS A 65 -5.981 11.587 9.316 1.00 0.58 N ATOM 1214 CA LYS A 65 -7.127 10.700 9.180 1.00 0.69 C ATOM 1215 C LYS A 65 -6.734 9.508 8.320 1.00 0.71 C ATOM 1216 O LYS A 65 -7.062 8.367 8.629 1.00 0.76 O ATOM 1217 CB LYS A 65 -8.348 11.420 8.581 1.00 0.84 C ATOM 1218 CG LYS A 65 -8.142 11.926 7.159 1.00 1.92 C ATOM 1219 CD LYS A 65 -9.416 12.513 6.568 1.00 2.40 C ATOM 1220 CE LYS A 65 -10.445 11.437 6.237 1.00 3.23 C ATOM 1221 NZ LYS A 65 -9.988 10.538 5.138 1.00 3.96 N ATOM 0 H LYS A 65 -6.086 12.502 8.878 1.00 0.58 H new ATOM 0 HA LYS A 65 -7.418 10.361 10.174 1.00 0.69 H new ATOM 0 HB2 LYS A 65 -9.199 10.738 8.592 1.00 0.84 H new ATOM 0 HB3 LYS A 65 -8.607 12.264 9.220 1.00 0.84 H new ATOM 0 HG2 LYS A 65 -7.359 12.684 7.155 1.00 1.92 H new ATOM 0 HG3 LYS A 65 -7.796 11.106 6.530 1.00 1.92 H new ATOM 0 HD2 LYS A 65 -9.849 13.223 7.273 1.00 2.40 H new ATOM 0 HD3 LYS A 65 -9.172 13.071 5.664 1.00 2.40 H new ATOM 0 HE2 LYS A 65 -10.647 10.844 7.129 1.00 3.23 H new ATOM 0 HE3 LYS A 65 -11.384 11.911 5.950 1.00 3.23 H new ATOM 0 HZ1 LYS A 65 -10.814 10.176 4.620 1.00 3.96 H new ATOM 0 HZ2 LYS A 65 -9.376 11.070 4.487 1.00 3.96 H new ATOM 0 HZ3 LYS A 65 -9.455 9.741 5.541 1.00 3.96 H new ATOM 1235 N LEU A 66 -5.968 9.793 7.269 1.00 0.72 N ATOM 1236 CA LEU A 66 -5.524 8.777 6.330 1.00 0.80 C ATOM 1237 C LEU A 66 -4.594 7.786 7.010 1.00 0.76 C ATOM 1238 O LEU A 66 -4.625 6.591 6.722 1.00 1.07 O ATOM 1239 CB LEU A 66 -4.800 9.432 5.154 1.00 0.84 C ATOM 1240 CG LEU A 66 -4.165 8.460 4.159 1.00 0.77 C ATOM 1241 CD1 LEU A 66 -5.217 7.590 3.505 1.00 1.50 C ATOM 1242 CD2 LEU A 66 -3.380 9.217 3.109 1.00 1.37 C ATOM 0 H LEU A 66 -5.641 10.734 7.049 1.00 0.72 H new ATOM 0 HA LEU A 66 -6.401 8.242 5.965 1.00 0.80 H new ATOM 0 HB2 LEU A 66 -5.508 10.064 4.619 1.00 0.84 H new ATOM 0 HB3 LEU A 66 -4.021 10.086 5.546 1.00 0.84 H new ATOM 0 HG LEU A 66 -3.481 7.812 4.708 1.00 0.77 H new ATOM 0 HD11 LEU A 66 -4.739 6.908 2.802 1.00 1.50 H new ATOM 0 HD12 LEU A 66 -5.741 7.016 4.269 1.00 1.50 H new ATOM 0 HD13 LEU A 66 -5.930 8.219 2.972 1.00 1.50 H new ATOM 0 HD21 LEU A 66 -2.934 8.511 2.408 1.00 1.37 H new ATOM 0 HD22 LEU A 66 -4.047 9.890 2.571 1.00 1.37 H new ATOM 0 HD23 LEU A 66 -2.592 9.796 3.591 1.00 1.37 H new ATOM 1254 N HIS A 67 -3.791 8.282 7.938 1.00 0.52 N ATOM 1255 CA HIS A 67 -2.781 7.460 8.568 1.00 0.55 C ATOM 1256 C HIS A 67 -3.463 6.514 9.523 1.00 0.44 C ATOM 1257 O HIS A 67 -3.115 5.345 9.612 1.00 0.45 O ATOM 1258 CB HIS A 67 -1.757 8.328 9.306 1.00 0.67 C ATOM 1259 CG HIS A 67 -0.554 7.569 9.776 1.00 0.94 C ATOM 1260 ND1 HIS A 67 -0.142 7.542 11.092 1.00 1.62 N ATOM 1261 CD2 HIS A 67 0.341 6.823 9.090 1.00 1.85 C ATOM 1262 CE1 HIS A 67 0.954 6.816 11.193 1.00 2.13 C ATOM 1263 NE2 HIS A 67 1.267 6.366 9.993 1.00 2.34 N ATOM 0 H HIS A 67 -3.822 9.247 8.268 1.00 0.52 H new ATOM 0 HA HIS A 67 -2.242 6.893 7.809 1.00 0.55 H new ATOM 0 HB2 HIS A 67 -1.433 9.133 8.646 1.00 0.67 H new ATOM 0 HB3 HIS A 67 -2.240 8.794 10.165 1.00 0.67 H new ATOM 0 HD2 HIS A 67 0.329 6.624 8.029 1.00 1.85 H new ATOM 0 HE1 HIS A 67 1.502 6.623 12.103 1.00 2.13 H new ATOM 0 HE2 HIS A 67 2.068 5.774 9.772 1.00 2.34 H new ATOM 1272 N ALA A 68 -4.462 7.039 10.206 1.00 0.39 N ATOM 1273 CA ALA A 68 -5.280 6.259 11.111 1.00 0.36 C ATOM 1274 C ALA A 68 -6.081 5.209 10.343 1.00 0.34 C ATOM 1275 O ALA A 68 -6.274 4.094 10.822 1.00 0.37 O ATOM 1276 CB ALA A 68 -6.204 7.196 11.860 1.00 0.40 C ATOM 0 H ALA A 68 -4.729 8.022 10.148 1.00 0.39 H new ATOM 0 HA ALA A 68 -4.642 5.732 11.820 1.00 0.36 H new ATOM 0 HB1 ALA A 68 -6.827 6.622 12.546 1.00 0.40 H new ATOM 0 HB2 ALA A 68 -5.612 7.917 12.424 1.00 0.40 H new ATOM 0 HB3 ALA A 68 -6.839 7.725 11.150 1.00 0.40 H new ATOM 1282 N MET A 69 -6.548 5.586 9.156 1.00 0.33 N ATOM 1283 CA MET A 69 -7.262 4.671 8.269 1.00 0.37 C ATOM 1284 C MET A 69 -6.368 3.506 7.864 1.00 0.37 C ATOM 1285 O MET A 69 -6.695 2.340 8.089 1.00 0.42 O ATOM 1286 CB MET A 69 -7.721 5.414 7.015 1.00 0.46 C ATOM 1287 CG MET A 69 -8.896 6.352 7.234 1.00 0.44 C ATOM 1288 SD MET A 69 -8.892 7.736 6.073 1.00 0.72 S ATOM 1289 CE MET A 69 -8.487 6.890 4.548 1.00 0.55 C ATOM 0 H MET A 69 -6.443 6.529 8.783 1.00 0.33 H new ATOM 0 HA MET A 69 -8.128 4.282 8.804 1.00 0.37 H new ATOM 0 HB2 MET A 69 -6.883 5.988 6.621 1.00 0.46 H new ATOM 0 HB3 MET A 69 -7.993 4.683 6.254 1.00 0.46 H new ATOM 0 HG2 MET A 69 -9.827 5.795 7.129 1.00 0.44 H new ATOM 0 HG3 MET A 69 -8.867 6.736 8.254 1.00 0.44 H new ATOM 0 HE1 MET A 69 -8.102 7.609 3.825 1.00 0.55 H new ATOM 0 HE2 MET A 69 -7.730 6.130 4.743 1.00 0.55 H new ATOM 0 HE3 MET A 69 -9.382 6.415 4.146 1.00 0.55 H new ATOM 1299 N VAL A 70 -5.232 3.839 7.262 1.00 0.36 N ATOM 1300 CA VAL A 70 -4.264 2.852 6.830 1.00 0.39 C ATOM 1301 C VAL A 70 -3.786 2.012 8.011 1.00 0.38 C ATOM 1302 O VAL A 70 -3.695 0.786 7.925 1.00 0.38 O ATOM 1303 CB VAL A 70 -3.069 3.554 6.154 1.00 0.42 C ATOM 1304 CG1 VAL A 70 -2.002 2.557 5.747 1.00 0.79 C ATOM 1305 CG2 VAL A 70 -3.547 4.348 4.949 1.00 0.70 C ATOM 0 H VAL A 70 -4.961 4.802 7.062 1.00 0.36 H new ATOM 0 HA VAL A 70 -4.741 2.186 6.110 1.00 0.39 H new ATOM 0 HB VAL A 70 -2.622 4.238 6.875 1.00 0.42 H new ATOM 0 HG11 VAL A 70 -1.174 3.084 5.273 1.00 0.79 H new ATOM 0 HG12 VAL A 70 -1.640 2.031 6.630 1.00 0.79 H new ATOM 0 HG13 VAL A 70 -2.424 1.839 5.044 1.00 0.79 H new ATOM 0 HG21 VAL A 70 -2.697 4.841 4.477 1.00 0.70 H new ATOM 0 HG22 VAL A 70 -4.019 3.675 4.233 1.00 0.70 H new ATOM 0 HG23 VAL A 70 -4.269 5.099 5.271 1.00 0.70 H new ATOM 1309 N LYS A 71 -3.509 2.680 9.124 1.00 0.40 N ATOM 1310 CA LYS A 71 -3.075 1.999 10.336 1.00 0.43 C ATOM 1311 C LYS A 71 -4.162 1.088 10.885 1.00 0.44 C ATOM 1312 O LYS A 71 -3.856 0.047 11.440 1.00 0.45 O ATOM 1313 CB LYS A 71 -2.649 3.002 11.410 1.00 0.48 C ATOM 1314 CG LYS A 71 -1.244 3.554 11.215 1.00 1.22 C ATOM 1315 CD LYS A 71 -0.179 2.480 11.395 1.00 1.30 C ATOM 1316 CE LYS A 71 -0.226 1.880 12.793 1.00 0.75 C ATOM 1317 NZ LYS A 71 0.845 0.871 13.007 1.00 1.47 N ATOM 0 H LYS A 71 -3.577 3.694 9.212 1.00 0.40 H new ATOM 0 HA LYS A 71 -2.215 1.386 10.066 1.00 0.43 H new ATOM 0 HB2 LYS A 71 -3.356 3.831 11.420 1.00 0.48 H new ATOM 0 HB3 LYS A 71 -2.708 2.521 12.386 1.00 0.48 H new ATOM 0 HG2 LYS A 71 -1.159 3.985 10.218 1.00 1.22 H new ATOM 0 HG3 LYS A 71 -1.069 4.361 11.927 1.00 1.22 H new ATOM 0 HD2 LYS A 71 -0.325 1.693 10.655 1.00 1.30 H new ATOM 0 HD3 LYS A 71 0.807 2.909 11.214 1.00 1.30 H new ATOM 0 HE2 LYS A 71 -0.126 2.675 13.532 1.00 0.75 H new ATOM 0 HE3 LYS A 71 -1.199 1.415 12.955 1.00 0.75 H new ATOM 0 HZ1 LYS A 71 0.775 0.489 13.972 1.00 1.47 H new ATOM 0 HZ2 LYS A 71 0.736 0.098 12.320 1.00 1.47 H new ATOM 0 HZ3 LYS A 71 1.775 1.319 12.879 1.00 1.47 H new ATOM 1331 N SER A 72 -5.422 1.481 10.740 1.00 0.45 N ATOM 1332 CA SER A 72 -6.539 0.657 11.196 1.00 0.49 C ATOM 1333 C SER A 72 -6.499 -0.710 10.519 1.00 0.45 C ATOM 1334 O SER A 72 -6.582 -1.750 11.178 1.00 0.49 O ATOM 1335 CB SER A 72 -7.874 1.353 10.898 1.00 0.56 C ATOM 1336 OG SER A 72 -8.973 0.592 11.371 1.00 1.26 O ATOM 0 H SER A 72 -5.697 2.364 10.311 1.00 0.45 H new ATOM 0 HA SER A 72 -6.449 0.519 12.273 1.00 0.49 H new ATOM 0 HB2 SER A 72 -7.884 2.338 11.365 1.00 0.56 H new ATOM 0 HB3 SER A 72 -7.973 1.508 9.824 1.00 0.56 H new ATOM 0 HG SER A 72 -9.808 1.062 11.168 1.00 1.26 H new ATOM 1342 N LYS A 73 -6.345 -0.692 9.206 1.00 0.39 N ATOM 1343 CA LYS A 73 -6.251 -1.914 8.423 1.00 0.38 C ATOM 1344 C LYS A 73 -4.975 -2.674 8.769 1.00 0.33 C ATOM 1345 O LYS A 73 -5.017 -3.866 9.042 1.00 0.38 O ATOM 1346 CB LYS A 73 -6.290 -1.590 6.928 1.00 0.44 C ATOM 1347 CG LYS A 73 -7.551 -0.859 6.491 1.00 0.62 C ATOM 1348 CD LYS A 73 -7.438 -0.365 5.059 1.00 0.78 C ATOM 1349 CE LYS A 73 -8.735 0.266 4.575 1.00 0.88 C ATOM 1350 NZ LYS A 73 -9.853 -0.715 4.530 1.00 1.54 N ATOM 0 H LYS A 73 -6.282 0.164 8.655 1.00 0.39 H new ATOM 0 HA LYS A 73 -7.105 -2.547 8.665 1.00 0.38 H new ATOM 0 HB2 LYS A 73 -5.422 -0.981 6.675 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -6.204 -2.518 6.362 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -8.409 -1.525 6.581 1.00 0.62 H new ATOM 0 HG3 LYS A 73 -7.732 -0.014 7.156 1.00 0.62 H new ATOM 0 HD2 LYS A 73 -6.631 0.364 4.989 1.00 0.78 H new ATOM 0 HD3 LYS A 73 -7.173 -1.198 4.407 1.00 0.78 H new ATOM 0 HE2 LYS A 73 -9.004 1.091 5.234 1.00 0.88 H new ATOM 0 HE3 LYS A 73 -8.584 0.688 3.581 1.00 0.88 H new ATOM 0 HZ1 LYS A 73 -10.635 -0.324 3.967 1.00 1.54 H new ATOM 0 HZ2 LYS A 73 -9.521 -1.600 4.095 1.00 1.54 H new ATOM 0 HZ3 LYS A 73 -10.185 -0.907 5.497 1.00 1.54 H new ATOM 1364 N ILE A 74 -3.854 -1.981 8.804 1.00 0.28 N ATOM 1365 CA ILE A 74 -2.580 -2.619 9.105 1.00 0.28 C ATOM 1366 C ILE A 74 -2.537 -3.131 10.556 1.00 0.28 C ATOM 1367 O ILE A 74 -1.818 -4.073 10.878 1.00 0.30 O ATOM 1368 CB ILE A 74 -1.416 -1.649 8.802 1.00 0.30 C ATOM 1369 CG1 ILE A 74 -1.392 -1.385 7.294 1.00 0.30 C ATOM 1370 CG2 ILE A 74 -0.084 -2.202 9.276 1.00 0.34 C ATOM 1371 CD1 ILE A 74 -0.301 -0.446 6.833 1.00 0.32 C ATOM 0 H ILE A 74 -3.795 -0.978 8.629 1.00 0.28 H new ATOM 0 HA ILE A 74 -2.469 -3.492 8.462 1.00 0.28 H new ATOM 0 HB ILE A 74 -1.575 -0.717 9.344 1.00 0.30 H new ATOM 0 HG12 ILE A 74 -1.277 -2.336 6.774 1.00 0.30 H new ATOM 0 HG13 ILE A 74 -2.356 -0.974 6.996 1.00 0.30 H new ATOM 0 HG21 ILE A 74 0.709 -1.490 9.044 1.00 0.34 H new ATOM 0 HG22 ILE A 74 -0.121 -2.366 10.353 1.00 0.34 H new ATOM 0 HG23 ILE A 74 0.118 -3.147 8.771 1.00 0.34 H new ATOM 0 HD11 ILE A 74 -0.363 -0.319 5.752 1.00 0.32 H new ATOM 0 HD12 ILE A 74 -0.424 0.522 7.319 1.00 0.32 H new ATOM 0 HD13 ILE A 74 0.672 -0.862 7.095 1.00 0.32 H new ATOM 1378 N ALA A 75 -3.343 -2.524 11.416 1.00 0.31 N ATOM 1379 CA ALA A 75 -3.493 -2.980 12.798 1.00 0.32 C ATOM 1380 C ALA A 75 -4.299 -4.269 12.849 1.00 0.32 C ATOM 1381 O ALA A 75 -4.096 -5.120 13.715 1.00 0.35 O ATOM 1382 CB ALA A 75 -4.192 -1.919 13.634 1.00 0.34 C ATOM 0 H ALA A 75 -3.909 -1.708 11.182 1.00 