USER MOD reduce.3.24.130724 H: found=0, std=0, add=1336, rem=0, adj=47 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 -176:sc= 0.12 USER MOD Set 1.2: A 103 ASN : amide:sc= 0.502 X(o=0.62,f=0.76) USER MOD Set 2.1: A 45 THR OG1 : rot 157:sc= 0.058 USER MOD Set 2.2: A 67 HIS : no HE2:sc= -2.17! K(o=-2.1!,f=-1.2) USER MOD Set 3.1: A 24 ASN : amide:sc= 2.24 K(o=3.4,f=-6.2!) USER MOD Set 3.2: A 62 LYS NZ :NH3+ -165:sc= 1.19 (180deg=0) USER MOD Set 4.1: A 10 TYR OH : rot 30:sc= 0.0382 USER MOD Set 4.2: A 96 LYS NZ :NH3+ -148:sc= -0.652! (180deg=-0.819!) USER MOD Set 5.1: A -3 SER OG : rot 134:sc=0.000594 USER MOD Set 5.2: A -6 HIS : no HD1:sc= 0 X(o=0.00059,f=-0.055) USER MOD Set 6.1: A 0 MET CE :methyl -126:sc= -0.132 (180deg=-2.32) USER MOD Set 6.2: A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 2 LYS NZ :NH3+ 165:sc= -1.18 (180deg=-1.55!) USER MOD Single : A 3 TYR OH : rot 180:sc= -2.82! USER MOD Single : A -1 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -4 SER OG : rot 180:sc= 0 USER MOD Single : A -5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -7 HIS : no HD1:sc= 0 X(o=0,f=-0.015) USER MOD Single : A -8 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A -9 HIS : no HD1:sc= 0.704 K(o=0.7,f=-2.5!) USER MOD Single : A 14 MET CE :methyl 156:sc= -1.17 (180deg=-2.16) USER MOD Single : A 23 GLN : amide:sc= -0.811 K(o=-0.81,f=-5.5!) USER MOD Single : A 26 SER OG : rot 66:sc= 0.609 USER MOD Single : A 30 LYS NZ :NH3+ 145:sc= 0.44! (180deg=-0.222!) USER MOD Single : A 34 LYS NZ :NH3+ -163:sc= -0.52! (180deg=-2.17!) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 TYR OH : rot 180:sc= -0.0016 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 ASN : amide:sc= 0.264! C(o=0.26!,f=-8.4!) USER MOD Single : A 48 SER OG : rot -45:sc= 0.441 USER MOD Single : A 53 LYS NZ :NH3+ 145:sc= -1.13 (180deg=-2.86!) USER MOD Single : A 54 LYS NZ :NH3+ 170:sc= -0.0295 (180deg=-0.176) USER MOD Single : A 55 LYS NZ :NH3+ -128:sc= -0.765 (180deg=-2.45!) USER MOD Single : A 56 SER OG : rot 161:sc= 0.544 USER MOD Single : A 65 LYS NZ :NH3+ -162:sc= 1.2 (180deg=1.16) USER MOD Single : A 69 MET CE :methyl -152:sc= -1.6 (180deg=-3.88!) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 SER OG : rot 71:sc= 1.3 USER MOD Single : A 73 LYS NZ :NH3+ -170:sc=-0.00619 (180deg=-0.0903) USER MOD Single : A 82 LYS NZ :NH3+ -177:sc= 1.13 (180deg=1.09) USER MOD Single : A 87 LYS NZ :NH3+ 167:sc= -0.0346 (180deg=-0.23) USER MOD Single : A 88 SER OG : rot -80:sc= 1.2 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A -10 HIS : no HD1:sc= -0.0316 X(o=-0.032,f=0) USER MOD Single : A -11 SER OG : rot 180:sc= 0 USER MOD Single : A -12 SER OG : rot 180:sc= 0.0375 USER MOD Single : A -14 MET CE :methyl -132:sc= -0.157 (180deg=-0.736) USER MOD Single : A -14 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 100 TYR OH : rot -66:sc= 0.414! USER MOD Single : A 106 THR OG1 : rot -70:sc= 1.15 USER MOD Single : A 107 LYS NZ :NH3+ 169:sc= -0.0157 (180deg=-0.137) USER MOD Single : A 111 LYS NZ :NH3+ -163:sc= 1.26 (180deg=1.25) USER MOD Single : A 113 SER OG : rot -150:sc= -1.85! USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 LYS NZ :NH3+ -148:sc= 1.24 (180deg=0.416) USER MOD Single : A 121 TYR OH : rot 30:sc=-0.00746 USER MOD Single : A 122 LYS NZ :NH3+ -176:sc= 1.21 (180deg=1.18) USER MOD Single : A 124 MET CE :methyl -146:sc= -0.547 (180deg=-1.16) USER MOD Single : A 125 SER OG : rot 106:sc= 1.21 USER MOD Single : A 129 LYS NZ :NH3+ -177:sc= 0.532 (180deg=0.527) USER MOD Single : A 134 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 135 GLN : amide:sc= -0.509 K(o=-0.51,f=-2.6) USER MOD Single : A 141 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0059) USER MOD Single : A 145 SER OG : rot 79:sc= 0.952 USER MOD Single : A 147 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 150 LYS NZ :NH3+ 165:sc= -0.0284 (180deg=-0.23) USER MOD Single : A 155 ASN : amide:sc= 0 X(o=0,f=-0.014) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A -14 -3.989 22.525 -19.006 1.00 23.34 N ATOM 2 CA MET A -14 -3.064 22.628 -17.856 1.00 23.09 C ATOM 3 C MET A -14 -2.856 24.092 -17.503 1.00 22.83 C ATOM 4 O MET A -14 -2.542 24.909 -18.370 1.00 23.06 O ATOM 5 CB MET A -14 -1.724 21.958 -18.196 1.00 23.32 C ATOM 6 CG MET A -14 -0.788 21.760 -17.006 1.00 23.49 C ATOM 7 SD MET A -14 0.001 23.283 -16.439 1.00 23.59 S ATOM 8 CE MET A -14 0.985 23.721 -17.871 1.00 23.42 C ATOM 0 H1 MET A -14 -4.132 21.524 -19.248 1.00 23.34 H new ATOM 0 H2 MET A -14 -4.903 22.954 -18.756 1.00 23.34 H new ATOM 0 H3 MET A -14 -3.584 23.024 -19.823 1.00 23.34 H new ATOM 0 HA MET A -14 -3.495 22.115 -16.996 1.00 23.09 H new ATOM 0 HB2 MET A -14 -1.924 20.987 -18.649 1.00 23.32 H new ATOM 0 HB3 MET A -14 -1.212 22.561 -18.947 1.00 23.32 H new ATOM 0 HG2 MET A -14 -1.351 21.325 -16.181 1.00 23.49 H new ATOM 0 HG3 MET A -14 -0.015 21.041 -17.279 1.00 23.49 H new ATOM 0 HE1 MET A -14 2.000 23.961 -17.555 1.00 23.42 H new ATOM 0 HE2 MET A -14 1.010 22.881 -18.566 1.00 23.42 H new ATOM 0 HE3 MET A -14 0.544 24.587 -18.365 1.00 23.42 H new ATOM 20 N GLY A -13 -3.048 24.420 -16.236 1.00 22.47 N ATOM 21 CA GLY A -13 -2.902 25.788 -15.798 1.00 22.32 C ATOM 22 C GLY A -13 -4.239 26.441 -15.540 1.00 21.64 C ATOM 23 O GLY A -13 -4.962 26.777 -16.480 1.00 21.33 O ATOM 0 H GLY A -13 -3.303 23.760 -15.502 1.00 22.47 H new ATOM 0 HA2 GLY A -13 -2.302 25.816 -14.888 1.00 22.32 H new ATOM 0 HA3 GLY A -13 -2.360 26.356 -16.554 1.00 22.32 H new ATOM 27 N SER A -12 -4.584 26.603 -14.272 1.00 21.51 N ATOM 28 CA SER A -12 -5.828 27.252 -13.900 1.00 20.97 C ATOM 29 C SER A -12 -5.702 28.767 -14.041 1.00 20.41 C ATOM 30 O SER A -12 -6.700 29.485 -14.100 1.00 20.34 O ATOM 31 CB SER A -12 -6.214 26.862 -12.474 1.00 21.18 C ATOM 32 OG SER A -12 -5.085 26.892 -11.616 1.00 21.36 O ATOM 0 H SER A -12 -4.017 26.293 -13.483 1.00 21.51 H new ATOM 0 HA SER A -12 -6.618 26.918 -14.573 1.00 20.97 H new ATOM 0 HB2 SER A -12 -6.977 27.544 -12.100 1.00 21.18 H new ATOM 0 HB3 SER A -12 -6.651 25.863 -12.472 1.00 21.18 H new ATOM 0 HG SER A -12 -5.357 26.641 -10.709 1.00 21.36 H new ATOM 38 N SER A -11 -4.449 29.230 -14.083 1.00 20.15 N ATOM 39 CA SER A -11 -4.117 30.614 -14.417 1.00 19.73 C ATOM 40 C SER A -11 -4.777 31.619 -13.473 1.00 19.37 C ATOM 41 O SER A -11 -5.084 32.741 -13.870 1.00 19.50 O ATOM 42 CB SER A -11 -4.522 30.906 -15.865 1.00 20.02 C ATOM 43 OG SER A -11 -4.014 29.915 -16.746 1.00 20.19 O ATOM 0 H SER A -11 -3.634 28.650 -13.885 1.00 20.15 H new ATOM 0 HA SER A -11 -3.039 30.729 -14.301 1.00 19.73 H new ATOM 0 HB2 SER A -11 -5.609 30.943 -15.942 1.00 20.02 H new ATOM 0 HB3 SER A -11 -4.148 31.886 -16.160 1.00 20.02 H new ATOM 0 HG SER A -11 -4.287 30.122 -17.664 1.00 20.19 H new ATOM 49 N HIS A -10 -4.984 31.225 -12.224 1.00 19.05 N ATOM 50 CA HIS A -10 -5.627 32.104 -11.255 1.00 18.80 C ATOM 51 C HIS A -10 -4.596 32.890 -10.463 1.00 17.89 C ATOM 52 O HIS A -10 -4.909 33.931 -9.885 1.00 17.81 O ATOM 53 CB HIS A -10 -6.525 31.314 -10.304 1.00 19.29 C ATOM 54 CG HIS A -10 -7.737 30.737 -10.965 1.00 20.11 C ATOM 55 ND1 HIS A -10 -8.326 29.562 -10.559 1.00 20.55 N ATOM 56 CD2 HIS A -10 -8.477 31.188 -12.004 1.00 20.68 C ATOM 57 CE1 HIS A -10 -9.372 29.311 -11.322 1.00 21.33 C ATOM 58 NE2 HIS A -10 -9.487 30.282 -12.205 1.00 21.42 N ATOM 0 H HIS A -10 -4.719 30.310 -11.859 1.00 19.05 H new ATOM 0 HA HIS A -10 -6.247 32.806 -11.813 1.00 18.80 H new ATOM 0 HB2 HIS A -10 -5.945 30.506 -9.858 1.00 19.29 H new ATOM 0 HB3 HIS A -10 -6.841 31.967 -9.490 1.00 19.29 H new ATOM 0 HD2 HIS A -10 -8.305 32.092 -12.569 1.00 20.68 H new ATOM 0 HE1 HIS A -10 -10.024 28.454 -11.237 1.00 21.33 H new ATOM 0 HE2 HIS A -10 -10.210 30.349 -12.922 1.00 21.42 H new ATOM 67 N HIS A -9 -3.365 32.399 -10.443 1.00 17.33 N ATOM 68 CA HIS A -9 -2.292 33.087 -9.737 1.00 16.53 C ATOM 69 C HIS A -9 -1.753 34.221 -10.594 1.00 15.50 C ATOM 70 O HIS A -9 -0.742 34.064 -11.283 1.00 15.25 O ATOM 71 CB HIS A -9 -1.152 32.131 -9.377 1.00 16.68 C ATOM 72 CG HIS A -9 -1.562 30.991 -8.500 1.00 17.20 C ATOM 73 ND1 HIS A -9 -1.398 29.675 -8.865 1.00 17.69 N ATOM 74 CD2 HIS A -9 -2.117 30.973 -7.268 1.00 17.45 C ATOM 75 CE1 HIS A -9 -1.835 28.898 -7.898 1.00 18.20 C ATOM 76 NE2 HIS A -9 -2.277 29.657 -6.914 1.00 18.08 N ATOM 0 H HIS A -9 -3.085 31.533 -10.904 1.00 17.33 H new ATOM 0 HA HIS A -9 -2.705 33.486 -8.811 1.00 16.53 H new ATOM 0 HB2 HIS A -9 -0.724 31.732 -10.296 1.00 16.68 H new ATOM 0 HB3 HIS A -9 -0.364 32.695 -8.877 1.00 16.68 H new ATOM 0 HD2 HIS A -9 -2.385 31.834 -6.673 1.00 17.45 H new ATOM 0 HE1 HIS A -9 -1.832 27.818 -7.908 1.00 18.20 H new ATOM 0 HE2 HIS A -9 -2.672 29.321 -6.036 1.00 18.08 H new ATOM 85 N HIS A -8 -2.441 35.352 -10.566 1.00 15.05 N ATOM 86 CA HIS A -8 -2.003 36.526 -11.307 1.00 14.17 C ATOM 87 C HIS A -8 -0.789 37.126 -10.613 1.00 13.33 C ATOM 88 O HIS A -8 -0.002 37.858 -11.211 1.00 13.18 O ATOM 89 CB HIS A -8 -3.135 37.553 -11.406 1.00 14.48 C ATOM 90 CG HIS A -8 -2.900 38.614 -12.439 1.00 15.02 C ATOM 91 ND1 HIS A -8 -3.430 38.554 -13.709 1.00 15.53 N ATOM 92 CD2 HIS A -8 -2.190 39.766 -12.387 1.00 15.28 C ATOM 93 CE1 HIS A -8 -3.054 39.618 -14.392 1.00 16.06 C ATOM 94 NE2 HIS A -8 -2.303 40.370 -13.612 1.00 15.93 N ATOM 0 H HIS A -8 -3.304 35.482 -10.039 1.00 15.05 H new ATOM 0 HA HIS A -8 -1.730 36.235 -12.321 1.00 14.17 H new ATOM 0 HB2 HIS A -8 -4.065 37.034 -11.637 1.00 14.48 H new ATOM 0 HB3 HIS A -8 -3.268 38.028 -10.434 1.00 14.48 H new ATOM 0 HD2 HIS A -8 -1.637 40.139 -11.538 1.00 15.28 H new ATOM 0 HE1 HIS A -8 -3.317 39.836 -15.417 1.00 16.06 H new ATOM 0 HE2 HIS A -8 -1.875 41.257 -13.877 1.00 15.93 H new ATOM 103 N HIS A -7 -0.656 36.801 -9.338 1.00 12.97 N ATOM 104 CA HIS A -7 0.519 37.149 -8.563 1.00 12.32 C ATOM 105 C HIS A -7 0.920 35.946 -7.721 1.00 11.63 C ATOM 106 O HIS A -7 0.049 35.234 -7.221 1.00 11.60 O ATOM 107 CB HIS A -7 0.265 38.377 -7.671 1.00 12.67 C ATOM 108 CG HIS A -7 -0.804 38.189 -6.635 1.00 12.79 C ATOM 109 ND1 HIS A -7 -0.538 37.800 -5.338 1.00 12.93 N ATOM 110 CD2 HIS A -7 -2.147 38.346 -6.706 1.00 13.01 C ATOM 111 CE1 HIS A -7 -1.668 37.725 -4.662 1.00 13.22 C ATOM 112 NE2 HIS A -7 -2.659 38.052 -5.467 1.00 13.27 N ATOM 0 H HIS A -7 -1.363 36.287 -8.812 1.00 12.97 H new ATOM 0 HA HIS A -7 1.329 37.413 -9.243 1.00 12.32 H new ATOM 0 HB2 HIS A -7 1.195 38.643 -7.169 1.00 12.67 H new ATOM 0 HB3 HIS A -7 -0.008 39.220 -8.306 1.00 12.67 H new ATOM 0 HD2 HIS A -7 -2.711 38.647 -7.577 1.00 13.01 H new ATOM 0 HE1 HIS A -7 -1.765 37.443 -3.624 1.00 13.22 H new ATOM 0 HE2 HIS A -7 -3.646 38.082 -5.211 1.00 13.27 H new ATOM 121 N HIS A -6 2.224 35.719 -7.589 1.00 11.27 N ATOM 122 CA HIS A -6 2.752 34.567 -6.855 1.00 10.81 C ATOM 123 C HIS A -6 2.357 33.260 -7.544 1.00 10.06 C ATOM 124 O HIS A -6 1.305 32.683 -7.266 1.00 10.07 O ATOM 125 CB HIS A -6 2.272 34.575 -5.392 1.00 11.05 C ATOM 126 CG HIS A -6 2.759 33.410 -4.585 1.00 11.45 C ATOM 127 ND1 HIS A -6 1.919 32.450 -4.063 1.00 11.75 N ATOM 128 CD2 HIS A -6 4.009 33.051 -4.212 1.00 11.82 C ATOM 129 CE1 HIS A -6 2.630 31.556 -3.405 1.00 12.27 C ATOM 130 NE2 HIS A -6 3.903 31.895 -3.481 1.00 12.33 N ATOM 0 H HIS A -6 2.944 36.324 -7.985 1.00 11.27 H new ATOM 0 HA HIS A -6 3.840 34.640 -6.853 1.00 10.81 H new ATOM 0 HB2 HIS A -6 2.604 35.498 -4.916 1.00 11.05 H new ATOM 0 HB3 HIS A -6 1.182 34.584 -5.378 1.00 11.05 H new ATOM 0 HD2 HIS A -6 4.922 33.578 -4.447 1.00 11.82 H new ATOM 0 HE1 HIS A -6 2.237 30.692 -2.890 1.00 12.27 H new ATOM 0 HE2 HIS A -6 4.680 31.382 -3.065 1.00 12.33 H new ATOM 139 N HIS A -5 3.205 32.804 -8.453 1.00 9.63 N ATOM 140 CA HIS A -5 2.971 31.549 -9.157 1.00 9.11 C ATOM 141 C HIS A -5 3.514 30.378 -8.342 1.00 8.16 C ATOM 142 O HIS A -5 3.730 30.505 -7.135 1.00 8.12 O ATOM 143 CB HIS A -5 3.624 31.570 -10.545 1.00 9.69 C ATOM 144 CG HIS A -5 2.979 32.509 -11.519 1.00 10.23 C ATOM 145 ND1 HIS A -5 2.362 32.082 -12.675 1.00 10.62 N ATOM 146 CD2 HIS A -5 2.880 33.858 -11.518 1.00 10.71 C ATOM 147 CE1 HIS A -5 1.913 33.129 -13.343 1.00 11.27 C ATOM 148 NE2 HIS A -5 2.214 34.218 -12.662 1.00 11.33 N ATOM 0 H HIS A -5 4.064 33.284 -8.722 1.00 9.63 H new ATOM 0 HA HIS A -5 1.896 31.426 -9.285 1.00 9.11 H new ATOM 0 HB2 HIS A -5 4.673 31.844 -10.435 1.00 9.69 H new ATOM 0 HB3 HIS A -5 3.599 30.562 -10.960 1.00 9.69 H new ATOM 0 HD2 HIS A -5 3.255 34.527 -10.758 1.00 10.71 H new ATOM 0 HE1 HIS A -5 1.388 33.099 -14.287 1.00 11.27 H new ATOM 0 HE2 HIS A -5 1.988 35.173 -12.941 1.00 11.33 H new ATOM 157 N SER A -4 3.721 29.244 -8.995 1.00 7.67 N ATOM 158 CA SER A -4 4.261 28.067 -8.335 1.00 6.97 C ATOM 159 C SER A -4 5.648 28.350 -7.756 1.00 6.27 C ATOM 160 O SER A -4 6.561 28.761 -8.477 1.00 6.26 O ATOM 161 CB SER A -4 4.337 26.912 -9.334 1.00 7.36 C ATOM 162 OG SER A -4 3.096 26.735 -9.998 1.00 7.95 O ATOM 0 H SER A -4 3.522 29.115 -9.987 1.00 7.67 H new ATOM 0 HA SER A -4 3.600 27.797 -7.512 1.00 6.97 H new ATOM 0 HB2 SER A -4 5.121 27.110 -10.066 1.00 7.36 H new ATOM 0 HB3 SER A -4 4.610 25.994 -8.814 1.00 7.36 H new ATOM 0 HG SER A -4 3.168 25.992 -10.633 1.00 7.95 H new ATOM 168 N SER A -3 5.794 28.147 -6.453 1.00 6.06 N ATOM 169 CA SER A -3 7.075 28.325 -5.787 1.00 5.84 C ATOM 170 C SER A -3 7.966 27.103 -6.015 1.00 5.11 C ATOM 171 O SER A -3 8.272 26.352 -5.084 1.00 5.39 O ATOM 172 CB SER A -3 6.857 28.560 -4.290 1.00 6.61 C ATOM 173 OG SER A -3 5.958 29.638 -4.075 1.00 7.36 O ATOM 0 H SER A -3 5.036 27.857 -5.835 1.00 6.06 H new ATOM 0 HA SER A -3 7.575 29.197 -6.208 1.00 5.84 H new ATOM 0 HB2 SER A -3 6.463 27.654 -3.829 1.00 6.61 H new ATOM 0 HB3 SER A -3 7.811 28.774 -3.808 1.00 6.61 H new ATOM 0 HG SER A -3 5.296 29.382 -3.399 1.00 7.36 H new ATOM 179 N GLY A -2 8.366 26.908 -7.263 1.00 4.57 N ATOM 180 CA GLY A -2 9.169 25.762 -7.624 1.00 4.26 C ATOM 181 C GLY A -2 8.501 24.932 -8.699 1.00 3.39 C ATOM 182 O GLY A -2 7.788 25.469 -9.547 1.00 3.57 O ATOM 0 H GLY A -2 8.145 27.532 -8.039 1.00 4.57 H new ATOM 0 HA2 GLY A -2 10.145 26.097 -7.975 1.00 4.26 H new ATOM 0 HA3 GLY A -2 9.342 25.145 -6.742 1.00 4.26 H new ATOM 186 N HIS A -1 8.720 23.627 -8.664 1.00 2.94 N ATOM 187 CA HIS A -1 8.119 22.728 -9.640 1.00 2.48 C ATOM 188 C HIS A -1 6.869 22.086 -9.061 1.00 1.95 C ATOM 189 O HIS A -1 6.939 21.342 -8.082 1.00 2.40 O ATOM 190 CB HIS A -1 9.118 21.651 -10.067 1.00 3.02 C ATOM 191 CG HIS A -1 10.335 22.197 -10.746 1.00 3.37 C ATOM 192 ND1 HIS A -1 11.564 22.288 -10.129 1.00 4.00 N ATOM 193 CD2 HIS A -1 10.509 22.691 -11.994 1.00 3.77 C ATOM 194 CE1 HIS A -1 12.437 22.814 -10.967 1.00 4.52 C ATOM 195 NE2 HIS A -1 11.824 23.066 -12.105 1.00 4.43 N ATOM 0 H HIS A -1 9.309 23.166 -7.971 1.00 2.94 H new ATOM 0 HA HIS A -1 7.842 23.309 -10.520 1.00 2.48 H new ATOM 0 HB2 HIS A -1 9.426 21.084 -9.188 1.00 3.02 H new ATOM 0 HB3 HIS A -1 8.620 20.952 -10.739 1.00 3.02 H new ATOM 0 HD2 HIS A -1 9.753 22.775 -12.760 1.00 3.77 H new ATOM 0 HE1 HIS A -1 13.479 23.006 -10.755 1.00 4.52 H new ATOM 0 HE2 HIS A -1 12.256 23.474 -12.934 1.00 4.43 H new ATOM 204 N MET A 0 5.723 22.388 -9.654 1.00 1.39 N ATOM 205 CA MET A 0 4.459 21.859 -9.167 1.00 1.16 C ATOM 206 C MET A 0 4.027 20.622 -9.930 1.00 1.03 C ATOM 207 O MET A 0 3.682 20.681 -11.112 1.00 1.08 O ATOM 208 CB MET A 0 3.360 22.913 -9.234 1.00 1.34 C ATOM 209 CG MET A 0 3.133 23.591 -7.905 1.00 1.63 C ATOM 210 SD MET A 0 2.683 22.414 -6.614 1.00 2.00 S ATOM 211 CE MET A 0 3.049 23.387 -5.164 1.00 1.61 C ATOM 0 H MET A 0 5.643 22.994 -10.470 1.00 1.39 H new ATOM 0 HA MET A 0 4.620 21.577 -8.127 1.00 1.16 H new ATOM 0 HB2 MET A 0 3.623 23.662 -9.981 1.00 1.34 H new ATOM 0 HB3 MET A 0 2.432 22.446 -9.564 1.00 1.34 H new ATOM 0 HG2 MET A 0 4.037 24.124 -7.611 1.00 1.63 H new ATOM 0 HG3 MET A 0 2.344 24.336 -8.008 1.00 1.63 H new ATOM 0 HE1 MET A 0 3.726 22.832 -4.515 1.00 1.61 H new ATOM 0 HE2 MET A 0 3.520 24.323 -5.463 1.00 1.61 H new ATOM 0 HE3 MET A 0 2.125 23.601 -4.627 1.00 1.61 H new ATOM 221 N PHE A 1 4.056 19.499 -9.244 1.00 1.03 N ATOM 222 CA PHE A 1 3.537 18.256 -9.789 1.00 1.07 C ATOM 223 C PHE A 1 2.103 18.065 -9.312 1.00 0.89 C ATOM 224 O PHE A 1 1.722 18.589 -8.262 1.00 0.81 O ATOM 225 CB PHE A 1 4.405 17.065 -9.355 1.00 1.39 C ATOM 226 CG PHE A 1 4.180 16.638 -7.928 1.00 0.93 C ATOM 227 CD1 PHE A 1 4.670 17.404 -6.882 1.00 1.15 C ATOM 228 CD2 PHE A 1 3.490 15.472 -7.636 1.00 1.11 C ATOM 229 CE1 PHE A 1 4.476 17.017 -5.571 1.00 1.47 C ATOM 230 CE2 PHE A 1 3.294 15.080 -6.325 1.00 1.14 C ATOM 231 CZ PHE A 1 3.742 15.846 -5.304 1.00 1.31 C ATOM 0 H PHE A 1 4.436 19.418 -8.301 1.00 1.03 H new ATOM 0 HA PHE A 1 3.559 18.307 -10.878 1.00 1.07 H new ATOM 0 HB2 PHE A 1 4.202 16.220 -10.014 1.00 1.39 H new ATOM 0 HB3 PHE A 1 5.455 17.326 -9.485 1.00 1.39 H new ATOM 0 HD1 PHE A 1 5.210 18.315 -7.095 1.00 1.15 H new ATOM 0 HD2 PHE A 1 3.102 14.864 -8.440 1.00 1.11 H new ATOM 0 HE1 PHE A 1 4.882 17.605 -4.761 1.00 1.47 H new ATOM 0 HE2 PHE A 1 2.779 14.154 -6.114 1.00 1.14 H new ATOM 0 HZ PHE A 1 3.536 15.559 -4.283 1.00 1.31 H new ATOM 241 N LYS A 2 1.311 17.330 -10.066 1.00 0.96 N ATOM 242 CA LYS A 2 -0.067 17.072 -9.678 1.00 0.98 C ATOM 243 C LYS A 2 -0.378 15.586 -9.738 1.00 1.01 C ATOM 244 O LYS A 2 0.433 14.794 -10.216 1.00 1.42 O ATOM 245 CB LYS A 2 -1.045 17.844 -10.573 1.00 1.14 C ATOM 246 CG LYS A 2 -1.069 19.345 -10.320 1.00 1.62 C ATOM 247 CD LYS A 2 -1.741 19.703 -8.995 1.00 2.02 C ATOM 248 CE LYS A 2 -3.260 19.819 -9.122 1.00 2.67 C ATOM 249 NZ LYS A 2 -3.937 18.503 -9.295 1.00 3.15 N ATOM 0 H LYS A 2 1.593 16.901 -10.947 1.00 0.96 H new ATOM 0 HA LYS A 2 -0.188 17.415 -8.651 1.00 0.98 H new ATOM 0 HB2 LYS A 2 -0.783 17.667 -11.616 1.00 1.14 H new ATOM 0 HB3 LYS A 2 -2.049 17.445 -10.424 1.00 1.14 H new ATOM 0 HG2 LYS A 2 -0.048 19.727 -10.321 1.00 1.62 H new ATOM 0 HG3 LYS A 2 -1.595 19.840 -11.136 1.00 1.62 H new ATOM 0 HD2 LYS A 2 -1.499 18.944 -8.252 1.00 2.02 H new ATOM 0 HD3 LYS A 2 -1.337 20.647 -8.630 1.00 2.02 H new ATOM 0 HE2 LYS A 2 -3.656 20.310 -8.233 1.00 2.67 H new ATOM 0 HE3 LYS A 2 -3.499 20.458 -9.972 1.00 2.67 H new ATOM 0 HZ1 LYS A 2 -4.957 18.612 -9.122 1.00 3.15 H new ATOM 0 HZ2 LYS A 2 -3.785 18.159 -10.265 1.00 3.15 H new ATOM 0 HZ3 LYS A 2 -3.542 17.818 -8.619 1.00 3.15 H new ATOM 263 N TYR A 3 -1.550 15.221 -9.243 1.00 0.91 N ATOM 264 CA TYR A 3 -2.036 13.848 -9.302 1.00 0.94 C ATOM 265 C TYR A 3 -2.073 13.372 -10.752 1.00 1.01 C ATOM 266 O TYR A 3 -1.685 12.244 -11.071 1.00 0.90 O ATOM 267 CB TYR A 3 -3.435 13.808 -8.680 1.00 1.02 C ATOM 268 CG TYR A 3 -4.129 12.466 -8.719 1.00 1.12 C ATOM 269 CD1 TYR A 3 -3.720 11.434 -7.882 1.00 1.31 C ATOM 270 CD2 TYR A 3 -5.163 12.217 -9.611 1.00 1.36 C ATOM 271 CE1 TYR A 3 -4.328 10.196 -7.928 1.00 1.62 C ATOM 272 CE2 TYR A 3 -5.771 10.979 -9.667 1.00 1.78 C ATOM 273 CZ TYR A 3 -5.457 10.025 -8.757 1.00 1.87 C ATOM 274 OH TYR A 3 -5.948 8.735 -8.882 1.00 2.35 O ATOM 0 H TYR