0.31 H new ATOM 0 HA ALA A 75 -2.498 -3.162 13.204 1.00 0.32 H new ATOM 0 HB1 ALA A 75 -4.296 -2.274 14.659 1.00 0.34 H new ATOM 0 HB2 ALA A 75 -3.603 -1.002 13.625 1.00 0.34 H new ATOM 0 HB3 ALA A 75 -5.179 -1.720 13.217 1.00 0.34 H new ATOM 1388 N ALA A 76 -5.221 -4.394 11.909 1.00 0.31 N ATOM 1389 CA ALA A 76 -6.102 -5.547 11.821 1.00 0.32 C ATOM 1390 C ALA A 76 -5.452 -6.651 11.003 1.00 0.34 C ATOM 1391 O ALA A 76 -6.009 -7.736 10.841 1.00 0.49 O ATOM 1392 CB ALA A 76 -7.421 -5.133 11.184 1.00 0.35 C ATOM 0 H ALA A 76 -5.380 -3.696 11.183 1.00 0.31 H new ATOM 0 HA ALA A 76 -6.289 -5.927 12.825 1.00 0.32 H new ATOM 0 HB1 ALA A 76 -8.081 -5.998 11.118 1.00 0.35 H new ATOM 0 HB2 ALA A 76 -7.893 -4.362 11.793 1.00 0.35 H new ATOM 0 HB3 ALA A 76 -7.235 -4.742 10.184 1.00 0.35 H new ATOM 1398 N LEU A 77 -4.272 -6.363 10.490 1.00 0.34 N ATOM 1399 CA LEU A 77 -3.565 -7.287 9.629 1.00 0.31 C ATOM 1400 C LEU A 77 -2.574 -8.105 10.444 1.00 0.32 C ATOM 1401 O LEU A 77 -1.807 -7.550 11.234 1.00 0.33 O ATOM 1402 CB LEU A 77 -2.844 -6.491 8.543 1.00 0.30 C ATOM 1403 CG LEU A 77 -2.446 -7.268 7.293 1.00 0.38 C ATOM 1404 CD1 LEU A 77 -3.596 -8.141 6.815 1.00 0.71 C ATOM 1405 CD2 LEU A 77 -2.049 -6.294 6.203 1.00 0.58 C ATOM 0 H LEU A 77 -3.779 -5.486 10.658 1.00 0.34 H new ATOM 0 HA LEU A 77 -4.269 -7.977 9.164 1.00 0.31 H new ATOM 0 HB2 LEU A 77 -3.485 -5.663 8.242 1.00 0.30 H new ATOM 0 HB3 LEU A 77 -1.944 -6.056 8.977 1.00 0.30 H new ATOM 0 HG LEU A 77 -1.602 -7.915 7.532 1.00 0.38 H new ATOM 0 HD11 LEU A 77 -3.292 -8.687 5.922 1.00 0.71 H new ATOM 0 HD12 LEU A 77 -3.866 -8.849 7.599 1.00 0.71 H new ATOM 0 HD13 LEU A 77 -4.456 -7.514 6.581 1.00 0.71 H new ATOM 0 HD21 LEU A 77 -1.764 -6.846 5.308 1.00 0.58 H new ATOM 0 HD22 LEU A 77 -2.891 -5.641 5.974 1.00 0.58 H new ATOM 0 HD23 LEU A 77 -1.206 -5.692 6.542 1.00 0.58 H new ATOM 1417 N GLY A 78 -2.609 -9.420 10.267 1.00 0.36 N ATOM 1418 CA GLY A 78 -1.711 -10.293 10.999 1.00 0.42 C ATOM 1419 C GLY A 78 -0.256 -10.025 10.665 1.00 0.46 C ATOM 1420 O GLY A 78 0.038 -9.581 9.559 1.00 0.76 O ATOM 0 H GLY A 78 -3.244 -9.898 9.628 1.00 0.36 H new ATOM 0 HA2 GLY A 78 -1.868 -10.158 12.069 1.00 0.42 H new ATOM 0 HA3 GLY A 78 -1.950 -11.332 10.770 1.00 0.42 H new ATOM 1424 N PRO A 79 0.668 -10.303 11.606 1.00 0.66 N ATOM 1425 CA PRO A 79 2.109 -10.017 11.465 1.00 0.86 C ATOM 1426 C PRO A 79 2.677 -10.302 10.072 1.00 0.60 C ATOM 1427 O PRO A 79 3.438 -9.498 9.530 1.00 0.64 O ATOM 1428 CB PRO A 79 2.728 -10.967 12.486 1.00 1.32 C ATOM 1429 CG PRO A 79 1.717 -11.046 13.576 1.00 1.56 C ATOM 1430 CD PRO A 79 0.369 -10.931 12.910 1.00 1.10 C ATOM 0 HA PRO A 79 2.320 -8.959 11.618 1.00 0.86 H new ATOM 0 HB2 PRO A 79 2.921 -11.948 12.051 1.00 1.32 H new ATOM 0 HB3 PRO A 79 3.681 -10.588 12.855 1.00 1.32 H new ATOM 0 HG2 PRO A 79 1.803 -11.987 14.119 1.00 1.56 H new ATOM 0 HG3 PRO A 79 1.863 -10.245 14.301 1.00 1.56 H new ATOM 0 HD2 PRO A 79 -0.099 -11.907 12.785 1.00 1.10 H new ATOM 0 HD3 PRO A 79 -0.317 -10.322 13.499 1.00 1.10 H new ATOM 1438 N GLU A 80 2.288 -11.432 9.495 1.00 0.51 N ATOM 1439 CA GLU A 80 2.806 -11.850 8.200 1.00 0.49 C ATOM 1440 C GLU A 80 2.407 -10.873 7.109 1.00 0.42 C ATOM 1441 O GLU A 80 3.230 -10.478 6.282 1.00 0.49 O ATOM 1442 CB GLU A 80 2.303 -13.250 7.851 1.00 0.70 C ATOM 1443 CG GLU A 80 2.802 -14.320 8.803 1.00 1.25 C ATOM 1444 CD GLU A 80 4.311 -14.336 8.920 1.00 1.79 C ATOM 1445 OE1 GLU A 80 4.971 -14.980 8.076 1.00 2.19 O ATOM 1446 OE2 GLU A 80 4.847 -13.717 9.862 1.00 2.52 O ATOM 0 H GLU A 80 1.613 -12.077 9.906 1.00 0.51 H new ATOM 0 HA GLU A 80 3.894 -11.867 8.266 1.00 0.49 H new ATOM 0 HB2 GLU A 80 1.213 -13.249 7.856 1.00 0.70 H new ATOM 0 HB3 GLU A 80 2.617 -13.500 6.838 1.00 0.70 H new ATOM 0 HG2 GLU A 80 2.366 -14.156 9.789 1.00 1.25 H new ATOM 0 HG3 GLU A 80 2.457 -15.296 8.460 1.00 1.25 H new ATOM 1453 N ALA A 81 1.150 -10.465 7.123 1.00 0.36 N ATOM 1454 CA ALA A 81 0.652 -9.576 6.088 1.00 0.34 C ATOM 1455 C ALA A 81 0.933 -8.122 6.455 1.00 0.31 C ATOM 1456 O ALA A 81 1.148 -7.279 5.586 1.00 0.32 O ATOM 1457 CB ALA A 81 -0.825 -9.826 5.843 1.00 0.36 C ATOM 0 H ALA A 81 0.464 -10.731 7.829 1.00 0.36 H new ATOM 0 HA ALA A 81 1.177 -9.784 5.156 1.00 0.34 H new ATOM 0 HB1 ALA A 81 -1.184 -9.152 5.065 1.00 0.36 H new ATOM 0 HB2 ALA A 81 -0.971 -10.858 5.525 1.00 0.36 H new ATOM 0 HB3 ALA A 81 -1.382 -9.647 6.763 1.00 0.36 H new ATOM 1463 N LYS A 82 0.944 -7.852 7.759 1.00 0.31 N ATOM 1464 CA LYS A 82 1.262 -6.531 8.294 1.00 0.33 C ATOM 1465 C LYS A 82 2.645 -6.084 7.841 1.00 0.33 C ATOM 1466 O LYS A 82 2.818 -4.951 7.388 1.00 0.32 O ATOM 1467 CB LYS A 82 1.210 -6.547 9.824 1.00 0.41 C ATOM 1468 CG LYS A 82 1.225 -5.157 10.442 1.00 0.60 C ATOM 1469 CD LYS A 82 1.141 -5.206 11.959 1.00 0.86 C ATOM 1470 CE LYS A 82 2.488 -5.497 12.598 1.00 1.33 C ATOM 1471 NZ LYS A 82 3.435 -4.356 12.461 1.00 2.04 N ATOM 0 H LYS A 82 0.732 -8.546 8.476 1.00 0.31 H new ATOM 0 HA LYS A 82 0.520 -5.829 7.915 1.00 0.33 H new ATOM 0 HB2 LYS A 82 0.309 -7.070 10.144 1.00 0.41 H new ATOM 0 HB3 LYS A 82 2.060 -7.115 10.203 1.00 0.41 H new ATOM 0 HG2 LYS A 82 2.137 -4.639 10.146 1.00 0.60 H new ATOM 0 HG3 LYS A 82 0.388 -4.578 10.051 1.00 0.60 H new ATOM 0 HD2 LYS A 82 0.762 -4.254 12.331 1.00 0.86 H new ATOM 0 HD3 LYS A 82 0.426 -5.973 12.257 1.00 0.86 H new ATOM 0 HE2 LYS A 82 2.345 -5.723 13.655 1.00 1.33 H new ATOM 0 HE3 LYS A 82 2.922 -6.384 12.138 1.00 1.33 H new ATOM 0 HZ1 LYS A 82 4.266 -4.520 13.065 1.00 2.04 H new ATOM 0 HZ2 LYS A 82 3.738 -4.274 11.470 1.00 2.04 H new ATOM 0 HZ3 LYS A 82 2.963 -3.476 12.753 1.00 2.04 H new ATOM 1485 N GLY A 83 3.619 -6.984 7.950 1.00 0.37 N ATOM 1486 CA GLY A 83 4.976 -6.664 7.552 1.00 0.41 C ATOM 1487 C GLY A 83 5.059 -6.246 6.100 1.00 0.39 C ATOM 1488 O GLY A 83 5.774 -5.301 5.755 1.00 0.41 O ATOM 0 H GLY A 83 3.490 -7.931 8.308 1.00 0.37 H new ATOM 0 HA2 GLY A 83 5.359 -5.861 8.182 1.00 0.41 H new ATOM 0 HA3 GLY A 83 5.616 -7.531 7.716 1.00 0.41 H new ATOM 1492 N PHE A 84 4.318 -6.945 5.251 1.00 0.37 N ATOM 1493 CA PHE A 84 4.251 -6.605 3.840 1.00 0.37 C ATOM 1494 C PHE A 84 3.503 -5.295 3.630 1.00 0.34 C ATOM 1495 O PHE A 84 3.962 -4.433 2.887 1.00 0.37 O ATOM 1496 CB PHE A 84 3.583 -7.726 3.039 1.00 0.39 C ATOM 1497 CG PHE A 84 3.151 -7.296 1.665 1.00 0.74 C ATOM 1498 CD1 PHE A 84 4.092 -6.935 0.713 1.00 0.71 C ATOM 1499 CD2 PHE A 84 1.811 -7.278 1.316 1.00 1.22 C ATOM 1500 CE1 PHE A 84 3.703 -6.564 -0.556 1.00 1.13 C ATOM 1501 CE2 PHE A 84 1.418 -6.904 0.047 1.00 1.65 C ATOM 1502 CZ PHE A 84 2.342 -6.453 -0.853 1.00 1.59 C ATOM 0 H PHE A 84 3.754 -7.752 5.518 1.00 0.37 H new ATOM 0 HA PHE A 84 5.273 -6.482 3.480 1.00 0.37 H new ATOM 0 HB2 PHE A 84 4.276 -8.563 2.950 1.00 0.39 H new ATOM 0 HB3 PHE A 84 2.715 -8.089 3.589 1.00 0.39 H new ATOM 0 HD1 PHE A 84 5.141 -6.945 0.969 1.00 0.71 H new ATOM 0 HD2 PHE A 84 1.065 -7.560 2.045 1.00 1.22 H new ATOM 0 HE1 PHE A 84 4.444 -6.361 -1.315 1.00 1.13 H new ATOM 0 HE2 PHE A 84 0.378 -6.968 -0.235 1.00 1.65 H new ATOM 0 HZ PHE A 84 2.023 -6.014 -1.787 1.00 1.59 H new ATOM 1512 N ALA A 85 2.357 -5.148 4.286 1.00 0.30 N ATOM 1513 CA ALA A 85 1.523 -3.961 4.130 1.00 0.30 C ATOM 1514 C ALA A 85 2.305 -2.692 4.440 1.00 0.32 C ATOM 1515 O ALA A 85 2.281 -1.730 3.678 1.00 0.41 O ATOM 1516 CB ALA A 85 0.304 -4.049 5.028 1.00 0.28 C ATOM 0 H ALA A 85 1.982 -5.840 4.935 1.00 0.30 H new ATOM 0 HA ALA A 85 1.199 -3.917 3.090 1.00 0.30 H new ATOM 0 HB1 ALA A 85 -0.308 -3.156 4.900 1.00 0.28 H new ATOM 0 HB2 ALA A 85 -0.280 -4.930 4.763 1.00 0.28 H new ATOM 0 HB3 ALA A 85 0.623 -4.124 6.068 1.00 0.28 H new ATOM 1522 N GLU A 86 3.019 -2.714 5.550 1.00 0.31 N ATOM 1523 CA GLU A 86 3.794 -1.560 5.973 1.00 0.37 C ATOM 1524 C GLU A 86 4.925 -1.280 4.989 1.00 0.44 C ATOM 1525 O GLU A 86 5.191 -0.125 4.659 1.00 0.70 O ATOM 1526 CB GLU A 86 4.343 -1.776 7.381 1.00 0.43 C ATOM 1527 CG GLU A 86 3.256 -1.851 8.438 1.00 0.55 C ATOM 1528 CD GLU A 86 3.794 -2.149 9.820 1.00 0.95 C ATOM 1529 OE1 GLU A 86 4.055 -3.331 10.124 1.00 1.96 O ATOM 1530 OE2 GLU A 86 3.949 -1.198 10.614 1.00 1.11 O ATOM 0 H GLU A 86 3.079 -3.517 6.176 1.00 0.31 H new ATOM 0 HA GLU A 86 3.137 -0.690 5.989 1.00 0.37 H new ATOM 0 HB2 GLU A 86 4.925 -2.698 7.400 1.00 0.43 H new ATOM 0 HB3 GLU A 86 5.026 -0.963 7.627 1.00 0.43 H new ATOM 0 HG2 GLU A 86 2.714 -0.906 8.461 1.00 0.55 H new ATOM 0 HG3 GLU A 86 2.539 -2.623 8.159 1.00 0.55 H new ATOM 1537 N LYS A 87 5.558 -2.338 4.497 1.00 0.41 N ATOM 1538 CA LYS A 87 6.687 -2.204 3.596 1.00 0.49 C ATOM 1539 C LYS A 87 6.240 -1.782 2.198 1.00 0.49 C ATOM 1540 O LYS A 87 6.873 -0.934 1.569 1.00 0.57 O ATOM 1541 CB LYS A 87 7.449 -3.526 3.532 1.00 0.57 C ATOM 1542 CG LYS A 87 8.687 -3.474 2.663 1.00 0.69 C ATOM 1543 CD LYS A 87 9.680 -2.439 3.168 1.00 1.25 C ATOM 1544 CE LYS A 87 10.964 -2.446 2.355 1.00 1.75 C ATOM 1545 NZ LYS A 87 11.685 -3.742 2.461 1.00 2.12 N ATOM 0 H LYS A 87 5.304 -3.302 4.711 1.00 0.41 H new ATOM 0 HA LYS A 87 7.342 -1.423 3.981 1.00 0.49 H new ATOM 0 HB2 LYS A 87 7.737 -3.818 4.542 1.00 0.57 H new ATOM 0 HB3 LYS A 87 6.783 -4.301 3.154 1.00 0.57 H new ATOM 0 HG2 LYS A 87 9.161 -4.455 2.644 1.00 0.69 H new ATOM 0 HG3 LYS A 87 8.403 -3.237 1.638 1.00 0.69 H new ATOM 0 HD2 LYS A 87 9.227 -1.449 3.124 1.00 1.25 H new ATOM 0 HD3 LYS A 87 9.911 -2.637 4.215 1.00 1.25 H new ATOM 0 HE2 LYS A 87 10.732 -2.245 1.309 1.00 1.75 H new ATOM 0 HE3 LYS A 87 11.614 -1.641 2.697 1.00 1.75 H new ATOM 0 HZ1 LYS A 87 12.658 -3.627 2.113 1.00 2.12 H new ATOM 0 HZ2 LYS A 87 11.706 -4.047 3.455 1.00 2.12 H new ATOM 0 HZ3 LYS A 87 11.195 -4.460 1.889 1.00 2.12 H new ATOM 1559 N SER A 88 5.154 -2.371 1.712 1.00 0.46 N ATOM 1560 CA SER A 88 4.623 -2.026 0.401 1.00 0.51 C ATOM 1561 C SER A 88 4.152 -0.580 0.390 1.00 0.51 C ATOM 1562 O SER A 88 4.359 0.147 -0.586 1.00 0.57 O ATOM 1563 CB SER A 88 3.481 -2.968 0.013 1.00 0.56 C ATOM 1564 OG SER A 88 2.517 -3.060 1.046 1.00 0.48 O ATOM 0 H SER A 88 4.625 -3.089 2.206 1.00 0.46 H new ATOM 0 HA SER A 88 5.419 -2.139 -0.335 1.00 0.51 H new ATOM 0 HB2 SER A 88 3.006 -2.610 -0.900 1.00 0.56 H new ATOM 0 HB3 SER A 88 3.881 -3.959 -0.203 1.00 0.56 H new ATOM 0 HG SER A 88 2.850 -3.653 1.752 1.00 0.48 H new ATOM 1570 N ILE A 89 3.536 -0.164 1.493 1.00 0.50 N ATOM 1571 CA ILE A 89 3.150 1.223 1.675 1.00 0.56 C ATOM 1572 C ILE A 89 4.379 2.126 1.606 1.00 0.55 C ATOM 1573 O ILE A 89 4.328 3.191 1.006 1.00 0.59 O ATOM 1574 CB ILE A 89 2.378 1.433 3.011 1.00 0.63 C ATOM 1575 CG1 ILE A 89 0.862 1.459 2.769 1.00 0.83 C ATOM 1576 CG2 ILE A 89 2.808 2.713 3.718 1.00 0.79 C ATOM 1577 CD1 ILE A 89 0.293 0.169 2.221 1.00 1.09 C ATOM 0 H ILE A 89 3.295 -0.774 2.274 1.00 0.50 H new ATOM 0 HA ILE A 89 2.472 1.493 0.865 1.00 0.56 H new ATOM 0 HB ILE A 89 2.623 0.589 3.656 1.00 0.63 H new ATOM 0 HG12 ILE A 89 0.361 1.693 3.708 1.00 0.83 H new ATOM 0 HG13 ILE A 89 0.631 2.267 2.075 1.00 0.83 H new ATOM 0 HG21 ILE A 89 2.246 2.823 4.646 1.00 0.79 H new ATOM 0 HG22 ILE A 89 3.873 2.664 3.943 1.00 0.79 H new ATOM 0 HG23 ILE A 89 2.612 3.569 3.072 1.00 0.79 H new ATOM 0 HD11 ILE A 89 -0.783 0.276 2.081 1.00 1.09 H new ATOM 0 HD12 ILE A 89 0.763 -0.058 1.264 1.00 1.09 H new ATOM 0 HD13 ILE A 89 0.488 -0.642 2.923 1.00 1.09 H new ATOM 1584 N GLU A 90 5.491 1.680 2.196 1.00 0.53 N ATOM 1585 CA GLU A 90 6.732 2.455 2.181 1.00 0.60 C ATOM 1586 C GLU A 90 7.301 2.572 0.768 1.00 0.56 C ATOM 1587 O GLU A 90 7.697 3.659 0.347 1.00 0.63 O ATOM 1588 CB GLU A 90 7.782 1.839 3.107 1.00 0.69 C ATOM 1589 CG GLU A 90 7.407 1.895 4.576 1.00 1.28 C ATOM 1590 CD GLU A 90 8.528 1.428 5.478 1.00 2.08 C ATOM 1591 OE1 GLU A 90 8.693 0.204 5.648 1.00 2.82 O ATOM 1592 OE2 GLU A 90 9.258 2.286 6.020 1.00 2.41 O ATOM 0 H GLU A 90 5.556 0.789 2.688 1.00 0.53 H new ATOM 0 HA GLU A 90 6.486 3.454 2.542 1.00 0.60 H new ATOM 0 HB2 GLU A 90 7.941 0.799 2.821 1.00 0.69 H new ATOM 0 HB3 GLU A 90 8.730 2.358 2.963 1.00 0.69 H new ATOM 0 HG2 GLU A 90 7.135 2.917 4.839 1.00 1.28 H new ATOM 0 HG3 GLU A 90 6.526 1.276 4.747 1.00 1.28 H new ATOM 1599 N ILE A 91 7.338 1.461 0.039 1.00 0.47 N ATOM 1600 CA ILE A 91 7.860 1.463 -1.324 1.00 0.46 C ATOM 1601 C ILE A 91 7.022 2.373 -2.217 1.00 0.47 C ATOM 1602 O ILE A 91 7.557 3.150 -3.011 1.00 0.51 O ATOM 1603 CB ILE A 91 7.903 0.043 -1.929 1.00 0.43 C ATOM 1604 CG1 ILE A 91 8.816 -0.868 -1.095 1.00 0.43 C ATOM 1605 CG2 ILE A 91 8.382 0.104 -3.375 1.00 0.49 C ATOM 1606 CD1 ILE A 91 8.890 -2.293 -1.602 1.00 0.45 C ATOM 0 H ILE A 91 7.014 0.551 0.367 1.00 0.47 H new ATOM 0 HA ILE A 91 8.881 1.840 -1.274 1.00 0.46 H new ATOM 0 HB ILE A 91 6.897 -0.376 -1.913 1.00 0.43 H new ATOM 0 HG12 ILE A 91 9.820 -0.445 -1.082 1.00 0.43 H new ATOM 0 HG13 ILE A 91 8.460 -0.877 -0.065 1.00 0.43 H new ATOM 0 HG21 ILE A 91 8.409 -0.903 -3.792 1.00 0.49 H new ATOM 0 HG22 ILE A 91 7.699 0.721 -3.959 1.00 0.49 H new ATOM 0 HG23 ILE A 91 9.381 0.538 -3.409 1.00 0.49 H new ATOM 0 HD11 ILE A 91 9.554 -2.873 -0.961 1.00 0.45 H new ATOM 0 HD12 ILE A 91 7.894 -2.736 -1.589 1.00 0.45 H new ATOM 0 HD13 ILE A 91 9.276 -2.297 -2.622 1.00 0.45 H new ATOM 1613 N ALA A 92 5.707 2.288 -2.071 1.00 0.47 N ATOM 1614 CA ALA A 92 4.812 3.132 -2.833 1.00 0.53 C ATOM 1615 C ALA A 92 4.921 4.574 -2.354 1.00 0.60 C ATOM 1616 O ALA A 92 4.878 5.507 -3.153 1.00 0.64 O ATOM 1617 CB ALA A 92 3.380 2.630 -2.721 1.00 0.56 C ATOM 0 H ALA A 92 5.242 1.643 -1.432 1.00 0.47 H new ATOM 0 HA ALA A 92 5.100 3.094 -3.883 1.00 0.53 H new ATOM 0 HB1 ALA A 92 2.721 3.277 -3.300 1.00 0.56 H new ATOM 0 HB2 ALA A 92 3.320 1.612 -3.107 1.00 0.56 H new ATOM 0 HB3 ALA A 92 3.071 2.641 -1.676 1.00 0.56 H new ATOM 1623 N ARG A 93 5.074 4.738 -1.046 1.00 0.66 N ATOM 1624 CA ARG A 93 5.239 6.051 -0.430 1.00 0.77 C ATOM 1625 C ARG A 93 6.475 6.754 -0.970 1.00 0.68 C ATOM 1626 O ARG A 93 6.425 7.937 -1.286 1.00 0.68 O ATOM 1627 CB ARG A 93 5.338 5.906 1.092 1.00 0.99 C ATOM 1628 CG ARG A 93 5.645 7.194 1.835 1.00 1.55 C ATOM 1629 CD ARG A 93 5.683 6.959 3.338 1.00 1.83 C ATOM 1630 NE ARG A 93 4.359 6.642 3.875 1.00 2.71 N ATOM 1631 CZ ARG A 93 4.150 5.832 4.914 1.00 3.44 C ATOM 1632 NH1 ARG A 93 5.171 5.229 5.511 1.00 3.55 N ATOM 1633 NH2 ARG A 93 2.914 5.618 5.355 1.00 4.42 N ATOM 0 H ARG A 93 5.087 3.965 -0.381 1.00 0.66 H new ATOM 0 HA ARG A 93 4.368 6.658 -0.677 1.00 0.77 H new ATOM 0 HB2 ARG A 93 4.397 5.502 1.466 1.00 0.99 H new ATOM 0 HB3 ARG A 93 6.113 5.176 1.324 1.00 0.99 H new ATOM 0 HG2 ARG A 93 6.603 7.592 1.501 1.00 1.55 H new ATOM 0 HG3 ARG A 93 4.889 7.943 1.599 1.00 1.55 H new ATOM 0 HD2 ARG A 93 6.370 6.142 3.560 1.00 1.83 H new ATOM 0 HD3 ARG A 93 6.073 7.848 3.835 1.00 1.83 H new ATOM 0 HE ARG A 93 3.547 7.066 3.428 1.00 2.71 H new ATOM 0 HH11 ARG A 93 6.122 5.384 5.176 1.00 3.55 H new ATOM 0 HH12 ARG A 93 5.005 4.611 6.305 1.00 3.55 H new ATOM 0 HH21 ARG A 93 2.124 6.074 4.899 1.00 4.42 H new ATOM 0 HH22 ARG A 93 2.756 4.998 6.150 1.00 4.42 H new ATOM 1647 N GLY A 94 7.571 6.013 -1.103 1.00 0.66 N ATOM 1648 CA GLY A 94 8.819 6.596 -1.562 1.00 0.65 C ATOM 1649 C GLY A 94 8.725 7.126 -2.979 1.00 0.56 C ATOM 1650 O GLY A 94 9.401 8.093 -3.333 1.00 0.56 O ATOM 0 H GLY A 94 7.617 5.014 -0.900 1.00 0.66 H new ATOM 0 HA2 GLY A 94 9.105 7.407 -0.892 1.00 0.65 H new ATOM 0 HA3 GLY A 94 9.608 5.846 -1.510 1.00 0.65 H new ATOM 1654 N ILE A 95 7.875 6.499 -3.784 1.00 0.52 N ATOM 1655 CA ILE A 95 7.678 6.907 -5.168 1.00 0.48 C ATOM 1656 C ILE A 95 6.997 8.273 -5.254 1.00 0.47 C ATOM 1657 O ILE A 95 7.427 9.143 -6.006 1.00 0.49 O ATOM 1658 CB ILE A 95 6.854 5.857 -5.945 1.00 0.50 C ATOM 1659 CG1 ILE A 95 7.603 4.518 -5.985 1.00 0.53 C ATOM 1660 CG2 ILE A 95 6.544 6.341 -7.355 1.00 0.52 C ATOM 1661 CD1 ILE A 95 8.984 4.610 -6.604 1.00 0.55 C ATOM 0 H ILE A 95 7.308 5.701 -3.498 1.00 0.52 H new ATOM 0 HA ILE A 95 8.664 6.985 -5.625 1.00 0.48 H new ATOM 0 HB ILE A 95 5.907 5.712 -5.425 1.00 0.50 H new ATOM 0 HG12 ILE A 95 7.695 4.133 -4.969 1.00 0.53 H new ATOM 0 HG13 ILE A 95 7.010 3.797 -6.547 1.00 0.53 H new ATOM 0 HG21 ILE A 95 5.963 5.583 -7.880 1.00 0.52 H new ATOM 0 HG22 ILE A 95 5.971 7.267 -7.304 1.00 0.52 H new ATOM 0 HG23 ILE A 95 7.476 6.520 -7.891 1.00 0.52 H new ATOM 0 HD11 ILE A 95 9.452 3.626 -6.597 1.00 0.55 H new ATOM 0 HD12 ILE A 95 8.899 4.965 -7.631 1.00 0.55 H new ATOM 0 HD13 ILE A 95 9.595 5.306 -6.029 1.00 0.55 H new ATOM 1668 N LYS A 96 5.944 8.469 -4.474 1.00 0.50 N ATOM 1669 CA LYS A 96 5.267 9.763 -4.451 1.00 0.54 C ATOM 1670 C LYS A 96 5.999 10.722 -3.526 1.00 0.57 C ATOM 1671 O LYS A 96 5.826 11.926 -3.638 1.00 0.83 O ATOM 1672 CB LYS A 96 3.789 9.669 -4.043 1.00 0.64 C ATOM 1673 CG LYS A 96 2.929 8.766 -4.918 1.00 1.47 C ATOM 1674 CD LYS A 96 3.093 7.301 -4.549 1.00 1.78 C ATOM 1675 CE LYS A 96 2.065 6.430 -5.244 1.00 1.90 C ATOM 1676 NZ LYS A 96 2.255 4.989 -4.925 1.00 2.70 N ATOM 0 H LYS A 96 5.543 7.763 -3.857 1.00 0.50 H new ATOM 0 HA LYS A 96 5.287 10.140 -5.474 1.00 0.54 H new ATOM 0 HB2 LYS A 96 3.735 9.310 -3.015 1.00 0.64 H new ATOM 0 HB3 LYS A 96 3.362 10.672 -4.053 1.00 0.64 H new ATOM 0 HG2 LYS A 96 1.882 9.051 -4.816 1.00 1.47 H new ATOM 0 HG3 LYS A 96 3.199 8.910 -5.964 1.00 1.47 H new ATOM 0 HD2 LYS A 96 4.095 6.968 -4.819 1.00 1.78 H new ATOM 0 HD3 LYS A 96 2.999 7.185 -3.469 1.00 1.78 H new ATOM 0 HE2 LYS A 96 1.064 6.740 -4.944 1.00 1.90 H new ATOM 0 HE3 LYS A 96 2.134 6.576 -6.322 1.00 1.90 H new ATOM 0 HZ1 LYS A 96 1.342 4.569 -4.658 1.00 2.70 H new ATOM 0 HZ2 LYS A 96 2.632 4.496 -5.759 1.00 2.70 H new ATOM 0 HZ3 LYS A 96 2.924 4.894 -4.135 1.00 2.70 H new ATOM 1690 N ALA A 97 6.839 10.206 -2.650 1.00 0.50 N ATOM 1691 CA ALA A 97 7.707 11.059 -1.848 1.00 0.53 C ATOM 1692 C ALA A 97 8.650 11.847 -2.742 1.00 0.46 C ATOM 1693 O ALA A 97 8.919 13.020 -2.494 1.00 0.48 O ATOM 1694 CB ALA A 97 8.496 10.231 -0.848 1.00 0.63 C ATOM 0 H ALA A 97 6.942 9.207 -2.473 1.00 0.50 H new ATOM 0 HA ALA A 97 7.082 11.761 -1.296 1.00 0.53 H new ATOM 0 HB1 ALA A 97 9.138 10.886 -0.259 1.00 0.63 H new ATOM 0 HB2 ALA A 97 7.807 9.707 -0.186 1.00 0.63 H new ATOM 0 HB3 ALA A 97 9.110 9.505 -1.381 1.00 0.63 H new ATOM 1700 N ARG A 98 9.122 11.206 -3.797 1.00 0.41 N ATOM 1701 CA ARG A 98 9.997 11.868 -4.749 1.00 0.44 C ATOM 1702 C ARG A 98 9.183 12.525 -5.857 1.00 0.44 C ATOM 1703 O ARG A 98 9.730 12.992 -6.845 1.00 0.53 O ATOM 1704 CB ARG A 98 11.028 10.891 -5.311 1.00 0.51 C ATOM 1705 CG ARG A 98 10.416 9.621 -5.861 1.00 1.02 C ATOM 1706 CD ARG A 98 11.471 8.571 -6.148 1.00 0.81 C ATOM 1707 NE ARG A 98 12.329 8.944 -7.262 1.00 1.51 N ATOM 1708 CZ ARG A 98 13.095 8.081 -7.919 1.00 1.94 C ATOM 1709 NH1 ARG A 98 13.193 6.829 -7.493 1.00 1.37 N ATOM 1710 NH2 ARG A 98 13.787 8.476 -8.977 1.00 3.10 N ATOM 0 H ARG A 98 8.915 10.231 -4.016 1.00 0.41 H new ATOM 0 HA ARG A 98 10.544 12.654 -4.228 1.00 0.44 H new ATOM 0 HB2 ARG A 98 11.593 11.385 -6.102 1.00 0.51 H new ATOM 0 HB3 ARG A 98 11.738 10.633 -4.526 1.00 0.51 H new ATOM 0 HG2 ARG A 98 9.694 9.226 -5.147 1.00 1.02 H new ATOM 0 HG3 ARG A 98 9.869 9.847 -6.776 1.00 1.02 H new ATOM 0 HD2 ARG A 98 12.081 8.418 -5.257 1.00 0.81 H new ATOM 0 HD3 ARG A 98 10.985 7.621 -6.368 1.00 0.81 H new ATOM 0 HE ARG A 98 12.343 9.921 -7.554 1.00 1.51 H new ATOM 0 HH11 ARG A 98 12.681 6.531 -6.663 1.00 1.37 H new ATOM 0 HH12 ARG A 98 13.781 6.164 -7.996 1.00 1.37 H new ATOM 0 HH21 ARG A 98 13.732 9.446 -9.289 1.00 3.10 H new ATOM 0 HH22 ARG A 98 14.375 7.811 -9.480 1.00 3.10 H new ATOM 1724 N TYR A 99 7.870 12.528 -5.688 1.00 0.44 N ATOM 1725 CA TYR A 99 7.005 13.427 -6.439 1.00 0.50 C ATOM 1726 C TYR A 99 6.743 14.666 -5.597 1.00 0.54 C ATOM 1727 O TYR A 99 6.773 15.790 -6.100 1.00 0.64 O ATOM 1728 CB TYR A 99 5.671 12.768 -6.805 1.00 0.53 C ATOM 1729 CG TYR A 99 5.662 12.093 -8.158 1.00 0.59 C ATOM 1730 CD1 TYR A 99 5.791 12.826 -9.331 1.00 0.73 C ATOM 1731 CD2 TYR A 99 5.533 10.714 -8.258 1.00 0.60 C ATOM 1732 CE1 TYR A 99 5.791 12.203 -10.563 1.00 