A 3 -2.194 15.868 -8.788 1.00 0.91 H new ATOM 0 HA TYR A 3 -1.372 13.184 -8.749 1.00 0.94 H new ATOM 0 HB2 TYR A 3 -3.360 14.128 -7.641 1.00 1.02 H new ATOM 0 HB3 TYR A 3 -4.062 14.536 -9.194 1.00 1.02 H new ATOM 0 HD1 TYR A 3 -2.913 11.604 -7.184 1.00 1.31 H new ATOM 0 HD2 TYR A 3 -5.497 13.004 -10.271 1.00 1.36 H new ATOM 0 HE1 TYR A 3 -3.947 9.374 -7.341 1.00 1.62 H new ATOM 0 HE2 TYR A 3 -6.498 10.770 -10.438 1.00 1.78 H new ATOM 0 HH TYR A 3 -6.727 8.738 -9.476 1.00 2.35 H new ATOM 284 N GLU A 4 -2.519 14.268 -11.620 1.00 1.38 N ATOM 285 CA GLU A 4 -2.648 13.991 -13.042 1.00 1.74 C ATOM 286 C GLU A 4 -1.293 13.725 -13.699 1.00 1.24 C ATOM 287 O GLU A 4 -1.227 13.050 -14.725 1.00 1.52 O ATOM 288 CB GLU A 4 -3.336 15.161 -13.757 1.00 2.44 C ATOM 289 CG GLU A 4 -4.581 15.683 -13.053 1.00 3.05 C ATOM 290 CD GLU A 4 -4.272 16.770 -12.038 1.00 3.65 C ATOM 291 OE1 GLU A 4 -3.791 16.440 -10.935 1.00 3.95 O ATOM 292 OE2 GLU A 4 -4.520 17.956 -12.329 1.00 4.16 O ATOM 0 H GLU A 4 -2.803 15.212 -11.356 1.00 1.38 H new ATOM 0 HA GLU A 4 -3.256 13.091 -13.137 1.00 1.74 H new ATOM 0 HB2 GLU A 4 -2.622 15.978 -13.860 1.00 2.44 H new ATOM 0 HB3 GLU A 4 -3.608 14.846 -14.764 1.00 2.44 H new ATOM 0 HG2 GLU A 4 -5.276 16.073 -13.796 1.00 3.05 H new ATOM 0 HG3 GLU A 4 -5.083 14.856 -12.551 1.00 3.05 H new ATOM 299 N ASP A 5 -0.211 14.242 -13.113 1.00 0.71 N ATOM 300 CA ASP A 5 1.105 14.128 -13.746 1.00 0.73 C ATOM 301 C ASP A 5 1.733 12.778 -13.438 1.00 0.72 C ATOM 302 O ASP A 5 2.704 12.370 -14.076 1.00 0.90 O ATOM 303 CB ASP A 5 2.057 15.246 -13.300 1.00 1.07 C ATOM 304 CG ASP A 5 1.569 16.632 -13.657 1.00 1.83 C ATOM 305 OD1 ASP A 5 1.012 16.800 -14.764 1.00 2.15 O ATOM 306 OD2 ASP A 5 1.738 17.561 -12.840 1.00 2.57 O ATOM 0 H ASP A 5 -0.217 14.734 -12.220 1.00 0.71 H new ATOM 0 HA ASP A 5 0.948 14.223 -14.821 1.00 0.73 H new ATOM 0 HB2 ASP A 5 2.196 15.185 -12.221 1.00 1.07 H new ATOM 0 HB3 ASP A 5 3.034 15.084 -13.756 1.00 1.07 H new ATOM 311 N ILE A 6 1.174 12.092 -12.455 1.00 0.58 N ATOM 312 CA ILE A 6 1.651 10.775 -12.075 1.00 0.55 C ATOM 313 C ILE A 6 1.050 9.734 -13.012 1.00 0.54 C ATOM 314 O ILE A 6 -0.165 9.729 -13.220 1.00 0.58 O ATOM 315 CB ILE A 6 1.267 10.448 -10.613 1.00 0.55 C ATOM 316 CG1 ILE A 6 1.818 11.523 -9.672 1.00 0.63 C ATOM 317 CG2 ILE A 6 1.782 9.070 -10.211 1.00 0.56 C ATOM 318 CD1 ILE A 6 1.434 11.323 -8.222 1.00 0.69 C ATOM 0 H ILE A 6 0.385 12.429 -11.904 1.00 0.58 H new ATOM 0 HA ILE A 6 2.738 10.760 -12.152 1.00 0.55 H new ATOM 0 HB ILE A 6 0.180 10.437 -10.536 1.00 0.55 H new ATOM 0 HG12 ILE A 6 2.905 11.539 -9.751 1.00 0.63 H new ATOM 0 HG13 ILE A 6 1.460 12.499 -10.001 1.00 0.63 H new ATOM 0 HG21 ILE A 6 1.499 8.863 -9.179 1.00 0.56 H new ATOM 0 HG22 ILE A 6 1.347 8.314 -10.865 1.00 0.56 H new ATOM 0 HG23 ILE A 6 2.868 9.047 -10.302 1.00 0.56 H new ATOM 0 HD11 ILE A 6 1.861 12.124 -7.619 1.00 0.69 H new ATOM 0 HD12 ILE A 6 0.348 11.338 -8.128 1.00 0.69 H new ATOM 0 HD13 ILE A 6 1.815 10.363 -7.874 1.00 0.69 H new ATOM 325 N PRO A 7 1.898 8.861 -13.601 1.00 0.53 N ATOM 326 CA PRO A 7 1.469 7.830 -14.555 1.00 0.55 C ATOM 327 C PRO A 7 0.188 7.128 -14.127 1.00 0.53 C ATOM 328 O PRO A 7 0.156 6.430 -13.109 1.00 0.52 O ATOM 329 CB PRO A 7 2.645 6.857 -14.554 1.00 0.55 C ATOM 330 CG PRO A 7 3.829 7.722 -14.306 1.00 0.60 C ATOM 331 CD PRO A 7 3.359 8.814 -13.382 1.00 0.54 C ATOM 0 HA PRO A 7 1.237 8.247 -15.535 1.00 0.55 H new ATOM 0 HB2 PRO A 7 2.535 6.099 -13.778 1.00 0.55 H new ATOM 0 HB3 PRO A 7 2.728 6.330 -15.505 1.00 0.55 H new ATOM 0 HG2 PRO A 7 4.641 7.152 -13.855 1.00 0.60 H new ATOM 0 HG3 PRO A 7 4.211 8.137 -15.239 1.00 0.60 H new ATOM 0 HD2 PRO A 7 3.600 8.589 -12.343 1.00 0.54 H new ATOM 0 HD3 PRO A 7 3.829 9.768 -13.619 1.00 0.54 H new ATOM 339 N ALA A 8 -0.860 7.314 -14.922 1.00 0.55 N ATOM 340 CA ALA A 8 -2.186 6.812 -14.591 1.00 0.54 C ATOM 341 C ALA A 8 -2.221 5.292 -14.516 1.00 0.55 C ATOM 342 O ALA A 8 -3.101 4.723 -13.867 1.00 0.56 O ATOM 343 CB ALA A 8 -3.205 7.317 -15.601 1.00 0.57 C ATOM 0 H ALA A 8 -0.814 7.815 -15.809 1.00 0.55 H new ATOM 0 HA ALA A 8 -2.442 7.190 -13.601 1.00 0.54 H new ATOM 0 HB1 ALA A 8 -4.193 6.935 -15.343 1.00 0.57 H new ATOM 0 HB2 ALA A 8 -3.222 8.407 -15.587 1.00 0.57 H new ATOM 0 HB3 ALA A 8 -2.931 6.971 -16.598 1.00 0.57 H new ATOM 349 N ASP A 9 -1.262 4.631 -15.160 1.00 0.55 N ATOM 350 CA ASP A 9 -1.202 3.175 -15.120 1.00 0.57 C ATOM 351 C ASP A 9 -0.865 2.714 -13.708 1.00 0.54 C ATOM 352 O ASP A 9 -1.376 1.710 -13.215 1.00 0.55 O ATOM 353 CB ASP A 9 -0.148 2.638 -16.100 1.00 0.61 C ATOM 354 CG ASP A 9 -0.582 2.732 -17.550 1.00 0.93 C ATOM 355 OD1 ASP A 9 -1.271 1.810 -18.033 1.00 1.33 O ATOM 356 OD2 ASP A 9 -0.230 3.727 -18.218 1.00 1.37 O ATOM 0 H ASP A 9 -0.525 5.075 -15.709 1.00 0.55 H new ATOM 0 HA ASP A 9 -2.176 2.785 -15.414 1.00 0.57 H new ATOM 0 HB2 ASP A 9 0.780 3.195 -15.968 1.00 0.61 H new ATOM 0 HB3 ASP A 9 0.068 1.597 -15.858 1.00 0.61 H new ATOM 361 N TYR A 10 0.001 3.492 -13.069 1.00 0.52 N ATOM 362 CA TYR A 10 0.487 3.203 -11.726 1.00 0.50 C ATOM 363 C TYR A 10 -0.518 3.645 -10.672 1.00 0.49 C ATOM 364 O TYR A 10 -0.591 3.060 -9.592 1.00 0.51 O ATOM 365 CB TYR A 10 1.836 3.904 -11.514 1.00 0.52 C ATOM 366 CG TYR A 10 2.293 3.988 -10.068 1.00 0.53 C ATOM 367 CD1 TYR A 10 2.793 2.865 -9.420 1.00 0.59 C ATOM 368 CD2 TYR A 10 2.214 5.177 -9.353 1.00 0.59 C ATOM 369 CE1 TYR A 10 3.205 2.922 -8.103 1.00 0.66 C ATOM 370 CE2 TYR A 10 2.622 5.242 -8.032 1.00 0.66 C ATOM 371 CZ TYR A 10 3.144 4.173 -7.425 1.00 0.70 C ATOM 372 OH TYR A 10 3.522 4.167 -6.096 1.00 0.80 O ATOM 0 H TYR A 10 0.388 4.346 -13.471 1.00 0.52 H new ATOM 0 HA TYR A 10 0.618 2.126 -11.622 1.00 0.50 H new ATOM 0 HB2 TYR A 10 2.597 3.378 -12.090 1.00 0.52 H new ATOM 0 HB3 TYR A 10 1.772 4.914 -11.919 1.00 0.52 H new ATOM 0 HD1 TYR A 10 2.861 1.930 -9.956 1.00 0.59 H new ATOM 0 HD2 TYR A 10 1.829 6.063 -9.835 1.00 0.59 H new ATOM 0 HE1 TYR A 10 3.565 2.038 -7.599 1.00 0.66 H new ATOM 0 HE2 TYR A 10 2.517 6.168 -7.486 1.00 0.66 H new ATOM 0 HH TYR A 10 4.193 3.468 -5.950 1.00 0.80 H new ATOM 382 N ARG A 11 -1.306 4.671 -10.981 1.00 0.48 N ATOM 383 CA ARG A 11 -2.281 5.175 -10.021 1.00 0.49 C ATOM 384 C ARG A 11 -3.395 4.154 -9.836 1.00 0.50 C ATOM 385 O ARG A 11 -4.088 4.149 -8.821 1.00 0.54 O ATOM 386 CB ARG A 11 -2.862 6.521 -10.462 1.00 0.51 C ATOM 387 CG ARG A 11 -1.814 7.572 -10.788 1.00 0.48 C ATOM 388 CD ARG A 11 -2.446 8.933 -11.040 1.00 0.60 C ATOM 389 NE ARG A 11 -3.611 8.851 -11.923 1.00 0.88 N ATOM 390 CZ ARG A 11 -3.844 9.676 -12.944 1.00 1.19 C ATOM 391 NH1 ARG A 11 -2.954 10.602 -13.284 1.00 1.61 N ATOM 392 NH2 ARG A 11 -4.965 9.555 -13.642 1.00 1.73 N ATOM 0 H ARG A 11 -1.290 5.163 -11.874 1.00 0.48 H new ATOM 0 HA ARG A 11 -1.771 5.333 -9.071 1.00 0.49 H new ATOM 0 HB2 ARG A 11 -3.489 6.364 -11.340 1.00 0.51 H new ATOM 0 HB3 ARG A 11 -3.509 6.902 -9.672 1.00 0.51 H new ATOM 0 HG2 ARG A 11 -1.104 7.647 -9.964 1.00 0.48 H new ATOM 0 HG3 ARG A 11 -1.250 7.263 -11.668 1.00 0.48 H new ATOM 0 HD2 ARG A 11 -2.744 9.374 -10.089 1.00 0.60 H new ATOM 0 HD3 ARG A 11 -1.705 9.599 -11.482 1.00 0.60 H new ATOM 0 HE ARG A 11 -4.291 8.112 -11.745 1.00 0.88 H new ATOM 0 HH11 ARG A 11 -2.082 10.687 -12.762 1.00 1.61 H new ATOM 0 HH12 ARG A 11 -3.143 11.228 -14.067 1.00 1.61 H new ATOM 0 HH21 ARG A 11 -5.643 8.834 -13.397 1.00 1.73 H new ATOM 0 HH22 ARG A 11 -5.149 10.183 -14.424 1.00 1.73 H new ATOM 406 N ASP A 12 -3.533 3.280 -10.824 1.00 0.48 N ATOM 407 CA ASP A 12 -4.496 2.184 -10.779 1.00 0.50 C ATOM 408 C ASP A 12 -4.128 1.193 -9.677 1.00 0.52 C ATOM 409 O ASP A 12 -4.965 0.424 -9.209 1.00 0.62 O ATOM 410 CB ASP A 12 -4.521 1.461 -12.129 1.00 0.51 C ATOM 411 CG ASP A 12 -5.731 0.558 -12.279 1.00 0.76 C ATOM 412 OD1 ASP A 12 -6.821 1.073 -12.619 1.00 1.02 O ATOM 413 OD2 ASP A 12 -5.607 -0.663 -12.071 1.00 0.99 O ATOM 0 H ASP A 12 -2.981 3.310 -11.681 1.00 0.48 H new ATOM 0 HA ASP A 12 -5.482 2.597 -10.566 1.00 0.50 H new ATOM 0 HB2 ASP A 12 -4.519 2.197 -12.933 1.00 0.51 H new ATOM 0 HB3 ASP A 12 -3.613 0.868 -12.237 1.00 0.51 H new ATOM 418 N LEU A 13 -2.861 1.216 -9.273 1.00 0.50 N ATOM 419 CA LEU A 13 -2.363 0.315 -8.240 1.00 0.53 C ATOM 420 C LEU A 13 -2.526 0.931 -6.855 1.00 0.62 C ATOM 421 O LEU A 13 -2.376 0.249 -5.842 1.00 0.93 O ATOM 422 CB LEU A 13 -0.885 -0.008 -8.479 1.00 0.49 C ATOM 423 CG LEU A 13 -0.545 -0.570 -9.861 1.00 0.44 C ATOM 424 CD1 LEU A 13 0.945 -0.855 -9.968 1.00 0.78 C ATOM 425 CD2 LEU A 13 -1.346 -1.830 -10.141 1.00 0.88 C ATOM 0 H LEU A 13 -2.158 1.853 -9.648 1.00 0.50 H new ATOM 0 HA LEU A 13 -2.948 -0.603 -8.290 1.00 0.53 H new ATOM 0 HB2 LEU A 13 -0.303 0.901 -8.323 1.00 0.49 H new ATOM 0 HB3 LEU A 13 -0.562 -0.726 -7.725 1.00 0.49 H new ATOM 0 HG LEU A 13 -0.810 0.178 -10.608 1.00 0.44 H new ATOM 0 HD11 LEU A 13 1.169 -1.254 -10.957 1.00 0.78 H new ATOM 0 HD12 LEU A 13 1.504 0.068 -9.814 1.00 0.78 H new ATOM 0 HD13 LEU A 13 1.231 -1.583 -9.209 1.00 0.78 H new ATOM 0 HD21 LEU A 13 -1.089 -2.213 -11.129 1.00 0.88 H new ATOM 0 HD22 LEU A 13 -1.114 -2.583 -9.388 1.00 0.88 H new ATOM 0 HD23 LEU A 13 -2.411 -1.599 -10.107 1.00 0.88 H new ATOM 437 N MET A 14 -2.828 2.219 -6.811 1.00 0.55 N ATOM 438 CA MET A 14 -2.957 2.918 -5.542 1.00 0.64 C ATOM 439 C MET A 14 -4.415 2.962 -5.102 1.00 0.55 C ATOM 440 O MET A 14 -5.299 3.346 -5.870 1.00 0.53 O ATOM 441 CB MET A 14 -2.377 4.333 -5.635 1.00 0.82 C ATOM 442 CG MET A 14 -0.879 4.355 -5.911 1.00 0.97 C ATOM 443 SD MET A 14 -0.133 5.984 -5.661 1.00 1.15 S ATOM 444 CE MET A 14 -1.028 6.971 -6.859 1.00 1.04 C ATOM 0 H MET A 14 -2.988 2.799 -7.635 1.00 0.55 H new ATOM 0 HA MET A 14 -2.387 2.369 -4.792 1.00 0.64 H new ATOM 0 HB2 MET A 14 -2.893 4.878 -6.426 1.00 0.82 H new ATOM 0 HB3 MET A 14 -2.575 4.861 -4.702 1.00 0.82 H new ATOM 0 HG2 MET A 14 -0.386 3.633 -5.261 1.00 0.97 H new ATOM 0 HG3 MET A 14 -0.700 4.034 -6.937 1.00 0.97 H new ATOM 0 HE1 MET A 14 -1.009 8.018 -6.555 1.00 1.04 H new ATOM 0 HE2 MET A 14 -0.559 6.869 -7.838 1.00 1.04 H new ATOM 0 HE3 MET A 14 -2.061 6.628 -6.914 1.00 1.04 H new ATOM 454 N PRO A 15 -4.683 2.558 -3.851 1.00 0.62 N ATOM 455 CA PRO A 15 -6.044 2.476 -3.317 1.00 0.67 C ATOM 456 C PRO A 15 -6.701 3.846 -3.178 1.00 0.59 C ATOM 457 O PRO A 15 -6.005 4.856 -3.036 1.00 0.57 O ATOM 458 CB PRO A 15 -5.855 1.822 -1.944 1.00 0.88 C ATOM 459 CG PRO A 15 -4.445 2.114 -1.569 1.00 0.90 C ATOM 460 CD PRO A 15 -3.674 2.149 -2.858 1.00 0.74 C ATOM 0 HA PRO A 15 -6.705 1.916 -3.978 1.00 0.67 H new ATOM 0 HB2 PRO A 15 -6.551 2.232 -1.212 1.00 0.88 H new ATOM 0 HB3 PRO A 15 -6.037 0.748 -1.990 1.00 0.88 H new ATOM 0 HG2 PRO A 15 -4.370 3.066 -1.043 1.00 0.90 H new ATOM 0 HG3 PRO A 15 -4.052 1.348 -0.900 1.00 0.90 H new ATOM 0 HD2 PRO A 15 -2.846 2.857 -2.812 1.00 0.74 H new ATOM 0 HD3 PRO A 15 -3.247 1.175 -3.097 1.00 0.74 H new ATOM 468 N PRO A 16 -8.044 3.902 -3.245 1.00 0.65 N ATOM 469 CA PRO A 16 -8.803 5.159 -3.214 1.00 0.70 C ATOM 470 C PRO A 16 -8.298 6.162 -2.175 1.00 0.71 C ATOM 471 O PRO A 16 -8.100 7.330 -2.499 1.00 0.74 O ATOM 472 CB PRO A 16 -10.220 4.697 -2.882 1.00 0.85 C ATOM 473 CG PRO A 16 -10.313 3.335 -3.475 1.00 0.96 C ATOM 474 CD PRO A 16 -8.938 2.729 -3.358 1.00 0.76 C ATOM 0 HA PRO A 16 -8.716 5.700 -4.156 1.00 0.70 H new ATOM 0 HB2 PRO A 16 -10.389 4.674 -1.805 1.00 0.85 H new ATOM 0 HB3 PRO A 16 -10.967 5.368 -3.307 1.00 0.85 H new ATOM 0 HG2 PRO A 16 -11.051 2.731 -2.947 1.00 0.96 H new ATOM 0 HG3 PRO A 16 -10.629 3.385 -4.517 1.00 0.96 H new ATOM 0 HD2 PRO A 16 -8.860 2.081 -2.485 1.00 0.76 H new ATOM 0 HD3 PRO A 16 -8.693 2.122 -4.229 1.00 0.76 H new ATOM 482 N GLU A 17 -8.062 5.706 -0.949 1.00 0.78 N ATOM 483 CA GLU A 17 -7.599 6.592 0.119 1.00 0.89 C ATOM 484 C GLU A 17 -6.255 7.232 -0.224 1.00 0.84 C ATOM 485 O GLU A 17 -6.078 8.440 -0.071 1.00 1.13 O ATOM 486 CB GLU A 17 -7.505 5.859 1.463 1.00 1.09 C ATOM 487 CG GLU A 17 -6.821 4.507 1.392 1.00 1.48 C ATOM 488 CD GLU A 17 -7.778 3.381 1.059 1.00 1.36 C ATOM 489 OE1 GLU A 17 -8.069 3.179 -0.135 1.00 1.65 O ATOM 490 OE2 GLU A 17 -8.230 2.686 1.992 1.00 1.83 O ATOM 0 H GLU A 17 -8.182 4.733 -0.669 1.00 0.78 H new ATOM 0 HA GLU A 17 -8.343 7.383 0.212 1.00 0.89 H new ATOM 0 HB2 GLU A 17 -6.965 6.489 2.170 1.00 1.09 H new ATOM 0 HB3 GLU A 17 -8.511 5.723 1.860 1.00 1.09 H new ATOM 0 HG2 GLU A 17 -6.033 4.543 0.639 1.00 1.48 H new ATOM 0 HG3 GLU A 17 -6.340 4.298 2.347 1.00 1.48 H new ATOM 497 N ALA A 18 -5.324 6.429 -0.724 1.00 0.72 N ATOM 498 CA ALA A 18 -3.991 6.920 -1.049 1.00 0.73 C ATOM 499 C ALA A 18 -4.051 7.952 -2.169 1.00 0.62 C ATOM 500 O ALA A 18 -3.213 8.848 -2.252 1.00 0.72 O ATOM 501 CB ALA A 18 -3.080 5.765 -1.440 1.00 0.82 C ATOM 0 H ALA A 18 -5.467 5.437 -0.913 1.00 0.72 H new ATOM 0 HA ALA A 18 -3.581 7.403 -0.162 1.00 0.73 H new ATOM 0 HB1 ALA A 18 -2.088 6.149 -1.680 1.00 0.82 H new ATOM 0 HB2 ALA A 18 -3.006 5.063 -0.610 1.00 0.82 H new ATOM 0 HB3 ALA A 18 -3.492 5.255 -2.311 1.00 0.82 H new ATOM 507 N ARG A 19 -5.056 7.823 -3.022 1.00 0.52 N ATOM 508 CA ARG A 19 -5.232 8.748 -4.127 1.00 0.49 C ATOM 509 C ARG A 19 -6.088 9.942 -3.714 1.00 0.50 C ATOM 510 O ARG A 19 -5.930 11.031 -4.252 1.00 0.52 O ATOM 511 CB ARG A 19 -5.866 8.035 -5.319 1.00 0.52 C ATOM 512 CG ARG A 19 -4.998 6.925 -5.892 1.00 0.64 C ATOM 513 CD ARG A 19 -5.621 6.305 -7.134 1.00 0.72 C ATOM 514 NE ARG A 19 -6.845 5.564 -6.835 1.00 1.01 N ATOM 515 CZ ARG A 19 -8.074 6.040 -7.043 1.00 1.43 C ATOM 516 NH1 ARG A 19 -8.243 7.264 -7.531 1.00 1.46 N ATOM 517 NH2 ARG A 19 -9.133 5.286 -6.775 1.00 2.16 N ATOM 0 H ARG A 19 -5.760 7.087 -2.969 1.00 0.52 H new ATOM 0 HA ARG A 19 -4.248 9.118 -4.416 1.00 0.49 H new ATOM 0 HB2 ARG A 19 -6.825 7.615 -5.014 1.00 0.52 H new ATOM 0 HB3 ARG A 19 -6.072 8.765 -6.102 1.00 0.52 H new ATOM 0 HG2 ARG A 19 -4.014 7.324 -6.139 1.00 0.64 H new ATOM 0 HG3 ARG A 19 -4.849 6.154 -5.137 1.00 0.64 H new ATOM 0 HD2 ARG A 19 -5.843 7.091 -7.856 1.00 0.72 H new ATOM 0 HD3 ARG A 19 -4.900 5.635 -7.603 1.00 0.72 H new ATOM 0 HE ARG A 19 -6.754 4.626 -6.444 1.00 1.01 H new ATOM 0 HH11 ARG A 19 -7.432 7.843 -7.748 1.00 1.46 H new ATOM 0 HH12 ARG A 19 -9.184 7.625 -7.689 1.00 1.46 H new ATOM 0 HH21 ARG A 19 -9.008 4.342 -6.410 1.00 2.16 H new ATOM 0 HH22 ARG A 19 -10.072 5.651 -6.934 1.00 2.16 H new ATOM 531 N ASP A 20 -6.987 9.724 -2.757 1.00 0.53 N ATOM 532 CA ASP A 20 -7.876 10.780 -2.256 1.00 0.57 C ATOM 533 C ASP A 20 -7.078 11.979 -1.756 1.00 0.56 C ATOM 534 O ASP A 20 -7.465 13.130 -1.945 1.00 0.57 O ATOM 535 CB ASP A 20 -8.765 10.249 -1.131 1.00 0.63 C ATOM 536 CG ASP A 20 -9.668 11.322 -0.556 1.00 0.80 C ATOM 537 OD1 ASP A 20 -10.691 11.648 -1.193 1.00 1.06 O ATOM 538 OD2 ASP A 20 -9.356 11.852 0.529 1.00 0.98 O ATOM 0 H ASP A 20 -7.123 8.819 -2.307 1.00 0.53 H new ATOM 0 HA ASP A 20 -8.505 11.102 -3.086 1.00 0.57 H new ATOM 0 HB2 ASP A 20 -9.375 9.429 -1.509 1.00 0.63 H new ATOM 0 HB3 ASP A 20 -8.139 9.841 -0.338 1.00 0.63 H new ATOM 543 N PHE A 21 -5.962 11.691 -1.107 1.00 0.57 N ATOM 544 CA PHE A 21 -5.033 12.719 -0.664 1.00 0.57 C ATOM 545 C PHE A 21 -4.546 13.564 -1.845 1.00 0.55 C ATOM 546 O PHE A 21 -4.779 14.769 -1.855 1.00 0.64 O ATOM 547 CB PHE A 21 -3.870 12.072 0.092 1.00 0.60 C ATOM 548 CG PHE A 21 -2.937 13.042 0.759 1.00 0.59 C ATOM 549 CD1 PHE A 21 -3.310 13.689 1.925 1.00 0.62 C ATOM 550 CD2 PHE A 21 -1.682 13.294 0.229 1.00 0.64 C ATOM 551 CE1 PHE A 21 -2.451 14.571 2.549 1.00 0.65 C ATOM 552 CE2 PHE A 21 -0.817 14.176 0.850 1.00 0.65 C ATOM 553 CZ PHE A 21 -1.202 14.814 2.011 1.00 0.63 C ATOM 0 H PHE A 21 -5.674 10.741 -0.873 1.00 0.57 H new ATOM 0 HA PHE A 21 -5.548 13.396 0.018 1.00 0.57 H new ATOM 0 HB2 PHE A 21 -4.275 11.400 0.849 1.00 0.60 H new ATOM 0 HB3 PHE A 21 -3.298 11.459 -0.605 1.00 0.60 H new ATOM 0 HD1 PHE A 21 -4.284 13.501 2.351 1.00 0.62 H new ATOM 0 HD2 PHE A 21 -1.376 12.796 -0.679 1.00 0.64 H new ATOM 0 HE1 PHE A 21 -2.755 15.071 3.457 1.00 0.65 H new ATOM 0 HE2 PHE A 21 0.158 14.365 0.427 1.00 0.65 H new ATOM 0 HZ PHE A 21 -0.528 15.503 2.499 1.00 0.63 H new ATOM 563 N LEU A 22 -3.923 12.976 -2.852 1.00 0.56 N ATOM 564 CA LEU A 22 -3.463 13.774 -3.995 1.00 0.55 C ATOM 565 C LEU A 22 -4.621 14.185 -4.909 1.00 0.54 C ATOM 566 O LEU A 22 -4.427 14.981 -5.826 1.00 0.57 O ATOM 567 CB LEU A 22 -2.363 13.064 -4.783 1.00 0.56 C ATOM 568 CG LEU A 22 -0.996 13.024 -4.105 1.00 0.65 C ATOM 569 CD1 LEU A 22 -0.033 12.155 -4.897 1.00 1.04 C ATOM 570 CD2 LEU A 22 -0.442 14.434 -3.959 1.00 1.13 C ATOM 0 H LEU A 22 -3.724 11.977 -2.911 1.00 0.56 H new ATOM 0 HA LEU A 22 -3.032 14.686 -3.583 1.00 0.55 H new ATOM 0 HB2 LEU A 22 -2.683 12.041 -4.980 1.00 0.56 H new ATOM 0 HB3 LEU A 22 -2.256 13.556 -5.750 1.00 0.56 H new ATOM 0 HG LEU A 22 -1.113 12.589 -3.112 1.00 0.65 H new ATOM 0 HD11 LEU A 22 0.936 12.138 -4.399 1.00 1.04 H new ATOM 0 HD12 LEU A 22 -0.426 11.140 -4.960 1.00 1.04 H new ATOM 0 HD13 LEU A 22 0.083 12.562 -5.901 1.00 1.04 H new ATOM 0 HD21 LEU A 22 0.533 14.393 -3.474 1.00 1.13 H new ATOM 0 HD22 LEU A 22 -0.339 14.888 -4.944 1.00 1.13 H new ATOM 0 HD23 LEU A 22 -1.123 15.032 -3.354 1.00 1.13 H new ATOM 582 N GLN A 23 -5.809 13.662 -4.665 1.00 0.52 N ATOM 583 CA GLN A 23 -7.023 14.248 -5.214 1.00 0.52 C ATOM 584 C GLN A 23 -7.282 15.619 -4.580 1.00 0.53 C ATOM 585 O GLN A 23 -7.650 16.577 -5.259 1.00 0.54 O ATOM 586 CB GLN A 23 -8.208 13.314 -4.953 1.00 0.53 C ATOM 587 CG GLN A 23 -9.562 13.902 -5.311 1.00 0.78 C ATOM 588 CD GLN A 23 -9.756 14.117 -6.803 1.00 1.38 C ATOM 589 OE1 GLN A 23 -8.808 14.379 -7.546 1.00 2.05 O ATOM 590 NE2 GLN A 23 -10.993 13.996 -7.253 1.00 2.06 N ATOM 0 H GLN A 23 -5.961 12.833 -4.091 1.00 0.52 H new ATOM 0 HA GLN A 23 -6.901 14.380 -6.289 1.00 0.52 H new ATOM 0 HB2 GLN A 23 -8.063 12.395 -5.521 1.00 0.53 H new ATOM 0 HB3 GLN A 23 -8.212 13.039 -3.898 1.00 0.53 H new ATOM 0 HG2 GLN A 23 -10.345 13.240 -4.943 1.00 0.78 H new ATOM 0 HG3 GLN A 23 -9.683 14.855 -4.796 1.00 0.78 H new ATOM 0 HE21 GLN A 23 -11.752 13.778 -6.607 1.00 2.06 H new ATOM 0 HE22 GLN A 23 -11.189 14.120 -8.246 1.00 2.06 H new ATOM 599 N ASN A 24 -7.066 15.696 -3.271 1.00 0.58 N ATOM 600 CA ASN A 24 -7.294 16.922 -2.514 1.00 0.65 C ATOM 601 C ASN A 24 -6.208 17.943 -2.800 1.00 0.60 C ATOM 602 O ASN A 24 -6.497 19.091 -3.145 1.00 0.63 O ATOM 603 CB ASN A 24 -7.335 16.621 -1.013 1.00 0.85 C ATOM 604 CG ASN A 24 -8.718 16.241 -0.525 1.00 1.10 C ATOM 605 OD1 ASN A 24 -9.475 17.094 -0.061 1.00 1.84 O ATOM 606 ND2 ASN A 24 -9.060 14.966 -0.619 1.00 1.21 N ATOM 0 H ASN A 24 -6.730 14.915 -2.707 1.00 0.58 H new ATOM 0 HA ASN A 24 -8.254 17.336 -2.824 1.00 0.65 H new ATOM 0 HB2 ASN A 24 -6.641 15.810 -0.791 1.00 0.85 H new ATOM 0 HB3 ASN A 24 -6.989 17.496 -0.463 1.00 0.85 H new ATOM 0 HD21 ASN A 24 -9.979 14.660 -0.301 1.00 1.21 H new ATOM 0 HD22 ASN A 24 -8.404 14.290 -1.010 1.00 1.21 H new ATOM 613 N LEU A 25 -4.962 17.513 -2.648 1.00 0.60 N ATOM 614 CA LEU A 25 -3.814 18.375 -2.824 1.00 0.65 C ATOM 615 C LEU A 25 -3.851 19.144 -4.139 1.00 0.64 C ATOM 616 O LEU A 25 -3.876 18.584 -5.235 1.00 0.64 O ATOM 617 CB LEU A 25 -2.527 17.564 -2.708 1.00 0.76 C ATOM 618 CG LEU A 25 -2.022 17.311 -1.293 1.00 0.59 C ATOM 619 CD1 LEU A 25 -1.584 18.607 -0.667 1.00 0.81 C ATOM 620 CD2 LEU A 25 -3.080 16.659 -0.430 1.00 1.05 C ATOM 0 H LEU A 25 -4.725 16.553 -2.398 1.00 0.60 H new ATOM 0 HA LEU A 25 -3.845 19.120 -2.029 1.00 0.65 H new ATOM 0 HB2 LEU A 25 -2.683 16.601 -3.194 1.00 0.76 H new ATOM 0 HB3 LEU A 25 -1.745 18.080 -3.265 1.00 0.76 H new ATOM 0 HG LEU A 25 -1.175 16.628 -1.359 1.00 0.59 H new ATOM 0 HD11 LEU A 25 -1.224 18.419 0.345 1.00 0.81 H new ATOM 0 HD12 LEU A 25 -0.783 19.046 -1.262 1.00 0.81 H new ATOM 0 HD13 LEU A 25 -2.427 19.296 -0.630 1.00 0.81 H new ATOM 0 HD21 LEU A 25 -2.682 16.495 0.571 1.00 1.05 H new ATOM 0 HD22 LEU A 25 -3.953 17.309 -0.371 1.00 1.05 H new ATOM 0 HD23 LEU A 25 -3.368 15.703 -0.867 1.00 1.05 H new ATOM 632 N SER A 26 -3.822 20.456 -3.961 1.00 0.73 N ATOM 633 CA SER A 26 -3.823 21.422 -5.038 1.00 0.83 C ATOM 634 C SER A 26 -2.881 22.562 -4.649 1.00 1.02 C ATOM 635 O SER A 26 -2.149 22.436 -3.661 1.00 1.78 O ATOM 636 CB SER A 26 -5.243 21.937 -5.286 1.00 0.93 C ATOM 637 OG SER A 26 -6.156 20.862 -5.453 1.00 1.72 O ATOM 0 H SER A 26 -3.796 20.885 -3.036 1.00 0.73 H new ATOM 0 HA SER A 26 -3.479 20.963 -5.965 1.00 0.83 H new ATOM 0 HB2 SER A 26 -5.559 22.559 -4.449 1.00 0.93 H new ATOM 0 HB3 SER A 26 -5.254 22.569 -6.174 1.00 0.93 H new ATOM 0 HG SER A 26 -6.230 20.362 -4.613 1.00 1.72 H new ATOM 643 N ASP A 27 -2.887 23.662 -5.389 1.00 0.96 N ATOM 644 CA ASP A 27 -1.959 24.759 -5.112 1.00 1.11 C ATOM 645 C ASP A 27 -2.117 25.262 -3.677 1.00 1.13 C ATOM 646 O ASP A 27 -3.219 25.265 -3.123 1.00 1.95 O ATOM 647 CB ASP A 27 -2.149 25.913 -6.105 1.00 1.42 C ATOM 648 CG ASP A 27 -3.400 26.731 -5.852 1.00 1.84 C ATOM 649 OD1 ASP A 27 -4.481 26.337 -6.342 1.00 2.19 O ATOM 650 OD2 ASP A 27 -3.318 27.749 -5.134 1.00 2.39 O ATOM 0 H ASP A 27 -3.514 23.822 -6.177 1.00 0.96 H new ATOM 0 HA ASP A 27 -0.948 24.370 -5.232 1.00 1.11 H new ATOM 0 HB2 ASP A 27 -1.280 26.569 -6.057 1.00 1.42 H new ATOM 0 HB3 ASP A 27 -2.188 25.508 -7.116 1.00 1.42 H new ATOM 655 N GLY A 28 -1.006 25.646 -3.066 1.00 0.93 N ATOM 656 CA GLY A 28 -1.037 26.114 -1.694 1.00 0.87 C ATOM 657 C GLY A 28 -0.563 25.058 -0.717 1.00 0.75 C ATOM 658 O GLY A 28 0.403 25.268 0.019 1.00 0.73 O ATOM 0 H GLY A 28 -0.081 25.642 -3.496 1.00 0.93 H new ATOM 0 HA2 GLY A 28 -0.410 27.001 -1.600 1.00 0.87 H new ATOM 0 HA3 GLY A 28 -2.053 26.414 -1.437 1.00 0.87 H new ATOM 662 N ASP A 29 -1.232 23.915 -0.721 1.00 0.70 N ATOM 663 CA ASP A 29 -0.909 22.841 0.212 1.00 0.67 C ATOM 664 C ASP A 29 0.185 21.939 -0.341 1.00 0.59 C ATOM 665 O ASP A 29 0.975 21.389 0.410 1.00 0.60 O ATOM 666 CB ASP A 29 -2.153 22.005 0.535 1.00 0.80 C ATOM 667 CG ASP A 29 -3.188 22.761 1.347 1.00 1.47 C ATOM 668 OD1 ASP A 29 -2.910 23.101 2.518 1.00 2.25 O ATOM 669 OD2 ASP A 29 -4.291 23.022 0.814 1.00 1.74 O ATOM 0 H ASP A 29 -2.001 23.705 -1.358 1.00 0.70 H new ATOM 0 HA ASP A 29 -0.546 23.306 1.129 1.00 0.67 H new ATOM 0 HB2 ASP A 29 -2.607 21.667 -0.396 1.00 0.80 H new ATOM 0 HB3 ASP A 29 -1.851 21.113 1.084 1.00 0.80 H new ATOM 674 N LYS A 30 0.253 21.786 -1.654 1.00 0.63 N ATOM 675 CA LYS A 30 1.293 20.949 -2.247 1.00 0.65 C ATOM 676 C LYS A 30 2.652 21.615 -2.090 1.00 0.61 C ATOM 677 O LYS A 30 3.696 20.974 -2.205 1.00 0.65 O ATOM 678 CB LYS A 30 1.003 20.672 -3.720 1.00 0.78 C ATOM 679 CG LYS A 30 -0.385 20.114 -3.943 1.00 0.92 C ATOM 680 CD LYS A 30 -0.512 19.339 -5.243 1.00 0.89 C ATOM 681 CE LYS A 30 0.214 18.007 -5.165 1.00 0.96 C ATOM 682 NZ LYS A 30 1.604 18.104 -5.673 1.00 1.31 N ATOM 0 H LYS A 30 -0.385 22.220 -2.322 1.00 0.63 H new ATOM 0 HA LYS A 30 1.303 19.994 -1.722 1.00 0.65 H new ATOM 0 HB2 LYS A 30 1.116 21.595 -4.289 1.00 0.78 H new ATOM 0 HB3 LYS A 30 1.740 19.968 -4.106 1.00 0.78 H new ATOM 0 HG2 LYS A 30 -0.646 19.461 -3.110 1.00 0.92 H new ATOM 0 HG3 LYS A 30 -1.104 20.933 -3.943 1.00 0.92 H new ATOM 0 HD2 LYS A 30 -1.565 19.169 -5.466 1.00 0.89 H new ATOM 0 HD3 LYS A 30 -0.104 19.930 -6.063 1.00 0.89 H new ATOM 0 HE2 LYS A 30 0.229 17.662 -4.131 1.00 0.96 H new ATOM 0 HE3 LYS A 30 -0.332 17.261 -5.743 1.00 0.96 H new ATOM 0 HZ1 LYS A 30 2.220 17.475 -5.120 1.00 1.31 H new ATOM 0 HZ2 LYS A 30 1.629 17.821 -6.673 1.00 1.31 H new ATOM 0 HZ3 LYS A 30 1.939 19.084 -5.582 1.00 1.31 H new ATOM 696 N THR A 31 2.610 22.908 -1.821 1.00 0.60 N ATOM 697 CA THR A 31 3.803 23.697 -1.600 1.00 0.61 C ATOM 698 C THR A 31 4.536 23.233 -0.341 1.00 0.52 C ATOM 699 O THR A 31 5.766 23.187 -0.310 1.00 0.54 O ATOM 700 CB THR A 31 3.434 25.186 -1.472 1.00 0.68 C ATOM 701 OG1 THR A 31 2.530 25.549 -2.528 1.00 0.80 O ATOM 702 CG2 THR A 31 4.674 26.064 -1.546 1.00 0.76 C ATOM 0 H THR A 31 1.743 23.440 -1.750 1.00 0.60 H new ATOM 0 HA THR A 31 4.466 23.562 -2.455 1.00 0.61 H new ATOM 0 HB THR A 31 2.958 25.340 -0.503 1.00 0.68 H new ATOM 0 HG1 THR A 31 2.294 26.497 -2.445 1.00 0.80 H new ATOM 0 HG21 THR A 31 4.385 27.111 -1.453 1.00 0.76 H new ATOM 0 HG22 THR A 31 5.354 25.802 -0.736 1.00 0.76 H new ATOM 0 HG23 THR A 31 5.173 25.909 -2.503 1.00 0.76 H new ATOM 710 N VAL A 32 3.769 22.839 0.674 1.00 0.50 N ATOM 711 CA VAL A 32 4.342 22.485 1.961 1.00 0.50 C ATOM 712 C VAL A 32 4.875 21.053 1.980 1.00 0.47 C ATOM 713 O VAL A 32 5.856 20.776 2.665 1.00 0.48 O ATOM 714 CB VAL A 32 3.346 22.698 3.123 1.00 0.57 C ATOM 715 CG1 VAL A 32 2.119 21.830 2.998 1.00 0.60 C ATOM 716 CG2 VAL A 32 4.026 22.436 4.446 1.00 0.85 C ATOM 0 H VAL A 32 2.753 22.759 0.626 1.00 0.50 H new ATOM 0 HA VAL A 32 5.183 23.162 2.109 1.00 0.50 H new ATOM 0 HB VAL A 32 3.017 23.736 3.075 1.00 0.57 H new ATOM 0 HG11 VAL A 32 1.452 22.019 3.839 1.00 0.60 H new ATOM 0 HG12 VAL A 32 1.602 22.062 2.067 1.00 0.60 H new ATOM 0 HG13 VAL A 32 2.414 20.781 2.997 1.00 0.60 H new ATOM 0 HG21 VAL A 32 3.315 22.589 5.257 1.00 0.85 H new ATOM 0 HG22 VAL A 32 4.389 21.409 4.471 1.00 0.85 H new ATOM 0 HG23 VAL A 32 4.866 23.121 4.565 1.00 0.85 H new ATOM 720 N LEU A 33 4.253 20.146 1.231 1.00 0.48 N ATOM 721 CA LEU A 33 4.766 18.776 1.114 1.00 0.49 C ATOM 722 C LEU A 33 6.217 18.799 0.646 1.00 0.50 C ATOM 723 O LEU A 33 7.057 18.079 1.175 1.00 0.54 O ATOM 724 CB LEU A 33 3.937 17.954 0.108 1.00 0.53 C ATOM 725 CG LEU A 33 2.608 17.354 0.597 1.00 0.58 C ATOM 726 CD1 LEU A 33 2.844 16.354 1.711 1.00 0.98 C ATOM 727 CD2 LEU A 33 1.630 18.428 1.038 1.00 0.74 C ATOM 0 H LEU A 33 3.402 20.328 0.700 1.00 0.48 H new ATOM 0 HA LEU A 33 4.694 18.312 2.098 1.00 0.49 H new ATOM 0 HB2 LEU A 33 3.722 18.592 -0.749 1.00 0.53 H new ATOM 0 HB3 LEU A 33 4.562 17.136 -0.252 1.00 0.53 H new ATOM 0 HG LEU A 33 2.160 16.831 -0.248 1.00 0.58 H new ATOM 0 HD11 LEU A 33 1.889 15.944 2.040 1.00 0.98 H new ATOM 0 HD12 LEU A 33 3.480 15.547 1.347 1.00 0.98 H new ATOM 0 HD13 LEU A 33 3.333 16.851 2.549 1.00 0.98 H new ATOM 0 HD21 LEU A 33 0.705 17.961 1.376 1.00 0.74 H new ATOM 0 HD22 LEU A 33 2.065 19.003 1.855 1.00 0.74 H new ATOM 0 HD23 LEU A 33 1.417 19.092 0.200 1.00 0.74 H new ATOM 739 N LYS A 34 6.506 19.655 -0.327 1.00 0.51 N ATOM 740 CA LYS A 34 7.850 19.757 -0.884 1.00 0.56 C ATOM 741 C LYS A 34 8.833 20.224 0.185 1.00 0.53 C ATOM 742 O LYS A 34 10.016 19.882 0.163 1.00 0.59 O ATOM 743 CB LYS A 34 7.847 20.724 -2.071 1.00 0.65 C ATOM 744 CG LYS A 34 9.185 20.848 -2.783 1.00 0.93 C ATOM 745 CD LYS A 34 9.100 21.792 -3.977 1.00 0.89 C ATOM 746 CE LYS A 34 9.270 23.258 -3.584 1.00 1.70 C ATOM 747 NZ LYS A 34 8.268 23.716 -2.579 1.00 2.41 N ATOM 0 H LYS A 34 5.827 20.289 -0.747 1.00 0.51 H new ATOM 0 HA LYS A 34 8.166 18.774 -1.232 1.00 0.56 H new ATOM 0 HB2 LYS A 34 7.096 20.396 -2.789 1.00 0.65 H new ATOM 0 HB3 LYS A 34 7.543 21.710 -1.720 1.00 0.65 H new ATOM 0 HG2 LYS A 34 9.938 21.212 -2.084 1.00 0.93 H new ATOM 0 HG3 LYS A 34 9.512 19.864 -3.119 1.00 0.93 H new ATOM 0 HD2 LYS A 34 9.868 21.523 -4.702 1.00 0.89 H new ATOM 0 HD3 LYS A 34 8.137 21.662 -4.470 1.00 0.89 H new ATOM 0 HE2 LYS A 34 10.272 23.406 -3.182 1.00 1.70 H new ATOM 0 HE3 LYS A 34 9.190 23.879 -4.477 1.00 1.70 H new ATOM 0 HZ1 LYS A 34 8.241 24.756 -2.565 1.00 2.41 H new ATOM 0 HZ2 LYS A 34 7.329 23.348 -2.833 1.00 2.41 H new ATOM 0 HZ3 LYS A 34 8.535 23.364 -1.637 1.00 2.41 H new ATOM 761 N GLU A 35 8.316 20.988 1.130 1.00 0.47 N ATOM 762 CA GLU A 35 9.112 21.507 2.224 1.00 0.47 C ATOM 763 C GLU A 35 9.325 20.440 3.291 1.00 0.46 C ATOM 764 O GLU A 35 10.446 20.245 3.753 1.00 0.57 O ATOM 765 CB GLU A 35 8.436 22.737 2.831 1.00 0.47 C ATOM 766 CG GLU A 35 8.072 23.800 1.806 1.00 0.61 C ATOM 767 CD GLU A 35 9.240 24.179 0.920 1.00 1.26 C ATOM 768 OE1 GLU A 35 10.048 25.041 1.327 1.00 1.47 O ATOM 769 OE2 GLU A 35 9.354 23.629 -0.191 1.00 1.96 O ATOM 0 H GLU A 35 7.335 21.265 1.160 1.00 0.47 H new ATOM 0 HA GLU A 35 10.087 21.798 1.832 1.00 0.47 H new ATOM 0 HB2 GLU A 35 7.532 22.424 3.354 1.00 0.47 H new ATOM 0 HB3 GLU A 35 9.100 23.175 3.576 1.00 0.47 H new ATOM 0 HG2 GLU A 35 7.253 23.436 1.185 1.00 0.61 H new ATOM 0 HG3 GLU A 35 7.709 24.689 2.323 1.00 0.61 H new ATOM 776 N VAL A 36 8.267 19.728 3.656 1.00 0.41 N ATOM 777 CA VAL A 36 8.346 18.758 4.727 1.00 0.42 C ATOM 778 C VAL A 36 9.057 17.471 4.294 1.00 0.50 C ATOM 779 O VAL A 36 9.804 16.877 5.071 1.00 0.62 O ATOM 780 CB VAL A 36 6.950 18.470 5.311 1.00 0.43 C ATOM 781 CG1 VAL A 36 6.482 19.671 6.111 1.00 0.98 C ATOM 782 CG2 VAL A 36 5.929 18.128 4.253 1.00 0.74 C ATOM 0 H VAL A 36 7.347 19.808 3.223 1.00 0.41 H new ATOM 0 HA VAL A 36 8.956 19.196 5.517 1.00 0.42 H new ATOM 0 HB VAL A 36 7.041 17.595 5.954 1.00 0.43 H new ATOM 0 HG11 VAL A 36 5.494 19.470 6.525 1.00 0.98 H new ATOM 0 HG12 VAL A 36 7.184 19.863 6.923 1.00 0.98 H new ATOM 0 HG13 VAL A 36 6.431 20.544 5.461 1.00 0.98 H new ATOM 0 HG21 VAL A 36 4.966 17.935 4.726 1.00 0.74 H new ATOM 0 HG22 VAL A 36 5.832 18.962 3.558 1.00 0.74 H new ATOM 0 HG23 VAL A 36 6.251 17.239 3.710 1.00 0.74 H new ATOM 786 N PHE A 37 8.831 17.059 3.059 1.00 0.49 N ATOM 787 CA PHE A 37 9.555 15.958 2.441 1.00 0.54 C ATOM 788 C PHE A 37 11.050 16.204 2.308 1.00 0.59 C ATOM 789 O PHE A 37 11.845 15.312 2.599 1.00 0.66 O ATOM 790 CB PHE A 37 8.932 15.671 1.082 1.00 0.57 C ATOM 791 CG PHE A 37 7.802 14.694 1.238 1.00 0.57 C ATOM 792 CD1 PHE A 37 6.572 15.108 1.723 1.00 0.74 C ATOM 793 CD2 PHE A 37 7.988 13.353 0.958 1.00 0.66 C ATOM 794 CE1 PHE A 37 5.548 14.202 1.916 1.00 0.83 C ATOM 795 CE2 PHE A 37 6.967 12.443 1.155 1.00 0.68 C ATOM 796 CZ PHE A 37 5.745 12.868 1.633 1.00 0.71 C ATOM 0 H PHE A 37 8.132 17.483 2.449 1.00 0.49 H new ATOM 0 HA PHE A 37 9.465 15.094 3.099 1.00 0.54 H new ATOM 0 HB2 PHE A 37 8.566 16.596 0.636 1.00 0.57 H new ATOM 0 HB3 PHE A 37 9.684 15.266 0.405 1.00 0.57 H new ATOM 0 HD1 PHE A 37 6.412 16.151 1.953 1.00 0.74 H new ATOM 0 HD2 PHE A 37 8.941 13.013 0.581 1.00 0.66 H new ATOM 0 HE1 PHE A 37 4.592 14.539 2.289 1.00 0.83 H new ATOM 0 HE2 PHE A 37 7.126 11.398 0.934 1.00 0.68 H new ATOM 0 HZ PHE A 37 4.946 12.158 1.785 1.00 0.71 H new ATOM 806 N LYS A 38 11.457 17.393 1.880 1.00 0.60 N ATOM 807 CA LYS A 38 12.884 17.663 1.746 1.00 0.69 C ATOM 808 C LYS A 38 13.493 18.010 3.100 1.00 0.78 C ATOM 809 O LYS A 38 14.713 17.967 3.272 1.00 1.02 O ATOM 810 CB LYS A 38 13.169 18.754 0.710 1.00 0.75 C ATOM 811 CG LYS A 38 12.883 18.309 -0.717 1.00 0.76 C ATOM 812 CD LYS A 38 13.594 19.178 -1.743 1.00 0.91 C ATOM 813 CE LYS A 38 13.113 20.617 -1.700 1.00 1.37 C ATOM 814 NZ LYS A 38 13.838 21.474 -2.675 1.00 2.18 N ATOM 0 H LYS A 38 10.841 18.165 1.626 1.00 0.60 H new ATOM 0 HA LYS A 38 13.358 16.752 1.380 1.00 0.69 H new ATOM 0 HB2 LYS A 38 12.564 19.632 0.939 1.00 0.75 H new ATOM 0 HB3 LYS A 38 14.213 19.057 0.788 1.00 0.75 H new ATOM 0 HG2 LYS A 38 13.196 17.272 -0.842 1.00 0.76 H new ATOM 0 HG3 LYS A 38 11.809 18.342 -0.898 1.00 0.76 H new ATOM 0 HD2 LYS A 38 14.668 19.149 -1.561 1.00 0.91 H new ATOM 0 HD3 LYS A 38 13.429 18.770 -2.740 1.00 0.91 H new ATOM 0 HE2 LYS A 38 12.044 20.649 -1.913 1.00 1.37 H new ATOM 0 HE3 LYS A 38 13.250 21.015 -0.695 1.00 1.37 H new ATOM 0 HZ1 LYS A 38 13.480 22.449 -2.614 1.00 2.18 H new ATOM 0 HZ2 LYS A 38 14.855 21.464 -2.457 1.00 2.18 H new ATOM 0 HZ3 LYS A 38 13.687 21.109 -3.637 1.00 2.18 H new ATOM 828 N ALA A 39 12.639 18.362 4.054 1.00 0.71 N ATOM 829 CA ALA A 39 13.050 18.480 5.443 1.00 0.87 C ATOM 830 C ALA A 39 13.331 17.096 6.021 1.00 0.82 C ATOM 831 O ALA A 39 14.495 16.704 6.123 1.00 1.56 O ATOM 832 CB ALA A 39 11.996 19.219 6.264 1.00 1.06 C ATOM 0 H ALA A 39 11.655 18.571 3.887 1.00 0.71 H new ATOM 0 HA ALA A 39 13.968 19.066 5.489 1.00 0.87 H new ATOM 0 HB1 ALA A 39 12.328 19.294 7.300 1.00 1.06 H new ATOM 0 HB2 ALA A 39 11.852 20.219 5.856 1.00 1.06 H new ATOM 0 HB3 ALA A 39 11.054 18.672 6.224 1.00 1.06 H new ATOM 838 N GLY A 40 12.278 16.351 6.361 1.00 0.78 N ATOM 839 CA GLY A 40 12.451 15.022 6.939 1.00 1.03 C ATOM 840 C GLY A 40 13.506 14.995 8.035 1.00 1.29 C ATOM 841 O GLY A 40 13.640 15.963 8.787 1.00 1.54 O ATOM 0 H GLY A 40 11.307 16.643 6.247 1.00 0.78 H new ATOM 0 HA2 GLY A 40 11.500 14.680 7.347 1.00 1.03 H new ATOM 0 HA3 GLY A 40 12.731 14.321 6.153 1.00 1.03 H new ATOM 845 N PRO A 41 14.243 13.887 8.193 1.00 1.37 N ATOM 846 CA PRO A 41 13.948 12.604 7.569 1.00 1.22 C ATOM 847 C PRO A 41 13.072 11.755 8.481 1.00 1.09 C ATOM 848 O PRO A 41 13.421 11.482 9.630 1.00 1.18 O ATOM 849 CB PRO A 41 15.333 11.966 7.388 1.00 1.37 C ATOM 850 CG PRO A 41 16.300 12.838 8.142 1.00 1.60 C ATOM 851 CD PRO A 41 15.480 13.796 8.963 1.00 1.68 C ATOM 0 HA PRO A 41 13.402 12.699 6.631 1.00 1.22 H new ATOM 0 HB2 PRO A 41 15.345 10.947 7.774 1.00 1.37 H new ATOM 0 HB3 PRO A 41 15.601 11.910 6.333 1.00 1.37 H new ATOM 0 HG2 PRO A 41 16.945 12.235 8.782 1.00 1.60 H new ATOM 0 HG3 PRO A 41 16.950 13.378 7.454 1.00 1.60 H new ATOM 0 HD2 PRO A 41 15.305 13.420 9.971 1.00 1.68 H new ATOM 0 HD3 PRO A 41 15.968 14.765 9.064 1.00 1.68 H new ATOM 859 N TYR A 42 11.925 11.349 7.964 1.00 0.99 N ATOM 860 CA TYR A 42 10.908 10.724 8.787 1.00 0.92 C ATOM 861 C TYR A 42 10.939 9.207 8.672 1.00 0.97 C ATOM 862 O TYR A 42 10.723 8.638 7.603 1.00 1.08 O ATOM 863 CB TYR A 42 9.529 11.273 8.413 1.00 0.85 C ATOM 864 CG TYR A 42 9.473 12.787 8.445 1.00 0.87 C ATOM 865 CD1 TYR A 42 9.911 13.490 9.563 1.00 0.90 C ATOM 866 CD2 TYR A 42 8.997 13.513 7.361 1.00 0.99 C ATOM 867 CE1 TYR A 42 9.882 14.868 9.596 1.00 1.02 C ATOM 868 CE2 TYR A 42 8.960 14.895 7.390 1.00 1.10 C ATOM 869 CZ TYR A 42 9.406 15.567 8.510 1.00 1.12 C ATOM 870 OH TYR A 42 9.390 16.942 8.540 1.00 1.28 O ATOM 0 H TYR A 42 11.676 11.441 6.979 1.00 0.99 H new ATOM 0 HA TYR A 42 11.118 10.967 9.829 1.00 0.92 H new ATOM 0 HB2 TYR A 42 9.262 10.925 7.415 1.00 0.85 H new ATOM 0 HB3 TYR A 42 8.784 10.872 9.100 1.00 0.85 H new ATOM 0 HD1 TYR A 42 10.280 12.947 10.420 1.00 0.90 H new ATOM 0 HD2 TYR A 42 8.650 12.990 6.482 1.00 0.99 H new ATOM 0 HE1 TYR A 42 10.231 15.397 10.470 1.00 1.02 H new ATOM 0 HE2 TYR A 42 8.584 15.446 6.540 1.00 1.10 H new ATOM 0 HH TYR A 42 9.026 17.283 7.697 1.00 1.28 H new ATOM 880 N LYS A 43 11.225 8.573 9.797 1.00 0.96 N ATOM 881 CA LYS A 43 11.218 7.121 9.926 1.00 1.01 C ATOM 882 C LYS A 43 9.802 6.566 9.882 1.00 0.98 C ATOM 883 O LYS A 43 9.606 5.368 9.676 1.00 1.06 O ATOM 884 CB LYS A 43 11.864 6.723 11.255 1.00 1.10 C ATOM 885 CG LYS A 43 13.342 7.074 11.343 1.00 1.72 C ATOM 886 CD LYS A 43 13.917 6.752 12.714 1.00 2.26 C ATOM 887 CE LYS A 43 13.343 7.660 13.793 1.00 2.94 C ATOM 888 NZ LYS A 43 14.036 7.485 15.096 1.00 3.51 N ATOM 0 H LYS A 43 11.472 9.057 10.660 1.00 0.96 H new ATOM 0 HA LYS A 43 11.780 6.707 9.089 1.00 1.01 H new ATOM 0 HB2 LYS A 43 11.333 7.216 12.069 1.00 1.10 H new ATOM 0 HB3 LYS A 43 11.745 5.649 11.400 1.00 1.10 H new ATOM 0 HG2 LYS A 43 13.892 6.524 10.579 1.00 1.72 H new ATOM 0 HG3 LYS A 43 13.477 8.135 11.132 1.00 1.72 H new ATOM 0 HD2 LYS A 43 13.705 5.712 12.963 1.00 2.26 H new ATOM 0 HD3 LYS A 43 15.001 6.858 12.688 1.00 2.26 H new ATOM 0 HE2 LYS A 43 13.427 8.699 13.475 1.00 2.94 H new ATOM 0 HE3 LYS A 43 12.281 7.449 13.916 1.00 2.94 H new ATOM 0 HZ1 LYS A 43 13.614 8.122 15.802 1.00 3.51 H new ATOM 0 HZ2 LYS A 43 13.934 6.500 15.414 1.00 3.51 H new ATOM 0 HZ3 LYS A 43 15.045 7.711 14.986 1.00 3.51 H new ATOM 902 N ASN A 44 8.817 7.430 10.065 1.00 0.88 N ATOM 903 CA ASN A 44 7.436 6.992 10.169 1.00 0.85 C ATOM 904 C ASN A 44 6.506 8.045 9.582 1.00 0.80 C ATOM 905 O ASN A 44 6.906 9.194 9.382 1.00 0.85 O ATOM 906 CB ASN A 44 7.074 6.729 11.635 1.00 0.89 C ATOM 907 CG ASN A 44 7.091 7.993 12.473 1.00 0.95 C ATOM 908 OD1 ASN A 44 6.081 8.673 12.605 1.00 1.52 O ATOM 909 ND2 ASN A 44 8.245 8.323 13.030 1.00 1.10 N ATOM 0 H ASN A 44 8.949 8.438 10.145 1.00 0.88 H new ATOM 0 HA ASN A 44 7.319 6.066 9.606 1.00 0.85 H new ATOM 0 HB2 ASN A 44 6.084 6.277 11.686 1.00 0.89 H new ATOM 0 HB3 ASN A 44 7.776 6.009 12.056 1.00 0.89 H new ATOM 0 HD21 ASN A 44 8.316 9.171 13.593 1.00 1.10 H new ATOM 0 HD22 ASN A 44 9.064 7.730 12.896 1.00 1.10 H new ATOM 916 N THR A 45 5.267 7.651 9.320 1.00 0.77 N ATOM 917 CA THR A 45 4.300 8.533 8.692 1.00 0.76 C ATOM 918 C THR A 45 3.804 9.614 9.654 1.00 0.74 C ATOM 919 O THR A 45 3.504 10.729 9.233 1.00 0.92 O ATOM 920 CB THR A 45 3.094 7.736 8.166 1.00 0.84 C ATOM 921 OG1 THR A 45 3.548 6.579 7.451 1.00 1.05 O ATOM 922 CG2 THR A 45 2.233 8.592 7.250 1.00 1.18 C ATOM 0 H THR A 45 4.909 6.720 9.535 1.00 0.77 H new ATOM 0 HA THR A 45 4.811 9.017 7.860 1.00 0.76 H new ATOM 0 HB THR A 45 2.492 7.427 9.021 1.00 0.84 H new ATOM 0 HG1 THR A 45 2.840 5.902 7.441 1.00 1.05 H new ATOM 0 HG21 THR A 45 1.387 8.005 6.892 1.00 1.18 H new ATOM 0 HG22 THR A 45 1.866 9.458 7.800 1.00 1.18 H new ATOM 0 HG23 THR A 45 2.828 8.927 6.400 1.00 1.18 H new ATOM 930 N GLU A 46 3.730 9.286 10.939 1.00 0.72 N ATOM 931 CA GLU A 46 3.247 10.231 11.947 1.00 0.71 C ATOM 932 C GLU A 46 4.096 11.501 11.960 1.00 0.66 C ATOM 933 O GLU A 46 3.565 12.608 12.047 1.00 0.65 O ATOM 934 CB GLU A 46 3.238 9.583 13.331 1.00 0.79 C ATOM 935 CG GLU A 46 2.190 8.493 13.481 1.00 1.41 C ATOM 936 CD GLU A 46 2.299 7.756 14.801 1.00 1.82 C ATOM 937 OE1 GLU A 46 2.242 8.417 15.858 1.00 2.24 O ATOM 938 OE2 GLU A 46 2.452 6.514 14.788 1.00 2.12 O ATOM 0 H GLU A 46 3.997 8.374 11.310 1.00 0.72 H new ATOM 0 HA GLU A 46 2.226 10.508 11.685 1.00 0.71 H new ATOM 0 HB2 GLU A 46 4.222 9.160 13.532 1.00 0.79 H new ATOM 0 HB3 GLU A 46 3.062 10.352 14.083 1.00 0.79 H new ATOM 0 HG2 GLU A 46 1.197 8.935 13.397 1.00 1.41 H new ATOM 0 HG3 GLU A 46 2.292 7.781 12.662 1.00 1.41 H new ATOM 945 N GLU A 47 5.409 11.339 11.852 1.00 0.67 N ATOM 946 CA GLU A 47 6.321 12.474 11.779 1.00 0.67 C ATOM 947 C GLU A 47 6.051 13.332 10.543 1.00 0.60 C ATOM 948 O GLU A 47 6.219 14.554 10.579 1.00 0.58 O ATOM 949 CB GLU A 47 7.764 11.983 11.776 1.00 0.73 C ATOM 950 CG GLU A 