0.85 C ATOM 1733 CE2 TYR A 99 5.529 10.085 -9.486 1.00 0.71 C ATOM 1734 CZ TYR A 99 5.635 10.870 -10.655 1.00 0.83 C ATOM 1735 OH TYR A 99 5.654 10.208 -11.862 1.00 0.97 O ATOM 0 H TYR A 99 7.378 11.917 -5.036 1.00 0.44 H new ATOM 0 HA TYR A 99 7.508 13.688 -7.370 1.00 0.50 H new ATOM 0 HB2 TYR A 99 5.422 12.030 -6.042 1.00 0.53 H new ATOM 0 HB3 TYR A 99 4.887 13.525 -6.784 1.00 0.53 H new ATOM 0 HD1 TYR A 99 5.893 13.900 -9.278 1.00 0.73 H new ATOM 0 HD2 TYR A 99 5.434 10.124 -7.359 1.00 0.60 H new ATOM 0 HE1 TYR A 99 5.917 12.791 -11.460 1.00 0.85 H new ATOM 0 HE2 TYR A 99 5.446 9.010 -9.552 1.00 0.71 H new ATOM 0 HH TYR A 99 5.525 9.248 -11.711 1.00 0.97 H new ATOM 1745 N TYR A 100 6.522 14.447 -4.299 1.00 0.51 N ATOM 1746 CA TYR A 100 6.224 15.524 -3.366 1.00 0.58 C ATOM 1747 C TYR A 100 7.375 16.512 -3.276 1.00 0.58 C ATOM 1748 O TYR A 100 7.162 17.710 -3.121 1.00 0.71 O ATOM 1749 CB TYR A 100 5.913 14.974 -1.974 1.00 0.57 C ATOM 1750 CG TYR A 100 4.555 14.318 -1.854 1.00 0.72 C ATOM 1751 CD1 TYR A 100 3.401 14.998 -2.211 1.00 1.03 C ATOM 1752 CD2 TYR A 100 4.430 13.013 -1.400 1.00 0.97 C ATOM 1753 CE1 TYR A 100 2.162 14.403 -2.116 1.00 1.26 C ATOM 1754 CE2 TYR A 100 3.193 12.409 -1.303 1.00 1.16 C ATOM 1755 CZ TYR A 100 2.062 13.119 -1.612 1.00 1.21 C ATOM 1756 OH TYR A 100 0.829 12.514 -1.567 1.00 1.48 O ATOM 0 H TYR A 100 6.545 13.521 -3.871 1.00 0.51 H new ATOM 0 HA TYR A 100 5.345 16.044 -3.747 1.00 0.58 H new ATOM 0 HB2 TYR A 100 6.680 14.248 -1.703 1.00 0.57 H new ATOM 0 HB3 TYR A 100 5.976 15.788 -1.252 1.00 0.57 H new ATOM 0 HD1 TYR A 100 3.475 16.014 -2.571 1.00 1.03 H new ATOM 0 HD2 TYR A 100 5.315 12.461 -1.118 1.00 0.97 H new ATOM 0 HE1 TYR A 100 1.277 14.935 -2.432 1.00 1.26 H new ATOM 0 HE2 TYR A 100 3.116 11.380 -0.985 1.00 1.16 H new ATOM 0 HH TYR A 100 0.288 12.927 -0.862 1.00 1.48 H new ATOM 1766 N THR A 101 8.593 16.003 -3.387 1.00 0.55 N ATOM 1767 CA THR A 101 9.786 16.829 -3.291 1.00 0.66 C ATOM 1768 C THR A 101 9.995 17.688 -4.538 1.00 0.71 C ATOM 1769 O THR A 101 10.982 18.421 -4.639 1.00 0.71 O ATOM 1770 CB THR A 101 11.026 15.951 -3.066 1.00 0.71 C ATOM 1771 OG1 THR A 101 11.050 14.886 -4.024 1.00 0.65 O ATOM 1772 CG2 THR A 101 11.032 15.379 -1.654 1.00 0.87 C ATOM 0 H THR A 101 8.781 15.013 -3.545 1.00 0.55 H new ATOM 0 HA THR A 101 9.643 17.497 -2.441 1.00 0.66 H new ATOM 0 HB THR A 101 11.915 16.569 -3.192 1.00 0.71 H new ATOM 0 HG1 THR A 101 11.789 14.277 -3.817 1.00 0.65 H new ATOM 0 HG21 THR A 101 11.919 14.760 -1.516 1.00 0.87 H new ATOM 0 HG22 THR A 101 11.042 16.195 -0.931 1.00 0.87 H new ATOM 0 HG23 THR A 101 10.139 14.772 -1.503 1.00 0.87 H new ATOM 1780 N GLY A 102 9.072 17.591 -5.490 1.00 0.82 N ATOM 1781 CA GLY A 102 9.175 18.362 -6.715 1.00 0.95 C ATOM 1782 C GLY A 102 9.956 17.635 -7.789 1.00 0.95 C ATOM 1783 O GLY A 102 10.236 18.195 -8.850 1.00 1.16 O ATOM 0 H GLY A 102 8.251 16.989 -5.434 1.00 0.82 H new ATOM 0 HA2 GLY A 102 8.175 18.586 -7.085 1.00 0.95 H new ATOM 0 HA3 GLY A 102 9.657 19.316 -6.502 1.00 0.95 H new ATOM 1787 N ASN A 103 10.304 16.389 -7.513 1.00 0.82 N ATOM 1788 CA ASN A 103 11.048 15.572 -8.461 1.00 0.89 C ATOM 1789 C ASN A 103 10.090 14.690 -9.256 1.00 0.98 C ATOM 1790 O ASN A 103 8.871 14.788 -9.093 1.00 1.83 O ATOM 1791 CB ASN A 103 12.074 14.699 -7.729 1.00 0.90 C ATOM 1792 CG ASN A 103 13.101 15.504 -6.956 1.00 1.28 C ATOM 1793 OD1 ASN A 103 13.454 16.623 -7.338 1.00 1.76 O ATOM 1794 ND2 ASN A 103 13.593 14.941 -5.862 1.00 1.65 N ATOM 0 H ASN A 103 10.082 15.918 -6.636 1.00 0.82 H new ATOM 0 HA ASN A 103 11.578 16.233 -9.146 1.00 0.89 H new ATOM 0 HB2 ASN A 103 11.551 14.034 -7.042 1.00 0.90 H new ATOM 0 HB3 ASN A 103 12.588 14.068 -8.454 1.00 0.90 H new ATOM 0 HD21 ASN A 103 14.289 15.435 -5.303 1.00 1.65 H new ATOM 0 HD22 ASN A 103 13.276 14.014 -5.579 1.00 1.65 H new ATOM 1801 N GLU A 104 10.640 13.839 -10.118 1.00 0.56 N ATOM 1802 CA GLU A 104 9.834 12.917 -10.914 1.00 0.56 C ATOM 1803 C GLU A 104 10.585 11.608 -11.164 1.00 0.49 C ATOM 1804 O GLU A 104 11.564 11.581 -11.910 1.00 0.55 O ATOM 1805 CB GLU A 104 9.449 13.545 -12.258 1.00 0.67 C ATOM 1806 CG GLU A 104 8.438 14.674 -12.151 1.00 0.80 C ATOM 1807 CD GLU A 104 7.982 15.169 -13.504 1.00 1.15 C ATOM 1808 OE1 GLU A 104 7.220 14.450 -14.182 1.00 1.75 O ATOM 1809 OE2 GLU A 104 8.377 16.285 -13.899 1.00 1.17 O ATOM 0 H GLU A 104 11.644 13.769 -10.284 1.00 0.56 H new ATOM 0 HA GLU A 104 8.928 12.705 -10.347 1.00 0.56 H new ATOM 0 HB2 GLU A 104 10.350 13.924 -12.741 1.00 0.67 H new ATOM 0 HB3 GLU A 104 9.043 12.768 -12.906 1.00 0.67 H new ATOM 0 HG2 GLU A 104 7.574 14.331 -11.582 1.00 0.80 H new ATOM 0 HG3 GLU A 104 8.879 15.501 -11.594 1.00 0.80 H new ATOM 1816 N PRO A 105 10.145 10.508 -10.528 1.00 0.44 N ATOM 1817 CA PRO A 105 10.702 9.169 -10.773 1.00 0.44 C ATOM 1818 C PRO A 105 10.453 8.695 -12.200 1.00 0.42 C ATOM 1819 O PRO A 105 9.530 9.164 -12.871 1.00 0.47 O ATOM 1820 CB PRO A 105 9.948 8.277 -9.780 1.00 0.48 C ATOM 1821 CG PRO A 105 8.718 9.033 -9.424 1.00 0.53 C ATOM 1822 CD PRO A 105 9.084 10.485 -9.510 1.00 0.49 C ATOM 0 HA PRO A 105 11.784 9.151 -10.645 1.00 0.44 H new ATOM 0 HB2 PRO A 105 9.701 7.314 -10.226 1.00 0.48 H new ATOM 0 HB3 PRO A 105 10.553 8.074 -8.897 1.00 0.48 H new ATOM 0 HG2 PRO A 105 7.903 8.795 -10.107 1.00 0.53 H new ATOM 0 HG3 PRO A 105 8.379 8.775 -8.421 1.00 0.53 H new ATOM 0 HD2 PRO A 105 8.232 11.098 -9.804 1.00 0.49 H new ATOM 0 HD3 PRO A 105 9.437 10.868 -8.553 1.00 0.49 H new ATOM 1830 N THR A 106 11.274 7.764 -12.659 1.00 0.42 N ATOM 1831 CA THR A 106 11.117 7.197 -13.985 1.00 0.42 C ATOM 1832 C THR A 106 10.046 6.118 -13.959 1.00 0.39 C ATOM 1833 O THR A 106 9.587 5.729 -12.884 1.00 0.41 O ATOM 1834 CB THR A 106 12.434 6.581 -14.504 1.00 0.50 C ATOM 1835 OG1 THR A 106 12.897 5.564 -13.604 1.00 1.48 O ATOM 1836 CG2 THR A 106 13.506 7.643 -14.660 1.00 1.05 C ATOM 0 H THR A 106 12.059 7.385 -12.129 1.00 0.42 H new ATOM 0 HA THR A 106 10.827 8.006 -14.656 1.00 0.42 H new ATOM 0 HB THR A 106 12.234 6.138 -15.480 1.00 0.50 H new ATOM 0 HG1 THR A 106 13.222 5.981 -12.779 1.00 1.48 H new ATOM 0 HG21 THR A 106 14.423 7.183 -15.027 1.00 1.05 H new ATOM 0 HG22 THR A 106 13.170 8.398 -15.371 1.00 1.05 H new ATOM 0 HG23 THR A 106 13.696 8.112 -13.695 1.00 1.05 H new ATOM 1844 N LYS A 107 9.653 5.618 -15.121 1.00 0.39 N ATOM 1845 CA LYS A 107 8.689 4.530 -15.163 1.00 0.39 C ATOM 1846 C LYS A 107 9.304 3.288 -14.526 1.00 0.36 C ATOM 1847 O LYS A 107 8.604 2.439 -13.973 1.00 0.38 O ATOM 1848 CB LYS A 107 8.246 4.245 -16.602 1.00 0.43 C ATOM 1849 CG LYS A 107 9.380 3.794 -17.513 1.00 1.33 C ATOM 1850 CD LYS A 107 8.913 3.611 -18.949 1.00 1.66 C ATOM 1851 CE LYS A 107 8.491 4.930 -19.575 1.00 2.22 C ATOM 1852 NZ LYS A 107 8.023 4.757 -20.976 1.00 2.88 N ATOM 0 H LYS A 107 9.980 5.941 -16.032 1.00 0.39 H new ATOM 0 HA LYS A 107 7.801 4.818 -14.600 1.00 0.39 H new ATOM 0 HB2 LYS A 107 7.474 3.476 -16.590 1.00 0.43 H new ATOM 0 HB3 LYS A 107 7.793 5.145 -17.018 1.00 0.43 H new ATOM 0 HG2 LYS A 107 10.184 4.529 -17.483 1.00 1.33 H new ATOM 0 HG3 LYS A 107 9.792 2.855 -17.143 1.00 1.33 H new ATOM 0 HD2 LYS A 107 9.715 3.168 -19.539 1.00 1.66 H new ATOM 0 HD3 LYS A 107 8.077 2.912 -18.974 1.00 1.66 H new ATOM 0 HE2 LYS A 107 7.695 5.376 -18.979 1.00 2.22 H new ATOM 0 HE3 LYS A 107 9.330 5.625 -19.556 1.00 2.22 H new ATOM 0 HZ1 LYS A 107 7.745 5.680 -21.366 1.00 2.88 H new ATOM 0 HZ2 LYS A 107 8.791 4.356 -21.551 1.00 2.88 H new ATOM 0 HZ3 LYS A 107 7.206 4.114 -20.992 1.00 2.88 H new ATOM 1866 N ASP A 108 10.633 3.223 -14.575 1.00 0.36 N ATOM 1867 CA ASP A 108 11.381 2.109 -14.011 1.00 0.38 C ATOM 1868 C ASP A 108 11.269 2.102 -12.498 1.00 0.36 C ATOM 1869 O ASP A 108 11.144 1.045 -11.884 1.00 0.38 O ATOM 1870 CB ASP A 108 12.854 2.183 -14.420 1.00 0.47 C ATOM 1871 CG ASP A 108 13.054 2.015 -15.910 1.00 1.29 C ATOM 1872 OD1 ASP A 108 13.031 0.865 -16.393 1.00 1.26 O ATOM 1873 OD2 ASP A 108 13.236 3.034 -16.609 1.00 2.24 O ATOM 0 H ASP A 108 11.217 3.940 -15.006 1.00 0.36 H new ATOM 0 HA ASP A 108 10.953 1.186 -14.402 1.00 0.38 H new ATOM 0 HB2 ASP A 108 13.266 3.143 -14.108 1.00 0.47 H new ATOM 0 HB3 ASP A 108 13.413 1.410 -13.893 1.00 0.47 H new ATOM 1878 N ASP A 109 11.305 3.292 -11.899 1.00 0.36 N ATOM 1879 CA ASP A 109 11.141 3.429 -10.460 1.00 0.37 C ATOM 1880 C ASP A 109 9.795 2.871 -10.023 1.00 0.34 C ATOM 1881 O ASP A 109 9.689 2.187 -9.006 1.00 0.36 O ATOM 1882 CB ASP A 109 11.249 4.898 -10.051 1.00 0.39 C ATOM 1883 CG ASP A 109 12.651 5.449 -10.237 1.00 0.88 C ATOM 1884 OD1 ASP A 109 13.555 5.054 -9.476 1.00 0.94 O ATOM 1885 OD2 ASP A 109 12.860 6.279 -11.146 1.00 1.73 O ATOM 0 H ASP A 109 11.447 4.173 -12.392 1.00 0.36 H new ATOM 0 HA ASP A 109 11.934 2.864 -9.969 1.00 0.37 H new ATOM 0 HB2 ASP A 109 10.548 5.489 -10.641 1.00 0.39 H new ATOM 0 HB3 ASP A 109 10.955 5.004 -9.007 1.00 0.39 H new ATOM 1890 N LEU A 110 8.768 3.166 -10.816 1.00 0.30 N ATOM 1891 CA LEU A 110 7.415 2.690 -10.554 1.00 0.30 C ATOM 1892 C LEU A 110 7.326 1.183 -10.759 1.00 0.29 C ATOM 1893 O LEU A 110 6.741 0.473 -9.942 1.00 0.33 O ATOM 1894 CB LEU A 110 6.407 3.403 -11.466 1.00 0.30 C ATOM 1895 CG LEU A 110 5.982 4.811 -11.031 1.00 0.38 C ATOM 1896 CD1 LEU A 110 7.183 5.669 -10.697 1.00 0.82 C ATOM 1897 CD2 LEU A 110 5.151 5.470 -12.121 1.00 0.82 C ATOM 0 H LEU A 110 8.851 3.740 -11.655 1.00 0.30 H new ATOM 0 HA LEU A 110 7.172 2.917 -9.516 1.00 0.30 H new ATOM 0 HB2 LEU A 110 6.835 3.468 -12.466 1.00 0.30 H new ATOM 0 HB3 LEU A 110 5.514 2.783 -11.541 1.00 0.30 H new ATOM 0 HG LEU A 110 5.376 4.716 -10.130 1.00 0.38 H new ATOM 0 HD11 LEU A 110 6.848 6.661 -10.392 1.00 0.82 H new ATOM 0 HD12 LEU A 110 7.744 5.209 -9.883 1.00 0.82 H new ATOM 0 HD13 LEU A 110 7.823 5.756 -11.575 1.00 0.82 H new ATOM 0 HD21 LEU A 110 4.856 6.469 -11.800 1.00 0.82 H new ATOM 0 HD22 LEU A 110 5.741 5.542 -13.035 1.00 0.82 H new ATOM 0 HD23 LEU A 110 4.260 4.872 -12.311 1.00 0.82 H new ATOM 1909 N LYS A 111 7.910 0.703 -11.855 1.00 0.28 N ATOM 1910 CA LYS A 111 7.943 -0.729 -12.141 1.00 0.31 C ATOM 1911 C LYS A 111 8.613 -1.485 -11.005 1.00 0.33 C ATOM 1912 O LYS A 111 8.084 -2.479 -10.519 1.00 0.35 O ATOM 1913 CB LYS A 111 8.676 -1.006 -13.455 1.00 0.37 C ATOM 1914 CG LYS A 111 7.930 -0.528 -14.692 1.00 0.93 C ATOM 1915 CD LYS A 111 8.759 -0.704 -15.956 1.00 0.92 C ATOM 1916 CE LYS A 111 9.146 -2.158 -16.189 1.00 1.02 C ATOM 1917 NZ LYS A 111 7.962 -3.028 -16.412 1.00 1.74 N ATOM 0 H LYS A 111 8.366 1.284 -12.558 1.00 0.28 H new ATOM 0 HA LYS A 111 6.914 -1.075 -12.238 1.00 0.31 H new ATOM 0 HB2 LYS A 111 9.653 -0.523 -13.423 1.00 0.37 H new ATOM 0 HB3 LYS A 111 8.853 -2.078 -13.542 1.00 0.37 H new ATOM 0 HG2 LYS A 111 6.996 -1.082 -14.790 1.00 0.93 H new ATOM 0 HG3 LYS A 111 7.666 0.523 -14.574 1.00 0.93 H new ATOM 0 HD2 LYS A 111 8.194 -0.338 -16.813 1.00 0.92 H new ATOM 0 HD3 LYS A 111 9.661 -0.096 -15.885 1.00 0.92 H new ATOM 0 HE2 LYS A 111 9.808 -2.221 -17.052 1.00 1.02 H new ATOM 0 HE3 LYS A 111 9.707 -2.525 -15.329 1.00 1.02 H new ATOM 0 HZ1 LYS A 111 8.271 -4.016 -16.515 1.00 1.74 H new ATOM 0 HZ2 LYS A 111 7.316 -2.950 -15.600 1.00 1.74 H new ATOM 0 HZ3 LYS A 111 7.468 -2.728 -17.277 1.00 1.74 H new ATOM 1931 N ALA A 112 9.773 -0.997 -10.576 1.00 0.36 N ATOM 1932 CA ALA A 112 10.498 -1.607 -9.469 1.00 0.42 C ATOM 1933 C ALA A 112 9.699 -1.510 -8.173 1.00 0.43 C ATOM 1934 O ALA A 112 9.691 -2.441 -7.370 1.00 0.47 O ATOM 1935 CB ALA A 112 11.856 -0.947 -9.300 1.00 0.46 C ATOM 0 H ALA A 112 10.231 -0.180 -10.980 1.00 0.36 H new ATOM 0 HA ALA A 112 10.645 -2.662 -9.700 1.00 0.42 H new ATOM 0 HB1 ALA A 112 12.386 -1.413 -8.469 1.00 0.46 H new ATOM 0 HB2 ALA A 112 12.436 -1.069 -10.215 1.00 0.46 H new ATOM 0 HB3 ALA A 112 11.721 0.115 -9.094 1.00 0.46 H new ATOM 1941 N SER A 113 9.032 -0.376 -7.978 1.00 0.41 N ATOM 1942 CA SER A 113 8.203 -0.158 -6.799 1.00 0.45 C ATOM 1943 C SER A 113 7.174 -1.270 -6.639 1.00 0.40 C ATOM 1944 O SER A 113 7.063 -1.871 -5.573 1.00 0.44 O ATOM 1945 CB SER A 113 7.494 1.197 -6.895 1.00 0.54 C ATOM 1946 OG SER A 113 6.775 1.506 -5.712 1.00 1.34 O ATOM 0 H SER A 113 9.051 0.411 -8.627 1.00 0.41 H new ATOM 0 HA SER A 113 8.853 -0.164 -5.924 1.00 0.45 H new ATOM 0 HB2 SER A 113 8.230 1.978 -7.087 1.00 0.54 H new ATOM 0 HB3 SER A 113 6.810 1.189 -7.743 1.00 0.54 H new ATOM 0 HG SER A 113 5.921 1.924 -5.948 1.00 1.34 H new ATOM 1952 N VAL A 114 6.449 -1.578 -7.708 1.00 0.36 N ATOM 1953 CA VAL A 114 5.371 -2.546 -7.629 1.00 0.36 C ATOM 1954 C VAL A 114 5.937 -3.966 -7.711 1.00 0.35 C ATOM 1955 O VAL A 114 5.320 -4.934 -7.275 1.00 0.37 O ATOM 1956 CB VAL A 114 4.350 -2.328 -8.770 1.00 0.36 C ATOM 1957 CG1 VAL A 114 4.022 -0.848 -8.930 1.00 0.65 C ATOM 1958 CG2 VAL A 114 4.844 -2.913 -10.079 1.00 0.56 C ATOM 0 H VAL A 114 6.590 -1.172 -8.633 1.00 0.36 H new ATOM 0 HA VAL A 114 4.861 -2.411 -6.675 1.00 0.36 H new ATOM 0 HB VAL A 114 3.436 -2.855 -8.497 1.00 0.36 H new ATOM 0 HG11 VAL A 114 3.302 -0.720 -9.738 1.00 0.65 H new ATOM 0 HG12 VAL A 114 3.596 -0.467 -8.002 1.00 0.65 H new ATOM 0 HG13 VAL A 114 4.933 -0.297 -9.165 1.00 0.65 H new ATOM 0 HG21 VAL A 114 4.101 -2.741 -10.858 1.00 0.56 H new ATOM 0 HG22 VAL A 114 5.782 -2.434 -10.360 1.00 0.56 H new ATOM 0 HG23 VAL A 114 5.005 -3.985 -9.961 1.00 0.56 H new ATOM 1962 N LYS A 115 7.124 -4.057 -8.285 1.00 0.35 N ATOM 1963 CA LYS A 115 7.826 -5.316 -8.469 1.00 0.37 C ATOM 1964 C LYS A 115 8.266 -5.898 -7.136 1.00 0.35 C ATOM 1965 O LYS A 115 8.081 -7.086 -6.875 1.00 0.37 O ATOM 1966 CB LYS A 115 9.043 -5.073 -9.358 1.00 0.48 C ATOM 1967 CG LYS A 115 9.556 -6.304 -10.074 1.00 0.84 C ATOM 1968 CD LYS A 115 10.601 -5.919 -11.106 1.00 0.81 C ATOM 1969 CE LYS A 115 10.965 -7.088 -12.004 1.00 1.16 C ATOM 1970 NZ LYS A 115 11.534 -8.221 -11.235 1.00 1.72 N ATOM 0 H LYS A 115 7.634 -3.249 -8.641 1.00 0.35 H new ATOM 0 HA LYS A 115 7.153 -6.033 -8.939 1.00 0.37 H new ATOM 0 HB2 LYS A 115 8.789 -4.316 -10.100 1.00 0.48 H new ATOM 0 HB3 LYS A 115 9.847 -4.663 -8.747 1.00 0.48 H new ATOM 0 HG2 LYS A 115 9.986 -6.999 -9.353 1.00 0.84 H new ATOM 0 HG3 LYS A 115 8.729 -6.821 -10.560 1.00 0.84 H new ATOM 0 HD2 LYS A 115 10.225 -5.097 -11.715 1.00 0.81 H new ATOM 0 HD3 LYS A 115 11.496 -5.557 -10.600 1.00 0.81 H new ATOM 0 HE2 LYS A 115 10.078 -7.423 -12.541 1.00 1.16 H new ATOM 0 HE3 LYS A 115 11.686 -6.760 -12.753 1.00 1.16 H new ATOM 0 HZ1 LYS A 115 12.447 -8.498 -11.649 1.00 1.72 H new ATOM 0 HZ2 LYS A 115 11.676 -7.933 -10.246 1.00 1.72 H new ATOM 0 HZ3 LYS A 115 10.879 -9.028 -11.270 1.00 1.72 H new ATOM 1984 N GLU A 116 8.836 -5.059 -6.284 1.00 0.36 N ATOM 1985 CA GLU A 116 9.348 -5.533 -5.008 1.00 0.38 C ATOM 1986 C GLU A 116 8.203 -5.910 -4.076 1.00 0.37 C ATOM 1987 O GLU A 116 8.318 -6.862 -3.311 1.00 0.38 O ATOM 1988 CB GLU A 116 10.259 -4.493 -4.356 1.00 0.43 C ATOM 1989 CG GLU A 116 11.394 -4.024 -5.249 1.00 0.80 C ATOM 1990 CD GLU A 116 12.282 -5.157 -5.719 1.00 1.30 C ATOM 1991 OE1 GLU A 116 13.181 -5.571 -4.962 1.00 1.32 O ATOM 1992 OE2 GLU A 116 12.082 -5.646 -6.851 1.00 2.27 O ATOM 0 H GLU A 116 8.955 -4.060 -6.450 1.00 0.36 H new ATOM 0 HA GLU A 116 9.945 -6.425 -5.197 1.00 0.38 H new ATOM 0 HB2 GLU A 116 9.659 -3.631 -4.064 1.00 0.43 H new ATOM 0 HB3 GLU A 116 10.679 -4.914 -3.442 1.00 0.43 H new ATOM 0 HG2 GLU A 116 10.979 -3.511 -6.116 1.00 0.80 H new ATOM 0 HG3 GLU A 116 11.998 -3.296 -4.708 1.00 0.80 H new ATOM 1999 N VAL A 117 7.087 -5.197 -4.157 1.00 0.36 N ATOM 2000 CA VAL A 117 5.920 -5.548 -3.352 1.00 0.38 C ATOM 2001 C VAL A 117 5.375 -6.914 -3.771 1.00 0.38 C ATOM 2002 O VAL A 117 4.877 -7.661 -2.941 1.00 0.43 O ATOM 2003 CB VAL A 117 4.796 -4.482 -3.413 1.00 0.43 C ATOM 2004 CG1 VAL A 117 5.376 -3.087 -3.283 1.00 0.81 C ATOM 2005 CG2 VAL A 117 3.959 -4.602 -4.673 1.00 0.78 C ATOM 0 H VAL A 117 6.963 -4.384 -4.761 1.00 0.36 H new ATOM 0 HA VAL A 117 6.258 -5.590 -2.317 1.00 0.38 H new ATOM 0 HB VAL A 117 4.131 -4.665 -2.569 1.00 0.43 H new ATOM 0 HG11 VAL A 117 4.572 -2.353 -3.328 1.00 0.81 H new ATOM 0 HG12 VAL A 117 5.897 -2.997 -2.330 1.00 0.81 H new ATOM 0 HG13 VAL A 117 6.077 -2.907 -4.098 1.00 0.81 H new ATOM 0 HG21 VAL A 117 3.185 -3.834 -4.670 1.00 0.78 H new ATOM 0 HG22 VAL A 117 4.597 -4.471 -5.547 1.00 0.78 H new ATOM 0 HG23 VAL A 117 3.493 -5.587 -4.708 1.00 0.78 H new ATOM 2009 N LEU A 118 5.506 -7.260 -5.043 1.00 0.36 N ATOM 2010 CA LEU A 118 5.102 -8.583 -5.510 1.00 0.36 C ATOM 2011 C LEU A 118 6.093 -9.628 -5.033 1.00 0.36 C ATOM 2012 O LEU A 118 5.712 -10.745 -4.690 1.00 0.38 O ATOM 2013 CB LEU A 118 5.029 -8.621 -7.038 1.00 0.41 C ATOM 2014 CG LEU A 118 3.904 -7.819 -7.684 1.00 0.49 C ATOM 2015 CD1 LEU A 118 4.251 -7.526 -9.125 1.00 1.21 C ATOM 2016 CD2 LEU A 118 2.590 -8.576 -7.624 1.00 0.88 C ATOM 0 H LEU A 118 5.886 -6.650 -5.767 1.00 0.36 H new ATOM 0 HA LEU A 118 4.114 -8.799 -5.102 1.00 0.36 H new ATOM 0 HB2 LEU A 118 5.978 -8.259 -7.434 1.00 0.41 H new ATOM 0 HB3 LEU A 118 4.930 -9.661 -7.349 1.00 0.41 H new ATOM 0 HG LEU A 118 3.790 -6.886 -7.133 1.00 0.49 H new ATOM 0 HD11 LEU A 118 3.445 -6.953 -9.584 1.00 1.21 H new ATOM 0 HD12 LEU A 118 5.175 -6.950 -9.167 1.00 1.21 H new ATOM 0 HD13 LEU A 118 4.383 -8.463 -9.665 1.00 1.21 H new ATOM 0 HD21 LEU A 118 1.806 -7.981 -8.092 1.00 0.88 H new ATOM 0 HD22 LEU A 118 2.691 -9.523 -8.154 1.00 0.88 H new ATOM 0 HD23 LEU A 118 2.328 -8.768 -6.584 1.00 0.88 H new ATOM 2028 N LYS A 119 7.364 -9.249 -5.001 1.00 0.36 N ATOM 2029 CA LYS A 119 8.419 -10.128 -4.553 1.00 0.37 C ATOM 2030 C LYS A 119 8.140 -10.546 -3.121 1.00 0.36 C ATOM 2031 O LYS A 119 8.186 -11.725 -2.775 1.00 0.38 O ATOM 2032 CB LYS A 119 9.760 -9.400 -4.647 1.00 0.39 C ATOM 2033 CG LYS A 119 10.943 -10.256 -4.258 1.00 0.43 C ATOM 2034 CD LYS A 119 11.768 -9.625 -3.145 1.00 0.67 C ATOM 2035 CE LYS A 119 12.233 -8.216 -3.498 1.00 0.57 C ATOM 2036 NZ LYS A 119 13.131 -8.199 -4.683 1.00 0.95 N ATOM 0 H LYS A 119 7.685 -8.324 -5.286 1.00 0.36 H new ATOM 0 HA LYS A 119 8.460 -11.018 -5.182 1.00 0.37 H new ATOM 0 HB2 LYS A 119 9.900 -9.044 -5.668 1.00 0.39 H new ATOM 0 HB3 LYS A 119 9.732 -8.520 -4.004 1.00 0.39 H new ATOM 0 HG2 LYS A 119 10.590 -11.236 -3.936 1.00 0.43 H new ATOM 0 HG3 LYS A 119 11.576 -10.416 -5.131 1.00 0.43 H new ATOM 0 HD2 LYS A 119 11.176 -9.591 -2.231 1.00 0.67 H new ATOM 0 HD3 LYS A 119 12.636 -10.251 -2.939 1.00 0.67 H new ATOM 0 HE2 LYS A 119 11.364 -7.587 -3.694 1.00 0.57 H new ATOM 0 HE3 LYS A 119 12.754 -7.783 -2.644 1.00 0.57 H new ATOM 0 HZ1 LYS A 119 13.394 -7.218 -4.905 1.00 0.95 H new ATOM 0 HZ2 LYS A 119 13.989 -8.749 -4.476 1.00 0.95 H new ATOM 0 HZ3 LYS A 119 12.639 -8.619 -5.498 1.00 0.95 H new ATOM 2050 N LEU A 120 7.828 -9.555 -2.303 1.00 0.36 N ATOM 2051 CA LEU A 120 7.456 -9.784 -0.926 1.00 0.37 C ATOM 2052 C LEU A 120 6.108 -10.485 -0.814 1.00 0.36 C ATOM 2053 O LEU A 120 5.958 -11.431 -0.039 1.00 0.38 O ATOM 2054 CB LEU A 120 7.405 -8.459 -0.167 1.00 0.39 C ATOM 2055 CG LEU A 120 8.756 -7.954 0.339 1.00 0.42 C ATOM 2056 CD1 LEU A 120 9.677 -7.590 -0.806 1.00 1.06 C ATOM 2057 CD2 LEU A 120 8.565 -6.773 1.274 1.00 0.99 C ATOM 0 H LEU A 120 7.827 -8.573 -2.578 1.00 0.36 H new ATOM 0 HA LEU A 120 8.214 -10.433 -0.487 1.00 0.37 H new ATOM 0 HB2 LEU A 120 6.971 -7.700 -0.818 1.00 0.39 H new ATOM 0 HB3 LEU A 120 6.733 -8.570 0.684 1.00 0.39 H new ATOM 0 HG LEU A 120 9.229 -8.764 0.894 1.00 0.42 H new ATOM 0 HD11 LEU A 120 10.628 -7.235 -0.409 1.00 1.06 H new ATOM 0 HD12 LEU A 120 9.849 -8.468 -1.428 1.00 1.06 H new ATOM 0 HD13 LEU A 120 9.218 -6.804 -1.406 1.00 1.06 H new ATOM 0 HD21 LEU A 120 9.537 -6.426 1.625 1.00 0.99 H new ATOM 0 HD22 LEU A 120 8.062 -5.966 0.742 1.00 0.99 H new ATOM 0 HD23 LEU A 120 7.959 -7.079 2.127 1.00 0.99 H new ATOM 2069 N TYR A 121 5.120 -10.019 -1.582 1.00 0.35 N ATOM 2070 CA TYR A 121 3.757 -10.488 -1.388 1.00 0.36 C ATOM 2071 C TYR A 121 3.597 -11.944 -1.814 1.00 0.38 