47 8.472 12.165 13.106 1.00 0.98 C ATOM 951 CD GLU A 47 7.688 11.615 14.279 1.00 1.64 C ATOM 952 OE1 GLU A 47 6.822 12.340 14.813 1.00 2.03 O ATOM 953 OE2 GLU A 47 7.943 10.464 14.683 1.00 2.26 O ATOM 0 H GLU A 47 5.868 10.429 11.813 1.00 0.67 H new ATOM 0 HA GLU A 47 6.154 13.097 12.658 1.00 0.67 H new ATOM 0 HB2 GLU A 47 7.779 10.927 11.508 1.00 0.73 H new ATOM 0 HB3 GLU A 47 8.318 12.516 11.003 1.00 0.73 H new ATOM 0 HG2 GLU A 47 9.443 11.672 13.064 1.00 0.98 H new ATOM 0 HG3 GLU A 47 8.660 13.226 13.268 1.00 0.98 H new ATOM 960 N SER A 48 5.635 12.693 9.456 1.00 0.58 N ATOM 961 CA SER A 48 5.286 13.410 8.237 1.00 0.54 C ATOM 962 C SER A 48 3.970 14.163 8.437 1.00 0.51 C ATOM 963 O SER A 48 3.815 15.306 8.004 1.00 0.49 O ATOM 964 CB SER A 48 5.157 12.428 7.069 1.00 0.57 C ATOM 965 OG SER A 48 6.268 11.546 7.022 1.00 1.19 O ATOM 0 H SER A 48 5.531 11.680 9.394 1.00 0.58 H new ATOM 0 HA SER A 48 6.074 14.127 8.008 1.00 0.54 H new ATOM 0 HB2 SER A 48 4.236 11.854 7.172 1.00 0.57 H new ATOM 0 HB3 SER A 48 5.086 12.979 6.132 1.00 0.57 H new ATOM 0 HG SER A 48 7.096 12.056 7.146 1.00 1.19 H new ATOM 971 N ILE A 49 3.038 13.507 9.116 1.00 0.51 N ATOM 972 CA ILE A 49 1.733 14.080 9.416 1.00 0.49 C ATOM 973 C ILE A 49 1.886 15.296 10.322 1.00 0.49 C ATOM 974 O ILE A 49 1.272 16.341 10.095 1.00 0.47 O ATOM 975 CB ILE A 49 0.825 13.025 10.091 1.00 0.51 C ATOM 976 CG1 ILE A 49 0.557 11.873 9.114 1.00 0.52 C ATOM 977 CG2 ILE A 49 -0.479 13.651 10.567 1.00 0.50 C ATOM 978 CD1 ILE A 49 -0.181 10.700 9.722 1.00 0.55 C ATOM 0 H ILE A 49 3.166 12.561 9.475 1.00 0.51 H new ATOM 0 HA ILE A 49 1.269 14.395 8.481 1.00 0.49 H new ATOM 0 HB ILE A 49 1.337 12.630 10.968 1.00 0.51 H new ATOM 0 HG12 ILE A 49 -0.021 12.253 8.272 1.00 0.52 H new ATOM 0 HG13 ILE A 49 1.509 11.521 8.715 1.00 0.52 H new ATOM 0 HG21 ILE A 49 -1.099 12.888 11.038 1.00 0.50 H new ATOM 0 HG22 ILE A 49 -0.262 14.438 11.289 1.00 0.50 H new ATOM 0 HG23 ILE A 49 -1.011 14.076 9.716 1.00 0.50 H new ATOM 0 HD11 ILE A 49 -0.329 9.931 8.964 1.00 0.55 H new ATOM 0 HD12 ILE A 49 0.403 10.290 10.546 1.00 0.55 H new ATOM 0 HD13 ILE A 49 -1.149 11.033 10.095 1.00 0.55 H new ATOM 985 N ALA A 50 2.722 15.145 11.338 1.00 0.52 N ATOM 986 CA ALA A 50 3.062 16.229 12.244 1.00 0.53 C ATOM 987 C ALA A 50 3.613 17.430 11.486 1.00 0.50 C ATOM 988 O ALA A 50 3.171 18.561 11.693 1.00 0.50 O ATOM 989 CB ALA A 50 4.080 15.736 13.249 1.00 0.57 C ATOM 0 H ALA A 50 3.185 14.263 11.557 1.00 0.52 H new ATOM 0 HA ALA A 50 2.157 16.549 12.760 1.00 0.53 H new ATOM 0 HB1 ALA A 50 4.339 16.545 13.932 1.00 0.57 H new ATOM 0 HB2 ALA A 50 3.660 14.905 13.815 1.00 0.57 H new ATOM 0 HB3 ALA A 50 4.976 15.402 12.726 1.00 0.57 H new ATOM 995 N ALA A 51 4.579 17.171 10.603 1.00 0.49 N ATOM 996 CA ALA A 51 5.179 18.218 9.779 1.00 0.48 C ATOM 997 C ALA A 51 4.113 19.000 9.030 1.00 0.45 C ATOM 998 O ALA A 51 4.171 20.228 8.935 1.00 0.47 O ATOM 999 CB ALA A 51 6.170 17.617 8.791 1.00 0.50 C ATOM 0 H ALA A 51 4.963 16.240 10.441 1.00 0.49 H new ATOM 0 HA ALA A 51 5.708 18.902 10.442 1.00 0.48 H new ATOM 0 HB1 ALA A 51 6.607 18.411 8.186 1.00 0.50 H new ATOM 0 HB2 ALA A 51 6.960 17.100 9.336 1.00 0.50 H new ATOM 0 HB3 ALA A 51 5.654 16.909 8.143 1.00 0.50 H new ATOM 1005 N LEU A 52 3.133 18.284 8.512 1.00 0.42 N ATOM 1006 CA LEU A 52 2.050 18.901 7.768 1.00 0.40 C ATOM 1007 C LEU A 52 1.134 19.699 8.688 1.00 0.39 C ATOM 1008 O LEU A 52 0.730 20.801 8.339 1.00 0.40 O ATOM 1009 CB LEU A 52 1.255 17.841 7.004 1.00 0.40 C ATOM 1010 CG LEU A 52 1.996 17.208 5.828 1.00 0.41 C ATOM 1011 CD1 LEU A 52 1.295 15.940 5.373 1.00 0.45 C ATOM 1012 CD2 LEU A 52 2.085 18.197 4.682 1.00 0.41 C ATOM 0 H LEU A 52 3.064 17.270 8.593 1.00 0.42 H new ATOM 0 HA LEU A 52 2.487 19.594 7.049 1.00 0.40 H new ATOM 0 HB2 LEU A 52 0.966 17.053 7.699 1.00 0.40 H new ATOM 0 HB3 LEU A 52 0.335 18.294 6.634 1.00 0.40 H new ATOM 0 HG LEU A 52 3.003 16.945 6.152 1.00 0.41 H new ATOM 0 HD11 LEU A 52 1.839 15.505 4.535 1.00 0.45 H new ATOM 0 HD12 LEU A 52 1.265 15.226 6.196 1.00 0.45 H new ATOM 0 HD13 LEU A 52 0.278 16.178 5.062 1.00 0.45 H new ATOM 0 HD21 LEU A 52 2.615 17.739 3.847 1.00 0.41 H new ATOM 0 HD22 LEU A 52 1.081 18.478 4.365 1.00 0.41 H new ATOM 0 HD23 LEU A 52 2.624 19.086 5.010 1.00 0.41 H new ATOM 1024 N LYS A 53 0.841 19.164 9.866 1.00 0.39 N ATOM 1025 CA LYS A 53 -0.061 19.834 10.804 1.00 0.39 C ATOM 1026 C LYS A 53 0.492 21.183 11.270 1.00 0.40 C ATOM 1027 O LYS A 53 -0.264 22.123 11.512 1.00 0.45 O ATOM 1028 CB LYS A 53 -0.337 18.944 12.018 1.00 0.41 C ATOM 1029 CG LYS A 53 -1.248 17.767 11.719 1.00 0.42 C ATOM 1030 CD LYS A 53 -1.606 17.006 12.982 1.00 0.52 C ATOM 1031 CE LYS A 53 -2.684 15.969 12.717 1.00 0.52 C ATOM 1032 NZ LYS A 53 -3.159 15.332 13.972 1.00 1.22 N ATOM 0 H LYS A 53 1.211 18.273 10.197 1.00 0.39 H new ATOM 0 HA LYS A 53 -0.993 20.019 10.270 1.00 0.39 H new ATOM 0 HB2 LYS A 53 0.610 18.569 12.405 1.00 0.41 H new ATOM 0 HB3 LYS A 53 -0.786 19.549 12.806 1.00 0.41 H new ATOM 0 HG2 LYS A 53 -2.159 18.123 11.237 1.00 0.42 H new ATOM 0 HG3 LYS A 53 -0.757 17.095 11.015 1.00 0.42 H new ATOM 0 HD2 LYS A 53 -0.717 16.516 13.378 1.00 0.52 H new ATOM 0 HD3 LYS A 53 -1.951 17.705 13.744 1.00 0.52 H new ATOM 0 HE2 LYS A 53 -3.525 16.441 12.208 1.00 0.52 H new ATOM 0 HE3 LYS A 53 -2.294 15.203 12.046 1.00 0.52 H new ATOM 0 HZ1 LYS A 53 -4.176 15.128 13.894 1.00 1.22 H new ATOM 0 HZ2 LYS A 53 -2.639 14.445 14.130 1.00 1.22 H new ATOM 0 HZ3 LYS A 53 -2.996 15.976 14.772 1.00 1.22 H new ATOM 1046 N LYS A 54 1.811 21.270 11.391 1.00 0.39 N ATOM 1047 CA LYS A 54 2.458 22.486 11.888 1.00 0.41 C ATOM 1048 C LYS A 54 2.395 23.610 10.862 1.00 0.41 C ATOM 1049 O LYS A 54 2.386 24.787 11.221 1.00 0.47 O ATOM 1050 CB LYS A 54 3.918 22.212 12.261 1.00 0.44 C ATOM 1051 CG LYS A 54 4.097 21.052 13.222 1.00 1.24 C ATOM 1052 CD LYS A 54 3.367 21.288 14.530 1.00 1.63 C ATOM 1053 CE LYS A 54 3.463 20.076 15.442 1.00 2.24 C ATOM 1054 NZ LYS A 54 4.870 19.720 15.760 1.00 3.05 N ATOM 0 H LYS A 54 2.456 20.516 11.153 1.00 0.39 H new ATOM 0 HA LYS A 54 1.914 22.800 12.779 1.00 0.41 H new ATOM 0 HB2 LYS A 54 4.484 22.009 11.352 1.00 0.44 H new ATOM 0 HB3 LYS A 54 4.344 23.111 12.707 1.00 0.44 H new ATOM 0 HG2 LYS A 54 3.728 20.136 12.760 1.00 1.24 H new ATOM 0 HG3 LYS A 54 5.159 20.904 13.420 1.00 1.24 H new ATOM 0 HD2 LYS A 54 3.789 22.158 15.033 1.00 1.63 H new ATOM 0 HD3 LYS A 54 2.319 21.513 14.329 1.00 1.63 H new ATOM 0 HE2 LYS A 54 2.923 20.277 16.367 1.00 2.24 H new ATOM 0 HE3 LYS A 54 2.974 19.226 14.966 1.00 2.24 H new ATOM 0 HZ1 LYS A 54 4.885 19.002 16.512 1.00 3.05 H new ATOM 0 HZ2 LYS A 54 5.333 19.341 14.909 1.00 3.05 H new ATOM 0 HZ3 LYS A 54 5.379 20.568 16.082 1.00 3.05 H new ATOM 1068 N LYS A 55 2.350 23.256 9.592 1.00 0.42 N ATOM 1069 CA LYS A 55 2.292 24.249 8.534 1.00 0.48 C ATOM 1070 C LYS A 55 0.862 24.434 8.043 1.00 0.47 C ATOM 1071 O LYS A 55 0.362 25.556 7.949 1.00 0.58 O ATOM 1072 CB LYS A 55 3.174 23.824 7.374 1.00 0.55 C ATOM 1073 CG LYS A 55 3.267 24.862 6.271 1.00 1.23 C ATOM 1074 CD LYS A 55 4.393 25.857 6.491 1.00 1.16 C ATOM 1075 CE LYS A 55 5.773 25.206 6.477 1.00 1.03 C ATOM 1076 NZ LYS A 55 6.244 24.831 7.837 1.00 1.48 N ATOM 0 H LYS A 55 2.352 22.289 9.267 1.00 0.42 H new ATOM 0 HA LYS A 55 2.650 25.197 8.937 1.00 0.48 H new ATOM 0 HB2 LYS A 55 4.176 23.613 7.748 1.00 0.55 H new ATOM 0 HB3 LYS A 55 2.787 22.895 6.956 1.00 0.55 H new ATOM 0 HG2 LYS A 55 3.415 24.358 5.316 1.00 1.23 H new ATOM 0 HG3 LYS A 55 2.321 25.400 6.204 1.00 1.23 H new ATOM 0 HD2 LYS A 55 4.350 26.623 5.717 1.00 1.16 H new ATOM 0 HD3 LYS A 55 4.244 26.361 7.446 1.00 1.16 H new ATOM 0 HE2 LYS A 55 5.744 24.316 5.849 1.00 1.03 H new ATOM 0 HE3 LYS A 55 6.489 25.892 6.025 1.00 1.03 H new ATOM 0 HZ1 LYS A 55 7.194 25.223 7.996 1.00 1.48 H new ATOM 0 HZ2 LYS A 55 5.589 25.213 8.549 1.00 1.48 H new ATOM 0 HZ3 LYS A 55 6.279 23.795 7.919 1.00 1.48 H new ATOM 1090 N SER A 56 0.212 23.330 7.728 1.00 0.39 N ATOM 1091 CA SER A 56 -1.151 23.357 7.242 1.00 0.39 C ATOM 1092 C SER A 56 -1.993 22.409 8.093 1.00 0.38 C ATOM 1093 O SER A 56 -2.052 21.204 7.840 1.00 0.38 O ATOM 1094 CB SER A 56 -1.199 22.958 5.761 1.00 0.40 C ATOM 1095 OG SER A 56 -2.471 23.230 5.193 1.00 1.16 O ATOM 0 H SER A 56 0.613 22.395 7.802 1.00 0.39 H new ATOM 0 HA SER A 56 -1.554 24.367 7.323 1.00 0.39 H new ATOM 0 HB2 SER A 56 -0.430 23.500 5.211 1.00 0.40 H new ATOM 0 HB3 SER A 56 -0.974 21.896 5.661 1.00 0.40 H new ATOM 0 HG SER A 56 -2.394 23.257 4.216 1.00 1.16 H new ATOM 1101 N PRO A 57 -2.634 22.966 9.139 1.00 0.41 N ATOM 1102 CA PRO A 57 -3.408 22.199 10.127 1.00 0.43 C ATOM 1103 C PRO A 57 -4.401 21.242 9.479 1.00 0.44 C ATOM 1104 O PRO A 57 -4.434 20.047 9.777 1.00 0.45 O ATOM 1105 CB PRO A 57 -4.170 23.288 10.884 1.00 0.48 C ATOM 1106 CG PRO A 57 -3.311 24.495 10.778 1.00 0.58 C ATOM 1107 CD PRO A 57 -2.635 24.409 9.440 1.00 0.45 C ATOM 0 HA PRO A 57 -2.765 21.575 10.748 1.00 0.43 H new ATOM 0 HB2 PRO A 57 -5.152 23.462 10.445 1.00 0.48 H new ATOM 0 HB3 PRO A 57 -4.331 23.007 11.925 1.00 0.48 H new ATOM 0 HG2 PRO A 57 -3.906 25.405 10.856 1.00 0.58 H new ATOM 0 HG3 PRO A 57 -2.578 24.523 11.584 1.00 0.58 H new ATOM 0 HD2 PRO A 57 -3.175 24.976 8.682 1.00 0.45 H new ATOM 0 HD3 PRO A 57 -1.622 24.811 9.477 1.00 0.45 H new ATOM 1115 N GLU A 58 -5.223 21.812 8.598 1.00 0.47 N ATOM 1116 CA GLU A 58 -6.206 21.067 7.821 1.00 0.51 C ATOM 1117 C GLU A 58 -5.553 19.965 6.997 1.00 0.47 C ATOM 1118 O GLU A 58 -6.098 18.869 6.878 1.00 0.47 O ATOM 1119 CB GLU A 58 -6.961 22.034 6.903 1.00 0.65 C ATOM 1120 CG GLU A 58 -7.927 21.366 5.935 1.00 1.44 C ATOM 1121 CD GLU A 58 -9.095 20.702 6.629 1.00 1.92 C ATOM 1122 OE1 GLU A 58 -9.805 21.386 7.399 1.00 2.42 O ATOM 1123 OE2 GLU A 58 -9.308 19.492 6.416 1.00 2.45 O ATOM 0 H GLU A 58 -5.223 22.813 8.404 1.00 0.47 H new ATOM 0 HA GLU A 58 -6.901 20.590 8.512 1.00 0.51 H new ATOM 0 HB2 GLU A 58 -7.516 22.741 7.520 1.00 0.65 H new ATOM 0 HB3 GLU A 58 -6.235 22.612 6.331 1.00 0.65 H new ATOM 0 HG2 GLU A 58 -8.304 22.111 5.234 1.00 1.44 H new ATOM 0 HG3 GLU A 58 -7.388 20.621 5.349 1.00 1.44 H new ATOM 1130 N LEU A 59 -4.372 20.236 6.457 1.00 0.46 N ATOM 1131 CA LEU A 59 -3.739 19.289 5.553 1.00 0.48 C ATOM 1132 C LEU A 59 -3.297 18.080 6.363 1.00 0.43 C ATOM 1133 O LEU A 59 -3.520 16.927 5.989 1.00 0.47 O ATOM 1134 CB LEU A 59 -2.538 19.947 4.869 1.00 0.56 C ATOM 1135 CG LEU A 59 -2.130 19.395 3.498 1.00 0.67 C ATOM 1136 CD1 LEU A 59 -0.896 20.122 3.006 1.00 1.15 C ATOM 1137 CD2 LEU A 59 -1.865 17.902 3.541 1.00 1.42 C ATOM 0 H LEU A 59 -3.841 21.090 6.626 1.00 0.46 H new ATOM 0 HA LEU A 59 -4.439 18.976 4.779 1.00 0.48 H new ATOM 0 HB2 LEU A 59 -2.753 21.010 4.756 1.00 0.56 H new ATOM 0 HB3 LEU A 59 -1.680 19.864 5.537 1.00 0.56 H new ATOM 0 HG LEU A 59 -2.961 19.560 2.812 1.00 0.67 H new ATOM 0 HD11 LEU A 59 -0.607 19.729 2.031 1.00 1.15 H new ATOM 0 HD12 LEU A 59 -1.112 21.187 2.918 1.00 1.15 H new ATOM 0 HD13 LEU A 59 -0.080 19.974 3.714 1.00 1.15 H new ATOM 0 HD21 LEU A 59 -1.579 17.554 2.548 1.00 1.42 H new ATOM 0 HD22 LEU A 59 -1.058 17.696 4.244 1.00 1.42 H new ATOM 0 HD23 LEU A 59 -2.767 17.381 3.862 1.00 1.42 H new ATOM 1149 N GLY A 60 -2.675 18.382 7.500 1.00 0.37 N ATOM 1150 CA GLY A 60 -2.220 17.354 8.406 1.00 0.36 C ATOM 1151 C GLY A 60 -3.371 16.555 8.975 1.00 0.35 C ATOM 1152 O GLY A 60 -3.232 15.368 9.253 1.00 0.36 O ATOM 0 H GLY A 60 -2.479 19.334 7.808 1.00 0.37 H new ATOM 0 HA2 GLY A 60 -1.537 16.685 7.883 1.00 0.36 H new ATOM 0 HA3 GLY A 60 -1.657 17.811 9.220 1.00 0.36 H new ATOM 1156 N ALA A 61 -4.509 17.210 9.156 1.00 0.37 N ATOM 1157 CA ALA A 61 -5.712 16.533 9.610 1.00 0.42 C ATOM 1158 C ALA A 61 -6.219 15.570 8.542 1.00 0.44 C ATOM 1159 O ALA A 61 -6.716 14.486 8.854 1.00 0.48 O ATOM 1160 CB ALA A 61 -6.785 17.546 9.971 1.00 0.45 C ATOM 0 H ALA A 61 -4.623 18.211 8.995 1.00 0.37 H new ATOM 0 HA ALA A 61 -5.469 15.956 10.502 1.00 0.42 H new ATOM 0 HB1 ALA A 61 -7.680 17.023 10.309 1.00 0.45 H new ATOM 0 HB2 ALA A 61 -6.420 18.194 10.768 1.00 0.45 H new ATOM 0 HB3 ALA A 61 -7.026 18.149 9.095 1.00 0.45 H new ATOM 1166 N LYS A 62 -6.087 15.972 7.283 1.00 0.45 N ATOM 1167 CA LYS A 62 -6.481 15.124 6.165 1.00 0.50 C ATOM 1168 C LYS A 62 -5.649 13.851 6.132 1.00 0.54 C ATOM 1169 O LYS A 62 -6.198 12.748 6.102 1.00 0.69 O ATOM 1170 CB LYS A 62 -6.345 15.864 4.832 1.00 0.53 C ATOM 1171 CG LYS A 62 -7.358 16.975 4.645 1.00 0.90 C ATOM 1172 CD LYS A 62 -7.286 17.563 3.246 1.00 1.25 C ATOM 1173 CE LYS A 62 -8.390 18.580 3.025 1.00 1.51 C ATOM 1174 NZ LYS A 62 -8.412 19.100 1.633 1.00 2.17 N ATOM 0 H LYS A 62 -5.710 16.880 7.011 1.00 0.45 H new ATOM 0 HA LYS A 62 -7.529 14.860 6.310 1.00 0.50 H new ATOM 0 HB2 LYS A 62 -5.342 16.284 4.760 1.00 0.53 H new ATOM 0 HB3 LYS A 62 -6.450 15.148 4.017 1.00 0.53 H new ATOM 0 HG2 LYS A 62 -8.361 16.589 4.828 1.00 0.90 H new ATOM 0 HG3 LYS A 62 -7.179 17.759 5.380 1.00 0.90 H new ATOM 0 HD2 LYS A 62 -6.316 18.036 3.096 1.00 1.25 H new ATOM 0 HD3 LYS A 62 -7.369 16.765 2.508 1.00 1.25 H new ATOM 0 HE2 LYS A 62 -9.353 18.123 3.254 1.00 1.51 H new ATOM 0 HE3 LYS A 62 -8.259 19.411 3.718 1.00 1.51 H new ATOM 0 HZ1 LYS A 62 -8.998 19.958 1.592 1.00 2.17 H new ATOM 0 HZ2 LYS A 62 -7.443 19.328 1.332 1.00 2.17 H new ATOM 0 HZ3 LYS A 62 -8.810 18.378 0.999 1.00 2.17 H new ATOM 1188 N VAL A 63 -4.329 14.005 6.147 1.00 0.45 N ATOM 1189 CA VAL A 63 -3.433 12.859 6.103 1.00 0.48 C ATOM 1190 C VAL A 63 -3.529 12.030 7.390 1.00 0.46 C ATOM 1191 O VAL A 63 -3.320 10.819 7.368 1.00 0.53 O ATOM 1192 CB VAL A 63 -1.972 13.293 5.853 1.00 0.48 C ATOM 1193 CG1 VAL A 63 -1.460 14.135 7.000 1.00 1.12 C ATOM 1194 CG2 VAL A 63 -1.071 12.088 5.614 1.00 1.12 C ATOM 0 H VAL A 63 -3.859 14.909 6.189 1.00 0.45 H new ATOM 0 HA VAL A 63 -3.749 12.235 5.267 1.00 0.48 H new ATOM 0 HB VAL A 63 -1.953 13.903 4.950 1.00 0.48 H new ATOM 0 HG11 VAL A 63 -0.429 14.430 6.803 1.00 1.12 H new ATOM 0 HG12 VAL A 63 -2.079 15.026 7.102 1.00 1.12 H new ATOM 0 HG13 VAL A 63 -1.502 13.557 7.923 1.00 1.12 H new ATOM 0 HG21 VAL A 63 -0.049 12.426 5.441 1.00 1.12 H new ATOM 0 HG22 VAL A 63 -1.095 11.437 6.488 1.00 1.12 H new ATOM 0 HG23 VAL A 63 -1.423 11.538 4.742 1.00 1.12 H new ATOM 1198 N GLU A 64 -3.866 12.684 8.501 1.00 0.41 N ATOM 1199 CA GLU A 64 -4.007 11.995 9.782 1.00 0.42 C ATOM 1200 C GLU A 64 -5.116 10.961 9.699 1.00 0.50 C ATOM 1201 O GLU A 64 -4.870 9.762 9.859 1.00 0.55 O ATOM 1202 CB GLU A 64 -4.296 12.994 10.914 1.00 0.42 C ATOM 1203 CG GLU A 64 -4.043 12.449 12.320 1.00 0.53 C ATOM 1204 CD GLU A 64 -5.207 11.666 12.907 1.00 1.11 C ATOM 1205 OE1 GLU A 64 -5.300 10.443 12.655 1.00 1.70 O ATOM 1206 OE2 GLU A 64 -6.054 12.269 13.594 1.00 1.66 O ATOM 0 H GLU A 64 -4.046 13.687 8.539 1.00 0.41 H new ATOM 0 HA GLU A 64 -3.067 11.491 10.005 1.00 0.42 H new ATOM 0 HB2 GLU A 64 -3.680 13.881 10.765 1.00 0.42 H new ATOM 0 HB3 GLU A 64 -5.336 13.313 10.843 1.00 0.42 H new ATOM 0 HG2 GLU A 64 -3.164 11.805 12.295 1.00 0.53 H new ATOM 0 HG3 GLU A 64 -3.809 13.282 12.983 1.00 0.53 H new ATOM 1213 N LYS A 65 -6.329 11.422 9.405 1.00 0.58 N ATOM 1214 CA LYS A 65 -7.480 10.534 9.377 1.00 0.69 C ATOM 1215 C LYS A 65 -7.309 9.504 8.275 1.00 0.71 C ATOM 1216 O LYS A 65 -7.663 8.337 8.431 1.00 0.76 O ATOM 1217 CB LYS A 65 -8.775 11.325 9.166 1.00 0.84 C ATOM 1218 CG LYS A 65 -9.014 12.396 10.216 1.00 1.92 C ATOM 1219 CD LYS A 65 -8.908 11.828 11.619 1.00 2.40 C ATOM 1220 CE LYS A 65 -9.121 12.895 12.675 1.00 3.23 C ATOM 1221 NZ LYS A 65 -8.786 12.390 14.029 1.00 3.96 N ATOM 0 H LYS A 65 -6.536 12.396 9.185 1.00 0.58 H new ATOM 0 HA LYS A 65 -7.547 10.024 10.338 1.00 0.69 H new ATOM 0 HB2 LYS A 65 -8.748 11.793 8.182 1.00 0.84 H new ATOM 0 HB3 LYS A 65 -9.617 10.633 9.167 1.00 0.84 H new ATOM 0 HG2 LYS A 65 -8.288 13.199 10.091 1.00 1.92 H new ATOM 0 HG3 LYS A 65 -10.002 12.834 10.073 1.00 1.92 H new ATOM 0 HD2 LYS A 65 -9.646 11.037 11.748 1.00 2.40 H new ATOM 0 HD3 LYS A 65 -7.927 11.373 11.754 1.00 2.40 H new ATOM 0 HE2 LYS A 65 -8.504 13.764 12.446 1.00 3.23 H new ATOM 0 HE3 LYS A 65 -10.159 13.227 12.655 1.00 3.23 H new ATOM 0 HZ1 LYS A 65 -9.217 13.008 14.746 1.00 3.96 H new ATOM 0 HZ2 LYS A 65 -9.153 11.423 14.139 1.00 3.96 H new ATOM 0 HZ3 LYS A 65 -7.753 12.385 14.152 1.00 3.96 H new ATOM 1235 N LEU A 66 -6.723 9.955 7.174 1.00 0.72 N ATOM 1236 CA LEU A 66 -6.492 9.115 6.011 1.00 0.80 C ATOM 1237 C LEU A 66 -5.544 7.976 6.352 1.00 0.76 C ATOM 1238 O LEU A 66 -5.730 6.838 5.918 1.00 1.07 O ATOM 1239 CB LEU A 66 -5.885 9.951 4.886 1.00 0.84 C ATOM 1240 CG LEU A 66 -5.677 9.222 3.568 1.00 0.77 C ATOM 1241 CD1 LEU A 66 -6.982 9.127 2.813 1.00 1.50 C ATOM 1242 CD2 LEU A 66 -4.628 9.923 2.730 1.00 1.37 C ATOM 0 H LEU A 66 -6.395 10.915 7.064 1.00 0.72 H new ATOM 0 HA LEU A 66 -7.447 8.698 5.692 1.00 0.80 H new ATOM 0 HB2 LEU A 66 -6.530 10.811 4.707 1.00 0.84 H new ATOM 0 HB3 LEU A 66 -4.923 10.338 5.223 1.00 0.84 H new ATOM 0 HG LEU A 66 -5.324 8.213 3.782 1.00 0.77 H new ATOM 0 HD11 LEU A 66 -6.820 8.603 1.871 1.00 1.50 H new ATOM 0 HD12 LEU A 66 -7.710 8.580 3.412 1.00 1.50 H new ATOM 0 HD13 LEU A 66 -7.359 10.129 2.610 1.00 1.50 H new ATOM 0 HD21 LEU A 66 -4.494 9.386 1.791 1.00 1.37 H new ATOM 0 HD22 LEU A 66 -4.951 10.943 2.522 1.00 1.37 H new ATOM 0 HD23 LEU A 66 -3.683 9.945 3.273 1.00 1.37 H new ATOM 1254 N HIS A 67 -4.549 8.282 7.157 1.00 0.52 N ATOM 1255 CA HIS A 67 -3.521 7.319 7.477 1.00 0.55 C ATOM 1256 C HIS A 67 -4.011 6.398 8.573 1.00 0.44 C ATOM 1257 O HIS A 67 -3.671 5.223 8.606 1.00 0.45 O ATOM 1258 CB HIS A 67 -2.241 8.033 7.900 1.00 0.67 C ATOM 1259 CG HIS A 67 -1.110 7.102 8.199 1.00 0.94 C ATOM 1260 ND1 HIS A 67 -0.641 6.866 9.475 1.00 1.62 N ATOM 1261 CD2 HIS A 67 -0.359 6.340 7.377 1.00 1.85 C ATOM 1262 CE1 HIS A 67 0.352 5.997 9.419 1.00 2.13 C ATOM 1263 NE2 HIS A 67 0.539 5.661 8.158 1.00 2.34 N ATOM 0 H HIS A 67 -4.431 9.192 7.602 1.00 0.52 H new ATOM 0 HA HIS A 67 -3.298 6.722 6.592 1.00 0.55 H new ATOM 0 HB2 HIS A 67 -1.938 8.718 7.108 1.00 0.67 H new ATOM 0 HB3 HIS A 67 -2.447 8.638 8.783 1.00 0.67 H new ATOM 0 HD1 HIS A 67 -1.004 7.295 10.327 1.00 1.62 H new ATOM 0 HD2 HIS A 67 -0.449 6.277 6.303 1.00 1.85 H new ATOM 0 HE1 HIS A 67 0.915 5.625 10.262 1.00 2.13 H new ATOM 1272 N ALA A 68 -4.819 6.954 9.455 1.00 0.39 N ATOM 1273 CA ALA A 68 -5.431 6.205 10.535 1.00 0.36 C ATOM 1274 C ALA A 68 -6.358 5.113 9.995 1.00 0.34 C ATOM 1275 O ALA A 68 -6.439 4.027 10.566 1.00 0.37 O ATOM 1276 CB ALA A 68 -6.204 7.167 11.414 1.00 0.40 C ATOM 0 H ALA A 68 -5.070 7.942 9.442 1.00 0.39 H new ATOM 0 HA ALA A 68 -4.652 5.713 11.117 1.00 0.36 H new ATOM 0 HB1 ALA A 68 -6.671 6.618 12.232 1.00 0.40 H new ATOM 0 HB2 ALA A 68 -5.524 7.915 11.821 1.00 0.40 H new ATOM 0 HB3 ALA A 68 -6.975 7.661 10.823 1.00 0.40 H new ATOM 1282 N MET A 69 -7.058 5.404 8.896 1.00 0.33 N ATOM 1283 CA MET A 69 -7.920 4.407 8.251 1.00 0.37 C ATOM 1284 C MET A 69 -7.080 3.247 7.744 1.00 0.37 C ATOM 1285 O MET A 69 -7.331 2.087 8.071 1.00 0.42 O ATOM 1286 CB MET A 69 -8.687 5.009 7.073 1.00 0.46 C ATOM 1287 CG MET A 69 -9.540 6.212 7.430 1.00 0.44 C ATOM 1288 SD MET A 69 -10.509 6.812 6.029 1.00 0.72 S ATOM 1289 CE MET A 69 -9.293 6.745 4.712 1.00 0.55 C ATOM 0 H MET A 69 -7.046 6.314 8.436 1.00 0.33 H new ATOM 0 HA MET A 69 -8.636 4.060 8.996 1.00 0.37 H new ATOM 0 HB2 MET A 69 -7.974 5.300 6.302 1.00 0.46 H new ATOM 0 HB3 MET A 69 -9.327 4.240 6.641 1.00 0.46 H new ATOM 0 HG2 MET A 69 -10.212 5.947 8.246 1.00 0.44 H new ATOM 0 HG3 MET A 69 -8.898 7.014 7.794 1.00 0.44 H new ATOM 0 HE1 MET A 69 -9.529 7.498 3.960 1.00 0.55 H new ATOM 0 HE2 MET A 69 -8.302 6.940 5.122 1.00 0.55 H new ATOM 0 HE3 MET A 69 -9.308 5.756 4.253 1.00 0.55 H new ATOM 1299 N VAL A 70 -6.073 3.582 6.945 1.00 0.36 N ATOM 1300 CA VAL A 70 -5.114 2.618 6.443 1.00 0.39 C ATOM 1301 C VAL A 70 -4.482 1.855 7.602 1.00 0.38 C ATOM 1302 O VAL A 70 -4.292 0.638 7.549 1.00 0.38 O ATOM 1303 CB VAL A 70 -4.017 3.354 5.647 1.00 0.42 C ATOM 1304 CG1 VAL A 70 -2.939 2.398 5.180 1.00 0.79 C ATOM 1305 CG2 VAL A 70 -4.632 4.094 4.468 1.00 0.70 C ATOM 0 H VAL A 70 -5.902 4.537 6.628 1.00 0.36 H new ATOM 0 HA VAL A 70 -5.626 1.910 5.792 1.00 0.39 H new ATOM 0 HB VAL A 70 -3.546 4.080 6.309 1.00 0.42 H new ATOM 0 HG11 VAL A 70 -2.181 2.948 4.622 1.00 0.79 H new ATOM 0 HG12 VAL A 70 -2.478 1.920 6.044 1.00 0.79 H new ATOM 0 HG13 VAL A 70 -3.381 1.637 4.537 1.00 0.79 H new ATOM 0 HG21 VAL A 70 -3.848 4.610 3.913 1.00 0.70 H new ATOM 0 HG22 VAL A 70 -5.132 3.381 3.812 1.00 0.70 H new ATOM 0 HG23 VAL A 70 -5.357 4.821 4.833 1.00 0.70 H new ATOM 1309 N LYS A 71 -4.189 2.593 8.655 1.00 0.40 N ATOM 1310 CA LYS A 71 -3.569 2.050 9.848 1.00 0.43 C ATOM 1311 C LYS A 71 -4.498 1.066 10.554 1.00 0.44 C ATOM 1312 O LYS A 71 -4.047 0.034 11.036 1.00 0.45 O ATOM 1313 CB LYS A 71 -3.200 3.195 10.783 1.00 0.48 C ATOM 1314 CG LYS A 71 -2.410 2.782 11.997 1.00 1.22 C ATOM 1315 CD LYS A 71 -0.980 2.460 11.630 1.00 1.30 C ATOM 1316 CE LYS A 71 -0.149 2.299 12.876 1.00 0.75 C ATOM 1317 NZ LYS A 71 1.295 2.181 12.563 1.00 1.47 N ATOM 0 H LYS A 71 -4.376 3.594 8.707 1.00 0.40 H new ATOM 0 HA LYS A 71 -2.670 1.505 9.561 1.00 0.43 H new ATOM 0 HB2 LYS A 71 -2.624 3.932 10.224 1.00 0.48 H new ATOM 0 HB3 LYS A 71 -4.115 3.688 11.111 1.00 0.48 H new ATOM 0 HG2 LYS A 71 -2.428 3.583 12.736 1.00 1.22 H new ATOM 0 HG3 LYS A 71 -2.875 1.911 12.459 1.00 1.22 H new ATOM 0 HD2 LYS A 71 -0.945 1.544 11.040 1.00 1.30 H new ATOM 0 HD3 LYS A 71 -0.568 3.255 11.009 1.00 1.30 H new ATOM 0 HE2 LYS A 71 -0.310 3.154 13.533 1.00 0.75 H new ATOM 0 HE3 LYS A 71 -0.477 1.413 13.420 1.00 0.75 H new ATOM 0 HZ1 LYS A 71 1.834 2.072 13.446 1.00 1.47 H new ATOM 0 HZ2 LYS A 71 1.452 1.351 11.957 1.00 1.47 H new ATOM 0 HZ3 LYS A 71 1.614 3.038 12.067 1.00 1.47 H new ATOM 1331 N SER A 72 -5.782 1.392 10.619 1.00 0.45 N ATOM 1332 CA SER A 72 -6.769 0.500 11.222 1.00 0.49 C ATOM 1333 C SER A 72 -6.768 -0.861 10.522 1.00 0.45 C ATOM 1334 O SER A 72 -6.903 -1.902 11.166 1.00 0.49 O ATOM 1335 CB SER A 72 -8.162 1.133 11.165 1.00 0.56 C ATOM 1336 OG SER A 72 -8.178 2.389 11.830 1.00 1.26 O ATOM 0 H SER A 72 -6.167 2.267 10.262 1.00 0.45 H new ATOM 0 HA SER A 72 -6.500 0.345 12.267 1.00 0.49 H new ATOM 0 HB2 SER A 72 -8.464 1.264 10.126 1.00 0.56 H new ATOM 0 HB3 SER A 72 -8.889 0.464 11.626 1.00 0.56 H new ATOM 0 HG SER A 72 -7.679 3.046 11.301 1.00 1.26 H new ATOM 1342 N LYS A 73 -6.589 -0.834 9.206 1.00 0.39 N ATOM 1343 CA LYS A 73 -6.491 -2.052 8.409 1.00 0.38 C ATOM 1344 C LYS A 73 -5.207 -2.809 8.752 1.00 0.33 C ATOM 1345 O LYS A 73 -5.232 -4.014 8.974 1.00 0.38 O ATOM 1346 CB LYS A 73 -6.510 -1.714 6.915 1.00 0.44 C ATOM 1347 CG LYS A 73 -7.648 -0.797 6.495 1.00 0.62 C ATOM 1348 CD LYS A 73 -7.470 -0.336 5.056 1.00 0.78 C ATOM 1349 CE LYS A 73 -8.572 0.613 4.620 1.00 0.88 C ATOM 1350 NZ LYS A 73 -9.905 -0.041 4.624 1.00 1.54 N ATOM 0 H LYS A 73 -6.508 0.026 8.664 1.00 0.39 H new ATOM 0 HA LYS A 73 -7.348 -2.684 8.640 1.00 0.38 H new ATOM 0 HB2 LYS A 73 -5.563 -1.244 6.649 1.00 0.44 H new ATOM 0 HB3 LYS A 73 -6.577 -2.641 6.346 1.00 0.44 H new ATOM 0 HG2 LYS A 73 -8.599 -1.320 6.599 1.00 0.62 H new ATOM 0 HG3 LYS A 73 -7.686 0.069 7.156 1.00 0.62 H new ATOM 0 HD2 LYS A 73 -6.504 0.158 4.951 1.00 0.78 H new ATOM 0 HD3 LYS A 73 -7.458 -1.204 4.397 1.00 0.78 H new ATOM 0 HE2 LYS A 73 -8.590 1.477 5.285 1.00 0.88 H new ATOM 0 HE3 LYS A 73 -8.354 0.986 3.619 1.00 0.88 H new ATOM 0 HZ1 LYS A 73 -10.599 0.582 4.163 1.00 1.54 H new ATOM 0 HZ2 LYS A 73 -9.851 -0.942 4.107 1.00 1.54 H new ATOM 0 HZ3 LYS A 73 -10.200 -0.222 5.605 1.00 1.54 H new ATOM 1364 N ILE A 74 -4.096 -2.093 8.812 1.00 0.28 N ATOM 1365 CA ILE A 74 -2.803 -2.696 9.127 1.00 0.28 C ATOM 1366 C ILE A 74 -2.738 -3.169 10.584 1.00 0.28 C ATOM 1367 O ILE A 74 -2.051 -4.139 10.906 1.00 0.30 O ATOM 1368 CB ILE A 74 -1.662 -1.709 8.804 1.00 0.30 C ATOM 1369 CG1 ILE A 74 -1.577 -1.560 7.286 1.00 0.30 C ATOM 1370 CG2 ILE A 74 -0.335 -2.176 9.381 1.00 0.34 C ATOM 1371 CD1 ILE A 74 -0.584 -0.535 6.802 1.00 0.32 C ATOM 0 H ILE A 74 -4.060 -1.087 8.646 1.00 0.28 H new ATOM 0 HA ILE A 74 -2.680 -3.581 8.502 1.00 0.28 H new ATOM 0 HB ILE A 74 -1.876 -0.744 9.264 1.00 0.30 H new ATOM 0 HG12 ILE A 74 -1.318 -2.527 6.855 1.00 0.30 H new ATOM 0 HG13 ILE A 74 -2.564 -1.296 6.906 1.00 0.30 H new ATOM 0 HG21 ILE A 74 0.444 -1.455 9.133 1.00 0.34 H new ATOM 0 HG22 ILE A 74 -0.419 -2.261 10.464 1.00 0.34 H new ATOM 0 HG23 ILE A 74 -0.077 -3.148 8.960 1.00 0.34 H new ATOM 0 HD11 ILE A 74 -0.596 -0.502 5.713 1.00 0.32 H new ATOM 0 HD12 ILE A 74 -0.851 0.445 7.197 1.00 0.32 H new ATOM 0 HD13 ILE A 74 0.415 -0.805 7.145 1.00 0.32 H new ATOM 1378 N ALA A 75 -3.478 -2.498 11.454 1.00 0.31 N ATOM 1379 CA ALA A 75 -3.599 -2.921 12.845 1.00 0.32 C ATOM 1380 C ALA A 75 -4.331 -4.252 12.921 1.00 0.32 C ATOM 1381 O ALA A 75 -3.996 -5.125 13.721 1.00 0.35 O ATOM 1382 CB ALA A 75 -4.348 -1.875 13.652 1.00 0.34 C ATOM 0 H ALA A 75 -4.006 -1.656 11.223 1.00 0.31 H new ATOM 0 HA ALA A 75 -2.599 -3.037 13.262 1.00 0.32 H new ATOM 0 HB1 ALA A 75 -4.430 -2.205 14.688 1.00 0.34 H new ATOM 0 HB2 ALA A 75 -3.807 -0.930 13.614 1.00 0.34 H new ATOM 0 HB3 ALA A 75 -5.346 -1.739 13.234 1.00 0.34 H new ATOM 1388 N ALA A 76 -5.319 -4.393 12.050 1.00 0.31 N ATOM 1389 CA ALA A 76 -6.136 -5.592 11.966 1.00 0.32 C ATOM 1390 C ALA A 76 -5.469 -6.653 11.095 1.00 0.34 C ATOM 1391 O ALA A 76 -5.985 -7.759 10.935 1.00 0.49 O ATOM 1392 CB ALA A 76 -7.501 -5.231 11.398 1.00 0.35 C ATOM 0 H ALA A 76 -5.578 -3.672 11.377 1.00 0.31 H new ATOM 0 HA ALA A 76 -6.252 -6.007 12.967 1.00 0.32 H new ATOM 0 HB1 ALA A 76 -8.117 -6.128 11.333 1.00 0.35 H new ATOM 0 HB2 ALA A 76 -7.986 -4.504 12.050 1.00 0.35 H new ATOM 0 HB3 ALA A 76 -7.379 -4.802 10.403 1.00 0.35 H new ATOM 1398 N LEU A 77 -4.310 -6.316 10.548 1.00 0.34 N ATOM 1399 CA LEU A 77 -3.604 -7.199 9.643 1.00 0.31 C ATOM 1400 C LEU A 77 -2.609 -8.047 10.420 1.00 0.32 C ATOM 1401 O LEU A 77 -1.899 -7.539 11.292 1.00 0.33 O ATOM 1402 CB LEU A 77 -2.888 -6.358 8.583 1.00 0.30 C ATOM 1403 CG LEU A 77 -2.443 -7.089 7.316 1.00 0.38 C ATOM 1404 CD1 LEU A 77 -3.547 -8.004 6.810 1.00 0.71 C ATOM 1405 CD2 LEU A 77 -2.087 -6.067 6.253 1.00 0.58 C ATOM 0 H LEU A 77 -3.839 -5.428 10.720 1.00 0.34 H new ATOM 0 HA LEU A 77 -4.309 -7.868 9.150 1.00 0.31 H new ATOM 0 HB2 LEU A 77 -3.549 -5.542 8.291 1.00 0.30 H new ATOM 0 HB3 LEU A 77 -2.009 -5.907 9.043 1.00 0.30 H new ATOM 0 HG LEU A 77 -1.571 -7.702 7.544 1.00 0.38 H new ATOM 0 HD11 LEU A 77 -3.211 -8.515 5.908 1.00 0.71 H new ATOM 0 HD12 LEU A 77 -3.788 -8.741 7.576 1.00 0.71 H new ATOM 0 HD13 LEU A 77 -4.434 -7.413 6.583 1.00 0.71 H new ATOM 0 HD21 LEU A 77 -1.769 -6.581 5.346 1.00 0.58 H new ATOM 0 HD22 LEU A 77 -2.959 -5.451 6.034 1.00 0.58 H new ATOM 0 HD23 LEU A 77 -1.277 -5.433 6.614 1.00 0.58 H new ATOM 1417 N GLY A 78 -2.578 -9.338 10.120 1.00 0.36 N ATOM 1418 CA GLY A 78 -1.664 -10.232 10.802 1.00 0.42 C ATOM 1419 C GLY A 78 -0.220 -9.922 10.470 1.00 0.46 C ATOM 1420 O GLY A 78 0.059 -9.437 9.378 1.00 0.76 O ATOM 0 H GLY A 78 -3.169 -9.782 9.417 1.00 0.36 H new ATOM 0 HA2 GLY A 78 -1.814 -10.153 11.879 1.00 0.42 H new ATOM 0 HA3 GLY A 78 -1.888 -11.262 10.524 1.00 0.42 H new ATOM 1424 N PRO A 79 0.712 -10.183 11.407 1.00 0.66 N ATOM 1425 CA PRO A 79 2.152 -9.927 11.241 1.00 0.86 C ATOM 1426 C PRO A 79 2.695 -10.241 9.843 1.00 0.60 C ATOM 1427 O PRO A 79 3.572 -9.531 9.344 1.00 0.64 O ATOM 1428 CB PRO A 79 2.770 -10.877 12.260 1.00 1.32 C ATOM 1429 CG PRO A 79 1.781 -10.926 13.371 1.00 1.56 C ATOM 1430 CD PRO A 79 0.421 -10.743 12.741 1.00 1.10 C ATOM 0 HA PRO A 79 2.382 -8.871 11.379 1.00 0.86 H new ATOM 0 HB2 PRO A 79 2.935 -11.866 11.832 1.00 1.32 H new ATOM 0 HB3 PRO A 79 3.738 -10.514 12.606 1.00 1.32 H new ATOM 0 HG2 PRO A 79 1.839 -11.877 13.900 1.00 1.56 H new ATOM 0 HG3 PRO A 79 1.979 -10.142 14.102 1.00 1.56 H new ATOM 0 HD2 PRO A 79 -0.114 -11.690 12.667 1.00 1.10 H new ATOM 0 HD3 PRO A 79 -0.203 -10.069 13.328 1.00 1.10 H new ATOM 1438 N GLU A 80 2.175 -11.295 9.218 1.00 0.51 N ATOM 1439 CA GLU A 80 2.635 -11.706 7.901 1.00 0.49 C ATOM 1440 C GLU A 80 2.327 -10.617 6.889 1.00 0.42 C ATOM 1441 O GLU A 80 3.219 -10.091 6.223 1.00 0.49 O ATOM 1442 CB GLU A 80 1.954 -13.016 7.484 1.00 0.70 C ATOM 1443 CG GLU A 80 2.444 -13.588 6.161 1.00 1.25 C ATOM 1444 CD GLU A 80 3.825 -14.197 6.260 1.00 1.79 C ATOM 1445 OE1 GLU A 80 3.936 -15.354 6.724 1.00 2.52 O ATOM 1446 OE2 GLU A 80 4.809 -13.533 5.878 1.00 2.19 O ATOM 0 H GLU A 80 1.434 -11.878 9.606 1.00 0.51 H new ATOM 0 HA GLU A 80 3.712 -11.869 7.938 1.00 0.49 H new ATOM 0 HB2 GLU A 80 2.111 -13.758 8.267 1.00 0.70 H new ATOM 0 HB3 GLU A 80 0.879 -12.847 7.417 1.00 0.70 H new ATOM 0 HG2 GLU A 80 1.741 -14.347 5.816 1.00 1.25 H new ATOM 0 HG3 GLU A 80 2.454 -12.798 5.410 1.00 1.25 H new ATOM 1453 N ALA A 81 1.060 -10.250 6.811 1.00 0.36 N ATOM 1454 CA ALA A 81 0.626 -9.287 5.815 1.00 0.34 C ATOM 1455 C ALA A 81 0.922 -7.866 6.272 1.00 0.31 C ATOM 1456 O ALA A 81 1.174 -6.980 5.461 1.00 0.32 O ATOM 1457 CB ALA A 81 -0.843 -9.478 5.496 1.00 0.36 C ATOM 0 H ALA A 81 0.320 -10.600 7.419 1.00 0.36 H new ATOM 0 HA ALA A 81 1.189 -9.458 4.897 1.00 0.34 H new ATOM 0 HB1 ALA A 81 -1.151 -8.748 4.748 1.00 0.36 H new ATOM 0 HB2 ALA A 81 -1.003 -10.484 5.109 1.00 0.36 H new ATOM 0 HB3 ALA A 81 -1.433 -9.340 6.402 1.00 0.36 H new ATOM 1463 N LYS A 82 0.904 -7.671 7.583 1.00 0.31 N ATOM 1464 CA LYS A 82 1.226 -6.389 8.198 1.00 0.33 C ATOM 1465 C LYS A 82 2.660 -5.981 7.883 1.00 0.33 C ATOM 1466 O LYS A 82 2.943 -4.806 7.632 1.00 0.32 O ATOM 1467 CB LYS A 82 1.010 -6.485 9.711 1.00 0.41 C ATOM 1468 CG LYS A 82 1.510 -5.290 10.502 1.00 0.60 C ATOM 1469 CD LYS A 82 1.052 -5.373 11.947 1.00 0.86 C ATOM 1470 CE LYS A 82 1.772 -4.373 12.832 1.00 1.33 C ATOM 1471 NZ LYS A 82 1.615 -2.973 12.355 1.00 2.04 N ATOM 0 H LYS A 82 0.665 -8.401 8.254 1.00 0.31 H new ATOM 0 HA LYS A 82 0.568 -5.622 7.789 1.00 0.33 H new ATOM 0 HB2 LYS A 82 -0.055 -6.611 9.905 1.00 0.41 H new ATOM 0 HB3 LYS A 82 1.509 -7.381 10.079 1.00 0.41 H new ATOM 0 HG2 LYS A 82 2.599 -5.251 10.462 1.00 0.60 H new ATOM 0 HG3 LYS A 82 1.141 -4.369 10.051 1.00 0.60 H new ATOM 0 HD2 LYS A 82 -0.022 -5.194 11.997 1.00 0.86 H new ATOM 0 HD3 LYS A 82 1.225 -6.381 12.324 1.00 0.86 H new ATOM 0 HE2 LYS A 82 1.389 -4.452 13.850 1.00 1.33 H new ATOM 0 HE3 LYS A 82 2.832 -4.624 12.870 1.00 1.33 H new ATOM 0 HZ1 LYS A 82 2.167 -2.335 12.964 1.00 2.04 H new ATOM 0 HZ2 LYS A 82 1.957 -2.899 11.376 1.00 2.04 H new ATOM 0 HZ3 LYS A 82 0.611 -2.704 12.392 1.00 2.04 H new ATOM 1485 N GLY A 83 3.565 -6.952 7.883 1.00 0.37 N ATOM 1486 CA GLY A 83 4.943 -6.676 7.527 1.00 0.41 C ATOM 1487 C GLY A 83 5.067 -6.260 6.079 1.00 0.39 C ATOM 1488 O GLY A 83 5.833 -5.360 5.743 1.00 0.41 O ATOM 0 H GLY A 83 3.369 -7.924 8.123 1.00 0.37 H new ATOM 0 HA2 GLY A 83 5.335 -5.887 8.169 1.00 0.41 H new ATOM 0 HA3 GLY A 83 5.551 -7.563 7.705 1.00 0.41 H new ATOM 1492 N PHE A 84 4.310 -6.925 5.221 1.00 0.37 N ATOM 1493 CA PHE A 84 4.267 -6.582 3.808 1.00 0.37 C ATOM 1494 C PHE A 84 3.608 -5.221 3.589 1.00 0.34 C ATOM 1495 O PHE A 84 4.159 -4.375 2.898 1.00 0.37 O ATOM 1496 CB PHE A 84 3.521 -7.660 3.020 1.00 0.39 C ATOM 1497 CG PHE A 84 3.170 -7.252 1.616 1.00 0.74 C ATOM 1498 CD1 PHE A 84 4.161 -6.977 0.689 1.00 0.71 C ATOM 1499 CD2 PHE A 84 1.845 -7.138 1.230 1.00 1.22 C ATOM 1500 CE1 PHE A 84 3.834 -6.594 -0.596 1.00 1.13 C ATOM 1501 CE2 PHE A 84 1.515 -6.760 -0.054 1.00 1.65 C ATOM 1502 CZ PHE A 84 2.510 -6.485 -0.968 1.00 1.59 C ATOM 0 H PHE A 84 3.713 -7.710 5.481 1.00 0.37 H new ATOM 0 HA PHE A 84 5.294 -6.524 3.447 1.00 0.37 H new ATOM 0 HB2 PHE A 84 4.134 -8.560 2.984 1.00 0.39 H new ATOM 0 HB3 PHE A 84 2.606 -7.919 3.553 1.00 0.39 H new ATOM 0 HD1 PHE A 84 5.199 -7.063 0.974 1.00 0.71 H new ATOM 0 HD2 PHE A 84 1.061 -7.348 1.943 1.00 1.22 H new ATOM 0 HE1 PHE A 84 4.615 -6.380 -1.311 1.00 1.13 H new ATOM 0 HE2 PHE A 84 0.478 -6.679 -0.344 1.00 1.65 H new ATOM 0 HZ PHE A 84 2.253 -6.185 -1.973 1.00 1.59 H new ATOM 1512 N ALA A 85 2.438 -5.022 4.184 1.00 0.30 N ATOM 1513 CA ALA A 85 1.658 -3.798 3.994 1.00 0.30 C ATOM 1514 C ALA A 85 2.481 -2.547 4.276 1.00 0.32 C ATOM 1515 O ALA A 85 2.564 -1.645 3.446 1.00 0.41 O ATOM 1516 CB ALA A 85 0.432 -3.818 4.890 1.00 0.28 C ATOM 0 H ALA A 85 2.002 -5.699 4.810 1.00 0.30 H new ATOM 0 HA ALA A 85 1.351 -3.765 2.949 1.00 0.30 H new ATOM 0 HB1 ALA A 85 -0.142 -2.903 4.742 1.00 0.28 H new ATOM 0 HB2 ALA A 85 -0.187 -4.680 4.640 1.00 0.28 H new ATOM 0 HB3 ALA A 85 0.744 -3.885 5.932 1.00 0.28 H new ATOM 1522 N GLU A 86 3.115 -2.511 5.436 1.00 0.31 N ATOM 1523 CA GLU A 86 3.846 -1.326 5.856 1.00 0.37 C ATOM 1524 C GLU A 86 5.116 -1.136 5.033 1.00 0.44 C ATOM 1525 O GLU A 86 5.568 -0.008 4.832 1.00 0.70 O ATOM 1526 CB GLU A 86 4.161 -1.392 7.349 1.00 0.43 C ATOM 1527 CG GLU A 86 2.919 -1.264 8.217 1.00 0.55 C ATOM 1528 CD GLU A 86 3.227 -1.280 9.699 1.00 0.95 C ATOM 1529 OE1 GLU A 86 3.498 -0.201 10.264 1.00 1.11 O ATOM 1530 OE2 GLU A 86 3.193 -2.369 10.308 1.00 1.96 O ATOM 0 H GLU A 86 3.139 -3.284 6.101 1.00 0.31 H new ATOM 0 HA GLU A 86 3.211 -0.458 5.679 1.00 0.37 H new ATOM 0 HB2 GLU A 86 4.658 -2.337 7.570 1.00 0.43 H new ATOM 0 HB3 GLU A 86 4.861 -0.596 7.604 1.00 0.43 H new ATOM 0 HG2 GLU A 86 2.404 -0.336 7.969 1.00 0.55 H new ATOM 0 HG3 GLU A 86 2.235 -2.080 7.985 1.00 0.55 H new ATOM 1537 N LYS A 87 5.672 -2.231 4.527 1.00 0.41 N ATOM 1538 CA LYS A 87 6.882 -2.160 3.731 1.00 0.49 C ATOM 1539 C LYS A 87 6.561 -1.841 2.272 1.00 0.49 C ATOM 1540 O LYS A 87 7.275 -1.074 1.628 1.00 0.57 O ATOM 1541 CB LYS A 87 7.661 -3.470 3.837 1.00 0.57 C ATOM 1542 CG LYS A 87 9.010 -3.408 3.158 1.00 0.69 C ATOM 1543 CD LYS A 87 9.893 -4.580 3.550 1.00 1.25 C ATOM 1544 CE LYS A 87 11.238 -4.525 2.843 1.00 1.75 C ATOM 1545 NZ LYS A 87 12.002 -3.298 3.195 1.00 2.12 N ATOM 0 H LYS A 87 5.303 -3.173 4.656 1.00 0.41 H new ATOM 0 HA LYS A 87 7.501 -1.352 4.121 1.00 0.49 H new ATOM 0 HB2 LYS A 87 7.800 -3.720 4.889 1.00 0.57 H new ATOM 0 HB3 LYS A 87 7.073 -4.274 3.393 1.00 0.57 H new ATOM 0 HG2 LYS A 87 8.873 -3.402 2.077 1.00 0.69 H new ATOM 0 HG3 LYS A 87 9.507 -2.474 3.421 1.00 0.69 H new ATOM 0 HD2 LYS A 87 10.047 -4.576 4.629 1.00 1.25 H new ATOM 0 HD3 LYS A 87 9.389 -5.515 3.304 1.00 1.25 H new ATOM 0 HE2 LYS A 87 11.823 -5.405 3.108 1.00 1.75 H new ATOM 0 HE3 LYS A 87 11.083 -4.559 1.765 1.00 1.75 H new ATOM 0 HZ1 LYS A 87 12.987 -3.399 2.876 1.00 2.12 H new ATOM 0 HZ2 LYS A 87 11.570 -2.474 2.729 1.00 2.12 H new ATOM 0 HZ3 LYS A 87 11.984 -3.162 4.226 1.00 2.12 H new ATOM 1559 N SER A 88 5.489 -2.426 1.751 1.00 0.46 N ATOM 1560 CA SER A 88 5.065 -2.155 0.383 1.00 0.51 C ATOM 1561 C SER A 88 4.632 -0.701 0.244 1.00 0.51 C ATOM 1562 O SER A 88 5.033 -0.010 -0.695 1.00 0.57 O ATOM 1563 CB SER A 88 3.928 -3.094 -0.027 1.00 0.56 C ATOM 1564 OG SER A 88 2.868 -3.059 0.911 1.00 0.48 O ATOM 0 H SER A 88 4.899 -3.089 2.254 1.00 0.46 H new ATOM 0 HA SER A 88 5.910 -2.333 -0.282 1.00 0.51 H new ATOM 0 HB2 SER A 88 3.555 -2.809 -1.011 1.00 0.56 H new ATOM 0 HB3 SER A 88 4.307 -4.112 -0.112 1.00 0.56 H new ATOM 0 HG SER A 88 3.091 -3.626 1.678 1.00 0.48 H new ATOM 1570 N ILE A 89 3.831 -0.238 1.197 1.00 0.50 N ATOM 1571 CA ILE A 89 3.418 1.151 1.237 1.00 0.56 C ATOM 1572 C ILE A 89 4.629 2.059 1.428 1.00 0.55 C ATOM 1573 O ILE A 89 4.651 3.175 0.926 1.00 0.59 O ATOM 1574 CB ILE A 89 2.373 1.393 2.353 1.00 0.63 C ATOM 1575 CG1 ILE A 89 1.073 0.655 2.017 1.00 0.83 C ATOM 1576 CG2 ILE A 89 2.110 2.879 2.537 1.00 0.79 C ATOM 1577 CD1 ILE A 89 -0.016 0.835 3.050 1.00 1.09 C ATOM 0 H ILE A 89 3.456 -0.811 1.953 1.00 0.50 H new ATOM 0 HA ILE A 89 2.948 1.392 0.283 1.00 0.56 H new ATOM 0 HB ILE A 89 2.770 1.004 3.291 1.00 0.63 H new ATOM 0 HG12 ILE A 89 0.707 1.005 1.052 1.00 0.83 H new ATOM 0 HG13 ILE A 89 1.287 -0.408 1.910 1.00 0.83 H new ATOM 0 HG21 ILE A 89 1.372 3.023 3.327 1.00 0.79 H new ATOM 0 HG22 ILE A 89 3.038 3.381 2.811 1.00 0.79 H new ATOM 0 HG23 ILE A 89 1.731 3.300 1.605 1.00 0.79 H new ATOM 0 HD11 ILE A 89 -0.904 0.283 2.742 1.00 1.09 H new ATOM 0 HD12 ILE A 89 0.330 0.458 4.013 1.00 1.09 H new ATOM 0 HD13 ILE A 89 -0.260 1.893 3.141 1.00 1.09 H new ATOM 1584 N GLU A 90 5.641 1.570 2.136 1.00 0.53 N ATOM 1585 CA GLU A 90 6.889 2.291 2.297 1.00 0.60 C ATOM 1586 C GLU A 90 7.560 2.500 0.937 1.00 0.56 C ATOM 1587 O GLU A 90 7.975 3.609 0.601 1.00 0.63 O ATOM 1588 CB GLU A 90 7.790 1.496 3.236 1.00 0.69 C ATOM 1589 CG GLU A 90 9.193 2.032 3.358 1.00 1.28 C ATOM 1590 CD GLU A 90 9.259 3.369 4.065 1.00 2.08 C ATOM 1591 OE1 GLU A 90 9.215 3.388 5.315 1.00 2.82 O ATOM 1592 OE2 GLU A 90 9.367 4.404 3.378 1.00 2.41 O ATOM 0 H GLU A 90 5.616 0.667 2.610 1.00 0.53 H new ATOM 0 HA GLU A 90 6.701 3.276 2.725 1.00 0.60 H new ATOM 0 HB2 GLU A 90 7.335 1.477 4.226 1.00 0.69 H new ATOM 0 HB3 GLU A 90 7.838 0.465 2.887 1.00 0.69 H new ATOM 0 HG2 GLU A 90 9.805 1.311 3.900 1.00 1.28 H new ATOM 0 HG3 GLU A 90 9.625 2.133 2.362 1.00 1.28 H new ATOM 1599 N ILE A 91 7.638 1.431 0.150 1.00 0.47 N ATOM 1600 CA ILE A 91 8.214 1.501 -1.186 1.00 0.46 C ATOM 1601 C ILE A 91 7.387 2.431 -2.075 1.00 0.47 C ATOM 1602 O ILE A 91 7.928 3.305 -2.756 1.00 0.51 O ATOM 1603 CB ILE A 91 8.294 0.103 -1.840 1.00 0.43 C ATOM 1604 CG1 ILE A 91 9.131 -0.849 -0.974 1.00 0.43 C ATOM 1605 CG2 ILE A 91 8.886 0.207 -3.239 1.00 0.49 C ATOM 1606 CD1 ILE A 91 9.178 -2.273 -1.496 1.00 0.45 C ATOM 0 H ILE A 91 7.308 0.504 0.417 1.00 0.47 H new ATOM 0 HA ILE A 91 9.225 1.895 -1.086 1.00 0.46 H new ATOM 0 HB ILE A 91 7.285 -0.301 -1.918 1.00 0.43 H new ATOM 0 HG12 ILE A 91 10.148 -0.463 -0.906 1.00 0.43 H new ATOM 0 HG13 ILE A 91 8.725 -0.856 0.037 1.00 0.43 H new ATOM 0 HG21 ILE A 91 8.936 -0.785 -3.687 1.00 0.49 H new ATOM 0 HG22 ILE A 91 8.257 0.851 -3.853 1.00 