C ATOM 2072 O TYR A 121 2.882 -12.712 -1.169 1.00 0.41 O ATOM 2073 CB TYR A 121 2.745 -9.562 -2.080 1.00 0.37 C ATOM 2074 CG TYR A 121 1.413 -10.204 -2.385 1.00 0.56 C ATOM 2075 CD1 TYR A 121 0.414 -10.269 -1.424 1.00 0.84 C ATOM 2076 CD2 TYR A 121 1.160 -10.752 -3.636 1.00 0.74 C ATOM 2077 CE1 TYR A 121 -0.800 -10.866 -1.699 1.00 1.13 C ATOM 2078 CE2 TYR A 121 -0.050 -11.350 -3.917 1.00 1.05 C ATOM 2079 CZ TYR A 121 -1.025 -11.403 -2.945 1.00 1.23 C ATOM 2080 OH TYR A 121 -2.229 -12.003 -3.222 1.00 1.54 O ATOM 0 H TYR A 121 5.239 -9.332 -2.327 1.00 0.35 H new ATOM 0 HA TYR A 121 3.542 -10.452 -0.320 1.00 0.36 H new ATOM 0 HB2 TYR A 121 2.577 -8.691 -1.447 1.00 0.37 H new ATOM 0 HB3 TYR A 121 3.181 -9.200 -3.011 1.00 0.37 H new ATOM 0 HD1 TYR A 121 0.589 -9.846 -0.446 1.00 0.84 H new ATOM 0 HD2 TYR A 121 1.922 -10.709 -4.400 1.00 0.74 H new ATOM 0 HE1 TYR A 121 -1.568 -10.911 -0.941 1.00 1.13 H new ATOM 0 HE2 TYR A 121 -0.233 -11.774 -4.893 1.00 1.05 H new ATOM 0 HH TYR A 121 -2.935 -11.582 -2.689 1.00 1.54 H new ATOM 2090 N LYS A 122 4.281 -12.329 -2.880 1.00 0.40 N ATOM 2091 CA LYS A 122 4.241 -13.704 -3.349 1.00 0.45 C ATOM 2092 C LYS A 122 4.862 -14.655 -2.335 1.00 0.43 C ATOM 2093 O LYS A 122 4.496 -15.828 -2.261 1.00 0.46 O ATOM 2094 CB LYS A 122 4.964 -13.832 -4.685 1.00 0.52 C ATOM 2095 CG LYS A 122 4.156 -13.291 -5.846 1.00 0.60 C ATOM 2096 CD LYS A 122 4.860 -13.517 -7.168 1.00 1.21 C ATOM 2097 CE LYS A 122 3.926 -13.252 -8.331 1.00 1.27 C ATOM 2098 NZ LYS A 122 2.757 -14.174 -8.326 1.00 1.98 N ATOM 0 H LYS A 122 4.870 -11.709 -3.436 1.00 0.40 H new ATOM 0 HA LYS A 122 3.194 -13.977 -3.478 1.00 0.45 H new ATOM 0 HB2 LYS A 122 5.914 -13.300 -4.631 1.00 0.52 H new ATOM 0 HB3 LYS A 122 5.196 -14.881 -4.868 1.00 0.52 H new ATOM 0 HG2 LYS A 122 3.179 -13.774 -5.866 1.00 0.60 H new ATOM 0 HG3 LYS A 122 3.982 -12.224 -5.703 1.00 0.60 H new ATOM 0 HD2 LYS A 122 5.729 -12.863 -7.238 1.00 1.21 H new ATOM 0 HD3 LYS A 122 5.228 -14.542 -7.218 1.00 1.21 H new ATOM 0 HE2 LYS A 122 3.575 -12.221 -8.287 1.00 1.27 H new ATOM 0 HE3 LYS A 122 4.472 -13.363 -9.268 1.00 1.27 H new ATOM 0 HZ1 LYS A 122 2.387 -14.270 -9.293 1.00 1.98 H new ATOM 0 HZ2 LYS A 122 3.052 -15.107 -7.974 1.00 1.98 H new ATOM 0 HZ3 LYS A 122 2.014 -13.790 -7.708 1.00 1.98 H new ATOM 2112 N ALA A 123 5.795 -14.139 -1.547 1.00 0.42 N ATOM 2113 CA ALA A 123 6.529 -14.952 -0.591 1.00 0.43 C ATOM 2114 C ALA A 123 5.740 -15.175 0.697 1.00 0.43 C ATOM 2115 O ALA A 123 6.166 -15.946 1.556 1.00 0.70 O ATOM 2116 CB ALA A 123 7.870 -14.306 -0.281 1.00 0.49 C ATOM 0 H ALA A 123 6.062 -13.155 -1.552 1.00 0.42 H new ATOM 0 HA ALA A 123 6.692 -15.929 -1.046 1.00 0.43 H new ATOM 0 HB1 ALA A 123 8.413 -14.922 0.436 1.00 0.49 H new ATOM 0 HB2 ALA A 123 8.452 -14.218 -1.198 1.00 0.49 H new ATOM 0 HB3 ALA A 123 7.707 -13.315 0.142 1.00 0.49 H new ATOM 2122 N MET A 124 4.597 -14.512 0.841 1.00 0.44 N ATOM 2123 CA MET A 124 3.807 -14.666 2.056 1.00 0.42 C ATOM 2124 C MET A 124 3.061 -15.994 2.039 1.00 0.42 C ATOM 2125 O MET A 124 2.774 -16.533 0.969 1.00 0.42 O ATOM 2126 CB MET A 124 2.803 -13.524 2.222 1.00 0.41 C ATOM 2127 CG MET A 124 3.442 -12.157 2.380 1.00 0.45 C ATOM 2128 SD MET A 124 2.291 -10.925 3.023 1.00 0.50 S ATOM 2129 CE MET A 124 0.918 -11.115 1.893 1.00 0.46 C ATOM 0 H MET A 124 4.204 -13.876 0.147 1.00 0.44 H new ATOM 0 HA MET A 124 4.498 -14.644 2.899 1.00 0.42 H new ATOM 0 HB2 MET A 124 2.142 -13.507 1.355 1.00 0.41 H new ATOM 0 HB3 MET A 124 2.180 -13.725 3.094 1.00 0.41 H new ATOM 0 HG2 MET A 124 4.298 -12.235 3.051 1.00 0.45 H new ATOM 0 HG3 MET A 124 3.823 -11.824 1.415 1.00 0.45 H new ATOM 0 HE1 MET A 124 0.466 -10.142 1.703 1.00 0.46 H new ATOM 0 HE2 MET A 124 1.275 -11.538 0.954 1.00 0.46 H new ATOM 0 HE3 MET A 124 0.175 -11.781 2.332 1.00 0.46 H new ATOM 2139 N SER A 125 2.753 -16.516 3.214 1.00 0.47 N ATOM 2140 CA SER A 125 1.947 -17.723 3.321 1.00 0.54 C ATOM 2141 C SER A 125 0.526 -17.467 2.814 1.00 0.58 C ATOM 2142 O SER A 125 0.036 -16.340 2.911 1.00 0.92 O ATOM 2143 CB SER A 125 1.916 -18.196 4.774 1.00 0.62 C ATOM 2144 OG SER A 125 3.228 -18.347 5.294 1.00 1.18 O ATOM 0 H SER A 125 3.048 -16.124 4.108 1.00 0.47 H new ATOM 0 HA SER A 125 2.394 -18.501 2.703 1.00 0.54 H new ATOM 0 HB2 SER A 125 1.362 -17.479 5.380 1.00 0.62 H new ATOM 0 HB3 SER A 125 1.385 -19.146 4.839 1.00 0.62 H new ATOM 0 HG SER A 125 3.178 -18.649 6.225 1.00 1.18 H new ATOM 2150 N ASP A 126 -0.129 -18.493 2.279 1.00 0.44 N ATOM 2151 CA ASP A 126 -1.418 -18.317 1.602 1.00 0.43 C ATOM 2152 C ASP A 126 -2.447 -17.622 2.491 1.00 0.39 C ATOM 2153 O ASP A 126 -3.107 -16.671 2.058 1.00 0.38 O ATOM 2154 CB ASP A 126 -1.966 -19.661 1.119 1.00 0.47 C ATOM 2155 CG ASP A 126 -3.296 -19.518 0.405 1.00 1.37 C ATOM 2156 OD1 ASP A 126 -3.300 -19.189 -0.800 1.00 2.21 O ATOM 2157 OD2 ASP A 126 -4.347 -19.735 1.048 1.00 1.81 O ATOM 0 H ASP A 126 0.208 -19.456 2.299 1.00 0.44 H new ATOM 0 HA ASP A 126 -1.237 -17.674 0.741 1.00 0.43 H new ATOM 0 HB2 ASP A 126 -1.244 -20.125 0.447 1.00 0.47 H new ATOM 0 HB3 ASP A 126 -2.084 -20.330 1.971 1.00 0.47 H new ATOM 2162 N ALA A 127 -2.559 -18.071 3.737 1.00 0.38 N ATOM 2163 CA ALA A 127 -3.511 -17.489 4.678 1.00 0.37 C ATOM 2164 C ALA A 127 -3.235 -16.001 4.883 1.00 0.33 C ATOM 2165 O ALA A 127 -4.157 -15.210 5.077 1.00 0.34 O ATOM 2166 CB ALA A 127 -3.467 -18.227 6.007 1.00 0.42 C ATOM 0 H ALA A 127 -2.003 -18.836 4.119 1.00 0.38 H new ATOM 0 HA ALA A 127 -4.511 -17.594 4.256 1.00 0.37 H new ATOM 0 HB1 ALA A 127 -4.183 -17.779 6.696 1.00 0.42 H new ATOM 0 HB2 ALA A 127 -3.721 -19.275 5.850 1.00 0.42 H new ATOM 0 HB3 ALA A 127 -2.465 -18.156 6.429 1.00 0.42 H new ATOM 2172 N GLY A 128 -1.962 -15.633 4.813 1.00 0.31 N ATOM 2173 CA GLY A 128 -1.573 -14.244 4.958 1.00 0.31 C ATOM 2174 C GLY A 128 -1.915 -13.432 3.724 1.00 0.29 C ATOM 2175 O GLY A 128 -2.273 -12.259 3.824 1.00 0.30 O ATOM 0 H GLY A 128 -1.187 -16.277 4.657 1.00 0.31 H new ATOM 0 HA2 GLY A 128 -2.074 -13.815 5.826 1.00 0.31 H new ATOM 0 HA3 GLY A 128 -0.501 -14.184 5.147 1.00 0.31 H new ATOM 2179 N LYS A 129 -1.821 -14.065 2.558 1.00 0.32 N ATOM 2180 CA LYS A 129 -2.186 -13.419 1.300 1.00 0.39 C ATOM 2181 C LYS A 129 -3.671 -13.098 1.282 1.00 0.35 C ATOM 2182 O LYS A 129 -4.079 -11.997 0.910 1.00 0.36 O ATOM 2183 CB LYS A 129 -1.853 -14.321 0.109 1.00 0.56 C ATOM 2184 CG LYS A 129 -0.369 -14.474 -0.160 1.00 0.58 C ATOM 2185 CD LYS A 129 -0.119 -15.432 -1.312 1.00 0.59 C ATOM 2186 CE LYS A 129 1.336 -15.418 -1.736 1.00 0.94 C ATOM 2187 NZ LYS A 129 1.619 -16.422 -2.795 1.00 1.32 N ATOM 0 H LYS A 129 -1.495 -15.026 2.458 1.00 0.32 H new ATOM 0 HA LYS A 129 -1.612 -12.496 1.220 1.00 0.39 H new ATOM 0 HB2 LYS A 129 -2.283 -15.307 0.284 1.00 0.56 H new ATOM 0 HB3 LYS A 129 -2.333 -13.918 -0.783 1.00 0.56 H new ATOM 0 HG2 LYS A 129 0.064 -13.501 -0.391 1.00 0.58 H new ATOM 0 HG3 LYS A 129 0.131 -14.840 0.737 1.00 0.58 H new ATOM 0 HD2 LYS A 129 -0.404 -16.442 -1.016 1.00 0.59 H new ATOM 0 HD3 LYS A 129 -0.749 -15.158 -2.158 1.00 0.59 H new ATOM 0 HE2 LYS A 129 1.598 -14.424 -2.100 1.00 0.94 H new ATOM 0 HE3 LYS A 129 1.968 -15.617 -0.870 1.00 0.94 H new ATOM 0 HZ1 LYS A 129 2.647 -16.511 -2.923 1.00 1.32 H new ATOM 0 HZ2 LYS A 129 1.224 -17.343 -2.515 1.00 1.32 H new ATOM 0 HZ3 LYS A 129 1.184 -16.116 -3.689 1.00 1.32 H new ATOM 2201 N ALA A 130 -4.473 -14.070 1.688 1.00 0.35 N ATOM 2202 CA ALA A 130 -5.913 -13.898 1.735 1.00 0.37 C ATOM 2203 C ALA A 130 -6.307 -12.924 2.837 1.00 0.33 C ATOM 2204 O ALA A 130 -7.327 -12.240 2.736 1.00 0.38 O ATOM 2205 CB ALA A 130 -6.600 -15.238 1.942 1.00 0.42 C ATOM 0 H ALA A 130 -4.148 -14.988 1.990 1.00 0.35 H new ATOM 0 HA ALA A 130 -6.238 -13.483 0.781 1.00 0.37 H new ATOM 0 HB1 ALA A 130 -7.680 -15.092 1.975 1.00 0.42 H new ATOM 0 HB2 ALA A 130 -6.349 -15.907 1.118 1.00 0.42 H new ATOM 0 HB3 ALA A 130 -6.264 -15.678 2.881 1.00 0.42 H new ATOM 2211 N ASP A 131 -5.489 -12.849 3.883 1.00 0.29 N ATOM 2212 CA ASP A 131 -5.788 -11.976 5.011 1.00 0.29 C ATOM 2213 C ASP A 131 -5.459 -10.537 4.641 1.00 0.27 C ATOM 2214 O ASP A 131 -6.164 -9.604 5.027 1.00 0.30 O ATOM 2215 CB ASP A 131 -5.014 -12.418 6.258 1.00 0.30 C ATOM 2216 CG ASP A 131 -5.627 -11.911 7.547 1.00 0.40 C ATOM 2217 OD1 ASP A 131 -6.813 -12.199 7.802 1.00 0.55 O ATOM 2218 OD2 ASP A 131 -4.932 -11.187 8.293 1.00 0.45 O ATOM 0 H ASP A 131 -4.621 -13.378 3.972 1.00 0.29 H new ATOM 0 HA ASP A 131 -6.851 -12.043 5.245 1.00 0.29 H new ATOM 0 HB2 ASP A 131 -4.972 -13.507 6.286 1.00 0.30 H new ATOM 0 HB3 ASP A 131 -3.986 -12.061 6.186 1.00 0.30 H new ATOM 2223 N PHE A 132 -4.403 -10.371 3.853 1.00 0.24 N ATOM 2224 CA PHE A 132 -4.057 -9.076 3.283 1.00 0.22 C ATOM 2225 C PHE A 132 -5.191 -8.567 2.399 1.00 0.23 C ATOM 2226 O PHE A 132 -5.424 -7.364 2.301 1.00 0.25 O ATOM 2227 CB PHE A 132 -2.758 -9.185 2.474 1.00 0.23 C ATOM 2228 CG PHE A 132 -2.398 -7.933 1.722 1.00 0.24 C ATOM 2229 CD1 PHE A 132 -1.880 -6.835 2.391 1.00 0.33 C ATOM 2230 CD2 PHE A 132 -2.572 -7.857 0.350 1.00 0.26 C ATOM 2231 CE1 PHE A 132 -1.543 -5.686 1.704 1.00 0.39 C ATOM 2232 CE2 PHE A 132 -2.238 -6.709 -0.342 1.00 0.30 C ATOM 2233 CZ PHE A 132 -1.745 -5.620 0.331 1.00 0.36 C ATOM 0 H PHE A 132 -3.767 -11.125 3.593 1.00 0.24 H new ATOM 0 HA PHE A 132 -3.905 -8.365 4.095 1.00 0.22 H new ATOM 0 HB2 PHE A 132 -1.941 -9.438 3.150 1.00 0.23 H new ATOM 0 HB3 PHE A 132 -2.851 -10.008 1.765 1.00 0.23 H new ATOM 0 HD1 PHE A 132 -1.739 -6.879 3.461 1.00 0.33 H new ATOM 0 HD2 PHE A 132 -2.973 -8.705 -0.185 1.00 0.26 H new ATOM 0 HE1 PHE A 132 -1.124 -4.842 2.232 1.00 0.39 H new ATOM 0 HE2 PHE A 132 -2.365 -6.669 -1.414 1.00 0.30 H new ATOM 0 HZ PHE A 132 -1.514 -4.712 -0.206 1.00 0.36 H new ATOM 2243 N GLY A 133 -5.913 -9.494 1.783 1.00 0.22 N ATOM 2244 CA GLY A 133 -7.001 -9.130 0.900 1.00 0.24 C ATOM 2245 C GLY A 133 -8.228 -8.629 1.637 1.00 0.23 C ATOM 2246 O GLY A 133 -9.193 -8.195 1.015 1.00 0.27 O ATOM 0 H GLY A 133 -5.762 -10.498 1.881 1.00 0.22 H new ATOM 0 HA2 GLY A 133 -6.658 -8.358 0.211 1.00 0.24 H new ATOM 0 HA3 GLY A 133 -7.276 -9.995 0.297 1.00 0.24 H new ATOM 2250 N LYS A 134 -8.201 -8.694 2.958 1.00 0.27 N ATOM 2251 CA LYS A 134 -9.317 -8.209 3.760 1.00 0.29 C ATOM 2252 C LYS A 134 -9.048 -6.777 4.189 1.00 0.30 C ATOM 2253 O LYS A 134 -9.929 -5.918 4.169 1.00 0.39 O ATOM 2254 CB LYS A 134 -9.494 -9.089 4.994 1.00 0.34 C ATOM 2255 CG LYS A 134 -9.580 -10.565 4.679 1.00 0.63 C ATOM 2256 CD LYS A 134 -9.452 -11.394 5.938 1.00 1.29 C ATOM 2257 CE LYS A 134 -9.280 -12.861 5.615 1.00 1.61 C ATOM 2258 NZ LYS A 134 -8.978 -13.660 6.830 1.00 2.43 N ATOM 0 H LYS A 134 -7.424 -9.075 3.497 1.00 0.27 H new ATOM 0 HA LYS A 134 -10.229 -8.246 3.164 1.00 0.29 H new ATOM 0 HB2 LYS A 134 -8.659 -8.919 5.673 1.00 0.34 H new ATOM 0 HB3 LYS A 134 -10.399 -8.785 5.520 1.00 0.34 H new ATOM 0 HG2 LYS A 134 -10.530 -10.782 4.191 1.00 0.63 H new ATOM 0 HG3 LYS A 134 -8.792 -10.838 3.977 1.00 0.63 H new ATOM 0 HD2 LYS A 134 -8.599 -11.045 6.520 1.00 1.29 H new ATOM 0 HD3 LYS A 134 -10.338 -11.257 6.558 1.00 1.29 H new ATOM 0 HE2 LYS A 134 -10.189 -13.240 5.147 1.00 1.61 H new ATOM 0 HE3 LYS A 134 -8.475 -12.982 4.891 1.00 1.61 H new ATOM 0 HZ1 LYS A 134 -8.604 -14.589 6.550 1.00 2.43 H new ATOM 0 HZ2 LYS A 134 -8.271 -13.161 7.406 1.00 2.43 H new ATOM 0 HZ3 LYS A 134 -9.848 -13.790 7.385 1.00 2.43 H new ATOM 2272 N GLN A 135 -7.809 -6.540 4.580 1.00 0.30 N ATOM 2273 CA GLN A 135 -7.377 -5.226 5.024 1.00 0.31 C ATOM 2274 C GLN A 135 -7.067 -4.322 3.834 1.00 0.30 C ATOM 2275 O GLN A 135 -7.417 -3.145 3.837 1.00 0.36 O ATOM 2276 CB GLN A 135 -6.166 -5.355 5.949 1.00 0.33 C ATOM 2277 CG GLN A 135 -6.521 -5.725 7.388 1.00 0.51 C ATOM 2278 CD GLN A 135 -7.345 -6.991 7.525 1.00 0.71 C ATOM 2279 OE1 GLN A 135 -6.806 -8.090 7.626 1.00 1.83 O ATOM 2280 NE2 GLN A 135 -8.659 -6.843 7.559 1.00 0.75 N ATOM 0 H GLN A 135 -7.076 -7.249 4.599 1.00 0.30 H new ATOM 0 HA GLN A 135 -8.190 -4.764 5.584 1.00 0.31 H new ATOM 0 HB2 GLN A 135 -5.492 -6.111 5.546 1.00 0.33 H new ATOM 0 HB3 GLN A 135 -5.621 -4.411 5.951 1.00 0.33 H new ATOM 0 HG2 GLN A 135 -5.599 -5.843 7.958 1.00 0.51 H new ATOM 0 HG3 GLN A 135 -7.070 -4.898 7.838 1.00 0.51 H new ATOM 0 HE21 GLN A 135 -9.070 -5.914 7.472 1.00 0.75 H new ATOM 0 HE22 GLN A 135 -9.261 -7.658 7.672 1.00 0.75 H new ATOM 2289 N PHE A 136 -6.437 -4.876 2.808 1.00 0.26 N ATOM 2290 CA PHE A 136 -6.152 -4.123 1.592 1.00 0.26 C ATOM 2291 C PHE A 136 -6.586 -4.910 0.354 1.00 0.23 C ATOM 2292 O PHE A 136 -5.752 -5.418 -0.403 1.00 0.24 O ATOM 2293 CB PHE A 136 -4.665 -3.755 1.512 1.00 0.31 C ATOM 2294 CG PHE A 136 -4.285 -2.606 2.408 1.00 0.34 C ATOM 2295 CD1 PHE A 136 -4.737 -1.317 2.160 1.00 0.57 C ATOM 2296 CD2 PHE A 136 -3.465 -2.823 3.506 1.00 0.27 C ATOM 2297 CE1 PHE A 136 -4.378 -0.274 2.988 1.00 0.69 C ATOM 2298 CE2 PHE A 136 -3.103 -1.781 4.334 1.00 0.37 C ATOM 2299 CZ PHE A 136 -3.609 -0.468 4.050 1.00 0.58 C ATOM 0 H PHE A 136 -6.113 -5.843 2.792 1.00 0.26 H new ATOM 0 HA PHE A 136 -6.726 -3.197 1.624 1.00 0.26 H new ATOM 0 HB2 PHE A 136 -4.068 -4.627 1.778 1.00 0.31 H new ATOM 0 HB3 PHE A 136 -4.416 -3.501 0.482 1.00 0.31 H new ATOM 0 HD1 PHE A 136 -5.376 -1.129 1.310 1.00 0.57 H new ATOM 0 HD2 PHE A 136 -3.106 -3.820 3.715 1.00 0.27 H new ATOM 0 HE1 PHE A 136 -4.731 0.722 2.766 1.00 0.69 H new ATOM 0 HE2 PHE A 136 -2.452 -1.950 5.179 1.00 0.37 H new ATOM 0 HZ PHE A 136 -3.364 0.359 4.700 1.00 0.58 H new ATOM 2309 N PRO A 137 -7.910 -5.002 0.126 1.00 0.26 N ATOM 2310 CA PRO A 137 -8.478 -5.793 -0.972 1.00 0.30 C ATOM 2311 C PRO A 137 -8.111 -5.251 -2.346 1.00 0.29 C ATOM 2312 O PRO A 137 -7.952 -6.014 -3.296 1.00 0.30 O ATOM 2313 CB PRO A 137 -9.992 -5.692 -0.751 1.00 0.38 C ATOM 2314 CG PRO A 137 -10.184 -4.463 0.066 1.00 0.63 C ATOM 2315 CD PRO A 137 -8.959 -4.344 0.926 1.00 0.34 C ATOM 0 HA PRO A 137 -8.096 -6.814 -0.961 1.00 0.30 H new ATOM 0 HB2 PRO A 137 -10.525 -5.622 -1.699 1.00 0.38 H new ATOM 0 HB3 PRO A 137 -10.375 -6.572 -0.235 1.00 0.38 H new ATOM 0 HG2 PRO A 137 -10.301 -3.586 -0.570 1.00 0.63 H new ATOM 0 HG3 PRO A 137 -11.084 -4.537 0.676 1.00 0.63 H new ATOM 0 HD2 PRO A 137 -8.713 -3.302 1.131 1.00 0.34 H new ATOM 0 HD3 PRO A 137 -9.096 -4.835 1.889 1.00 0.34 H new ATOM 2323 N PHE A 138 -7.966 -3.933 -2.445 1.00 0.32 N ATOM 2324 CA PHE A 138 -7.640 -3.295 -3.714 1.00 0.36 C ATOM 2325 C PHE A 138 -6.302 -3.805 -4.242 1.00 0.35 C ATOM 2326 O PHE A 138 -6.155 -4.078 -5.432 1.00 0.36 O ATOM 2327 CB PHE A 138 -7.592 -1.775 -3.550 1.00 0.43 C ATOM 2328 CG PHE A 138 -7.472 -1.024 -4.849 1.00 0.86 C ATOM 2329 CD1 PHE A 138 -6.228 -0.794 -5.414 1.00 1.56 C ATOM 2330 CD2 PHE A 138 -8.598 -0.553 -5.505 1.00 1.21 C ATOM 2331 CE1 PHE A 138 -6.110 -0.109 -6.607 1.00 2.23 C ATOM 2332 CE2 PHE A 138 -8.485 0.134 -6.697 1.00 1.88 C ATOM 2333 CZ PHE A 138 -7.260 0.366 -7.246 1.00 2.31 C ATOM 0 H PHE A 138 -8.069 -3.287 -1.662 1.00 0.32 H new ATOM 0 HA PHE A 138 -8.419 -3.547 -4.433 1.00 0.36 H new ATOM 0 HB2 PHE A 138 -8.494 -1.447 -3.034 1.00 0.43 H new ATOM 0 HB3 PHE A 138 -6.747 -1.515 -2.912 1.00 0.43 H new ATOM 0 HD1 PHE A 138 -5.340 -1.155 -4.916 1.00 1.56 H new ATOM 0 HD2 PHE A 138 -9.575 -0.725 -5.079 1.00 1.21 H new ATOM 0 HE1 PHE A 138 -5.137 0.059 -7.044 1.00 2.23 H new ATOM 0 HE2 PHE A 138 -9.373 0.490 -7.198 1.00 1.88 H new ATOM 0 HZ PHE A 138 -7.177 0.915 -8.172 1.00 2.31 H new ATOM 2343 N LEU A 139 -5.336 -3.946 -3.349 1.00 0.35 N ATOM 2344 CA LEU A 139 -4.010 -4.394 -3.739 1.00 0.36 C ATOM 2345 C LEU A 139 -4.000 -5.900 -3.965 1.00 0.33 C ATOM 2346 O LEU A 139 -3.432 -6.376 -4.947 1.00 0.35 O ATOM 2347 CB LEU A 139 -2.975 -3.995 -2.685 1.00 0.40 C ATOM 2348 CG LEU A 139 -2.788 -2.488 -2.494 1.00 0.48 C ATOM 2349 CD1 LEU A 139 -1.803 -2.210 -1.369 1.00 1.02 C ATOM 2350 CD2 LEU A 139 -2.314 -1.840 -3.787 1.00 0.86 C ATOM 0 H LEU A 139 -5.445 -3.757 -2.353 1.00 0.35 H new ATOM 0 HA LEU A 139 -3.744 -3.907 -4.677 1.00 0.36 H new ATOM 0 HB2 LEU A 139 -3.265 -4.433 -1.730 1.00 0.40 H new ATOM 0 HB3 LEU A 139 -2.015 -4.433 -2.958 1.00 0.40 H new ATOM 0 HG LEU A 139 -3.751 -2.055 -2.224 1.00 0.48 H new ATOM 0 HD11 LEU A 139 -1.683 -1.133 -1.248 1.00 1.02 H new ATOM 0 HD12 LEU A 139 -2.180 -2.640 -0.441 1.00 1.02 H new ATOM 0 HD13 LEU A 139 -0.839 -2.658 -1.611 1.00 1.02 H new ATOM 0 HD21 LEU A 139 -2.187 -0.769 -3.632 1.00 0.86 H new ATOM 0 HD22 LEU A 139 -1.362 -2.279 -4.086 1.00 0.86 H new ATOM 0 HD23 LEU A 139 -3.053 -2.008 -4.570 1.00 0.86 H new ATOM 2362 N ALA A 140 -4.652 -6.645 -3.078 1.00 0.30 N ATOM 2363 CA ALA A 140 -4.745 -8.095 -3.224 1.00 0.28 C ATOM 2364 C ALA A 140 -5.421 -8.450 -4.547 1.00 0.28 C ATOM 2365 O ALA A 140 -5.090 -9.454 -5.181 1.00 0.35 O ATOM 2366 CB ALA A 140 -5.504 -8.696 -2.054 1.00 0.25 C ATOM 0 H ALA A 140 -5.122 -6.271 -2.254 1.00 0.30 H new ATOM 0 HA ALA A 140 -3.738 -8.513 -3.229 1.00 0.28 H new ATOM 0 HB1 ALA A 140 -5.565 -9.777 -2.177 1.00 0.25 H new ATOM 0 HB2 ALA A 140 -4.983 -8.465 -1.125 1.00 0.25 H new ATOM 0 HB3 ALA A 140 -6.510 -8.277 -2.019 1.00 0.25 H new ATOM 2372 N LYS A 141 -6.372 -7.613 -4.938 1.00 0.26 N ATOM 2373 CA LYS A 141 -6.995 -7.675 -6.252 1.00 0.27 C ATOM 2374 C LYS A 141 -5.952 -7.663 -7.366 1.00 0.29 C ATOM 2375 O LYS A 141 -5.728 -8.670 -8.046 1.00 0.30 O ATOM 2376 CB LYS A 141 -7.908 -6.460 -6.430 1.00 0.28 C ATOM 2377 CG LYS A 141 -8.658 -6.449 -7.752 1.00 0.36 C ATOM 2378 CD LYS A 141 -9.540 -5.220 -7.884 1.00 1.15 C ATOM 2379 CE LYS A 141 -10.230 -5.176 -9.238 1.00 1.76 C ATOM 2380 NZ LYS A 141 -11.093 -6.363 -9.466 1.00 2.58 N ATOM 0 H LYS A 141 -6.736 -6.866 -4.347 1.00 0.26 H new ATOM 0 HA LYS A 141 -7.561 -8.604 -6.314 1.00 0.27 H new ATOM 0 HB2 LYS A 141 -8.629 -6.435 -5.613 1.00 0.28 H new ATOM 0 HB3 LYS A 141 -7.309 -5.552 -6.354 1.00 0.28 H new ATOM 0 HG2 LYS A 141 -7.945 -6.476 -8.576 1.00 0.36 H new ATOM 0 HG3 LYS A 141 -9.270 -7.347 -7.831 1.00 0.36 H new ATOM 0 HD2 LYS A 141 -10.289 -5.221 -7.092 1.00 1.15 H new ATOM 0 HD3 LYS A 141 -8.937 -4.322 -7.752 1.00 1.15 H new ATOM 0 HE2 LYS A 141 -10.834 -4.271 -9.307 1.00 1.76 H new ATOM 0 HE3 LYS A 141 -9.478 -5.119 -10.025 1.00 1.76 H new ATOM 0 HZ1 LYS A 141 -11.683 -6.207 -10.308 1.00 2.58 H new ATOM 0 HZ2 LYS A 141 -10.497 -7.203 -9.612 1.00 2.58 H new ATOM 0 HZ3 LYS A 141 -11.704 -6.512 -8.638 1.00 2.58 H new ATOM 2394 N VAL A 142 -5.323 -6.501 -7.541 1.00 0.31 N ATOM 2395 CA VAL A 142 -4.419 -6.255 -8.651 1.00 0.36 C ATOM 2396 C VAL A 142 -3.199 -7.169 -8.638 1.00 0.37 C ATOM 2397 O VAL A 142 -2.659 -7.492 -9.697 1.00 0.44 O ATOM 2398 CB VAL A 142 -3.966 -4.782 -8.680 1.00 0.40 C ATOM 2399 CG1 VAL A 142 -5.154 -3.863 -8.482 1.00 0.50 C ATOM 2400 CG2 VAL A 142 -2.904 -4.505 -7.641 1.00 0.48 C ATOM 0 H VAL A 142 -5.430 -5.705 -6.912 1.00 0.31 H new ATOM 0 HA VAL A 142 -4.985 -6.479 -9.555 1.00 0.36 H new ATOM 0 HB VAL A 142 -3.527 -4.588 -9.659 1.00 0.40 H new ATOM 0 HG11 VAL A 142 -4.819 -2.826 -8.505 1.00 0.50 H new ATOM 0 HG12 VAL A 142 -5.879 -4.028 -9.279 1.00 0.50 H new ATOM 0 HG13 VAL A 142 -5.620 -4.073 -7.519 1.00 0.50 H new ATOM 0 HG21 VAL A 142 -2.610 -3.457 -7.692 1.00 0.48 H new ATOM 0 HG22 VAL A 142 -3.300 -4.723 -6.649 1.00 0.48 H new ATOM 0 HG23 VAL A 142 -2.035 -5.135 -7.832 1.00 0.48 H new ATOM 2404 N PHE A 143 -2.755 -7.582 -7.456 1.00 0.33 N ATOM 2405 CA PHE A 143 -1.580 -8.442 -7.375 1.00 0.36 C ATOM 2406 C PHE A 143 -1.883 -9.805 -7.981 1.00 0.40 C ATOM 2407 O PHE A 143 -1.127 -10.307 -8.812 1.00 0.47 O ATOM 2408 CB PHE A 143 -1.085 -8.614 -5.933 1.00 0.36 C ATOM 2409 CG PHE A 143 -0.566 -7.357 -5.286 1.00 0.34 C ATOM 2410 CD1 PHE A 143 -0.016 -6.336 -6.044 1.00 0.47 C ATOM 2411 CD2 PHE A 143 -0.621 -7.208 -3.909 1.00 0.58 C ATOM 2412 CE1 PHE A 143 0.460 -5.187 -5.442 1.00 0.47 C ATOM 2413 CE2 PHE A 143 -0.144 -6.062 -3.304 1.00 0.62 C ATOM 2414 CZ PHE A 143 0.397 -5.050 -4.071 1.00 0.39 C ATOM 0 H PHE A 143 -3.179 -7.342 -6.560 1.00 0.33 H new ATOM 0 HA PHE A 143 -0.786 -7.955 -7.941 1.00 0.36 H new ATOM 0 HB2 PHE A 143 -1.903 -9.006 -5.328 1.00 0.36 H new ATOM 0 HB3 PHE A 143 -0.294 -9.364 -5.923 1.00 0.36 H new ATOM 0 HD1 PHE A 143 0.041 -6.439 -7.118 1.00 0.47 H new ATOM 0 HD2 PHE A 143 -1.041 -7.997 -3.303 1.00 0.58 H new ATOM 0 HE1 PHE A 143 0.881 -4.396 -6.045 1.00 0.47 H new ATOM 0 HE2 PHE A 143 -0.194 -5.958 -2.230 1.00 0.62 H new ATOM 0 HZ PHE A 143 0.770 -4.153 -3.599 1.00 0.39 H new ATOM 2424 N GLU A 144 -3.014 -10.379 -7.585 1.00 0.41 N ATOM 2425 CA GLU A 144 -3.395 -11.714 -8.029 1.00 0.45 C ATOM 2426 C GLU A 144 -3.819 -11.712 -9.493 1.00 0.45 C ATOM 2427 O GLU A 144 -3.505 -12.642 -10.237 1.00 0.54 O ATOM 2428 CB GLU A 144 -4.531 -12.256 -7.165 1.00 0.47 C ATOM 2429 CG GLU A 144 -4.124 -12.538 -5.733 1.00 0.60 C ATOM 2430 CD GLU A 144 -3.185 -13.723 -5.618 1.00 1.55 C ATOM 2431 OE1 GLU A 144 -3.663 -14.878 -5.638 1.00 1.55 O ATOM 2432 OE2 GLU A 144 -1.963 -13.502 -5.506 1.00 2.58 O ATOM 0 H GLU A 144 -3.685 -9.938 -6.955 1.00 0.41 H new ATOM 0 HA GLU A 144 -2.522 -12.359 -7.926 1.00 0.45 H new ATOM 0 HB2 GLU A 144 -5.351 -11.538 -7.166 1.00 0.47 H new ATOM 0 HB3 GLU A 144 -4.911 -13.174 -7.613 1.00 0.47 H new ATOM 0 HG2 GLU A 144 -3.641 -11.654 -5.315 1.00 0.60 H new ATOM 0 HG3 GLU A 144 -5.016 -12.726 -5.136 1.00 0.60 H new ATOM 2439 N SER A 145 -4.525 -10.662 -9.900 1.00 0.43 N ATOM 2440 CA SER A 145 -5.023 -10.558 -11.267 1.00 0.49 C ATOM 2441 C SER A 145 -3.873 -10.312 -12.244 1.00 0.57 C ATOM 2442 O SER A 145 -3.996 -10.564 -13.444 1.00 1.32 O ATOM 2443 CB SER A 145 -6.054 -9.427 -11.361 1.00 0.50 C ATOM 2444 OG SER A 145 -6.644 -9.359 -12.650 1.00 1.29 O ATOM 0 H SER A 145 -4.765 -9.871 -9.303 1.00 0.43 H new ATOM 0 HA SER A 145 -5.502 -11.499 -11.537 1.00 0.49 H new ATOM 0 HB2 SER A 145 -6.832 -9.581 -10.613 1.00 0.50 H new ATOM 0 HB3 SER A 145 -5.573 -8.476 -11.130 1.00 0.50 H new ATOM 0 HG SER A 145 -7.297 -8.628 -12.673 1.00 1.29 H new ATOM 2450 N GLY A 146 -2.758 -9.821 -11.725 1.00 0.79 N ATOM 2451 CA GLY A 146 -1.599 -9.580 -12.556 1.00 0.78 C ATOM 2452 C GLY A 146 -1.506 -8.140 -13.011 1.00 0.70 C ATOM 2453 O GLY A 146 -0.591 -7.775 -13.743 1.00 1.09 O ATOM 0 H GLY A 146 -2.636 -9.585 -10.740 1.00 0.79 H new ATOM 0 HA2 GLY A 146 -0.697 -9.842 -12.003 1.00 0.78 H new ATOM 0 HA3 GLY A 146 -1.639 -10.232 -13.428 1.00 0.78 H new ATOM 2457 N LYS A 147 -2.446 -7.320 -12.560 1.00 0.54 N ATOM 2458 CA LYS A 147 -2.473 -5.905 -12.913 1.00 0.48 C ATOM 2459 C LYS A 147 -1.162 -5.220 -12.519 1.00 0.40 C ATOM 2460 O LYS A 147 -0.568 -4.490 -13.313 1.00 0.45 O ATOM 2461 CB LYS A 147 -3.675 -5.230 -12.239 1.00 0.54 C ATOM 2462 CG LYS A 147 -3.629 -3.709 -12.241 1.00 0.83 C ATOM 2463 CD LYS A 147 -3.586 -3.143 -13.651 1.00 1.15 C ATOM 2464 CE LYS A 147 -3.344 -1.643 -13.641 1.00 1.55 C ATOM 2465 NZ LYS A 147 -3.430 -1.058 -15.003 1.00 1.98 N ATOM 0 H LYS A 147 -3.205 -7.612 -11.945 1.00 0.54 H new ATOM 0 HA LYS A 147 -2.579 -5.810 -13.994 1.00 0.48 H new ATOM 0 HB2 LYS A 147 -4.586 -5.554 -12.742 1.00 0.54 H new ATOM 0 HB3 LYS A 147 -3.739 -5.577 -11.208 1.00 0.54 H new ATOM 0 HG2 LYS A 147 -4.504 -3.319 -11.720 1.00 0.83 H new ATOM 0 HG3 LYS A 147 -2.752 -3.372 -11.688 1.00 0.83 H new ATOM 0 HD2 LYS A 147 -2.797 -3.636 -14.218 1.00 1.15 H new ATOM 0 HD3 LYS A 147 -4.526 -3.358 -14.159 1.00 1.15 H new ATOM 0 HE2 LYS A 147 -4.076 -1.162 -12.993 1.00 1.55 H new ATOM 0 HE3 LYS A 147 -2.360 -1.437 -13.219 1.00 1.55 H new ATOM 0 HZ1 LYS A 147 -3.259 -0.033 -14.952 1.00 1.98 H new ATOM 0 HZ2 LYS A 147 -2.715 -1.499 -15.616 1.00 1.98 H new ATOM 0 HZ3 LYS A 147 -4.377 -1.232 -15.396 1.00 1.98 H new ATOM 2479 N ALA A 148 -0.706 -5.476 -11.298 1.00 0.33 N ATOM 2480 CA ALA A 148 0.563 -4.931 -10.838 1.00 0.29 C ATOM 2481 C ALA A 148 1.723 -5.728 -11.419 1.00 0.31 C ATOM 2482 O ALA A 148 2.764 -5.173 -11.770 1.00 0.34 O ATOM 2483 CB ALA A 148 0.627 -4.937 -9.321 1.00 0.33 C ATOM 0 H ALA A 148 -1.194 -6.054 -10.614 1.00 0.33 H new ATOM 0 HA ALA A 148 0.640 -3.900 -11.183 1.00 0.29 H new ATOM 0 HB1 ALA A 148 1.583 -4.526 -8.996 1.00 0.33 H new ATOM 0 HB2 ALA A 148 -0.185 -4.330 -8.920 1.00 0.33 H new ATOM 0 HB3 ALA A 148 0.529 -5.960 -8.957 1.00 0.33 H new ATOM 2489 N ALA A 149 1.522 -7.035 -11.526 1.00 0.35 N ATOM 2490 CA ALA A 149 2.542 -7.943 -12.031 1.00 0.41 C ATOM 2491 C ALA A 149 2.999 -7.556 -13.439 1.00 0.43 C ATOM 2492 O ALA A 149 4.196 -7.489 -13.718 1.00 0.51 O ATOM 2493 CB ALA A 149 2.015 -9.365 -12.021 1.00 0.48 C ATOM 0 H ALA A 149 0.649 -7.494 -11.266 1.00 0.35 H new ATOM 0 HA ALA A 149 3.410 -7.872 -11.375 1.00 0.41 H new ATOM 0 HB1 ALA A 149 2.782 -10.040 -12.400 1.00 0.48 H new ATOM 0 HB2 ALA A 149 1.753 -9.649 -11.002 1.00 0.48 H new ATOM 0 HB3 ALA A 149 1.130 -9.430 -12.654 1.00 0.48 H new ATOM 2499 N LYS A 150 2.037 -7.287 -14.313 1.00 0.41 N ATOM 2500 CA LYS A 150 2.328 -6.918 -15.696 1.00 0.46 C ATOM 2501 C LYS A 150 3.054 -5.580 -15.759 1.00 0.45 C ATOM 2502 O LYS A 150 3.932 -5.378 -16.596 1.00 0.59 O ATOM 2503 CB LYS A 150 1.039 -6.851 -16.514 1.00 0.53 C ATOM 2504 CG LYS A 150 0.375 -8.201 -16.729 1.00 1.16 C ATOM 2505 CD LYS A 150 1.207 -9.097 -17.630 1.00 1.45 C ATOM 2506 CE LYS A 150 0.559 -10.456 -17.815 1.00 1.96 C ATOM 2507 NZ LYS A 150 -0.806 -10.355 -18.396 1.00 2.82 N ATOM 0 H LYS A 150 1.043 -7.317 -14.088 1.00 0.41 H new ATOM 0 HA LYS A 150 2.977 -7.685 -16.120 1.00 0.46 H new ATOM 0 HB2 LYS A 150 0.336 -6.187 -16.012 1.00 0.53 H new ATOM 0 HB3 LYS A 150 1.259 -6.407 -17.485 1.00 0.53 H new ATOM 0 HG2 LYS A 150 0.225 -8.691 -15.767 1.00 1.16 H new ATOM 0 HG3 LYS A 150 -0.611 -8.056 -17.170 1.00 1.16 H new ATOM 0 HD2 LYS A 150 1.336 -8.619 -18.601 1.00 1.45 H new ATOM 0 HD3 LYS A 150 2.202 -9.222 -17.202 1.00 1.45 H new ATOM 0 HE2 LYS A 150 1.184 -11.069 -18.465 1.00 1.96 H new ATOM 0 HE3 LYS A 150 0.505 -10.965 -16.852 1.00 1.96 H new ATOM 0 HZ1 LYS A 150 -1.128 -11.299 -18.692 1.00 2.82 H new ATOM 0 HZ2 LYS A 150 -1.460 -9.974 -17.682 1.00 2.82 H new ATOM 0 HZ3 LYS A 150 -0.786 -9.721 -19.220 1.00 2.82 H new ATOM 2521 N PHE A 151 2.693 -4.679 -14.856 1.00 0.35 N ATOM 2522 CA PHE A 151 3.342 -3.376 -14.764 1.00 0.36 C ATOM 2523 C PHE A 151 4.810 -3.553 -14.380 1.00 0.40 C ATOM 2524 O PHE A 151 5.686 -2.824 -14.847 1.00 0.46 O ATOM 2525 CB PHE A 151 2.621 -2.506 -13.731 1.00 0.34 C ATOM 2526 CG PHE A 151 3.057 -1.067 -13.734 1.00 0.33 C ATOM 2527 CD1 PHE A 151 2.431 -0.140 -14.551 1.00 0.46 C ATOM 2528 CD2 PHE A 151 4.093 -0.644 -12.921 1.00 0.43 C ATOM 2529 CE1 PHE A 151 2.830 1.180 -14.555 1.00 0.49 C ATOM 2530 CE2 PHE A 151 4.498 0.677 -12.920 1.00 0.44 C ATOM 2531 CZ PHE A 151 3.857 1.594 -13.741 1.00 0.39 C ATOM 0 H PHE A 151 1.950 -4.827 -14.173 1.00 0.35 H new ATOM 0 HA PHE A 151 3.291 -2.881 -15.734 1.00 0.36 H new ATOM 0 HB2 PHE A 151 1.548 -2.551 -13.919 1.00 0.34 H new ATOM 0 HB3 PHE A 151 2.789 -2.924 -12.738 1.00 0.34 H new ATOM 0 HD1 PHE A 151 1.621 -0.455 -15.192 1.00 0.46 H new ATOM 0 HD2 PHE A 151 4.592 -1.355 -12.279 1.00 0.43 H new ATOM 0 HE1 PHE A 151 2.334 1.890 -15.200 1.00 0.49 H new ATOM 0 HE2 PHE A 151 5.310 0.995 -12.283 1.00 0.44 H new ATOM 0 HZ PHE A 151 4.164 2.629 -13.740 1.00 0.39 H new ATOM 2541 N ALA A 152 5.068 -4.546 -13.545 1.00 0.39 N ATOM 2542 CA ALA A 152 6.415 -4.832 -13.077 1.00 0.44 C ATOM 2543 C ALA A 152 7.226 -5.586 -14.123 1.00 0.52 C ATOM 2544 O ALA A 152 8.455 -5.543 -14.117 1.00 0.59 O ATOM 2545 CB ALA A 152 6.354 -5.638 -11.793 1.00 0.44 C ATOM 0 H ALA A 152 4.355 -5.174 -13.174 1.00 0.39 H new ATOM 0 HA ALA A 152 6.913 -3.880 -12.891 1.00 0.44 H new ATOM 0 HB1 ALA A 152 7.366 -5.849 -11.447 1.00 0.44 H new ATOM 0 HB2 ALA A 152 5.822 -5.069 -11.031 1.00 0.44 H new ATOM 0 HB3 ALA A 152 5.830 -6.576 -11.977 1.00 0.44 H new ATOM 2551 N GLY A 153 6.529 -6.261 -15.027 1.00 0.65 N ATOM 2552 CA GLY A 153 7.194 -7.104 -16.000 1.00 0.84 C ATOM 2553 C GLY A 153 7.302 -8.530 -15.508 1.00 1.06 C ATOM 2554 O GLY A 153 8.155 -9.299 -15.953 1.00 1.62 O ATOM 0 H GLY A 153 5.512 -6.239 -15.104 1.00 0.65 H new ATOM 0 HA2 GLY A 153 6.643 -7.082 -16.940 1.00 0.84 H new ATOM 0 HA3 GLY A 153 8.190 -6.711 -16.205 1.00 0.84 H new ATOM 2558 N GLU A 154 6.424 -8.874 -14.583 1.00 0.99 N ATOM 2559 CA GLU A 154 6.440 -10.172 -13.936 1.00 1.35 C ATOM 2560 C GLU A 154 5.466 -11.144 -14.599 1.00 1.52 C ATOM 2561 O GLU A 154 5.479 -11.330 -15.818 1.00 2.33 O ATOM 2562 CB GLU A 154 6.105 -10.009 -12.449 1.00 1.95 C ATOM 2563 CG GLU A 154 7.206 -9.346 -11.635 1.00 2.50 C ATOM 2564 CD GLU A 154 8.438 -10.217 -11.516 1.00 3.37 C ATOM 2565 OE1 GLU A 154 8.401 -11.205 -10.754 1.00 3.70 O ATOM 2566 OE2 GLU A 154 9.446 -9.922 -12.183 1.00 4.12 O ATOM 0 H GLU A 154 5.678 -8.259 -14.259 1.00 0.99 H new ATOM 0 HA GLU A 154 7.440 -10.593 -14.040 1.00 1.35 H new ATOM 0 HB2 GLU A 154 5.193 -9.419 -12.355 1.00 1.95 H new ATOM 0 HB3 GLU A 154 5.895 -10.991 -12.025 1.00 1.95 H new ATOM 0 HG2 GLU A 154 7.478 -8.398 -12.100 1.00 2.50 H new ATOM 0 HG3 GLU A 154 6.829 -9.116 -10.638 1.00 2.50 H new ATOM 2573 N ASN A 155 4.627 -11.749 -13.778 1.00 1.82 N ATOM 2574 CA ASN A 155 3.769 -12.846 -14.199 1.00 2.70 C ATOM 2575 C ASN A 155 2.531 -12.335 -14.928 1.00 3.48 C ATOM 2576 O ASN A 155 1.900 -11.377 -14.442 1.00 3.96 O ATOM 2577 CB ASN A 155 3.372 -13.694 -12.979 1.00 2.84 C ATOM 2578 CG ASN A 155 2.508 -12.945 -11.984 1.00 3.21 C ATOM 2579 OD1 ASN A 155 1.278 -12.999 -12.039 1.00 3.95 O ATOM 2580 ND2 ASN A 155 3.144 -12.246 -11.054 1.00 3.15 N ATOM 2581 OXT ASN A 155 2.183 -12.911 -15.979 1.00 4.01 O ATOM 0 H ASN A 155 4.520 -11.494 -12.796 1.00 1.82 H new ATOM 0 HA ASN A 155 4.325 -13.469 -14.899 1.00 2.70 H new ATOM 0 HB2 ASN A 155 2.837 -14.580 -13.320 1.00 2.84 H new ATOM 0 HB3 ASN A 155 4.275 -14.041 -12.477 1.00 2.84 H new ATOM 0 HD21 ASN A 155 2.614 -11.729 -10.352 1.00 3.15 H new ATOM 0 HD22 ASN A 155 4.164 -12.225 -11.040 1.00 3.15 H new TER 2588 ASN A 155