0.49 H new ATOM 0 HG23 ILE A 91 9.889 0.629 -3.179 1.00 0.49 H new ATOM 0 HD11 ILE A 91 9.788 -2.884 -0.831 1.00 0.45 H new ATOM 0 HD12 ILE A 91 8.167 -2.679 -1.537 1.00 0.45 H new ATOM 0 HD13 ILE A 91 9.613 -2.280 -2.496 1.00 0.45 H new ATOM 1613 N ALA A 92 6.070 2.250 -2.036 1.00 0.47 N ATOM 1614 CA ALA A 92 5.156 3.056 -2.832 1.00 0.53 C ATOM 1615 C ALA A 92 5.206 4.517 -2.401 1.00 0.60 C ATOM 1616 O ALA A 92 5.080 5.424 -3.229 1.00 0.64 O ATOM 1617 CB ALA A 92 3.742 2.511 -2.720 1.00 0.56 C ATOM 0 H ALA A 92 5.612 1.547 -1.457 1.00 0.47 H new ATOM 0 HA ALA A 92 5.468 3.003 -3.875 1.00 0.53 H new ATOM 0 HB1 ALA A 92 3.068 3.122 -3.320 1.00 0.56 H new ATOM 0 HB2 ALA A 92 3.719 1.483 -3.082 1.00 0.56 H new ATOM 0 HB3 ALA A 92 3.424 2.536 -1.678 1.00 0.56 H new ATOM 1623 N ARG A 93 5.376 4.731 -1.099 1.00 0.66 N ATOM 1624 CA ARG A 93 5.520 6.072 -0.547 1.00 0.77 C ATOM 1625 C ARG A 93 6.756 6.752 -1.100 1.00 0.68 C ATOM 1626 O ARG A 93 6.703 7.923 -1.453 1.00 0.68 O ATOM 1627 CB ARG A 93 5.592 6.058 0.984 1.00 0.99 C ATOM 1628 CG ARG A 93 4.236 6.127 1.668 1.00 1.55 C ATOM 1629 CD ARG A 93 4.379 6.169 3.183 1.00 1.83 C ATOM 1630 NE ARG A 93 4.872 4.904 3.730 1.00 2.71 N ATOM 1631 CZ ARG A 93 5.619 4.807 4.834 1.00 3.44 C ATOM 1632 NH1 ARG A 93 6.020 5.901 5.471 1.00 3.55 N ATOM 1633 NH2 ARG A 93 5.973 3.615 5.299 1.00 4.42 N ATOM 0 H ARG A 93 5.417 3.986 -0.404 1.00 0.66 H new ATOM 0 HA ARG A 93 4.632 6.631 -0.844 1.00 0.77 H new ATOM 0 HB2 ARG A 93 6.104 5.151 1.305 1.00 0.99 H new ATOM 0 HB3 ARG A 93 6.198 6.900 1.317 1.00 0.99 H new ATOM 0 HG2 ARG A 93 3.700 7.013 1.327 1.00 1.55 H new ATOM 0 HG3 ARG A 93 3.638 5.262 1.381 1.00 1.55 H new ATOM 0 HD2 ARG A 93 5.062 6.972 3.459 1.00 1.83 H new ATOM 0 HD3 ARG A 93 3.413 6.404 3.630 1.00 1.83 H new ATOM 0 HE ARG A 93 4.631 4.044 3.238 1.00 2.71 H new ATOM 0 HH11 ARG A 93 5.758 6.821 5.118 1.00 3.55 H new ATOM 0 HH12 ARG A 93 6.590 5.821 6.313 1.00 3.55 H new ATOM 0 HH21 ARG A 93 5.675 2.769 4.813 1.00 4.42 H new ATOM 0 HH22 ARG A 93 6.543 3.545 6.142 1.00 4.42 H new ATOM 1647 N GLY A 94 7.849 6.007 -1.208 1.00 0.66 N ATOM 1648 CA GLY A 94 9.090 6.577 -1.695 1.00 0.65 C ATOM 1649 C GLY A 94 8.954 7.112 -3.104 1.00 0.56 C ATOM 1650 O GLY A 94 9.558 8.124 -3.453 1.00 0.56 O ATOM 0 H GLY A 94 7.898 5.017 -0.967 1.00 0.66 H new ATOM 0 HA2 GLY A 94 9.405 7.382 -1.031 1.00 0.65 H new ATOM 0 HA3 GLY A 94 9.872 5.818 -1.669 1.00 0.65 H new ATOM 1654 N ILE A 95 8.129 6.444 -3.902 1.00 0.52 N ATOM 1655 CA ILE A 95 7.896 6.842 -5.284 1.00 0.48 C ATOM 1656 C ILE A 95 7.234 8.215 -5.367 1.00 0.47 C ATOM 1657 O ILE A 95 7.624 9.049 -6.180 1.00 0.49 O ATOM 1658 CB ILE A 95 7.034 5.799 -6.026 1.00 0.50 C ATOM 1659 CG1 ILE A 95 7.819 4.496 -6.191 1.00 0.53 C ATOM 1660 CG2 ILE A 95 6.573 6.324 -7.380 1.00 0.52 C ATOM 1661 CD1 ILE A 95 9.126 4.658 -6.943 1.00 0.55 C ATOM 0 H ILE A 95 7.607 5.617 -3.612 1.00 0.52 H new ATOM 0 HA ILE A 95 8.871 6.900 -5.768 1.00 0.48 H new ATOM 0 HB ILE A 95 6.143 5.603 -5.429 1.00 0.50 H new ATOM 0 HG12 ILE A 95 8.027 4.081 -5.205 1.00 0.53 H new ATOM 0 HG13 ILE A 95 7.196 3.772 -6.716 1.00 0.53 H new ATOM 0 HG21 ILE A 95 5.968 5.566 -7.877 1.00 0.52 H new ATOM 0 HG22 ILE A 95 5.978 7.226 -7.237 1.00 0.52 H new ATOM 0 HG23 ILE A 95 7.442 6.556 -7.995 1.00 0.52 H new ATOM 0 HD11 ILE A 95 9.624 3.692 -7.019 1.00 0.55 H new ATOM 0 HD12 ILE A 95 8.925 5.042 -7.943 1.00 0.55 H new ATOM 0 HD13 ILE A 95 9.769 5.357 -6.408 1.00 0.55 H new ATOM 1668 N LYS A 96 6.242 8.461 -4.523 1.00 0.50 N ATOM 1669 CA LYS A 96 5.568 9.751 -4.551 1.00 0.54 C ATOM 1670 C LYS A 96 6.198 10.711 -3.550 1.00 0.57 C ATOM 1671 O LYS A 96 5.922 11.903 -3.586 1.00 0.83 O ATOM 1672 CB LYS A 96 4.047 9.628 -4.342 1.00 0.64 C ATOM 1673 CG LYS A 96 3.608 9.400 -2.901 1.00 1.47 C ATOM 1674 CD LYS A 96 3.471 7.922 -2.547 1.00 1.78 C ATOM 1675 CE LYS A 96 2.315 7.243 -3.282 1.00 1.90 C ATOM 1676 NZ LYS A 96 2.735 6.629 -4.573 1.00 2.70 N ATOM 0 H LYS A 96 5.893 7.803 -3.827 1.00 0.50 H new ATOM 0 HA LYS A 96 5.705 10.164 -5.550 1.00 0.54 H new ATOM 0 HB2 LYS A 96 3.571 10.536 -4.711 1.00 0.64 H new ATOM 0 HB3 LYS A 96 3.678 8.804 -4.952 1.00 0.64 H new ATOM 0 HG2 LYS A 96 4.330 9.864 -2.229 1.00 1.47 H new ATOM 0 HG3 LYS A 96 2.653 9.898 -2.735 1.00 1.47 H new ATOM 0 HD2 LYS A 96 4.401 7.407 -2.788 1.00 1.78 H new ATOM 0 HD3 LYS A 96 3.321 7.823 -1.472 1.00 1.78 H new ATOM 0 HE2 LYS A 96 1.885 6.473 -2.641 1.00 1.90 H new ATOM 0 HE3 LYS A 96 1.530 7.975 -3.471 1.00 1.90 H new ATOM 0 HZ1 LYS A 96 1.948 6.675 -5.251 1.00 2.70 H new ATOM 0 HZ2 LYS A 96 3.552 7.148 -4.955 1.00 2.70 H new ATOM 0 HZ3 LYS A 96 2.999 5.635 -4.415 1.00 2.70 H new ATOM 1690 N ALA A 97 7.081 10.208 -2.704 1.00 0.50 N ATOM 1691 CA ALA A 97 7.894 11.071 -1.856 1.00 0.53 C ATOM 1692 C ALA A 97 8.894 11.834 -2.704 1.00 0.46 C ATOM 1693 O ALA A 97 9.164 13.009 -2.463 1.00 0.48 O ATOM 1694 CB ALA A 97 8.615 10.259 -0.790 1.00 0.63 C ATOM 0 H ALA A 97 7.255 9.210 -2.584 1.00 0.50 H new ATOM 0 HA ALA A 97 7.238 11.782 -1.354 1.00 0.53 H new ATOM 0 HB1 ALA A 97 9.215 10.925 -0.170 1.00 0.63 H new ATOM 0 HB2 ALA A 97 7.883 9.745 -0.167 1.00 0.63 H new ATOM 0 HB3 ALA A 97 9.264 9.525 -1.268 1.00 0.63 H new ATOM 1700 N ARG A 98 9.417 11.167 -3.723 1.00 0.41 N ATOM 1701 CA ARG A 98 10.325 11.809 -4.659 1.00 0.44 C ATOM 1702 C ARG A 98 9.534 12.519 -5.750 1.00 0.44 C ATOM 1703 O ARG A 98 10.104 13.070 -6.679 1.00 0.53 O ATOM 1704 CB ARG A 98 11.320 10.803 -5.245 1.00 0.51 C ATOM 1705 CG ARG A 98 10.656 9.587 -5.864 1.00 1.02 C ATOM 1706 CD ARG A 98 11.665 8.523 -6.255 1.00 0.81 C ATOM 1707 NE ARG A 98 12.478 8.927 -7.399 1.00 1.51 N ATOM 1708 CZ ARG A 98 13.158 8.076 -8.158 1.00 1.94 C ATOM 1709 NH1 ARG A 98 13.178 6.784 -7.858 1.00 1.37 N ATOM 1710 NH2 ARG A 98 13.829 8.517 -9.215 1.00 3.10 N ATOM 0 H ARG A 98 9.228 10.184 -3.921 1.00 0.41 H new ATOM 0 HA ARG A 98 10.909 12.556 -4.122 1.00 0.44 H new ATOM 0 HB2 ARG A 98 11.926 11.301 -6.002 1.00 0.51 H new ATOM 0 HB3 ARG A 98 11.999 10.475 -4.458 1.00 0.51 H new ATOM 0 HG2 ARG A 98 9.941 9.166 -5.157 1.00 1.02 H new ATOM 0 HG3 ARG A 98 10.091 9.892 -6.745 1.00 1.02 H new ATOM 0 HD2 ARG A 98 12.315 8.312 -5.406 1.00 0.81 H new ATOM 0 HD3 ARG A 98 11.141 7.597 -6.493 1.00 0.81 H new ATOM 0 HE ARG A 98 12.526 9.920 -7.628 1.00 1.51 H new ATOM 0 HH11 ARG A 98 12.670 6.442 -7.042 1.00 1.37 H new ATOM 0 HH12 ARG A 98 13.701 6.133 -8.443 1.00 1.37 H new ATOM 0 HH21 ARG A 98 13.823 9.511 -9.445 1.00 3.10 H new ATOM 0 HH22 ARG A 98 14.351 7.862 -9.797 1.00 3.10 H new ATOM 1724 N TYR A 99 8.215 12.492 -5.622 1.00 0.44 N ATOM 1725 CA TYR A 99 7.365 13.413 -6.359 1.00 0.50 C ATOM 1726 C TYR A 99 7.152 14.667 -5.525 1.00 0.54 C ATOM 1727 O TYR A 99 7.284 15.785 -6.023 1.00 0.64 O ATOM 1728 CB TYR A 99 6.009 12.788 -6.699 1.00 0.53 C ATOM 1729 CG TYR A 99 5.928 12.205 -8.092 1.00 0.59 C ATOM 1730 CD1 TYR A 99 5.894 13.036 -9.205 1.00 0.73 C ATOM 1731 CD2 TYR A 99 5.874 10.833 -8.297 1.00 0.60 C ATOM 1732 CE1 TYR A 99 5.815 12.516 -10.480 1.00 0.85 C ATOM 1733 CE2 TYR A 99 5.794 10.306 -9.572 1.00 0.71 C ATOM 1734 CZ TYR A 99 5.766 11.153 -10.659 1.00 0.83 C ATOM 1735 OH TYR A 99 5.696 10.635 -11.929 1.00 0.97 O ATOM 0 H TYR A 99 7.712 11.844 -5.016 1.00 0.44 H new ATOM 0 HA TYR A 99 7.862 13.658 -7.298 1.00 0.50 H new ATOM 0 HB2 TYR A 99 5.792 12.003 -5.975 1.00 0.53 H new ATOM 0 HB3 TYR A 99 5.234 13.546 -6.589 1.00 0.53 H new ATOM 0 HD1 TYR A 99 5.930 14.107 -9.070 1.00 0.73 H new ATOM 0 HD2 TYR A 99 5.895 10.167 -7.447 1.00 0.60 H new ATOM 0 HE1 TYR A 99 5.792 13.176 -11.334 1.00 0.85 H new ATOM 0 HE2 TYR A 99 5.754 9.236 -9.716 1.00 0.71 H new ATOM 0 HH TYR A 99 5.669 9.656 -11.882 1.00 0.97 H new ATOM 1745 N TYR A 100 6.856 14.469 -4.236 1.00 0.51 N ATOM 1746 CA TYR A 100 6.572 15.575 -3.324 1.00 0.58 C ATOM 1747 C TYR A 100 7.745 16.538 -3.222 1.00 0.58 C ATOM 1748 O TYR A 100 7.555 17.742 -3.079 1.00 0.71 O ATOM 1749 CB TYR A 100 6.215 15.067 -1.925 1.00 0.57 C ATOM 1750 CG TYR A 100 4.818 14.503 -1.805 1.00 0.72 C ATOM 1751 CD1 TYR A 100 3.704 15.286 -2.070 1.00 1.03 C ATOM 1752 CD2 TYR A 100 4.613 13.182 -1.440 1.00 0.97 C ATOM 1753 CE1 TYR A 100 2.429 14.771 -1.971 1.00 1.26 C ATOM 1754 CE2 TYR A 100 3.341 12.659 -1.339 1.00 1.16 C ATOM 1755 CZ TYR A 100 2.249 13.478 -1.563 1.00 1.21 C ATOM 1756 OH TYR A 100 0.985 12.947 -1.503 1.00 1.48 O ATOM 0 H TYR A 100 6.808 13.547 -3.802 1.00 0.51 H new ATOM 0 HA TYR A 100 5.717 16.107 -3.741 1.00 0.58 H new ATOM 0 HB2 TYR A 100 6.931 14.297 -1.637 1.00 0.57 H new ATOM 0 HB3 TYR A 100 6.326 15.886 -1.215 1.00 0.57 H new ATOM 0 HD1 TYR A 100 3.838 16.318 -2.359 1.00 1.03 H new ATOM 0 HD2 TYR A 100 5.464 12.551 -1.231 1.00 0.97 H new ATOM 0 HE1 TYR A 100 1.575 15.386 -2.215 1.00 1.26 H new ATOM 0 HE2 TYR A 100 3.199 11.618 -1.087 1.00 1.16 H new ATOM 0 HH TYR A 100 0.469 13.409 -0.810 1.00 1.48 H new ATOM 1766 N THR A 101 8.953 16.005 -3.307 1.00 0.55 N ATOM 1767 CA THR A 101 10.161 16.803 -3.168 1.00 0.66 C ATOM 1768 C THR A 101 10.404 17.711 -4.379 1.00 0.71 C ATOM 1769 O THR A 101 11.358 18.492 -4.397 1.00 0.71 O ATOM 1770 CB THR A 101 11.381 15.890 -2.952 1.00 0.71 C ATOM 1771 OG1 THR A 101 11.421 14.868 -3.959 1.00 0.65 O ATOM 1772 CG2 THR A 101 11.323 15.251 -1.570 1.00 0.87 C ATOM 0 H THR A 101 9.124 15.013 -3.473 1.00 0.55 H new ATOM 0 HA THR A 101 10.020 17.445 -2.298 1.00 0.66 H new ATOM 0 HB THR A 101 12.284 16.496 -3.025 1.00 0.71 H new ATOM 0 HG1 THR A 101 12.165 14.257 -3.775 1.00 0.65 H new ATOM 0 HG21 THR A 101 12.192 14.608 -1.430 1.00 0.87 H new ATOM 0 HG22 THR A 101 11.322 16.031 -0.808 1.00 0.87 H new ATOM 0 HG23 THR A 101 10.413 14.657 -1.482 1.00 0.87 H new ATOM 1780 N GLY A 102 9.540 17.610 -5.383 1.00 0.82 N ATOM 1781 CA GLY A 102 9.692 18.418 -6.578 1.00 0.95 C ATOM 1782 C GLY A 102 10.489 17.709 -7.654 1.00 0.95 C ATOM 1783 O GLY A 102 11.192 18.345 -8.439 1.00 1.16 O ATOM 0 H GLY A 102 8.736 16.982 -5.390 1.00 0.82 H new ATOM 0 HA2 GLY A 102 8.707 18.675 -6.968 1.00 0.95 H new ATOM 0 HA3 GLY A 102 10.187 19.354 -6.320 1.00 0.95 H new ATOM 1787 N ASN A 103 10.372 16.391 -7.691 1.00 0.82 N ATOM 1788 CA ASN A 103 11.099 15.580 -8.656 1.00 0.89 C ATOM 1789 C ASN A 103 10.140 14.617 -9.335 1.00 0.98 C ATOM 1790 O ASN A 103 8.959 14.570 -8.984 1.00 1.83 O ATOM 1791 CB ASN A 103 12.230 14.805 -7.973 1.00 0.90 C ATOM 1792 CG ASN A 103 13.285 15.704 -7.356 1.00 1.28 C ATOM 1793 OD1 ASN A 103 14.250 16.098 -8.015 1.00 1.76 O ATOM 1794 ND2 ASN A 103 13.122 16.021 -6.079 1.00 1.65 N ATOM 0 H ASN A 103 9.776 15.857 -7.059 1.00 0.82 H new ATOM 0 HA ASN A 103 11.542 16.238 -9.404 1.00 0.89 H new ATOM 0 HB2 ASN A 103 11.807 14.167 -7.197 1.00 0.90 H new ATOM 0 HB3 ASN A 103 12.704 14.148 -8.703 1.00 0.90 H new ATOM 0 HD21 ASN A 103 13.808 16.610 -5.608 1.00 1.65 H new ATOM 0 HD22 ASN A 103 12.310 15.675 -5.567 1.00 1.65 H new ATOM 1801 N GLU A 104 10.635 13.856 -10.302 1.00 0.56 N ATOM 1802 CA GLU A 104 9.797 12.907 -11.025 1.00 0.56 C ATOM 1803 C GLU A 104 10.554 11.621 -11.351 1.00 0.49 C ATOM 1804 O GLU A 104 11.427 11.613 -12.221 1.00 0.55 O ATOM 1805 CB GLU A 104 9.270 13.534 -12.318 1.00 0.67 C ATOM 1806 CG GLU A 104 8.274 14.657 -12.086 1.00 0.80 C ATOM 1807 CD GLU A 104 7.737 15.234 -13.375 1.00 1.15 C ATOM 1808 OE1 GLU A 104 7.044 14.500 -14.111 1.00 1.75 O ATOM 1809 OE2 GLU A 104 8.003 16.421 -13.659 1.00 1.17 O ATOM 0 H GLU A 104 11.609 13.876 -10.604 1.00 0.56 H new ATOM 0 HA GLU A 104 8.959 12.655 -10.376 1.00 0.56 H new ATOM 0 HB2 GLU A 104 10.111 13.919 -12.895 1.00 0.67 H new ATOM 0 HB3 GLU A 104 8.797 12.759 -12.922 1.00 0.67 H new ATOM 0 HG2 GLU A 104 7.444 14.283 -11.486 1.00 0.80 H new ATOM 0 HG3 GLU A 104 8.753 15.449 -11.510 1.00 0.80 H new ATOM 1816 N PRO A 105 10.234 10.519 -10.645 1.00 0.44 N ATOM 1817 CA PRO A 105 10.789 9.193 -10.944 1.00 0.44 C ATOM 1818 C PRO A 105 10.461 8.747 -12.363 1.00 0.42 C ATOM 1819 O PRO A 105 9.531 9.259 -12.989 1.00 0.47 O ATOM 1820 CB PRO A 105 10.100 8.267 -9.932 1.00 0.48 C ATOM 1821 CG PRO A 105 8.940 9.036 -9.408 1.00 0.53 C ATOM 1822 CD PRO A 105 9.323 10.482 -9.492 1.00 0.49 C ATOM 0 HA PRO A 105 11.877 9.186 -10.872 1.00 0.44 H new ATOM 0 HB2 PRO A 105 9.774 7.342 -10.407 1.00 0.48 H new ATOM 0 HB3 PRO A 105 10.781 7.990 -9.128 1.00 0.48 H new ATOM 0 HG2 PRO A 105 8.044 8.836 -9.995 1.00 0.53 H new ATOM 0 HG3 PRO A 105 8.717 8.752 -8.380 1.00 0.53 H new ATOM 0 HD2 PRO A 105 8.453 11.121 -9.645 1.00 0.49 H new ATOM 0 HD3 PRO A 105 9.813 10.823 -8.580 1.00 0.49 H new ATOM 1830 N THR A 106 11.219 7.796 -12.865 1.00 0.42 N ATOM 1831 CA THR A 106 10.948 7.235 -14.171 1.00 0.42 C ATOM 1832 C THR A 106 9.935 6.113 -14.030 1.00 0.39 C ATOM 1833 O THR A 106 9.698 5.634 -12.920 1.00 0.41 O ATOM 1834 CB THR A 106 12.228 6.692 -14.829 1.00 0.50 C ATOM 1835 OG1 THR A 106 12.817 5.678 -14.001 1.00 1.48 O ATOM 1836 CG2 THR A 106 13.233 7.808 -15.062 1.00 1.05 C ATOM 0 H THR A 106 12.027 7.395 -12.389 1.00 0.42 H new ATOM 0 HA THR A 106 10.553 8.026 -14.808 1.00 0.42 H new ATOM 0 HB THR A 106 11.957 6.261 -15.793 1.00 0.50 H new ATOM 0 HG1 THR A 106 13.182 6.089 -13.190 1.00 1.48 H new ATOM 0 HG21 THR A 106 14.129 7.399 -15.528 1.00 1.05 H new ATOM 0 HG22 THR A 106 12.795 8.561 -15.717 1.00 1.05 H new ATOM 0 HG23 THR A 106 13.496 8.265 -14.108 1.00 1.05 H new ATOM 1844 N LYS A 107 9.339 5.681 -15.129 1.00 0.39 N ATOM 1845 CA LYS A 107 8.405 4.567 -15.069 1.00 0.39 C ATOM 1846 C LYS A 107 9.125 3.311 -14.580 1.00 0.36 C ATOM 1847 O LYS A 107 8.513 2.410 -14.014 1.00 0.38 O ATOM 1848 CB LYS A 107 7.746 4.322 -16.429 1.00 0.43 C ATOM 1849 CG LYS A 107 8.732 4.076 -17.561 1.00 1.33 C ATOM 1850 CD LYS A 107 8.018 3.742 -18.864 1.00 1.66 C ATOM 1851 CE LYS A 107 7.156 4.896 -19.356 1.00 2.22 C ATOM 1852 NZ LYS A 107 7.958 6.111 -19.655 1.00 2.88 N ATOM 0 H LYS A 107 9.481 6.076 -16.059 1.00 0.39 H new ATOM 0 HA LYS A 107 7.614 4.818 -14.362 1.00 0.39 H new ATOM 0 HB2 LYS A 107 7.080 3.463 -16.349 1.00 0.43 H new ATOM 0 HB3 LYS A 107 7.127 5.183 -16.681 1.00 0.43 H new ATOM 0 HG2 LYS A 107 9.353 4.961 -17.702 1.00 1.33 H new ATOM 0 HG3 LYS A 107 9.400 3.258 -17.291 1.00 1.33 H new ATOM 0 HD2 LYS A 107 8.755 3.490 -19.626 1.00 1.66 H new ATOM 0 HD3 LYS A 107 7.394 2.860 -18.719 1.00 1.66 H new ATOM 0 HE2 LYS A 107 6.618 4.588 -20.253 1.00 2.22 H new ATOM 0 HE3 LYS A 107 6.407 5.135 -18.601 1.00 2.22 H new ATOM 0 HZ1 LYS A 107 7.366 6.803 -20.158 1.00 2.88 H new ATOM 0 HZ2 LYS A 107 8.299 6.529 -18.766 1.00 2.88 H new ATOM 0 HZ3 LYS A 107 8.771 5.853 -20.251 1.00 2.88 H new ATOM 1866 N ASP A 108 10.440 3.289 -14.772 1.00 0.36 N ATOM 1867 CA ASP A 108 11.265 2.174 -14.330 1.00 0.38 C ATOM 1868 C ASP A 108 11.406 2.169 -12.815 1.00 0.36 C ATOM 1869 O ASP A 108 11.510 1.106 -12.199 1.00 0.38 O ATOM 1870 CB ASP A 108 12.642 2.222 -14.989 1.00 0.47 C ATOM 1871 CG ASP A 108 12.577 1.913 -16.467 1.00 1.29 C ATOM 1872 OD1 ASP A 108 12.503 0.720 -16.827 1.00 1.26 O ATOM 1873 OD2 ASP A 108 12.613 2.861 -17.282 1.00 2.24 O ATOM 0 H ASP A 108 10.958 4.036 -15.234 1.00 0.36 H new ATOM 0 HA ASP A 108 10.769 1.252 -14.633 1.00 0.38 H new ATOM 0 HB2 ASP A 108 13.078 3.211 -14.845 1.00 0.47 H new ATOM 0 HB3 ASP A 108 13.303 1.507 -14.499 1.00 0.47 H new ATOM 1878 N ASP A 109 11.408 3.354 -12.212 1.00 0.36 N ATOM 1879 CA ASP A 109 11.397 3.465 -10.760 1.00 0.37 C ATOM 1880 C ASP A 109 10.112 2.862 -10.209 1.00 0.34 C ATOM 1881 O ASP A 109 10.116 2.152 -9.204 1.00 0.36 O ATOM 1882 CB ASP A 109 11.511 4.929 -10.334 1.00 0.39 C ATOM 1883 CG ASP A 109 12.886 5.505 -10.609 1.00 0.88 C ATOM 1884 OD1 ASP A 109 13.854 5.109 -9.925 1.00 0.94 O ATOM 1885 OD2 ASP A 109 13.011 6.351 -11.519 1.00 1.73 O ATOM 0 H ASP A 109 11.417 4.247 -12.705 1.00 0.36 H new ATOM 0 HA ASP A 109 12.252 2.920 -10.360 1.00 0.37 H new ATOM 0 HB2 ASP A 109 10.761 5.518 -10.862 1.00 0.39 H new ATOM 0 HB3 ASP A 109 11.291 5.013 -9.270 1.00 0.39 H new ATOM 1890 N LEU A 110 9.013 3.143 -10.900 1.00 0.30 N ATOM 1891 CA LEU A 110 7.705 2.610 -10.541 1.00 0.30 C ATOM 1892 C LEU A 110 7.678 1.097 -10.727 1.00 0.29 C ATOM 1893 O LEU A 110 7.128 0.377 -9.894 1.00 0.33 O ATOM 1894 CB LEU A 110 6.602 3.273 -11.378 1.00 0.30 C ATOM 1895 CG LEU A 110 6.155 4.669 -10.920 1.00 0.38 C ATOM 1896 CD1 LEU A 110 7.339 5.598 -10.740 1.00 0.82 C ATOM 1897 CD2 LEU A 110 5.174 5.265 -11.917 1.00 0.82 C ATOM 0 H LEU A 110 9.004 3.745 -11.723 1.00 0.30 H new ATOM 0 HA LEU A 110 7.519 2.834 -9.491 1.00 0.30 H new ATOM 0 HB2 LEU A 110 6.949 3.345 -12.409 1.00 0.30 H new ATOM 0 HB3 LEU A 110 5.731 2.617 -11.380 1.00 0.30 H new ATOM 0 HG LEU A 110 5.661 4.558 -9.955 1.00 0.38 H new ATOM 0 HD11 LEU A 110 6.987 6.577 -10.416 1.00 0.82 H new ATOM 0 HD12 LEU A 110 8.013 5.187 -9.988 1.00 0.82 H new ATOM 0 HD13 LEU A 110 7.870 5.699 -11.687 1.00 0.82 H new ATOM 0 HD21 LEU A 110 4.867 6.254 -11.578 1.00 0.82 H new ATOM 0 HD22 LEU A 110 5.652 5.348 -12.893 1.00 0.82 H new ATOM 0 HD23 LEU A 110 4.299 4.620 -11.996 1.00 0.82 H new ATOM 1909 N LYS A 111 8.282 0.619 -11.818 1.00 0.28 N ATOM 1910 CA LYS A 111 8.420 -0.818 -12.052 1.00 0.31 C ATOM 1911 C LYS A 111 9.095 -1.475 -10.859 1.00 0.33 C ATOM 1912 O LYS A 111 8.584 -2.438 -10.296 1.00 0.35 O ATOM 1913 CB LYS A 111 9.261 -1.105 -13.299 1.00 0.37 C ATOM 1914 CG LYS A 111 8.681 -0.582 -14.601 1.00 0.93 C ATOM 1915 CD LYS A 111 9.643 -0.842 -15.749 1.00 0.92 C ATOM 1916 CE LYS A 111 9.189 -0.187 -17.041 1.00 1.02 C ATOM 1917 NZ LYS A 111 10.243 -0.267 -18.087 1.00 1.74 N ATOM 0 H LYS A 111 8.682 1.205 -12.551 1.00 0.28 H new ATOM 0 HA LYS A 111 7.418 -1.222 -12.197 1.00 0.31 H new ATOM 0 HB2 LYS A 111 10.250 -0.670 -13.159 1.00 0.37 H new ATOM 0 HB3 LYS A 111 9.397 -2.183 -13.387 1.00 0.37 H new ATOM 0 HG2 LYS A 111 7.725 -1.066 -14.802 1.00 0.93 H new ATOM 0 HG3 LYS A 111 8.485 0.487 -14.516 1.00 0.93 H new ATOM 0 HD2 LYS A 111 10.632 -0.469 -15.483 1.00 0.92 H new ATOM 0 HD3 LYS A 111 9.739 -1.917 -15.903 1.00 0.92 H new ATOM 0 HE2 LYS A 111 8.281 -0.673 -17.398 1.00 1.02 H new ATOM 0 HE3 LYS A 111 8.938 0.857 -16.853 1.00 1.02 H new ATOM 0 HZ1 LYS A 111 10.036 0.419 -18.841 1.00 1.74 H new ATOM 0 HZ2 LYS A 111 11.168 -0.049 -17.665 1.00 1.74 H new ATOM 0 HZ3 LYS A 111 10.263 -1.227 -18.487 1.00 1.74 H new ATOM 1931 N ALA A 112 10.247 -0.931 -10.479 1.00 0.36 N ATOM 1932 CA ALA A 112 11.024 -1.459 -9.367 1.00 0.42 C ATOM 1933 C ALA A 112 10.222 -1.427 -8.072 1.00 0.43 C ATOM 1934 O ALA A 112 10.234 -2.387 -7.301 1.00 0.47 O ATOM 1935 CB ALA A 112 12.316 -0.671 -9.209 1.00 0.46 C ATOM 0 H ALA A 112 10.664 -0.117 -10.931 1.00 0.36 H new ATOM 0 HA ALA A 112 11.267 -2.499 -9.586 1.00 0.42 H new ATOM 0 HB1 ALA A 112 12.889 -1.075 -8.374 1.00 0.46 H new ATOM 0 HB2 ALA A 112 12.904 -0.749 -10.124 1.00 0.46 H new ATOM 0 HB3 ALA A 112 12.082 0.376 -9.016 1.00 0.46 H new ATOM 1941 N SER A 113 9.527 -0.321 -7.843 1.00 0.41 N ATOM 1942 CA SER A 113 8.698 -0.160 -6.656 1.00 0.45 C ATOM 1943 C SER A 113 7.672 -1.278 -6.531 1.00 0.40 C ATOM 1944 O SER A 113 7.545 -1.888 -5.470 1.00 0.44 O ATOM 1945 CB SER A 113 7.982 1.190 -6.683 1.00 0.54 C ATOM 1946 OG SER A 113 7.138 1.359 -5.555 1.00 1.34 O ATOM 0 H SER A 113 9.521 0.484 -8.469 1.00 0.41 H new ATOM 0 HA SER A 113 9.359 -0.204 -5.791 1.00 0.45 H new ATOM 0 HB2 SER A 113 8.719 1.992 -6.709 1.00 0.54 H new ATOM 0 HB3 SER A 113 7.391 1.270 -7.595 1.00 0.54 H new ATOM 0 HG SER A 113 6.380 1.932 -5.796 1.00 1.34 H new ATOM 1952 N VAL A 114 6.949 -1.565 -7.604 1.00 0.36 N ATOM 1953 CA VAL A 114 5.868 -2.530 -7.536 1.00 0.36 C ATOM 1954 C VAL A 114 6.427 -3.951 -7.625 1.00 0.35 C ATOM 1955 O VAL A 114 5.824 -4.910 -7.154 1.00 0.37 O ATOM 1956 CB VAL A 114 4.838 -2.295 -8.666 1.00 0.36 C ATOM 1957 CG1 VAL A 114 4.430 -0.829 -8.732 1.00 0.65 C ATOM 1958 CG2 VAL A 114 5.374 -2.751 -10.007 1.00 0.56 C ATOM 0 H VAL A 114 7.091 -1.146 -8.523 1.00 0.36 H new ATOM 0 HA VAL A 114 5.359 -2.402 -6.580 1.00 0.36 H new ATOM 0 HB VAL A 114 3.956 -2.892 -8.433 1.00 0.36 H new ATOM 0 HG11 VAL A 114 3.705 -0.689 -9.534 1.00 0.65 H new ATOM 0 HG12 VAL A 114 3.983 -0.533 -7.783 1.00 0.65 H new ATOM 0 HG13 VAL A 114 5.309 -0.215 -8.926 1.00 0.65 H new ATOM 0 HG21 VAL A 114 4.625 -2.571 -10.778 1.00 0.56 H new ATOM 0 HG22 VAL A 114 6.281 -2.194 -10.245 1.00 0.56 H new ATOM 0 HG23 VAL A 114 5.603 -3.816 -9.964 1.00 0.56 H new ATOM 1962 N LYS A 115 7.596 -4.061 -8.236 1.00 0.35 N ATOM 1963 CA LYS A 115 8.280 -5.328 -8.399 1.00 0.37 C ATOM 1964 C LYS A 115 8.732 -5.890 -7.058 1.00 0.35 C ATOM 1965 O LYS A 115 8.622 -7.093 -6.814 1.00 0.37 O ATOM 1966 CB LYS A 115 9.493 -5.132 -9.301 1.00 0.48 C ATOM 1967 CG LYS A 115 10.076 -6.428 -9.828 1.00 0.84 C ATOM 1968 CD LYS A 115 11.413 -6.203 -10.515 1.00 0.81 C ATOM 1969 CE LYS A 115 11.282 -5.314 -11.741 1.00 1.16 C ATOM 1970 NZ LYS A 115 12.576 -5.172 -12.461 1.00 1.72 N ATOM 0 H LYS A 115 8.098 -3.267 -8.634 1.00 0.35 H new ATOM 0 HA LYS A 115 7.585 -6.038 -8.848 1.00 0.37 H new ATOM 0 HB2 LYS A 115 9.210 -4.502 -10.144 1.00 0.48 H new ATOM 0 HB3 LYS A 115 10.264 -4.596 -8.747 1.00 0.48 H new ATOM 0 HG2 LYS A 115 10.203 -7.131 -9.005 1.00 0.84 H new ATOM 0 HG3 LYS A 115 9.377 -6.882 -10.531 1.00 0.84 H new ATOM 0 HD2 LYS A 115 12.110 -5.749 -9.811 1.00 0.81 H new ATOM 0 HD3 LYS A 115 11.836 -7.164 -10.808 1.00 0.81 H new ATOM 0 HE2 LYS A 115 10.535 -5.732 -12.415 1.00 1.16 H new ATOM 0 HE3 LYS A 115 10.924 -4.330 -11.440 1.00 1.16 H new ATOM 0 HZ1 LYS A 115 12.446 -4.559 -13.291 1.00 1.72 H new ATOM 0 HZ2 LYS A 115 13.282 -4.749 -11.825 1.00 1.72 H new ATOM 0 HZ3 LYS A 115 12.905 -6.109 -12.771 1.00 1.72 H new ATOM 1984 N GLU A 116 9.247 -5.032 -6.188 1.00 0.36 N ATOM 1985 CA GLU A 116 9.732 -5.491 -4.893 1.00 0.38 C ATOM 1986 C GLU A 116 8.566 -5.878 -3.986 1.00 0.37 C ATOM 1987 O GLU A 116 8.668 -6.838 -3.230 1.00 0.38 O ATOM 1988 CB GLU A 116 10.618 -4.444 -4.215 1.00 0.43 C ATOM 1989 CG GLU A 116 11.789 -3.975 -5.061 1.00 0.80 C ATOM 1990 CD GLU A 116 12.761 -5.085 -5.396 1.00 1.30 C ATOM 1991 OE1 GLU A 116 13.671 -5.351 -4.584 1.00 1.32 O ATOM 1992 OE2 GLU A 116 12.627 -5.692 -6.479 1.00 2.27 O ATOM 0 H GLU A 116 9.339 -4.029 -6.351 1.00 0.36 H new ATOM 0 HA GLU A 116 10.345 -6.375 -5.069 1.00 0.38 H new ATOM 0 HB2 GLU A 116 10.006 -3.581 -3.953 1.00 0.43 H new ATOM 0 HB3 GLU A 116 11.001 -4.858 -3.282 1.00 0.43 H new ATOM 0 HG2 GLU A 116 11.410 -3.540 -5.986 1.00 0.80 H new ATOM 0 HG3 GLU A 116 12.319 -3.184 -4.531 1.00 0.80 H new ATOM 1999 N VAL A 117 7.452 -5.162 -4.081 1.00 0.36 N ATOM 2000 CA VAL A 117 6.269 -5.515 -3.297 1.00 0.38 C ATOM 2001 C VAL A 117 5.725 -6.873 -3.742 1.00 0.38 C ATOM 2002 O VAL A 117 5.231 -7.648 -2.931 1.00 0.43 O ATOM 2003 CB VAL A 117 5.150 -4.440 -3.365 1.00 0.43 C ATOM 2004 CG1 VAL A 117 5.735 -3.049 -3.220 1.00 0.81 C ATOM 2005 CG2 VAL A 117 4.321 -4.547 -4.633 1.00 0.78 C ATOM 0 H VAL A 117 7.340 -4.346 -4.682 1.00 0.36 H new ATOM 0 HA VAL A 117 6.588 -5.569 -2.256 1.00 0.38 H new ATOM 0 HB VAL A 117 4.476 -4.626 -2.529 1.00 0.43 H new ATOM 0 HG11 VAL A 117 4.935 -2.311 -3.270 1.00 0.81 H new ATOM 0 HG12 VAL A 117 6.245 -2.967 -2.260 1.00 0.81 H new ATOM 0 HG13 VAL A 117 6.447 -2.868 -4.025 1.00 0.81 H new ATOM 0 HG21 VAL A 117 3.553 -3.774 -4.632 1.00 0.78 H new ATOM 0 HG22 VAL A 117 4.966 -4.416 -5.502 1.00 0.78 H new ATOM 0 HG23 VAL A 117 3.848 -5.528 -4.677 1.00 0.78 H new ATOM 2009 N LEU A 118 5.858 -7.182 -5.023 1.00 0.36 N ATOM 2010 CA LEU A 118 5.447 -8.486 -5.528 1.00 0.36 C ATOM 2011 C LEU A 118 6.425 -9.551 -5.073 1.00 0.36 C ATOM 2012 O LEU A 118 6.035 -10.678 -4.784 1.00 0.38 O ATOM 2013 CB LEU A 118 5.380 -8.485 -7.054 1.00 0.41 C ATOM 2014 CG LEU A 118 4.280 -7.637 -7.682 1.00 0.49 C ATOM 2015 CD1 LEU A 118 4.524 -7.510 -9.169 1.00 1.21 C ATOM 2016 CD2 LEU A 118 2.913 -8.254 -7.438 1.00 0.88 C ATOM 0 H LEU A 118 6.244 -6.554 -5.728 1.00 0.36 H new ATOM 0 HA LEU A 118 4.455 -8.703 -5.132 1.00 0.36 H new ATOM 0 HB2 LEU A 118 6.340 -8.139 -7.438 1.00 0.41 H new ATOM 0 HB3 LEU A 118 5.253 -9.514 -7.391 1.00 0.41 H new ATOM 0 HG LEU A 118 4.299 -6.650 -7.220 1.00 0.49 H new ATOM 0 HD11 LEU A 118 3.737 -6.903 -9.616 1.00 1.21 H new ATOM 0 HD12 LEU A 118 5.490 -7.034 -9.340 1.00 1.21 H new ATOM 0 HD13 LEU A 118 4.522 -8.500 -9.624 1.00 1.21 H new ATOM 0 HD21 LEU A 118 2.145 -7.630 -7.896 1.00 0.88 H new ATOM 0 HD22 LEU A 118 2.880 -9.251 -7.877 1.00 0.88 H new ATOM 0 HD23 LEU A 118 2.732 -8.324 -6.365 1.00 0.88 H new ATOM 2028 N LYS A 119 7.695 -9.177 -4.993 1.00 0.36 N ATOM 2029 CA LYS A 119 8.737 -10.088 -4.576 1.00 0.37 C ATOM 2030 C LYS A 119 8.435 -10.581 -3.174 1.00 0.36 C ATOM 2031 O LYS A 119 8.552 -11.768 -2.872 1.00 0.38 O ATOM 2032 CB LYS A 119 10.084 -9.371 -4.618 1.00 0.39 C ATOM 2033 CG LYS A 119 11.219 -10.176 -4.024 1.00 0.43 C ATOM 2034 CD LYS A 119 12.521 -9.388 -4.002 1.00 0.67 C ATOM 2035 CE LYS A 119 12.458 -8.205 -3.046 1.00 0.57 C ATOM 2036 NZ LYS A 119 13.745 -7.465 -2.999 1.00 0.95 N ATOM 0 H LYS A 119 8.024 -8.238 -5.215 1.00 0.36 H new ATOM 0 HA LYS A 119 8.779 -10.945 -5.249 1.00 0.37 H new ATOM 0 HB2 LYS A 119 10.325 -9.129 -5.653 1.00 0.39 H new ATOM 0 HB3 LYS A 119 10.000 -8.426 -4.081 1.00 0.39 H new ATOM 0 HG2 LYS A 119 10.959 -10.476 -3.009 1.00 0.43 H new ATOM 0 HG3 LYS A 119 11.357 -11.090 -4.601 1.00 0.43 H new ATOM 0 HD2 LYS A 119 13.338 -10.047 -3.709 1.00 0.67 H new ATOM 0 HD3 LYS A 119 12.745 -9.030 -5.007 1.00 0.67 H new ATOM 0 HE2 LYS A 119 11.661 -7.529 -3.356 1.00 0.57 H new ATOM 0 HE3 LYS A 119 12.205 -8.558 -2.046 1.00 0.57 H new ATOM 0 HZ1 LYS A 119 13.882 -7.067 -2.048 1.00 0.95 H new ATOM 0 HZ2 LYS A 119 14.527 -8.114 -3.219 1.00 0.95 H new ATOM 0 HZ3 LYS A 119 13.728 -6.695 -3.697 1.00 0.95 H new ATOM 2050 N LEU A 120 8.034 -9.652 -2.328 1.00 0.36 N ATOM 2051 CA LEU A 120 7.601 -9.976 -0.993 1.00 0.37 C ATOM 2052 C LEU A 120 6.273 -10.712 -1.002 1.00 0.36 C ATOM 2053 O LEU A 120 6.134 -11.750 -0.351 1.00 0.38 O ATOM 2054 CB LEU A 120 7.482 -8.707 -0.150 1.00 0.39 C ATOM 2055 CG LEU A 120 8.798 -8.204 0.439 1.00 0.42 C ATOM 2056 CD1 LEU A 120 9.763 -7.775 -0.647 1.00 1.06 C ATOM 2057 CD2 LEU A 120 8.549 -7.071 1.419 1.00 0.99 C ATOM 0 H LEU A 120 8.001 -8.657 -2.550 1.00 0.36 H new ATOM 0 HA LEU A 120 8.352 -10.633 -0.554 1.00 0.37 H new ATOM 0 HB2 LEU A 120 7.051 -7.918 -0.766 1.00 0.39 H new ATOM 0 HB3 LEU A 120 6.783 -8.893 0.665 1.00 0.39 H new ATOM 0 HG LEU A 120 9.258 -9.031 0.980 1.00 0.42 H new ATOM 0 HD11 LEU A 120 10.689 -7.423 -0.193 1.00 1.06 H new ATOM 0 HD12 LEU A 120 9.978 -8.622 -1.298 1.00 1.06 H new ATOM 0 HD13 LEU A 120 9.317 -6.971 -1.233 1.00 1.06 H new ATOM 0 HD21 LEU A 120 9.500 -6.727 1.827 1.00 0.99 H new ATOM 0 HD22 LEU A 120 8.056 -6.246 0.904 1.00 0.99 H new ATOM 0 HD23 LEU A 120 7.913 -7.425 2.230 1.00 0.99 H new ATOM 2069 N TYR A 121 5.299 -10.194 -1.749 1.00 0.35 N ATOM 2070 CA TYR A 121 3.942 -10.689 -1.612 1.00 0.36 C ATOM 2071 C TYR A 121 3.802 -12.112 -2.153 1.00 0.38 C ATOM 2072 O TYR A 121 3.098 -12.932 -1.566 1.00 0.41 O ATOM 2073 CB TYR A 121 2.921 -9.729 -2.237 1.00 0.37 C ATOM 2074 CG TYR A 121 1.557 -10.340 -2.463 1.00 0.56 C ATOM 2075 CD1 TYR A 121 0.637 -10.431 -1.425 1.00 0.84 C ATOM 2076 CD2 TYR A 121 1.184 -10.811 -3.713 1.00 0.74 C ATOM 2077 CE1 TYR A 121 -0.615 -10.975 -1.631 1.00 1.13 C ATOM 2078 CE2 TYR A 121 -0.067 -11.351 -3.927 1.00 1.05 C ATOM 2079 CZ TYR A 121 -0.935 -11.497 -2.872 1.00 1.23 C ATOM 2080 OH TYR A 121 -2.210 -11.967 -3.097 1.00 1.54 O ATOM 0 H TYR A 121 5.424 -9.451 -2.437 1.00 0.35 H new ATOM 0 HA TYR A 121 3.720 -10.734 -0.546 1.00 0.36 H new ATOM 0 HB2 TYR A 121 2.814 -8.858 -1.591 1.00 0.37 H new ATOM 0 HB3 TYR A 121 3.310 -9.372 -3.191 1.00 0.37 H new ATOM 0 HD1 TYR A 121 0.906 -10.071 -0.443 1.00 0.84 H new ATOM 0 HD2 TYR A 121 1.885 -10.754 -4.533 1.00 0.74 H new ATOM 0 HE1 TYR A 121 -1.339 -10.993 -0.830 1.00 1.13 H new ATOM 0 HE2 TYR A 121 -0.363 -11.658 -4.919 1.00 1.05 H new ATOM 0 HH TYR A 121 -2.845 -11.467 -2.543 1.00 1.54 H new ATOM 2090 N LYS A 122 4.491 -12.404 -3.249 1.00 0.40 N ATOM 2091 CA LYS A 122 4.471 -13.741 -3.838 1.00 0.45 C ATOM 2092 C LYS A 122 5.015 -14.780 -2.861 1.00 0.43 C ATOM 2093 O LYS A 122 4.560 -15.926 -2.839 1.00 0.46 O ATOM 2094 CB LYS A 122 5.300 -13.774 -5.122 1.00 0.52 C ATOM 2095 CG LYS A 122 4.682 -13.014 -6.283 1.00 0.60 C ATOM 2096 CD LYS A 122 5.675 -12.856 -7.423 1.00 1.21 C ATOM 2097 CE LYS A 122 5.028 -12.259 -8.662 1.00 1.27 C ATOM 2098 NZ LYS A 122 4.121 -13.225 -9.340 1.00 1.98 N ATOM 0 H LYS A 122 5.072 -11.733 -3.750 1.00 0.40 H new ATOM 0 HA LYS A 122 3.434 -13.983 -4.069 1.00 0.45 H new ATOM 0 HB2 LYS A 122 6.286 -13.359 -4.915 1.00 0.52 H new ATOM 0 HB3 LYS A 122 5.447 -14.812 -5.419 1.00 0.52 H new ATOM 0 HG2 LYS A 122 3.797 -13.542 -6.638 1.00 0.60 H new ATOM 0 HG3 LYS A 122 4.352 -12.032 -5.945 1.00 0.60 H new ATOM 0 HD2 LYS A 122 6.498 -12.219 -7.101 1.00 1.21 H new ATOM 0 HD3 LYS A 122 6.102 -13.828 -7.669 1.00 1.21 H new ATOM 0 HE2 LYS A 122 4.465 -11.368 -8.383 1.00 1.27 H new ATOM 0 HE3 LYS A 122 5.804 -11.941 -9.358 1.00 1.27 H new ATOM 0 HZ1 LYS A 122 3.754 -12.801 -10.216 1.00 1.98 H new ATOM 0 HZ2 LYS A 122 4.647 -14.093 -9.569 1.00 1.98 H new ATOM 0 HZ3 LYS A 122 3.327 -13.458 -8.709 1.00 1.98 H new ATOM 2112 N ALA A 123 5.972 -14.364 -2.045 1.00 0.42 N ATOM 2113 CA ALA A 123 6.680 -15.275 -1.156 1.00 0.43 C ATOM 2114 C ALA A 123 5.973 -15.459 0.187 1.00 0.43 C ATOM 2115 O ALA A 123 6.369 -16.314 0.981 1.00 0.70 O ATOM 2116 CB ALA A 123 8.095 -14.768 -0.932 1.00 0.49 C ATOM 0 H ALA A 123 6.278 -13.393 -1.980 1.00 0.42 H new ATOM 0 HA ALA A 123 6.700 -16.252 -1.640 1.00 0.43 H new ATOM 0 HB1 ALA A 123 8.625 -15.450 -0.267 1.00 0.49 H new ATOM 0 HB2 ALA A 123 8.618 -14.714 -1.887 1.00 0.49 H new ATOM 0 HB3 ALA A 123 8.059 -13.776 -0.481 1.00 0.49 H new ATOM 2122 N MET A 124 4.933 -14.676 0.449 1.00 0.44 N ATOM 2123 CA MET A 124 4.270 -14.743 1.748 1.00 0.42 C ATOM 2124 C MET A 124 3.418 -16.001 1.878 1.00 0.42 C ATOM 2125 O MET A 124 3.052 -16.620 0.876 1.00 0.42 O ATOM 2126 CB MET A 124 3.390 -13.519 1.996 1.00 0.41 C ATOM 2127 CG MET A 124 4.170 -12.242 2.251 1.00 0.45 C ATOM 2128 SD MET A 124 3.166 -10.974 3.046 1.00 0.50 S ATOM 2129 CE MET A 124 1.804 -10.842 1.893 1.00 0.46 C ATOM 0 H MET A 124 4.536 -14.001 -0.204 1.00 0.44 H new ATOM 0 HA MET A 124 5.063 -14.769 2.496 1.00 0.42 H new ATOM 0 HB2 MET A 124 2.740 -13.370 1.134 1.00 0.41 H new ATOM 0 HB3 MET A 124 2.744 -13.716 2.852 1.00 0.41 H new ATOM 0 HG2 MET A 124 5.033 -12.465 2.878 1.00 0.45 H new ATOM 0 HG3 MET A 124 4.554 -11.859 1.306 1.00 0.45 H new ATOM 0 HE1 MET A 124 1.455 -9.810 1.859 1.00 0.46 H new ATOM 0 HE2 MET A 124 2.137 -11.145 0.900 1.00 0.46 H new ATOM 0 HE3 MET A 124 0.990 -11.490 2.216 1.00 0.46 H new ATOM 2139 N SER A 125 3.118 -16.376 3.113 1.00 0.47 N ATOM 2140 CA SER A 125 2.198 -17.471 3.387 1.00 0.54 C ATOM 2141 C SER A 125 0.822 -17.180 2.780 1.00 0.58 C ATOM 2142 O SER A 125 0.380 -16.029 2.745 1.00 0.92 O ATOM 2143 CB SER A 125 2.082 -17.664 4.899 1.00 0.62 C ATOM 2144 OG SER A 125 3.368 -17.744 5.496 1.00 1.18 O ATOM 0 H SER A 125 3.502 -15.934 3.948 1.00 0.47 H new ATOM 0 HA SER A 125 2.582 -18.385 2.934 1.00 0.54 H new ATOM 0 HB2 SER A 125 1.525 -16.835 5.335 1.00 0.62 H new ATOM 0 HB3 SER A 125 1.520 -18.573 5.112 1.00 0.62 H new ATOM 0 HG SER A 125 3.558 -16.911 5.976 1.00 1.18 H new ATOM 2150 N ASP A 126 0.152 -18.230 2.307 1.00 0.44 N ATOM 2151 CA ASP A 126 -1.118 -18.087 1.594 1.00 0.43 C ATOM 2152 C ASP A 126 -2.207 -17.485 2.480 1.00 0.39 C ATOM 2153 O ASP A 126 -2.949 -16.604 2.042 1.00 0.38 O ATOM 2154 CB ASP A 126 -1.579 -19.436 1.039 1.00 0.47 C ATOM 2155 CG ASP A 126 -2.948 -19.361 0.392 1.00 1.37 C ATOM 2156 OD1 ASP A 126 -3.048 -18.870 -0.752 1.00 2.21 O ATOM 2157 OD2 ASP A 126 -3.932 -19.802 1.024 1.00 1.81 O ATOM 0 H ASP A 126 0.469 -19.194 2.405 1.00 0.44 H new ATOM 0 HA ASP A 126 -0.946 -17.399 0.766 1.00 0.43 H new ATOM 0 HB2 ASP A 126 -0.854 -19.791 0.307 1.00 0.47 H new ATOM 0 HB3 ASP A 126 -1.602 -20.168 1.846 1.00 0.47 H new ATOM 2162 N ALA A 127 -2.296 -17.949 3.723 1.00 0.38 N ATOM 2163 CA ALA A 127 -3.266 -17.402 4.669 1.00 0.37 C ATOM 2164 C ALA A 127 -3.001 -15.921 4.915 1.00 0.33 C ATOM 2165 O ALA A 127 -3.923 -15.147 5.184 1.00 0.34 O ATOM 2166 CB ALA A 127 -3.231 -18.173 5.979 1.00 0.42 C ATOM 0 H ALA A 127 -1.713 -18.697 4.098 1.00 0.38 H new ATOM 0 HA ALA A 127 -4.260 -17.506 4.235 1.00 0.37 H new ATOM 0 HB1 ALA A 127 -3.960 -17.750 6.670 1.00 0.42 H new ATOM 0 HB2 ALA A 127 -3.473 -19.219 5.792 1.00 0.42 H new ATOM 0 HB3 ALA A 127 -2.235 -18.103 6.416 1.00 0.42 H new ATOM 2172 N GLY A 128 -1.734 -15.539 4.802 1.00 0.31 N ATOM 2173 CA GLY A 128 -1.354 -14.147 4.948 1.00 0.31 C ATOM 2174 C GLY A 128 -1.776 -13.325 3.748 1.00 0.29 C ATOM 2175 O GLY A 128 -2.184 -12.173 3.888 1.00 0.30 O ATOM 0 H GLY A 128 -0.959 -16.174 4.611 1.00 0.31 H new ATOM 0 HA2 GLY A 128 -1.810 -13.737 5.849 1.00 0.31 H new ATOM 0 HA3 GLY A 128 -0.274 -14.076 5.077 1.00 0.31 H new ATOM 2179 N LYS A 129 -1.698 -13.929 2.565 1.00 0.32 N ATOM 2180 CA LYS A 129 -2.122 -13.269 1.337 1.00 0.39 C ATOM 2181 C LYS A 129 -3.614 -12.979 1.389 1.00 0.35 C ATOM 2182 O LYS A 129 -4.065 -11.881 1.060 1.00 0.36 O ATOM 2183 CB LYS A 129 -1.823 -14.143 0.115 1.00 0.56 C ATOM 2184 CG LYS A 129 -0.343 -14.366 -0.146 1.00 0.58 C ATOM 2185 CD LYS A 129 -0.127 -15.197 -1.400 1.00 0.59 C ATOM 2186 CE LYS A 129 1.347 -15.307 -1.747 1.00 0.94 C ATOM 2187 NZ LYS A 129 1.578 -16.074 -3.001 1.00 1.32 N ATOM 0 H LYS A 129 -1.344 -14.876 2.433 1.00 0.32 H new ATOM 0 HA LYS A 129 -1.567 -12.335 1.248 1.00 0.39 H new ATOM 0 HB2 LYS A 129 -2.307 -15.111 0.248 1.00 0.56 H new ATOM 0 HB3 LYS A 129 -2.270 -13.681 -0.766 1.00 0.56 H new ATOM 0 HG2 LYS A 129 0.159 -13.405 -0.252 1.00 0.58 H new ATOM 0 HG3 LYS A 129 0.108 -14.869 0.709 1.00 0.58 H new ATOM 0 HD2 LYS A 129 -0.543 -16.194 -1.253 1.00 0.59 H new ATOM 0 HD3 LYS A 129 -0.666 -14.746 -2.234 1.00 0.59 H new ATOM 0 HE2 LYS A 129 1.768 -14.307 -1.853 1.00 0.94 H new ATOM 0 HE3 LYS A 129 1.876 -15.791 -0.926 1.00 0.94 H new ATOM 0 HZ1 LYS A 129 2.600 -16.165 -3.169 1.00 1.32 H new ATOM 0 HZ2 LYS A 129 1.156 -17.020 -2.912 1.00 1.32 H new ATOM 0 HZ3 LYS A 129 1.140 -15.573 -3.800 1.00 1.32 H new ATOM 2201 N ALA A 130 -4.375 -13.981 1.809 1.00 0.35 N ATOM 2202 CA ALA A 130 -5.818 -13.861 1.912 1.00 0.37 C ATOM 2203 C ALA A 130 -6.218 -12.887 3.011 1.00 0.33 C ATOM 2204 O ALA A 130 -7.227 -12.190 2.893 1.00 0.38 O ATOM 2205 CB ALA A 130 -6.442 -15.222 2.163 1.00 0.42 C ATOM 0 H ALA A 130 -4.010 -14.892 2.085 1.00 0.35 H new ATOM 0 HA ALA A 130 -6.189 -13.468 0.966 1.00 0.37 H new ATOM 0 HB1 ALA A 130 -7.524 -15.118 2.238 1.00 0.42 H new ATOM 0 HB2 ALA A 130 -6.198 -15.892 1.338 1.00 0.42 H new ATOM 0 HB3 ALA A 130 -6.052 -15.635 3.093 1.00 0.42 H new ATOM 2211 N ASP A 131 -5.430 -12.831 4.080 1.00 0.29 N ATOM 2212 CA ASP A 131 -5.742 -11.935 5.189 1.00 0.29 C ATOM 2213 C ASP A 131 -5.429 -10.501 4.790 1.00 0.27 C ATOM 2214 O ASP A 131 -6.108 -9.563 5.207 1.00 0.30 O ATOM 2215 CB ASP A 131 -4.978 -12.339 6.453 1.00 0.30 C ATOM 2216 CG ASP A 131 -5.323 -11.489 7.660 1.00 0.40 C ATOM 2217 OD1 ASP A 131 -6.512 -11.442 8.036 1.00 0.55 O ATOM 2218 OD2 ASP A 131 -4.404 -10.884 8.253 1.00 0.45 O ATOM 0 H ASP A 131 -4.583 -13.386 4.202 1.00 0.29 H new ATOM 0 HA ASP A 131 -6.805 -12.010 5.417 1.00 0.29 H new ATOM 0 HB2 ASP A 131 -5.192 -13.384 6.680 1.00 0.30 H new ATOM 0 HB3 ASP A 131 -3.908 -12.267 6.261 1.00 0.30 H new ATOM 2223 N PHE A 132 -4.414 -10.346 3.944 1.00 0.24 N ATOM 2224 CA PHE A 132 -4.097 -9.058 3.345 1.00 0.22 C ATOM 2225 C PHE A 132 -5.284 -8.561 2.532 1.00 0.23 C ATOM 2226 O PHE A 132 -5.561 -7.365 2.484 1.00 0.25 O ATOM 2227 CB PHE A 132 -2.856 -9.185 2.450 1.00 0.23 C ATOM 2228 CG PHE A 132 -2.456 -7.905 1.771 1.00 0.24 C ATOM 2229 CD1 PHE A 132 -1.805 -6.906 2.477 1.00 0.33 C ATOM 2230 CD2 PHE A 132 -2.729 -7.702 0.429 1.00 0.26 C ATOM 2231 CE1 PHE A 132 -1.434 -5.731 1.855 1.00 0.39 C ATOM 2232 CE2 PHE A 132 -2.361 -6.529 -0.198 1.00 0.30 C ATOM 2233 CZ PHE A 132 -1.715 -5.541 0.516 1.00 0.36 C ATOM 0 H PHE A 132 -3.794 -11.104 3.658 1.00 0.24 H new ATOM 0 HA PHE A 132 -3.885 -8.339 4.136 1.00 0.22 H new ATOM 0 HB2 PHE A 132 -2.021 -9.540 3.054 1.00 0.23 H new ATOM 0 HB3 PHE A 132 -3.045 -9.943 1.690 1.00 0.23 H new ATOM 0 HD1 PHE A 132 -1.586 -7.048 3.525 1.00 0.33 H new ATOM 0 HD2 PHE A 132 -3.236 -8.471 -0.134 1.00 0.26 H new ATOM 0 HE1 PHE A 132 -0.924 -4.961 2.415 1.00 0.39 H new ATOM 0 HE2 PHE A 132 -2.578 -6.385 -1.246 1.00 0.30 H new ATOM 0 HZ PHE A 132 -1.429 -4.620 0.029 1.00 0.36 H new ATOM 2243 N GLY A 133 -5.999 -9.498 1.922 1.00 0.22 N ATOM 2244 CA GLY A 133 -7.150 -9.155 1.112 1.00 0.24 C ATOM 2245 C GLY A 133 -8.350 -8.722 1.932 1.00 0.23 C ATOM 2246 O GLY A 133 -9.335 -8.236 1.382 1.00 0.27 O ATOM 0 H GLY A 133 -5.799 -10.497 1.975 1.00 0.22 H new ATOM 0 HA2 GLY A 133 -6.878 -8.352 0.427 1.00 0.24 H new ATOM 0 HA3 GLY A 133 -7.426 -10.015 0.502 1.00 0.24 H new ATOM 2250 N LYS A 134 -8.285 -8.909 3.243 1.00 0.27 N ATOM 2251 CA LYS A 134 -9.366 -8.481 4.120 1.00 0.29 C ATOM 2252 C LYS A 134 -9.160 -7.034 4.543 1.00 0.30 C ATOM 2253 O LYS A 134 -10.115 -6.298 4.796 1.00 0.39 O ATOM 2254 CB LYS A 134 -9.427 -9.375 5.355 1.00 0.34 C ATOM 2255 CG LYS A 134 -9.613 -10.845 5.035 1.00 0.63 C ATOM 2256 CD LYS A 134 -9.546 -11.700 6.285 1.00 1.29 C ATOM 2257 CE LYS A 134 -9.611 -13.175 5.942 1.00 1.61 C ATOM 2258 NZ LYS A 134 -9.549 -14.035 7.155 1.00 2.43 N ATOM 0 H LYS A 134 -7.500 -9.352 3.721 1.00 0.27 H new ATOM 0 HA LYS A 134 -10.307 -8.561 3.575 1.00 0.29 H new ATOM 0 HB2 LYS A 134 -8.508 -9.251 5.928 1.00 0.34 H new ATOM 0 HB3 LYS A 134 -10.247 -9.044 5.992 1.00 0.34 H new ATOM 0 HG2 LYS A 134 -10.575 -10.992 4.544 1.00 0.63 H new ATOM 0 HG3 LYS A 134 -8.844 -11.165 4.332 1.00 0.63 H new ATOM 0 HD2 LYS A 134 -8.622 -11.489 6.824 1.00 1.29 H new ATOM 0 HD3 LYS A 134 -10.370 -11.442 6.951 1.00 1.29 H new ATOM 0 HE2 LYS A 134 -10.534 -13.380 5.399 1.00 1.61 H new ATOM 0 HE3 LYS A 134 -8.786 -13.429 5.276 1.00 1.61 H new ATOM 0 HZ1 LYS A 134 -9.596 -15.035 6.874 1.00 2.43 H new ATOM 0 HZ2 LYS A 134 -8.657 -13.859 7.660 1.00 2.43 H new ATOM 0 HZ3 LYS A 134 -10.350 -13.812 7.780 1.00 2.43 H new ATOM 2272 N GLN A 135 -7.899 -6.639 4.603 1.00 0.30 N ATOM 2273 CA GLN A 135 -7.525 -5.312 5.072 1.00 0.31 C ATOM 2274 C GLN A 135 -7.214 -4.387 3.904 1.00 0.30 C ATOM 2275 O GLN A 135 -7.567 -3.209 3.924 1.00 0.36 O ATOM 2276 CB GLN A 135 -6.330 -5.423 6.020 1.00 0.33 C ATOM 2277 CG GLN A 135 -6.607 -6.354 7.190 1.00 0.51 C ATOM 2278 CD GLN A 135 -7.912 -6.023 7.894 1.00 0.71 C ATOM 2279 OE1 GLN A 135 -8.320 -4.863 7.968 1.00 1.83 O ATOM 2280 NE2 GLN A 135 -8.589 -7.044 8.390 1.00 0.75 N ATOM 0 H GLN A 135 -7.109 -7.224 4.330 1.00 0.30 H new ATOM 0 HA GLN A 135 -8.366 -4.878 5.614 1.00 0.31 H new ATOM 0 HB2 GLN A 135 -5.463 -5.785 5.468 1.00 0.33 H new ATOM 0 HB3 GLN A 135 -6.076 -4.433 6.398 1.00 0.33 H new ATOM 0 HG2 GLN A 135 -6.641 -7.383 6.832 1.00 0.51 H new ATOM 0 HG3 GLN A 135 -5.786 -6.291 7.904 1.00 0.51 H new ATOM 0 HE21 GLN A 135 -8.217 -7.990 8.308 1.00 0.75 H new ATOM 0 HE22 GLN A 135 -9.483 -6.886 8.854 1.00 0.75 H new ATOM 2289 N PHE A 136 -6.582 -4.927 2.877 1.00 0.26 N ATOM 2290 CA PHE A 136 -6.313 -4.172 1.662 1.00 0.26 C ATOM 2291 C PHE A 136 -6.808 -4.947 0.443 1.00 0.23 C ATOM 2292 O PHE A 136 -6.012 -5.468 -0.343 1.00 0.24 O ATOM 2293 CB PHE A 136 -4.818 -3.853 1.531 1.00 0.31 C ATOM 2294 CG PHE A 136 -4.337 -2.813 2.505 1.00 0.34 C ATOM 2295 CD1 PHE A 136 -4.765 -1.496 2.417 1.00 0.57 C ATOM 2296 CD2 PHE A 136 -3.455 -3.156 3.517 1.00 0.27 C ATOM 2297 CE1 PHE A 136 -4.321 -0.552 3.312 1.00 0.69 C ATOM 2298 CE2 PHE A 136 -3.008 -2.211 4.415 1.00 0.37 C ATOM 2299 CZ PHE A 136 -3.460 -0.879 4.291 1.00 0.58 C ATOM 0 H PHE A 136 -6.244 -5.889 2.859 1.00 0.26 H new ATOM 0 HA PHE A 136 -6.851 -3.226 1.719 1.00 0.26 H new ATOM 0 HB2 PHE A 136 -4.245 -4.769 1.678 1.00 0.31 H new ATOM 0 HB3 PHE A 136 -4.616 -3.510 0.516 1.00 0.31 H new ATOM 0 HD1 PHE A 136 -5.455 -1.210 1.637 1.00 0.57 H new ATOM 0 HD2 PHE A 136 -3.113 -4.177 3.603 1.00 0.27 H new ATOM 0 HE1 PHE A 136 -4.669 0.467 3.227 1.00 0.69 H new ATOM 0 HE2 PHE A 136 -2.322 -2.485 5.202 1.00 0.37 H new ATOM 0 HZ PHE A 136 -3.114 -0.124 4.982 1.00 0.58 H new ATOM 2309 N PRO A 137 -8.142 -5.032 0.273 1.00 0.26 N ATOM 2310 CA PRO A 137 -8.762 -5.788 -0.819 1.00 0.30 C ATOM 2311 C PRO A 137 -8.391 -5.239 -2.189 1.00 0.29 C ATOM 2312 O PRO A 137 -8.197 -5.998 -3.135 1.00 0.30 O ATOM 2313 CB PRO A 137 -10.269 -5.627 -0.572 1.00 0.38 C ATOM 2314 CG PRO A 137 -10.385 -5.205 0.852 1.00 0.63 C ATOM 2315 CD PRO A 137 -9.156 -4.397 1.134 1.00 0.34 C ATOM 0 HA PRO A 137 -8.429 -6.826 -0.825 1.00 0.30 H new ATOM 0 HB2 PRO A 137 -10.701 -4.882 -1.240 1.00 0.38 H new ATOM 0 HB3 PRO A 137 -10.800 -6.562 -0.751 1.00 0.38 H new ATOM 0 HG2 PRO A 137 -11.287 -4.615 1.014 1.00 0.63 H new ATOM 0 HG3 PRO A 137 -10.446 -6.069 1.513 1.00 0.63 H new ATOM 0 HD2 PRO A 137 -9.297 -3.345 0.884 1.00 0.34 H new ATOM 0 HD3 PRO A 137 -8.877 -4.440 2.187 1.00 0.34 H new ATOM 2323 N PHE A 138 -8.277 -3.916 -2.287 1.00 0.32 N ATOM 2324 CA PHE A 138 -7.936 -3.271 -3.550 1.00 0.36 C ATOM 2325 C PHE A 138 -6.534 -3.677 -3.991 1.00 0.35 C ATOM 2326 O PHE A 138 -6.299 -3.948 -5.168 1.00 0.36 O ATOM 2327 CB PHE A 138 -8.029 -1.747 -3.421 1.00 0.43 C ATOM 2328 CG PHE A 138 -7.770 -1.007 -4.703 1.00 0.86 C ATOM 2329 CD1 PHE A 138 -6.485 -0.621 -5.043 1.00 1.56 C ATOM 2330 CD2 PHE A 138 -8.809 -0.703 -5.568 1.00 1.21 C ATOM 2331 CE1 PHE A 138 -6.241 0.054 -6.221 1.00 2.23 C ATOM 2332 CE2 PHE A 138 -8.570 -0.028 -6.746 1.00 1.88 C ATOM 2333 CZ PHE A 138 -7.294 0.366 -7.068 1.00 2.31 C ATOM 0 H PHE A 138 -8.416 -3.272 -1.508 1.00 0.32 H new ATOM 0 HA PHE A 138 -8.650 -3.598 -4.305 1.00 0.36 H new ATOM 0 HB2 PHE A 138 -9.022 -1.484 -3.056 1.00 0.43 H new ATOM 0 HB3 PHE A 138 -7.314 -1.412 -2.670 1.00 0.43 H new ATOM 0 HD1 PHE A 138 -5.665 -0.851 -4.379 1.00 1.56 H new ATOM 0 HD2 PHE A 138 -9.817 -0.998 -5.317 1.00 1.21 H new ATOM 0 HE1 PHE A 138 -5.233 0.339 -6.483 1.00 2.23 H new ATOM 0 HE2 PHE A 138 -9.387 0.191 -7.417 1.00 1.88 H new ATOM 0 HZ PHE A 138 -7.111 0.917 -7.978 1.00 2.31 H new ATOM 2343 N LEU A 139 -5.608 -3.728 -3.044 1.00 0.35 N ATOM 2344 CA LEU A 139 -4.243 -4.130 -3.350 1.00 0.36 C ATOM 2345 C LEU A 139 -4.183 -5.625 -3.636 1.00 0.33 C ATOM 2346 O LEU A 139 -3.555 -6.043 -4.608 1.00 0.35 O ATOM 2347 CB LEU A 139 -3.291 -3.761 -2.211 1.00 0.40 C ATOM 2348 CG LEU A 139 -3.118 -2.263 -1.962 1.00 0.48 C ATOM 2349 CD1 LEU A 139 -2.210 -2.021 -0.765 1.00 1.02 C ATOM 2350 CD2 LEU A 139 -2.554 -1.585 -3.198 1.00 0.86 C ATOM 0 H LEU A 139 -5.775 -3.498 -2.064 1.00 0.35 H new ATOM 0 HA LEU A 139 -3.922 -3.591 -4.241 1.00 0.36 H new ATOM 0 HB2 LEU A 139 -3.652 -4.226 -1.293 1.00 0.40 H new ATOM 0 HB3 LEU A 139 -2.313 -4.192 -2.423 1.00 0.40 H new ATOM 0 HG LEU A 139 -4.096 -1.834 -1.744 1.00 0.48 H new ATOM 0 HD11 LEU A 139 -2.099 -0.949 -0.604 1.00 1.02 H new ATOM 0 HD12 LEU A 139 -2.648 -2.478 0.122 1.00 1.02 H new ATOM 0 HD13 LEU A 139 -1.232 -2.463 -0.955 1.00 1.02 H new ATOM 0 HD21 LEU A 139 -2.436 -0.519 -3.006 1.00 0.86 H new ATOM 0 HD22 LEU A 139 -1.584 -2.019 -3.441 1.00 0.86 H new ATOM 0 HD23 LEU A 139 -3.236 -1.730 -4.036 1.00 0.86 H new ATOM 2362 N ALA A 140 -4.853 -6.424 -2.810 1.00 0.30 N ATOM 2363 CA ALA A 140 -4.912 -7.867 -3.033 1.00 0.28 C ATOM 2364 C ALA A 140 -5.488 -8.157 -4.416 1.00 0.28 C ATOM 2365 O ALA A 140 -5.004 -9.038 -5.127 1.00 0.35 O ATOM 2366 CB ALA A 140 -5.737 -8.546 -1.951 1.00 0.25 C ATOM 0 H ALA A 140 -5.359 -6.101 -1.986 1.00 0.30 H new ATOM 0 HA ALA A 140 -3.901 -8.270 -2.985 1.00 0.28 H new ATOM 0 HB1 ALA A 140 -5.768 -9.620 -2.137 1.00 0.25 H new ATOM 0 HB2 ALA A 140 -5.284 -8.359 -0.977 1.00 0.25 H new ATOM 0 HB3 ALA A 140 -6.751 -8.147 -1.962 1.00 0.25 H new ATOM 2372 N LYS A 141 -6.511 -7.388 -4.779 1.00 0.26 N ATOM 2373 CA LYS A 141 -7.093 -7.408 -6.115 1.00 0.27 C ATOM 2374 C LYS A 141 -6.010 -7.372 -7.189 1.00 0.29 C ATOM 2375 O LYS A 141 -5.749 -8.369 -7.863 1.00 0.30 O ATOM 2376 CB LYS A 141 -7.996 -6.185 -6.297 1.00 0.28 C ATOM 2377 CG LYS A 141 -8.866 -6.246 -7.545 1.00 0.36 C ATOM 2378 CD LYS A 141 -9.667 -4.966 -7.737 1.00 1.15 C ATOM 2379 CE LYS A 141 -8.815 -3.847 -8.318 1.00 1.76 C ATOM 2380 NZ LYS A 141 -8.583 -4.019 -9.777 1.00 2.58 N ATOM 0 H LYS A 141 -6.963 -6.727 -4.147 1.00 0.26 H new ATOM 0 HA LYS A 141 -7.666 -8.330 -6.218 1.00 0.27 H new ATOM 0 HB2 LYS A 141 -8.638 -6.085 -5.422 1.00 0.28 H new ATOM 0 HB3 LYS A 141 -7.376 -5.290 -6.341 1.00 0.28 H new ATOM 0 HG2 LYS A 141 -8.237 -6.416 -8.419 1.00 0.36 H new ATOM 0 HG3 LYS A 141 -9.547 -7.094 -7.473 1.00 0.36 H new ATOM 0 HD2 LYS A 141 -10.511 -5.161 -8.399 1.00 1.15 H new ATOM 0 HD3 LYS A 141 -10.080 -4.649 -6.779 1.00 1.15 H new ATOM 0 HE2 LYS A 141 -9.305 -2.890 -8.140 1.00 1.76 H new ATOM 0 HE3 LYS A 141 -7.856 -3.816 -7.800 1.00 1.76 H new ATOM 0 HZ1 LYS A 141 -8.042 -3.209 -10.140 1.00 2.58 H new ATOM 0 HZ2 LYS A 141 -8.048 -4.895 -9.942 1.00 2.58 H new ATOM 0 HZ3 LYS A 141 -9.497 -4.073 -10.270 1.00 2.58 H new ATOM 2394 N VAL A 142 -5.365 -6.214 -7.319 1.00 0.31 N ATOM 2395 CA VAL A 142 -4.415 -5.971 -8.391 1.00 0.36 C ATOM 2396 C VAL A 142 -3.209 -6.907 -8.319 1.00 0.37 C ATOM 2397 O VAL A 142 -2.585 -7.193 -9.342 1.00 0.44 O ATOM 2398 CB VAL A 142 -3.941 -4.498 -8.411 1.00 0.40 C ATOM 2399 CG1 VAL A 142 -5.060 -3.561 -7.999 1.00 0.50 C ATOM 2400 CG2 VAL A 142 -2.719 -4.290 -7.543 1.00 0.48 C ATOM 0 H VAL A 142 -5.489 -5.425 -6.685 1.00 0.31 H new ATOM 0 HA VAL A 142 -4.946 -6.178 -9.320 1.00 0.36 H new ATOM 0 HB VAL A 142 -3.658 -4.263 -9.437 1.00 0.40 H new ATOM 0 HG11 VAL A 142 -4.700 -2.532 -8.022 1.00 0.50 H new ATOM 0 HG12 VAL A 142 -5.897 -3.668 -8.689 1.00 0.50 H new ATOM 0 HG13 VAL A 142 -5.389 -3.808 -6.990 1.00 0.50 H new ATOM 0 HG21 VAL A 142 -2.418 -3.243 -7.584 1.00 0.48 H new ATOM 0 HG22 VAL A 142 -2.954 -4.560 -6.513 1.00 0.48 H new ATOM 0 HG23 VAL A 142 -1.904 -4.917 -7.906 1.00 0.48 H new ATOM 2404 N PHE A 143 -2.876 -7.390 -7.126 1.00 0.33 N ATOM 2405 CA PHE A 143 -1.736 -8.290 -7.000 1.00 0.36 C ATOM 2406 C PHE A 143 -2.087 -9.674 -7.535 1.00 0.40 C ATOM 2407 O PHE A 143 -1.290 -10.302 -8.233 1.00 0.47 O ATOM 2408 CB PHE A 143 -1.234 -8.398 -5.554 1.00 0.36 C ATOM 2409 CG PHE A 143 -0.627 -7.136 -5.002 1.00 0.34 C ATOM 2410 CD1 PHE A 143 0.116 -6.288 -5.808 1.00 0.47 C ATOM 2411 CD2 PHE A 143 -0.792 -6.806 -3.667 1.00 0.58 C ATOM 2412 CE1 PHE A 143 0.677 -5.134 -5.294 1.00 0.47 C ATOM 2413 CE2 PHE A 143 -0.234 -5.654 -3.148 1.00 0.62 C ATOM 2414 CZ PHE A 143 0.501 -4.817 -3.963 1.00 0.39 C ATOM 0 H PHE A 143 -3.364 -7.181 -6.255 1.00 0.33 H new ATOM 0 HA PHE A 143 -0.928 -7.865 -7.596 1.00 0.36 H new ATOM 0 HB2 PHE A 143 -2.067 -8.693 -4.916 1.00 0.36 H new ATOM 0 HB3 PHE A 143 -0.493 -9.195 -5.500 1.00 0.36 H new ATOM 0 HD1 PHE A 143 0.258 -6.532 -6.850 1.00 0.47 H new ATOM 0 HD2 PHE A 143 -1.364 -7.458 -3.024 1.00 0.58 H new ATOM 0 HE1 PHE A 143 1.252 -4.481 -5.934 1.00 0.47 H new ATOM 0 HE2 PHE A 143 -0.373 -5.408 -2.105 1.00 0.62 H new ATOM 0 HZ PHE A 143 0.938 -3.915 -3.559 1.00 0.39 H new ATOM 2424 N GLU A 144 -3.291 -10.145 -7.224 1.00 0.41 N ATOM 2425 CA GLU A 144 -3.713 -11.471 -7.651 1.00 0.45 C ATOM 2426 C GLU A 144 -4.164 -11.460 -9.103 1.00 0.45 C ATOM 2427 O GLU A 144 -4.004 -12.448 -9.819 1.00 0.54 O ATOM 2428 CB GLU A 144 -4.838 -11.998 -6.768 1.00 0.47 C ATOM 2429 CG GLU A 144 -4.465 -12.095 -5.302 1.00 0.60 C ATOM 2430 CD GLU A 144 -5.477 -12.882 -4.506 1.00 1.55 C ATOM 2431 OE1 GLU A 144 -6.563 -12.346 -4.216 1.00 2.58 O ATOM 2432 OE2 GLU A 144 -5.193 -14.055 -4.185 1.00 1.55 O ATOM 0 H GLU A 144 -3.986 -9.631 -6.682 1.00 0.41 H new ATOM 0 HA GLU A 144 -2.852 -12.133 -7.556 1.00 0.45 H new ATOM 0 HB2 GLU A 144 -5.705 -11.346 -6.871 1.00 0.47 H new ATOM 0 HB3 GLU A 144 -5.137 -12.984 -7.124 1.00 0.47 H new ATOM 0 HG2 GLU A 144 -3.486 -12.566 -5.208 1.00 0.60 H new ATOM 0 HG3 GLU A 144 -4.377 -11.092 -4.884 1.00 0.60 H new ATOM 2439 N SER A 145 -4.724 -10.336 -9.534 1.00 0.43 N ATOM 2440 CA SER A 145 -5.193 -10.179 -10.905 1.00 0.49 C ATOM 2441 C SER A 145 -4.023 -10.107 -11.885 1.00 0.57 C ATOM 2442 O SER A 145 -4.211 -10.178 -13.101 1.00 1.32 O ATOM 2443 CB SER A 145 -6.049 -8.913 -11.016 1.00 0.50 C ATOM 2444 OG SER A 145 -7.183 -8.992 -10.166 1.00 1.29 O ATOM 0 H SER A 145 -4.865 -9.513 -8.948 1.00 0.43 H new ATOM 0 HA SER A 145 -5.795 -11.050 -11.163 1.00 0.49 H new ATOM 0 HB2 SER A 145 -5.451 -8.041 -10.751 1.00 0.50 H new ATOM 0 HB3 SER A 145 -6.372 -8.777 -12.048 1.00 0.50 H new ATOM 0 HG SER A 145 -6.917 -8.785 -9.246 1.00 1.29 H new ATOM 2450 N GLY A 146 -2.815 -9.972 -11.349 1.00 0.79 N ATOM 2451 CA GLY A 146 -1.640 -9.837 -12.188 1.00 0.78 C ATOM 2452 C GLY A 146 -1.494 -8.429 -12.716 1.00 0.70 C ATOM 2453 O GLY A 146 -0.724 -8.173 -13.636 1.00 1.09 O ATOM 0 H GLY A 146 -2.629 -9.954 -10.346 1.00 0.79 H new ATOM 0 HA2 GLY A 146 -0.751 -10.106 -11.617 1.00 0.78 H new ATOM 0 HA3 GLY A 146 -1.706 -10.535 -13.023 1.00 0.78 H new ATOM 2457 N LYS A 147 -2.232 -7.512 -12.109 1.00 0.54 N ATOM 2458 CA LYS A 147 -2.245 -6.124 -12.534 1.00 0.48 C ATOM 2459 C LYS A 147 -0.910 -5.455 -12.222 1.00 0.40 C ATOM 2460 O LYS A 147 -0.212 -4.988 -13.124 1.00 0.45 O ATOM 2461 CB LYS A 147 -3.392 -5.391 -11.839 1.00 0.54 C ATOM 2462 CG LYS A 147 -3.474 -3.913 -12.169 1.00 0.83 C ATOM 2463 CD LYS A 147 -3.592 -3.693 -13.667 1.00 1.15 C ATOM 2464 CE LYS A 147 -3.679 -2.220 -14.012 1.00 1.55 C ATOM 2465 NZ LYS A 147 -3.832 -2.010 -15.471 1.00 1.98 N ATOM 0 H LYS A 147 -2.836 -7.710 -11.311 1.00 0.54 H new ATOM 0 HA LYS A 147 -2.396 -6.081 -13.613 1.00 0.48 H new ATOM 0 HB2 LYS A 147 -4.333 -5.867 -12.115 1.00 0.54 H new ATOM 0 HB3 LYS A 147 -3.282 -5.506 -10.761 1.00 0.54 H new ATOM 0 HG2 LYS A 147 -4.334 -3.472 -11.665 1.00 0.83 H new ATOM 0 HG3 LYS A 147 -2.587 -3.403 -11.792 1.00 0.83 H new ATOM 0 HD2 LYS A 147 -2.731 -4.134 -14.169 1.00 1.15 H new ATOM 0 HD3 LYS A 147 -4.477 -4.207 -14.042 1.00 1.15 H new ATOM 0 HE2 LYS A 147 -4.524 -1.772 -13.489 1.00 1.55 H new ATOM 0 HE3 LYS A 147 -2.781 -1.710 -13.663 1.00 1.55 H new ATOM 0 HZ1 LYS A 147 -3.888 -0.991 -15.671 1.00 1.98 H new ATOM 0 HZ2 LYS A 147 -3.013 -2.416 -15.968 1.00 1.98 H new ATOM 0 HZ3 LYS A 147 -4.702 -2.476 -15.799 1.00 1.98 H new ATOM 2479 N ALA A 148 -0.550 -5.429 -10.942 1.00 0.33 N ATOM 2480 CA ALA A 148 0.730 -4.869 -10.527 1.00 0.29 C ATOM 2481 C ALA A 148 1.864 -5.698 -11.102 1.00 0.31 C ATOM 2482 O ALA A 148 2.928 -5.176 -11.437 1.00 0.34 O ATOM 2483 CB ALA A 148 0.829 -4.821 -9.013 1.00 0.33 C ATOM 0 H ALA A 148 -1.124 -5.787 -10.179 1.00 0.33 H new ATOM 0 HA ALA A 148 0.805 -3.850 -10.906 1.00 0.29 H new ATOM 0 HB1 ALA A 148 1.792 -4.400 -8.725 1.00 0.33 H new ATOM 0 HB2 ALA A 148 0.027 -4.199 -8.615 1.00 0.33 H new ATOM 0 HB3 ALA A 148 0.739 -5.830 -8.610 1.00 0.33 H new ATOM 2489 N ALA A 149 1.615 -6.996 -11.221 1.00 0.35 N ATOM 2490 CA ALA A 149 2.579 -7.919 -11.790 1.00 0.41 C ATOM 2491 C ALA A 149 2.936 -7.529 -13.217 1.00 0.43 C ATOM 2492 O ALA A 149 4.108 -7.492 -13.585 1.00 0.51 O ATOM 2493 CB ALA A 149 2.033 -9.334 -11.746 1.00 0.48 C ATOM 0 H ALA A 149 0.742 -7.434 -10.926 1.00 0.35 H new ATOM 0 HA ALA A 149 3.490 -7.873 -11.194 1.00 0.41 H new ATOM 0 HB1 ALA A 149 2.764 -10.019 -12.175 1.00 0.48 H new ATOM 0 HB2 ALA A 149 1.835 -9.616 -10.712 1.00 0.48 H new ATOM 0 HB3 ALA A 149 1.107 -9.385 -12.319 1.00 0.48 H new ATOM 2499 N LYS A 150 1.921 -7.212 -14.012 1.00 0.41 N ATOM 2500 CA LYS A 150 2.129 -6.850 -15.405 1.00 0.46 C ATOM 2501 C LYS A 150 2.868 -5.520 -15.504 1.00 0.45 C ATOM 2502 O LYS A 150 3.754 -5.352 -16.345 1.00 0.59 O ATOM 2503 CB LYS A 150 0.793 -6.770 -16.146 1.00 0.53 C ATOM 2504 CG LYS A 150 0.945 -6.646 -17.652 1.00 1.16 C ATOM 2505 CD LYS A 150 1.624 -7.873 -18.242 1.00 1.45 C ATOM 2506 CE LYS A 150 1.887 -7.704 -19.730 1.00 1.96 C ATOM 2507 NZ LYS A 150 2.881 -6.630 -19.998 1.00 2.82 N ATOM 0 H LYS A 150 0.946 -7.199 -13.714 1.00 0.41 H new ATOM 0 HA LYS A 150 2.738 -7.624 -15.873 1.00 0.46 H new ATOM 0 HB2 LYS A 150 0.207 -7.660 -15.920 1.00 0.53 H new ATOM 0 HB3 LYS A 150 0.230 -5.914 -15.773 1.00 0.53 H new ATOM 0 HG2 LYS A 150 -0.036 -6.515 -18.109 1.00 1.16 H new ATOM 0 HG3 LYS A 150 1.528 -5.756 -17.889 1.00 1.16 H new ATOM 0 HD2 LYS A 150 2.566 -8.054 -17.723 1.00 1.45 H new ATOM 0 HD3 LYS A 150 0.997 -8.750 -18.080 1.00 1.45 H new ATOM 0 HE2 LYS A 150 2.249 -8.645 -20.144 1.00 1.96 H new ATOM 0 HE3 LYS A 150 0.953 -7.470 -20.240 1.00 1.96 H new ATOM 0 HZ1 LYS A 150 3.223 -6.710 -20.977 1.00 2.82 H new ATOM 0 HZ2 LYS A 150 2.433 -5.701 -19.863 1.00 2.82 H new ATOM 0 HZ3 LYS A 150 3.682 -6.727 -19.342 1.00 2.82 H new ATOM 2521 N PHE A 151 2.506 -4.588 -14.629 1.00 0.35 N ATOM 2522 CA PHE A 151 3.181 -3.297 -14.548 1.00 0.36 C ATOM 2523 C PHE A 151 4.662 -3.486 -14.227 1.00 0.40 C ATOM 2524 O PHE A 151 5.523 -2.794 -14.774 1.00 0.46 O ATOM 2525 CB PHE A 151 2.524 -2.415 -13.482 1.00 0.34 C ATOM 2526 CG PHE A 151 3.021 -0.997 -13.490 1.00 0.33 C ATOM 2527 CD1 PHE A 151 4.130 -0.631 -12.747 1.00 0.43 C ATOM 2528 CD2 PHE A 151 2.382 -0.031 -14.252 1.00 0.46 C ATOM 2529 CE1 PHE A 151 4.595 0.666 -12.761 1.00 0.44 C ATOM 2530 CE2 PHE A 151 2.843 1.272 -14.271 1.00 0.49 C ATOM 2531 CZ PHE A 151 3.951 1.621 -13.524 1.00 0.39 C ATOM 0 H PHE A 151 1.744 -4.704 -13.961 1.00 0.35 H new ATOM 0 HA PHE A 151 3.092 -2.804 -15.516 1.00 0.36 H new ATOM 0 HB2 PHE A 151 1.445 -2.415 -13.636 1.00 0.34 H new ATOM 0 HB3 PHE A 151 2.705 -2.850 -12.499 1.00 0.34 H new ATOM 0 HD1 PHE A 151 4.638 -1.372 -12.148 1.00 0.43 H new ATOM 0 HD2 PHE A 151 1.515 -0.299 -14.837 1.00 0.46 H new ATOM 0 HE1 PHE A 151 5.462 0.936 -12.176 1.00 0.44 H new ATOM 0 HE2 PHE A 151 2.338 2.016 -14.869 1.00 0.49 H new ATOM 0 HZ PHE A 151 4.313 2.638 -13.536 1.00 0.39 H new ATOM 2541 N ALA A 152 4.952 -4.433 -13.346 1.00 0.39 N ATOM 2542 CA ALA A 152 6.325 -4.725 -12.956 1.00 0.44 C ATOM 2543 C ALA A 152 7.077 -5.449 -14.062 1.00 0.52 C ATOM 2544 O ALA A 152 8.306 -5.441 -14.100 1.00 0.59 O ATOM 2545 CB ALA A 152 6.347 -5.573 -11.696 1.00 0.44 C ATOM 0 H ALA A 152 4.252 -5.015 -12.886 1.00 0.39 H new ATOM 0 HA ALA A 152 6.820 -3.772 -12.767 1.00 0.44 H new ATOM 0 HB1 ALA A 152 7.379 -5.783 -11.417 1.00 0.44 H new ATOM 0 HB2 ALA A 152 5.855 -5.034 -10.886 1.00 0.44 H new ATOM 0 HB3 ALA A 152 5.823 -6.511 -11.879 1.00 0.44 H new ATOM 2551 N GLY A 153 6.329 -6.072 -14.961 1.00 0.65 N ATOM 2552 CA GLY A 153 6.930 -6.936 -15.950 1.00 0.84 C ATOM 2553 C GLY A 153 7.137 -8.323 -15.384 1.00 1.06 C ATOM 2554 O GLY A 153 7.783 -9.172 -16.003 1.00 1.62 O ATOM 0 H GLY A 153 5.314 -5.993 -15.021 1.00 0.65 H new ATOM 0 HA2 GLY A 153 6.292 -6.988 -16.832 1.00 0.84 H new ATOM 0 HA3 GLY A 153 7.885 -6.521 -16.272 1.00 0.84 H new ATOM 2558 N GLU A 154 6.559 -8.536 -14.200 1.00 0.99 N ATOM 2559 CA GLU A 154 6.718 -9.770 -13.440 1.00 1.35 C ATOM 2560 C GLU A 154 8.151 -9.987 -12.973 1.00 1.52 C ATOM 2561 O GLU A 154 9.086 -9.300 -13.389 1.00 2.33 O ATOM 2562 CB GLU A 154 6.226 -10.985 -14.221 1.00 1.95 C ATOM 2563 CG GLU A 154 4.848 -11.450 -13.779 1.00 2.50 C ATOM 2564 CD GLU A 154 4.821 -11.959 -12.348 1.00 3.37 C ATOM 2565 OE1 GLU A 154 5.896 -12.093 -11.732 1.00 3.70 O ATOM 2566 OE2 GLU A 154 3.719 -12.240 -11.833 1.00 4.12 O ATOM 0 H GLU A 154 5.962 -7.848 -13.741 1.00 0.99 H new ATOM 0 HA GLU A 154 6.095 -9.657 -12.552 1.00 1.35 H new ATOM 0 HB2 GLU A 154 6.199 -10.742 -15.283 1.00 1.95 H new ATOM 0 HB3 GLU A 154 6.937 -11.802 -14.099 1.00 1.95 H new ATOM 0 HG2 GLU A 154 4.144 -10.624 -13.878 1.00 2.50 H new ATOM 0 HG3 GLU A 154 4.507 -12.242 -14.446 1.00 2.50 H new ATOM 2573 N ASN A 155 8.297 -10.947 -12.084 1.00 1.82 N ATOM 2574 CA ASN A 155 9.569 -11.251 -11.466 1.00 2.70 C ATOM 2575 C ASN A 155 10.099 -12.575 -11.987 1.00 3.48 C ATOM 2576 O ASN A 155 9.377 -13.587 -11.874 1.00 3.96 O ATOM 2577 CB ASN A 155 9.405 -11.307 -9.948 1.00 2.84 C ATOM 2578 CG ASN A 155 10.695 -11.660 -9.234 1.00 3.21 C ATOM 2579 OD1 ASN A 155 10.986 -12.829 -8.982 1.00 3.95 O ATOM 2580 ND2 ASN A 155 11.477 -10.647 -8.897 1.00 3.15 N ATOM 2581 OXT ASN A 155 11.238 -12.606 -12.494 1.00 4.01 O ATOM 0 H ASN A 155 7.531 -11.542 -11.768 1.00 1.82 H new ATOM 0 HA ASN A 155 10.284 -10.467 -11.716 1.00 2.70 H new ATOM 0 HB2 ASN A 155 9.048 -10.342 -9.589 1.00 2.84 H new ATOM 0 HB3 ASN A 155 8.642 -12.043 -9.696 1.00 2.84 H new ATOM 0 HD21 ASN A 155 12.356 -10.821 -8.411 1.00 3.15 H new ATOM 0 HD22 ASN A 155 11.200 -9.692 -9.124 1.00 3.15 H new TER 2588 ASN A 155